A0A060XDJ8_ONCMY Loading...

Glycerol-3-phosphate acyltransferase 1, mitochondrial

Mitochondrial membrane protein that catalyzes the essential first step of biosynthesis of glycerolipids such as triglycerides, phosphatidic acids and lysophosphatidic acids. Esterifies acyl-group from acyl-coenzyme A (acyl-CoA) to the sn-1 position of glycerol-3-phosphate, to produce lysophosphatidic acid. Has a narrow hydrophobic binding cleft that selects for a linear acyl chain. Catalytic activity is higher for substrates with a 16-carbon acyl chain.

AlphaFold DB , UniProt , Accession A0A060XDJ8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene gpam, Length 829 aa.

						>A0A060XDJ8_ONCMY|A0A060XDJ8|gpam
MEVAVTIGPDSLLQVNGADQGGSRWKQPNDDSDRSSSPSVLRCVTSTWKEGLLNRKRPFVGRCCHSCTPQSQARLFNSSIPSLGLRNVIYINETHTRHRGWLARRLSYVLFVLERDVQKDMFARNVVDNVLNNSRVESAIVEVATELDPAATEAGVEHKAVSKVRRKARGFLQEMVANISPAFIRLTGWALLKLFNGFFWSIQIHKGQLEMVKKAATEYNAPLVFLPVHKSHIDYLLITFILFCHNIKAPHIAAGNNLNIPIFSTLIRKLGGFFIRRKLDETPDGKKDVLYRSLLYVYTEELLRQQQFLEVFLEGTRSRSGKPSPARAGMLSIVVDALCNGVIPEVMVVPVGISYDRILEGNYNSEQLGKPKKNESLWGVACGVLRMLRKNYGCVRVDFTQPFSLKEYLDTQRSRHIPPTLSLEQTLVPTIIDAQPDQAQFEGEQEEQPNSRDLSDEPWRRQVIANLAKHVLFTANKSSAVMSTHIVACLLLYRHRQGVALSKLVEDFFNMKEEILSRDFDLGFSGNSEDVVMHALHLLDNCVHVTSTNRNTEFTIAPSKTVPALFELNFYSNGLFHVFISDAIIACSALALLREQAASEVEGEQGGPSILLSQERLIRKAAGLSHFLTNEVAVAPPCQTIYQVFHDAVSRLIQYGVLYVAEEDQEELTPSPTEEPWPKKFPEPLSWRSDEEDEDSDFAEEQRDRYLKVSLSPEHQEFFVFLQRLLSPVLEAYSGAAIFVHSLSQPMAEPEYTQQLFRYLLTRTEKGVAAYGESATHYLVKNTVRTFKELGVLKERRENHVSLVELSSTFLPQANRNKLLHYILGFTLL
					

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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	30.7	Very low	27	Very low	249 Å²	249	134.5 Å²	134.5	100%	1.227	80%	0.799	S	S	*	*				0	114.1	0	-153.7	165.1	172.1	0	0	105.7
2	E	26.7	Very low	26.7	Very low	182 Å²	182	135.5 Å²	135.5	85%	0.85	80%	0.797	S	S	*	*			trans	-54.5	156.6	179	-61.2	161.7	132.3	0	0	110.5
3	V	25.1	Very low	26.6	Very low	128 Å²	128	137.3 Å²	137.3	78%	0.776	80%	0.8	S	S	*	*				178.6	123.5	71	172.3	0	0	0	0	104
4	A	25.3	Very low	26.5	Very low	80 Å²	80	140.4 Å²	140.4	66%	0.661	80%	0.802	S	S	*	*				75.9	127.5	71	0	0	0	0	0	117.5
5	V	27	Very low	26.4	Very low	125 Å²	125	140.9 Å²	140.9	76%	0.758	81%	0.809	S	S	*	*			trans	71.5	145.7	149.9	-127.3	0	0	0	0	118.2
6	T	24.2	Very low	26.3	Very low	117 Å²	117	142.3 Å²	142.3	72%	0.718	81%	0.813	S	S	*	*			cis	-174	130.2	34.1	-9.2	0	0	0	0	108.7
7	I	26.8	Very low	26.1	Very low	160 Å²	160	138.2 Å²	138.2	82%	0.821	81%	0.809	S	S	*	*				55.7	109.8	97.1	-50.9	177.8	0	0	0	118.7
8	G	22.6	Very low	26.1	Very low	69 Å²	69	136 Å²	136	71%	0.711	81%	0.81	S	S	*	*			trans	52.3	173.1	135.9	0	0	0	0	0	122.5
9	P	38	Very low	26	Very low	117 Å²	117	136.2 Å²	136.2	76%	0.76	81%	0.806	S	S	*	*			cis	-143.5	172.2	6.7	41.1	-20.4	0	0	0	118.3
10	D	26.7	Very low	26	Very low	153 Å²	153	138.6 Å²	138.6	82%	0.818	81%	0.809	S	S	*	*			trans	57.8	120.8	138.6	-67.1	-13.9	0	0	0	127.3
11	S	23.5	Very low	25.9	Very low	99 Å²	99	135.9 Å²	135.9	69%	0.692	81%	0.81	S	S	*	*				71.8	123	118.7	-156.8	0	0	0	0	122
12	L	24.5	Very low	25.6	Very low	147 Å²	147	127.8 Å²	127.8	77%	0.77	79%	0.791	S	S	*	*				169.1	138.4	112.3	-91	162.5	0	0	0	114.5
13	L	25.2	Very low	25.4	Very low	159 Å²	159	124.6 Å²	124.6	83%	0.832	79%	0.789	S	S	*	*			trans	89.9	118	143.2	-69.5	157.8	0	0	0	123
14	Q	24.6	Very low	25.4	Very low	180 Å²	180	127.7 Å²	127.7	84%	0.841	79%	0.787	S	S	*	*			trans	-71.7	151	159.7	-66.8	170.3	-41.1	0	0	112.3
15	V	24.9	Very low	25.3	Very low	148 Å²	148	131.8 Å²	131.8	90%	0.897	79%	0.785	S	S	*	*			trans	-150.8	141	141.2	179.9	0	0	0	0	111
16	N	24.3	Very low	25.1	Very low	164 Å²	164	133.2 Å²	133.2	88%	0.877	78%	0.781	S	S	*	*			trans	-74	167.2	-177.4	-73.1	-37.6	0	0	0	117
17	G	24.3	Very low	25.1	Very low	73 Å²	73	135.6 Å²	135.6	75%	0.753	78%	0.784	S	S	*	*			trans	132.1	99.4	147	0	0	0	0	0	113.6
18	A	25.3	Very low	25.1	Very low	98 Å²	98	133.3 Å²	133.3	81%	0.81	78%	0.78	S	S	*	*				79.9	108	76.7	0	0	0	0	0	114.7
19	D	25	Very low	25.3	Very low	140 Å²	140	137.1 Å²	137.1	75%	0.749	78%	0.784	S	S	*	*			trans	-178.7	111.8	137.8	-100.8	-20.1	0	0	0	109.1
20	Q	26.3	Very low	24.7	Very low	183 Å²	183	137.6 Å²	137.6	86%	0.855	78%	0.78	S	S	*	*				68.3	114.3	90	-79.9	-168.8	82	0	0	116.1
21	G	24	Very low	24.7	Very low	82 Å²	82	137 Å²	137	85%	0.845	78%	0.777	S	S	*	*			trans	113.3	125.5	134	0	0	0	0	0	117.8
22	G	23.5	Very low	24.8	Very low	80 Å²	80	137.4 Å²	137.4	83%	0.825	78%	0.78	S	S	*	*			trans	106.1	94.4	133.6	0	0	0	0	0	117.6
23	S	22.6	Very low	25.1	Very low	115 Å²	115	138.2 Å²	138.2	80%	0.804	79%	0.785	S	S	*	*			trans	-58	137	156.8	55.5	0	0	0	0	113
24	R	24.7	Very low	25.2	Very low	192 Å²	192	141.5 Å²	141.5	73%	0.725	79%	0.786	S	S	*	*				148.8	121.1	119.1	-89.1	-165.7	128.5	153.5	-6.4	113.9
25	W	22.7	Very low	25.5	Very low	166 Å²	166	138.6 Å²	138.6	63%	0.629	79%	0.786	S	S	*	*				97.3	120.5	124.8	-72.8	33.7	0	0	0	121.1
26	K	23	Very low	25.7	Very low	155 Å²	155	136 Å²	136	67%	0.674	78%	0.775	S	S	*	*			trans	63	141.8	138.6	-65.5	-175.3	175.6	-177.8	0	117.2
27	Q	23.8	Very low	26.1	Very low	167 Å²	167	134 Å²	134	78%	0.78	77%	0.774	S	S	*	*			cis	-170.2	-171.3	14	-125.9	176.2	-21.6	0	0	104.5
28	P	27.5	Very low	26.3	Very low	113 Å²	113	134.2 Å²	134.2	73%	0.734	76%	0.761	S	S	*	*			cis	-136	173.2	-7.4	30.7	-7.2	0	0	0	115.3
29	N	26.1	Very low	27	Very low	148 Å²	148	130.4 Å²	130.4	79%	0.791	73%	0.729	S	S	*	*			trans	-56	141.8	156.8	-102.8	10.6	0	0	0	112.1
30	D	26.4	Very low	27.8	Very low	128 Å²	128	124.4 Å²	124.4	68%	0.684	70%	0.697	S	S	*	*				-174.9	136	99.2	-106.2	-5.8	0	0	0	112.1
31	D	27.5	Very low	28.7	Very low	140 Å²	140	116.5 Å²	116.5	75%	0.749	66%	0.661	S	S	*	*			trans	57.1	118.5	147.1	-60.8	-18.8	0	0	0	123.3
32	S	24.4	Very low	29.5	Very low	108 Å²	108	118.2 Å²	118.2	76%	0.755	64%	0.642	S	S	*	*				-165.3	121.5	94.1	64.3	0	0	0	0	112	R34	S32-R34 PolarHBondContact O-N 2.95Å
33	D	30.6	Very low	30.3	Very low	164 Å²	164	117.8 Å²	117.8	88%	0.877	63%	0.625	S	S	*	*			trans	-59.1	125.3	167.1	-85	-44.2	0	0	0	111.7
34	R	27.2	Very low	31.3	Very low	227 Å²	227	113.5 Å²	113.5	86%	0.857	59%	0.594	S	S	*	*			trans	-125.8	96.7	158.5	-93.2	-175	170.5	-178.8	-1.3	109.7	S32 S36	S32-R34 PolarHBondContact O-N 2.95Å; R34-S36 PolarHBondContact O-N 3.01Å
35	S	31.7	Very low	32.1	Very low	120 Å²	120	105.2 Å²	105.2	84%	0.839	57%	0.565	S	S	*	*			trans	28	87.3	148.1	67.4	0	0	0	0	116.9
36	S	28.5	Very low	32.8	Very low	94 Å²	94	101.2 Å²	101.2	66%	0.657	56%	0.562	S	S	*	*			trans	-129.4	90.5	157.9	59	0	0	0	0	109.1	R34	R34-S36 PolarHBondContact O-N 3.01Å
37	S	32.5	Very low	33.5	Very low	122 Å²	122	99.8 Å²	99.8	85%	0.853	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-66	126.1	176.2	-94.8	0	0	0	0	110.3
38	P	30	Very low	34.3	Very low	76 Å²	76	98.5 Å²	98.5	49%	0.494	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-80.1	129.7	177.9	30.6	-30.2	0	0	0	111.1	R42	P38-R42 HydrophobicContact CB-CB 4.29Å
39	S	38.4	Very low	34.7	Very low	18 Å²	18	97.2 Å²	97.2	13%	0.126	54%	0.538	C	S	.	.	P	Polyproline II helix	trans	-71.3	157.6	172.2	52.3	0	0	0	0	111.6	L41 R42 C43 E506	S39-L41 PolarHBondContact O-N 2.98Å; S39-R42 CarbonylContact O-C 3.57Å; S39-R42 VanDerWaalsContact O-CA 3.23Å; S39-R42 WeakPolarHBondContact O-CA 3.44Å; S39-R42 WeakPolarHBondContact O-CB 3.27Å; S39-R42 PolarHBondContact O-N 3.5Å; S39-C43 PolarHBondContact O-N 3Å; S39-E506 PolarHBondContact OG-OE1 2.89Å
40	V	41.6	Very low	35.2	Very low	14 Å²	14	99 Å²	99	9%	0.085	54%	0.541	C	S	.	.	H	α-helix	trans	-60.7	-25.2	173.3	137.7	0	0	0	0	113.1	R42 C43 V44 E714 H715	V40-R42 PolarHBondContact O-N 3.24Å; V40-C43 HydrophobicContact CG2-CB 4.2Å; V40-C43 PolarHBondContact O-N 3.1Å; V40-V44 PolarHBondContact O-N 2.87Å; V40-E714 HydrophobicContact CB-CB 3.28Å; V40-E714 HydrophobicContact CB-CG 4.32Å; V40-E714 HydrophobicContact CG1-CB 4.47Å; V40-E714 HydrophobicContact CG2-CB 3.36Å; V40-E714 HydrophobicContact CG2-CG 4.27Å; V40-H715 WeakPolarHBondContact CG2-CD2 3.34Å; V40-H715 WeakPolarHBondContact CG2-NE2 3.33Å
41	L	46.7	Very low	35.8	Very low	17 Å²	17	95.4 Å²	95.4	9%	0.089	54%	0.535	C	S	.	.	H	α-helix	trans	-65.8	-18.2	170.8	-60.3	158.2	0	0	0	111.9	S39 T45 N510 E514	S39-L41 PolarHBondContact O-N 2.98Å; L41-T45 WeakPolarHBondContact O-CG2 3.11Å; L41-T45 PolarHBondContact O-OG1 3.42Å; L41-N510 HydrophobicContact CB-CB 3.48Å; L41-N510 VanDerWaalsContact CB-CB 3.48Å; L41-N510 WeakPolarHBondContact CB-ND2 3.39Å; L41-N510 HydrophobicContact CD1-CB 3.44Å; L41-N510 VanDerWaalsContact CD1-CB 3.44Å; L41-N510 VanDerWaalsContact CD1-ND2 3.29Å; L41-N510 WeakPolarHBondContact CD1-ND2 3.31Å; L41-N510 HydrophobicContact CD2-CB 3.81Å; L41-N510 HydrophobicContact CG-CB 3.69Å; L41-E514 HydrophobicContact CD2-CG 4.23Å
42	R	40.7	Very low	36.3	Very low	118 Å²	118	90 Å²	90	45%	0.445	51%	0.506	S	S	.	.	H	α-helix	trans	-92.1	-30.2	167.3	-149.1	-176.8	-161.8	-164	0.5	113.5	P38 S39 V40 T45 S46	P38-R42 HydrophobicContact CB-CB 4.29Å; S39-R42 CarbonylContact O-C 3.57Å; S39-R42 VanDerWaalsContact O-CA 3.23Å; S39-R42 WeakPolarHBondContact O-CA 3.44Å; S39-R42 WeakPolarHBondContact O-CB 3.27Å; S39-R42 PolarHBondContact O-N 3.5Å; V40-R42 PolarHBondContact O-N 3.24Å; R42-T45 VanDerWaalsContact CA-OG1 3.26Å; R42-T45 WeakPolarHBondContact CA-OG1 3.47Å; R42-T45 CarbonylContact O-C 3.58Å; R42-T45 PolarHBondContact O-N 3.45Å; R42-T45 VanDerWaalsContact O-N 3.17Å; R42-T45 PolarHBondContact O-OG1 3.39Å; R42-T45 VanDerWaalsContact O-OG1 3.05Å; R42-S46 PolarHBondContact O-N 3.13Å
43	C	39.8	Very low	37.1	Very low	71 Å²	71	91.2 Å²	91.2	48%	0.48	50%	0.503	S	S	.	.	H	α-helix	trans	-65.3	-46.3	-177.9	-164.9	0	0	0	0	111.4	S39 V40 T45 S46	S39-C43 PolarHBondContact O-N 3Å; V40-C43 HydrophobicContact CG2-CB 4.2Å; V40-C43 PolarHBondContact O-N 3.1Å; C43-T45 PolarHBondContact O-N 2.93Å; C43-S46 PolarHBondContact O-N 2.95Å; C43-S46 VanDerWaalsContact O-N 3.13Å; C43-S46 PolarHBondContact O-OG 2.74Å
44	V	43.4	Very low	37.6	Very low	26 Å²	26	90.1 Å²	90.1	16%	0.158	50%	0.497	C	S	.	.	H	α-helix	trans	-61.8	-35.6	172.1	-179.2	0	0	0	0	110.8	V40 S46 W48	V40-V44 PolarHBondContact O-N 2.87Å; V44-S46 PolarHBondContact O-N 3.12Å; V44-W48 WeakPolarHBondContact O-CB 3.16Å; V44-W48 VanDerWaalsContact O-CD1 3.29Å; V44-W48 PolarHBondContact O-N 3.46Å
45	T	41	Very low	38.9	Very low	17 Å²	17	84.4 Å²	84.4	10%	0.104	48%	0.476	C	S	.	.	H	α-helix	trans	-82.1	-3.6	178	64.4	0	0	0	0	114.1	L41 R42 C43 K49 L52	L41-T45 WeakPolarHBondContact O-CG2 3.11Å; L41-T45 PolarHBondContact O-OG1 3.42Å; R42-T45 VanDerWaalsContact CA-OG1 3.26Å; R42-T45 WeakPolarHBondContact CA-OG1 3.47Å; R42-T45 CarbonylContact O-C 3.58Å; R42-T45 PolarHBondContact O-N 3.45Å; R42-T45 VanDerWaalsContact O-N 3.17Å; R42-T45 PolarHBondContact O-OG1 3.39Å; R42-T45 VanDerWaalsContact O-OG1 3.05Å; C43-T45 PolarHBondContact O-N 2.93Å; T45-K49 WeakPolarHBondContact O-CA 3.26Å; T45-K49 WeakPolarHBondContact O-CB 3.32Å; T45-K49 VanDerWaalsContact O-CD 3.28Å; T45-K49 WeakPolarHBondContact O-CD 3.44Å; T45-K49 WeakPolarHBondContact O-CG 3.42Å; T45-K49 PolarHBondContact O-N 3.15Å; T45-L52 HydrophobicContact CG2-CD1 4.41Å
46	S	37.2	Very low	40.4	Very low	83 Å²	83	87.8 Å²	87.8	58%	0.58	48%	0.475	S	S	*	.	H	α-helix	trans	-83	-38.2	178.6	69.2	0	0	0	0	112.8	R42 C43 V44	R42-S46 PolarHBondContact O-N 3.13Å; C43-S46 PolarHBondContact O-N 2.95Å; C43-S46 VanDerWaalsContact O-N 3.13Å; C43-S46 PolarHBondContact O-OG 2.74Å; V44-S46 PolarHBondContact O-N 3.12Å
47	T	39.2	Very low	42.8	Very low	125 Å²	125	88.1 Å²	88.1	77%	0.767	46%	0.462	S	S	*	.	H	α-helix	trans	-82.9	-19.4	169.6	37.5	0	0	0	0	112.7
48	W	40.8	Very low	45.3	Very low	139 Å²	139	83.3 Å²	83.3	53%	0.527	43%	0.428	S	S	.	.	H	α-helix	trans	-107.8	-3.1	179.2	-69.7	62.9	0	0	0	115.8	V44 E50 G51 L52	V44-W48 WeakPolarHBondContact O-CB 3.16Å; V44-W48 VanDerWaalsContact O-CD1 3.29Å; V44-W48 PolarHBondContact O-N 3.46Å; W48-E50 VanDerWaalsContact C-N 3.28Å; W48-E50 PolarHBondContact O-N 2.95Å; W48-G51 PolarHBondContact O-N 2.89Å; W48-G51 VanDerWaalsContact O-N 3.13Å; W48-L52 HydrophobicContact CB-CD1 3.66Å; W48-L52 HydrophobicContact CB-CG 4.21Å; W48-L52 HydrophobicContact CE3-CD1 4.3Å; W48-L52 HydrophobicContact CE3-CD2 4.45Å; W48-L52 HydrophobicContact CE3-CG 4.27Å; W48-L52 PolarHBondContact O-N 3.1Å
49	K	35.8	Very low	48.1	Very low	87 Å²	87	81.7 Å²	81.7	38%	0.378	41%	0.413	S	S	.	.	H	α-helix	trans	-59.6	-36.8	-172.4	-120.6	161.6	-176	-175.7	0	113.7	T45 G51 L53	T45-K49 WeakPolarHBondContact O-CA 3.26Å; T45-K49 WeakPolarHBondContact O-CB 3.32Å; T45-K49 VanDerWaalsContact O-CD 3.28Å; T45-K49 WeakPolarHBondContact O-CD 3.44Å; T45-K49 WeakPolarHBondContact O-CG 3.42Å; T45-K49 PolarHBondContact O-N 3.15Å; K49-G51 VanDerWaalsContact C-N 3.29Å; K49-G51 PolarHBondContact O-N 2.65Å; K49-L53 WeakPolarHBondContact O-CD1 3.12Å; K49-L53 WeakPolarHBondContact O-CG 3.33Å
50	E	35.9	Very low	50.6	Low	184 Å²	184	81.5 Å²	81.5	86%	0.86	41%	0.411	S	S	*	.	H	α-helix	trans	-75.4	-22.3	-176.1	-64.9	-174.2	166.3	0	0	111.9	W48	W48-E50 VanDerWaalsContact C-N 3.28Å; W48-E50 PolarHBondContact O-N 2.95Å
51	G	39.2	Very low	52.9	Low	53 Å²	53	81.4 Å²	81.4	55%	0.546	41%	0.413	S	S	.	.	H	α-helix	trans	-93.1	-35.9	176.9	0	0	0	0	0	115.1	W48 K49	W48-G51 PolarHBondContact O-N 2.89Å; W48-G51 VanDerWaalsContact O-N 3.13Å; K49-G51 VanDerWaalsContact C-N 3.29Å; K49-G51 PolarHBondContact O-N 2.65Å
52	L	38.4	Very low	55.1	Low	28 Å²	28	85.2 Å²	85.2	15%	0.147	43%	0.426	C	S	.	.	H	α-helix	trans	-77.4	-33.3	-173.2	-76	168	0	0	0	113.9	T45 W48 N54 R55	T45-L52 HydrophobicContact CG2-CD1 4.41Å; W48-L52 HydrophobicContact CB-CD1 3.66Å; W48-L52 HydrophobicContact CB-CG 4.21Å; W48-L52 HydrophobicContact CE3-CD1 4.3Å; W48-L52 HydrophobicContact CE3-CD2 4.45Å; W48-L52 HydrophobicContact CE3-CG 4.27Å; W48-L52 PolarHBondContact O-N 3.1Å; L52-N54 PolarHBondContact O-N 3.43Å; L52-R55 PolarHBondContact O-N 3.32Å
53	L	41.1	Very low	57.7	Low	133 Å²	133	80 Å²	80	70%	0.696	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-14.5	176.5	-67.5	172.2	0	0	0	113.3	K49	K49-L53 WeakPolarHBondContact O-CD1 3.12Å; K49-L53 WeakPolarHBondContact O-CG 3.33Å
54	N	40.2	Very low	60.2	Low	140 Å²	140	78 Å²	78	75%	0.749	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	2.4	177.2	-83.9	-28.4	0	0	0	114.2	L52 K56	L52-N54 PolarHBondContact O-N 3.43Å; N54-K56 PolarHBondContact O-N 2.5Å
55	R	54.3	Low	62.6	Low	108 Å²	108	82.4 Å²	82.4	41%	0.408	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-74	116.7	-176	-160.1	171.6	162.4	174	-7.2	109.9	L52 S517 D519	L52-R55 PolarHBondContact O-N 3.32Å; R55-S517 PolarHBondContact NH2-O 2.99Å; R55-D519 IonicContact NH2-OD1 3Å; R55-D519 PolarHBondContact NH2-OD1 2.95Å
56	K	64.5	Low	65	Low	190 Å²	190	84.1 Å²	84.1	83%	0.826	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-63	143.6	172.7	-66.2	178.3	-178.5	174.6	0	108.9	N54	N54-K56 PolarHBondContact O-N 2.5Å
57	R	77.8	Confident	67.7	Low	102 Å²	102	80.2 Å²	80.2	39%	0.385	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-46.9	133.4	174.1	-75.5	178.7	174.2	-110.4	-0.3	110.6	D521 L522 F524	R57-D521 IonicContact CZ-OD1 2.89Å; R57-D521 IonicContact NH1-OD1 3.66Å; R57-D521 PolarHBondContact NH1-OD1 3.19Å; R57-L522 PolarHBondContact NH1-O 3.11Å; R57-F524 PolarHBondContact NH2-O 3.32Å
58	P	85.3	Confident	70.4	Confident	21 Å²	21	74.4 Å²	74.4	14%	0.136	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-64.6	139	178.9	27	-33.2	0	0	0	110.1	V60 L516 D519 F520	P58-V60 PolarHBondContact O-N 3.3Å; P58-L516 HydrophobicContact CG-CD2 4.42Å; P58-D519 HydrophobicContact CB-CB 4.35Å; P58-F520 WeakPolarHBondContact CG-O 3.42Å
59	F	89	Confident	72.9	Confident	42 Å²	42	70 Å²	70	18%	0.184	35%	0.352	C	S	.	.			trans	-84.4	108.4	170.6	-179.2	-96.8	0	0	0	109.4	R62 F76 I80 P81 H205 Q208 M211	F59-R62 HydrophobicContact CD1-CG 4.09Å; F59-R62 HydrophobicContact CE1-CG 3.99Å; F59-F76 HydrophobicContact CD1-CD2 4.42Å; F59-F76 AromaticContact CD1-CE2 3.57Å; F59-F76 HydrophobicContact CD1-CE2 3.57Å; F59-F76 HydrophobicContact CD1-CZ 4.24Å; F59-F76 AromaticContact CE1-CD2 3.87Å; F59-F76 HydrophobicContact CE1-CD2 3.87Å; F59-F76 AromaticContact CE1-CE2 3.41Å; F59-F76 HydrophobicContact CE1-CE2 3.41Å; F59-F76 VanDerWaalsContact CE1-CE2 3.41Å; F59-F76 HydrophobicContact CE1-CZ 4.47Å; F59-F76 HydrophobicContact CG-CE2 4.34Å; F59-F76 HydrophobicContact CZ-CD2 4.45Å; F59-F76 HydrophobicContact CZ-CE2 4.07Å; F59-I80 HydrophobicContact CD2-CG2 4.25Å; F59-I80 HydrophobicContact CE1-CG2 4.3Å; F59-I80 HydrophobicContact CE2-CG2 3.51Å; F59-I80 HydrophobicContact CZ-CG2 3.54Å; F59-P81 HydrophobicContact CB-CB 4.03Å; F59-P81 HydrophobicContact CB-CG 3.83Å; F59-P81 HydrophobicContact CD2-CB 4.24Å; F59-P81 HydrophobicContact CD2-CG 4.09Å; F59-P81 HydrophobicContact CG-CB 4.32Å; F59-P81 HydrophobicContact CG-CG 3.88Å; F59-H205 AromaticContact CD2-CE1 3.85Å; F59-H205 AromaticContact CE2-CE1 3.65Å; F59-H205 AromaticContact CE2-ND1 3.78Å; F59-Q208 HydrophobicContact CE2-CG 3.86Å; F59-Q208 HydrophobicContact CZ-CG 3.9Å; F59-M211 HydrophobicContact CE1-CE 4.25Å; F59-M211 HydrophobicContact CZ-CE 3.71Å
60	V	91	Very high	75.6	Confident	13 Å²	13	71.2 Å²	71.2	8%	0.079	36%	0.359	C	S	.	.			trans	-94.5	157.3	-178.5	-61.7	0	0	0	0	112.4	P58 Q208 D519 D521	P58-V60 PolarHBondContact O-N 3.3Å; V60-Q208 PolarHBondContact O-NE2 3.23Å; V60-Q208 VanDerWaalsContact O-NE2 3.14Å; V60-D519 WeakPolarHBondContact CG1-O 3.48Å; V60-D521 HydrophobicContact CG1-CB 4.16Å; V60-D521 HydrophobicContact CG2-CB 4.15Å
61	G	90	Very high	78.4	Confident	12 Å²	12	62.5 Å²	62.5	12%	0.124	32%	0.318	C	S	.	.			trans	89.3	26.7	171.7	0	0	0	0	0	115.3	T400 Q401	G61-T400 CarbonylContact O-C 3.6Å; G61-T400 VanDerWaalsContact O-CA 3.24Å; G61-T400 WeakPolarHBondContact O-CA 3.42Å; G61-T400 VanDerWaalsContact O-CB 3.29Å; G61-T400 WeakPolarHBondContact O-CB 3.45Å; G61-Q401 PolarHBondContact O-N 2.88Å
62	R	93.4	Very high	80.9	Confident	98 Å²	98	61.4 Å²	61.4	37%	0.37	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-68.1	146.6	164.7	-66.7	-165.4	68.6	-165	1.7	110.5	F59 Q72	F59-R62 HydrophobicContact CD1-CG 4.09Å; F59-R62 HydrophobicContact CE1-CG 3.99Å; R62-Q72 PolarHBondContact NH2-O 2.94Å; R62-Q72 VanDerWaalsContact NH2-O 3.14Å
63	C	93.8	Very high	83.3	Confident	7 Å²	7	63.4 Å²	63.4	5%	0.047	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-71.9	162.9	173.6	62.6	0	0	0	0	110.7	H65 Q72 Q401 F403	C63-H65 PolarHBondContact O-N 3.25Å; C63-Q72 WeakPolarHBondContact SG-CA 3.27Å; C63-Q401 HydrophobicContact CB-CB 4.31Å; C63-Q401 HydrophobicContact CB-CG 4.46Å; C63-F403 HydrophobicContact CB-CB 4.08Å; C63-F403 HydrophobicContact CB-CD1 4.21Å
64	C	93.6	Very high	85.6	Confident	30 Å²	30	64 Å²	64	20%	0.203	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-70.6	123.4	-173.8	179.8	0	0	0	0	111	S66 C67 T68 H470	C64-S66 VanDerWaalsContact C-N 3.29Å; C64-S66 PolarHBondContact O-N 2.84Å; C64-C67 HydrophobicContact CB-CB 4.06Å; C64-C67 PolarHBondContact O-N 3.38Å; C64-C67 VanDerWaalsContact SG-SG 3.68Å; C64-T68 CarbonylContact O-C 3.56Å; C64-T68 PolarHBondContact O-N 2.84Å; C64-T68 PolarHBondContact O-OG1 3.34Å; C64-T68 VanDerWaalsContact O-OG1 3.06Å; C64-H470 VanDerWaalsContact CB-NE2 3.32Å; C64-H470 WeakPolarHBondContact CB-NE2 3.38Å
65	H	92.8	Very high	87.7	Confident	118 Å²	118	57.4 Å²	57.4	55%	0.546	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-40.5	177	-175.7	67.2	0	0	0	112	C63 P69 Q72	C63-H65 PolarHBondContact O-N 3.25Å; H65-P69 WeakPolarHBondContact O-CA 3.48Å; H65-P69 WeakPolarHBondContact O-CB 3.37Å; H65-P69 WeakPolarHBondContact O-CD 3.33Å; H65-Q72 PolarHBondContact ND1-OE1 3.35Å
66	S	92.2	Very high	89.3	Confident	54 Å²	54	54.5 Å²	54.5	38%	0.378	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-46.4	-179	-174	0	0	0	0	110.8	C64 R415	C64-S66 VanDerWaalsContact C-N 3.29Å; C64-S66 PolarHBondContact O-N 2.84Å; S66-R415 VanDerWaalsContact C-NH2 3.27Å; S66-R415 PolarHBondContact O-NH2 2.93Å; S66-R415 PolarHBondContact OG-NH1 3Å; S66-R415 PolarHBondContact OG-NH2 3.42Å
67	C	93.5	Very high	90.4	Very high	1 Å²	1	49 Å²	49	1%	0.007	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-30	-174.4	-59	0	0	0	0	114.3	C64 Y408 T411 C638	C64-C67 HydrophobicContact CB-CB 4.06Å; C64-C67 PolarHBondContact O-N 3.38Å; C64-C67 VanDerWaalsContact SG-SG 3.68Å; C67-Y408 HydrophobicContact CB-CD2 3.77Å; C67-Y408 HydrophobicContact CB-CE2 3.86Å; C67-T411 WeakPolarHBondContact O-CB 3.4Å; C67-T411 PolarHBondContact O-OG1 2.77Å; C67-C638 WeakPolarHBondContact SG-CB 3.16Å
68	T	95.1	Very high	90.8	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.012	27%	0.268	C	S	.	.			trans	-144.7	62.9	-173.1	58.2	0	0	0	0	111.8	C64 Q70 Q72 F403 E407 Y408	C64-T68 CarbonylContact O-C 3.56Å; C64-T68 PolarHBondContact O-N 2.84Å; C64-T68 PolarHBondContact O-OG1 3.34Å; C64-T68 VanDerWaalsContact O-OG1 3.06Å; T68-Q70 PolarHBondContact O-N 2.82Å; T68-Q72 VanDerWaalsContact O-CB 3.31Å; T68-Q72 WeakPolarHBondContact O-CB 3.26Å; T68-Q72 PolarHBondContact O-N 3.48Å; T68-F403 HydrophobicContact CG2-CB 3.99Å; T68-F403 HydrophobicContact CG2-CD2 3.71Å; T68-F403 HydrophobicContact CG2-CE2 4.5Å; T68-F403 HydrophobicContact CG2-CG 4.09Å; T68-E407 WeakPolarHBondContact CA-OE1 3.42Å; T68-Y408 HydrophobicContact CG2-CD2 4.19Å
69	P	93.9	Very high	90.9	Very high	48 Å²	48	51.5 Å²	51.5	31%	0.312	28%	0.281	S	S	.	.	H	α-helix	trans	-61.7	-37.1	-175.4	24.2	-33.6	0	0	0	114.3	H65 Q72 A73 E407	H65-P69 WeakPolarHBondContact O-CA 3.48Å; H65-P69 WeakPolarHBondContact O-CB 3.37Å; H65-P69 WeakPolarHBondContact O-CD 3.33Å; P69-Q72 PolarHBondContact O-N 3.49Å; P69-A73 PolarHBondContact O-N 3.03Å; P69-E407 VanDerWaalsContact CD-OE1 3.25Å; P69-E407 WeakPolarHBondContact CD-OE1 3.26Å
70	Q	93.1	Very high	90.8	Very high	111 Å²	111	49.8 Å²	49.8	52%	0.519	27%	0.274	S	S	.	.	H	α-helix	trans	-69.7	-48.3	-179.6	-51	-178.7	24.5	0	0	111.1	T68 Q72 A73 R74 E407	T68-Q70 PolarHBondContact O-N 2.82Å; Q70-Q72 PolarHBondContact O-N 2.98Å; Q70-A73 PolarHBondContact O-N 3.46Å; Q70-R74 WeakPolarHBondContact O-CG 3.34Å; Q70-R74 PolarHBondContact O-N 3Å; Q70-E407 WeakPolarHBondContact CA-OE1 3.48Å; Q70-E407 VanDerWaalsContact CB-OE1 3.26Å; Q70-E407 WeakPolarHBondContact CB-OE1 3.33Å; Q70-E407 PolarHBondContact N-OE1 3Å
71	S	93.4	Very high	90.6	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.014	29%	0.286	C	S	.	.	H	α-helix	trans	-58.4	-39.2	174.3	-68.2	0	0	0	0	111.6	A73 L75 Q401 S404 E407	S71-A73 VanDerWaalsContact C-N 3.32Å; S71-A73 PolarHBondContact O-N 3.07Å; S71-L75 PolarHBondContact O-N 3.03Å; S71-Q401 PolarHBondContact O-NE2 2.61Å; S71-S404 PolarHBondContact OG-N 3.03Å; S71-E407 VanDerWaalsContact CB-OE2 3.23Å; S71-E407 WeakPolarHBondContact CB-OE2 3.37Å; S71-E407 PolarHBondContact N-OE1 2.64Å; S71-E407 PolarHBondContact N-OE2 3.21Å; S71-E407 PolarHBondContact OG-OE2 3.43Å
72	Q	92	Very high	90.5	Very high	30 Å²	30	55.8 Å²	55.8	14%	0.14	31%	0.313	C	S	.	.	H	α-helix	trans	-63.1	-36.5	-179.3	-159.6	-136.2	30.7	0	0	113	R62 C63 H65 T68 P69 Q70 Q401	R62-Q72 PolarHBondContact NH2-O 2.94Å; R62-Q72 VanDerWaalsContact NH2-O 3.14Å; C63-Q72 WeakPolarHBondContact SG-CA 3.27Å; H65-Q72 PolarHBondContact ND1-OE1 3.35Å; T68-Q72 VanDerWaalsContact O-CB 3.31Å; T68-Q72 WeakPolarHBondContact O-CB 3.26Å; T68-Q72 PolarHBondContact O-N 3.48Å; P69-Q72 PolarHBondContact O-N 3.49Å; Q70-Q72 PolarHBondContact O-N 2.98Å; Q72-Q401 VanDerWaalsContact CA-NE2 3.32Å; Q72-Q401 PolarHBondContact O-NE2 3.28Å
73	A	90.4	Very high	90.3	Very high	69 Å²	69	54 Å²	54	57%	0.57	31%	0.31	S	S	*	.	H	α-helix	trans	-81.9	-38.3	179.6	0	0	0	0	0	113.4	P69 Q70 S71	P69-A73 PolarHBondContact O-N 3.03Å; Q70-A73 PolarHBondContact O-N 3.46Å; S71-A73 VanDerWaalsContact C-N 3.32Å; S71-A73 PolarHBondContact O-N 3.07Å
74	R	88.8	Confident	90	Very high	146 Å²	146	55 Å²	55	55%	0.551	32%	0.322	S	S	*	.	H	α-helix	trans	-77.9	-36.5	-170.1	-72.6	-179.9	-179.9	175.9	4.3	115.1	Q70 K214 Y219	Q70-R74 WeakPolarHBondContact O-CG 3.34Å; Q70-R74 PolarHBondContact O-N 3Å; R74-K214 PolarHBondContact O-NZ 3.01Å; R74-Y219 WeakPolarHBondContact CD-OH 3.36Å
75	L	84.1	Confident	89.9	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	33%	0.328	C	S	.	.	S	Bend	trans	-93.6	-12.3	-171.6	-71.7	170.6	0	0	0	113.4	S71 M211 K214 A215 Y219 M347 Q401 P402	S71-L75 PolarHBondContact O-N 3.03Å; L75-M211 VanDerWaalsContact O-CG 3.3Å; L75-M211 WeakPolarHBondContact O-CG 3.31Å; L75-K214 HydrophobicContact CD2-CB 4.25Å; L75-K214 HydrophobicContact CD2-CD 4.01Å; L75-K214 HydrophobicContact CD2-CG 4.03Å; L75-A215 HydrophobicContact CD1-CB 4.26Å; L75-A215 HydrophobicContact CD2-CB 4.21Å; L75-Y219 HydrophobicContact CD1-CE2 4.4Å; L75-Y219 HydrophobicContact CD2-CE2 3.81Å; L75-Y219 HydrophobicContact CG-CE2 4.25Å; L75-M347 HydrophobicContact CD1-CE 3.79Å; L75-Q401 HydrophobicContact CB-CG 4.18Å; L75-P402 HydrophobicContact CD1-CB 3.99Å; L75-P402 WeakPolarHBondContact CD1-O 3.46Å
76	F	88.7	Confident	89.8	Confident	46 Å²	46	56.3 Å²	56.3	20%	0.202	32%	0.322	C	S	.	.			trans	-106.5	145	-179.9	-175.1	-97.2	0	0	0	111.8	F59 I80 P81 M211	F59-F76 HydrophobicContact CD1-CD2 4.42Å; F59-F76 AromaticContact CD1-CE2 3.57Å; F59-F76 HydrophobicContact CD1-CE2 3.57Å; F59-F76 HydrophobicContact CD1-CZ 4.24Å; F59-F76 AromaticContact CE1-CD2 3.87Å; F59-F76 HydrophobicContact CE1-CD2 3.87Å; F59-F76 AromaticContact CE1-CE2 3.41Å; F59-F76 HydrophobicContact CE1-CE2 3.41Å; F59-F76 VanDerWaalsContact CE1-CE2 3.41Å; F59-F76 HydrophobicContact CE1-CZ 4.47Å; F59-F76 HydrophobicContact CG-CE2 4.34Å; F59-F76 HydrophobicContact CZ-CD2 4.45Å; F59-F76 HydrophobicContact CZ-CE2 4.07Å; F76-I80 HydrophobicContact CD2-CB 4.43Å; F76-I80 HydrophobicContact CD2-CD1 4.17Å; F76-I80 HydrophobicContact CD2-CG2 4.21Å; F76-I80 HydrophobicContact CE2-CB 4.13Å; F76-I80 HydrophobicContact CE2-CG2 3.86Å; F76-P81 HydrophobicContact CE2-CG 4.24Å; F76-P81 HydrophobicContact CZ-CG 3.93Å; F76-M211 HydrophobicContact CB-SD 4.44Å; F76-M211 HydrophobicContact CD2-SD 4.11Å
77	N	86.6	Confident	89.9	Confident	74 Å²	74	56.2 Å²	56.2	40%	0.396	32%	0.317	S	S	.	.			trans	-140.3	159.1	172.2	70.8	45.7	0	0	0	109.8	S79 I80	N77-S79 PolarHBondContact O-N 3.25Å; N77-S79 VanDerWaalsContact O-N 3.17Å; N77-S79 WeakPolarHBondContact OD1-CA 3.3Å; N77-S79 WeakPolarHBondContact OD1-CB 3.33Å; N77-S79 PolarHBondContact OD1-N 3.22Å; N77-S79 PolarHBondContact OD1-OG 3.42Å; N77-I80 WeakPolarHBondContact O-CB 3.38Å; N77-I80 PolarHBondContact O-N 2.76Å; N77-I80 WeakPolarHBondContact OD1-CG1 3.48Å; N77-I80 PolarHBondContact OD1-N 2.69Å
78	S	86.5	Confident	89.9	Confident	117 Å²	117	56.5 Å²	56.5	82%	0.818	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-18	-175.7	54.9	0	0	0	0	114.3
79	S	87.1	Confident	89.8	Confident	60 Å²	60	56.4 Å²	56.4	42%	0.42	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-22	178	75.7	0	0	0	0	113.5	N77 S82	N77-S79 PolarHBondContact O-N 3.25Å; N77-S79 VanDerWaalsContact O-N 3.17Å; N77-S79 WeakPolarHBondContact OD1-CA 3.3Å; N77-S79 WeakPolarHBondContact OD1-CB 3.33Å; N77-S79 PolarHBondContact OD1-N 3.22Å; N77-S79 PolarHBondContact OD1-OG 3.42Å; S79-S82 WeakPolarHBondContact O-CB 3.25Å; S79-S82 PolarHBondContact O-N 3.09Å; S79-S82 PolarHBondContact O-OG 3.46Å
80	I	87.5	Confident	89.6	Confident	6 Å²	6	60.6 Å²	60.6	3%	0.031	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-53.2	-49	-175.6	-85	166.4	0	0	0	113.1	F59 F76 N77 S82 L83 H205 M211	F59-I80 HydrophobicContact CD2-CG2 4.25Å; F59-I80 HydrophobicContact CE1-CG2 4.3Å; F59-I80 HydrophobicContact CE2-CG2 3.51Å; F59-I80 HydrophobicContact CZ-CG2 3.54Å; F76-I80 HydrophobicContact CD2-CB 4.43Å; F76-I80 HydrophobicContact CD2-CD1 4.17Å; F76-I80 HydrophobicContact CD2-CG2 4.21Å; F76-I80 HydrophobicContact CE2-CB 4.13Å; F76-I80 HydrophobicContact CE2-CG2 3.86Å; N77-I80 WeakPolarHBondContact O-CB 3.38Å; N77-I80 PolarHBondContact O-N 2.76Å; N77-I80 WeakPolarHBondContact OD1-CG1 3.48Å; N77-I80 PolarHBondContact OD1-N 2.69Å; I80-S82 PolarHBondContact O-N 3.08Å; I80-L83 WeakPolarHBondContact O-CB 3.41Å; I80-L83 PolarHBondContact O-N 2.93Å; I80-L83 VanDerWaalsContact O-N 3.16Å; I80-H205 PolarHBondContact O-CE1 3.27Å; I80-M211 HydrophobicContact CD1-CG 3.53Å; I80-M211 HydrophobicContact CD1-SD 3.95Å
81	P	87.3	Confident	89.5	Confident	52 Å²	52	56.1 Å²	56.1	34%	0.338	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-59.7	-27.8	179.6	-27	36.8	0	0	0	114.1	F59 F76 L83	F59-P81 HydrophobicContact CB-CB 4.03Å; F59-P81 HydrophobicContact CB-CG 3.83Å; F59-P81 HydrophobicContact CD2-CB 4.24Å; F59-P81 HydrophobicContact CD2-CG 4.09Å; F59-P81 HydrophobicContact CG-CB 4.32Å; F59-P81 HydrophobicContact CG-CG 3.88Å; F76-P81 HydrophobicContact CE2-CG 4.24Å; F76-P81 HydrophobicContact CZ-CG 3.93Å; P81-L83 PolarHBondContact O-N 2.82Å
82	S	87.3	Confident	89.2	Confident	99 Å²	99	58 Å²	58	69%	0.692	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-74.7	-12.5	-178.5	73.8	0	0	0	0	114.1	S79 I80 G84	S79-S82 WeakPolarHBondContact O-CB 3.25Å; S79-S82 PolarHBondContact O-N 3.09Å; S79-S82 PolarHBondContact O-OG 3.46Å; I80-S82 PolarHBondContact O-N 3.08Å; S82-G84 VanDerWaalsContact C-N 3.27Å; S82-G84 PolarHBondContact O-N 2.73Å
83	L	87.9	Confident	89	Confident	60 Å²	60	58.4 Å²	58.4	31%	0.314	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-73.9	-15.5	-175.2	-67.5	178	0	0	0	114.2	I80 P81 K206 E210	I80-L83 WeakPolarHBondContact O-CB 3.41Å; I80-L83 PolarHBondContact O-N 2.93Å; I80-L83 VanDerWaalsContact O-N 3.16Å; P81-L83 PolarHBondContact O-N 2.82Å; L83-K206 HydrophobicContact CB-CB 4.05Å; L83-K206 HydrophobicContact CB-CD 4.14Å; L83-K206 HydrophobicContact CB-CG 4.35Å; L83-K206 HydrophobicContact CD2-CD 4.44Å; L83-E210 HydrophobicContact CD1-CG 4.3Å
84	G	88.4	Confident	88.8	Confident	28 Å²	28	58.9 Å²	58.9	29%	0.289	32%	0.316	S	S	.	.			trans	66.2	-170.4	170.5	0	0	0	0	0	115.7	S82 K206	S82-G84 VanDerWaalsContact C-N 3.27Å; S82-G84 PolarHBondContact O-N 2.73Å; G84-K206 PolarHBondContact O-N 3.27Å
85	L	91.4	Very high	88.6	Confident	62 Å²	62	55.5 Å²	55.5	33%	0.325	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	149	-175.7	-55.4	177	0	0	0	111.9	I204 H205	L85-I204 CarbonylContact C-O 3.56Å; L85-I204 WeakPolarHBondContact CA-O 3.46Å; L85-H205 HydrophobicContact CD2-CB 3.92Å
86	R	91.1	Very high	88.8	Confident	114 Å²	114	55.8 Å²	55.8	43%	0.43	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	138.3	174.3	-69.8	-168.1	171.9	-159	-3.2	111.3	Q203 I204 K206	R86-Q203 WeakPolarHBondContact O-CA 3.42Å; R86-I204 HydrophobicContact CB-CG1 4.46Å; R86-I204 PolarHBondContact N-O 3.42Å; R86-I204 PolarHBondContact O-N 3.37Å; R86-K206 HydrophobicContact CG-CB 4.43Å
87	N	93.8	Very high	88.8	Confident	52 Å²	52	64 Å²	64	28%	0.278	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	112.4	169.8	-173.3	3.5	0	0	0	109.7	I89 Y90 S201 I202	N87-I89 VanDerWaalsContact C-N 3.33Å; N87-I89 PolarHBondContact O-N 3.27Å; N87-I89 WeakPolarHBondContact OD1-CG1 3.44Å; N87-I89 PolarHBondContact OD1-N 3.41Å; N87-Y90 PolarHBondContact O-N 2.88Å; N87-S201 WeakPolarHBondContact ND2-CB 3.38Å; N87-I202 CarbonylContact C-O 3.54Å; N87-I202 VanDerWaalsContact CA-O 3.31Å; N87-I202 WeakPolarHBondContact CA-O 3.49Å; N87-I202 PolarHBondContact OD1-N 2.9Å; N87-I202 PolarHBondContact OD1-O 3.38Å
88	V	93	Very high	88.8	Confident	6 Å²	6	65.2 Å²	65.2	4%	0.036	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.4	-175.2	-178.5	0	0	0	0	112	I202 I204 F240 I241 C244	V88-I202 HydrophobicContact CB-CB 4.44Å; V88-I202 HydrophobicContact CB-CG2 4.36Å; V88-I202 HydrophobicContact CG2-CG2 4.41Å; V88-I202 PolarHBondContact N-O 3.2Å; V88-I204 HydrophobicContact CG2-CB 4.29Å; V88-I204 HydrophobicContact CG2-CD1 3.68Å; V88-I204 HydrophobicContact CG2-CG1 3.66Å; V88-I204 HydrophobicContact CG2-CG2 3.72Å; V88-F240 HydrophobicContact CG1-CD1 4.37Å; V88-F240 HydrophobicContact CG1-CE1 3.77Å; V88-F240 HydrophobicContact CG1-CZ 4.49Å; V88-I241 HydrophobicContact CG1-CG1 4.31Å; V88-I241 HydrophobicContact CG2-CG1 4.34Å; V88-C244 HydrophobicContact CG1-CB 3.93Å
89	I	92.9	Very high	89	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-10.1	-176.4	54.8	163.4	0	0	0	113.2	N87 I91 Y108 F195 N196 F199 I202 F240	N87-I89 VanDerWaalsContact C-N 3.33Å; N87-I89 PolarHBondContact O-N 3.27Å; N87-I89 WeakPolarHBondContact OD1-CG1 3.44Å; N87-I89 PolarHBondContact OD1-N 3.41Å; I89-I91 PolarHBondContact O-N 3.02Å; I89-Y108 PolarHBondContact O-OH 3.42Å; I89-F195 HydrophobicContact CG2-CB 3.73Å; I89-F195 HydrophobicContact CG2-CD2 4.24Å; I89-N196 HydrophobicContact CD1-CB 4.34Å; I89-F199 HydrophobicContact CD1-CB 4.36Å; I89-I202 HydrophobicContact CD1-CG1 4.22Å; I89-I202 HydrophobicContact CG1-CB 4.4Å; I89-I202 HydrophobicContact CG1-CG1 4.27Å; I89-I202 HydrophobicContact CG2-CB 4.27Å; I89-I202 HydrophobicContact CG2-CD1 3.64Å; I89-I202 HydrophobicContact CG2-CG1 3.98Å; I89-F240 HydrophobicContact CG2-CE1 3.94Å; I89-F240 HydrophobicContact CG2-CZ 4.16Å
90	Y	91	Very high	89.1	Confident	136 Å²	136	65.8 Å²	65.8	53%	0.533	33%	0.325	S	S	.	.			trans	-85.1	93.4	177.6	-176.6	-98.8	0	0	0	110.9	N87	N87-Y90 PolarHBondContact O-N 2.88Å
91	I	89.9	Confident	89.2	Confident	17 Å²	17	72.9 Å²	72.9	9%	0.087	35%	0.351	C	S	.	.			trans	-114.9	122.4	-179.8	-54.5	-61.8	0	0	0	110.9	I89 H95 S107 Y108 F111 L192	I89-I91 PolarHBondContact O-N 3.02Å; I91-H95 HydrophobicContact CG2-CB 4.24Å; I91-S107 PolarHBondContact O-OG 3.44Å; I91-Y108 HydrophobicContact CB-CD1 3.74Å; I91-Y108 HydrophobicContact CB-CE1 3.67Å; I91-Y108 HydrophobicContact CG1-CE1 4.44Å; I91-Y108 HydrophobicContact CG2-CD1 4.12Å; I91-Y108 HydrophobicContact CG2-CE1 4.5Å; I91-Y108 WeakPolarHBondContact O-CE1 3.17Å; I91-F111 HydrophobicContact CD1-CD1 4.41Å; I91-F111 HydrophobicContact CD1-CD2 4.14Å; I91-F111 HydrophobicContact CD1-CE1 4.11Å; I91-F111 HydrophobicContact CD1-CE2 3.81Å; I91-F111 HydrophobicContact CD1-CG 4.41Å; I91-F111 HydrophobicContact CD1-CZ 3.8Å; I91-F111 HydrophobicContact CG1-CD1 4.37Å; I91-F111 HydrophobicContact CG1-CE1 4.43Å; I91-F111 HydrophobicContact CG1-CG 4.47Å; I91-F111 HydrophobicContact CG2-CB 3.73Å; I91-F111 HydrophobicContact CG2-CD1 4.39Å; I91-F111 HydrophobicContact CG2-CD2 3.88Å; I91-F111 HydrophobicContact CG2-CG 3.74Å; I91-L192 HydrophobicContact CG1-CD2 3.76Å
92	N	88.3	Confident	89.1	Confident	42 Å²	42	75.6 Å²	75.6	23%	0.225	36%	0.362	C	S	.	.			trans	-126.8	-177.4	178.2	68.2	9.1	0	0	0	110.7	T94 H95	N92-T94 PolarHBondContact O-N 3.45Å; N92-T94 VanDerWaalsContact O-N 3.14Å; N92-T94 PolarHBondContact OD1-N 2.92Å; N92-T94 PolarHBondContact OD1-OG1 3.45Å; N92-H95 PolarHBondContact O-N 2.92Å; N92-H95 VanDerWaalsContact O-N 3.1Å; N92-H95 PolarHBondContact OD1-CE1 2.99Å; N92-H95 PolarHBondContact OD1-ND1 3.12Å
93	E	86.4	Confident	89.1	Confident	38 Å²	38	71 Å²	71	18%	0.178	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-63	-18.7	-178.8	71.1	-179.4	158.8	0	0	114.3	H95 T96 R99 G100 A103 R104	E93-H95 PolarHBondContact O-N 3.37Å; E93-T96 PolarHBondContact O-N 3.17Å; E93-T96 PolarHBondContact O-OG1 2.82Å; E93-R99 PolarHBondContact O-NH1 3.24Å; E93-G100 PolarHBondContact OE2-N 2.9Å; E93-A103 HydrophobicContact CB-CB 4.39Å; E93-R104 HydrophobicContact CB-CG 4.19Å; E93-R104 VanDerWaalsContact CD-NE 3.32Å; E93-R104 HydrophobicContact CG-CG 4.18Å; E93-R104 IonicContact OE1-CZ 3.42Å; E93-R104 IonicContact OE1-NE 2.78Å; E93-R104 PolarHBondContact OE1-NE 2.78Å; E93-R104 IonicContact OE1-NH2 3.51Å; E93-R104 PolarHBondContact OE1-NH2 3.45Å; E93-R104 WeakPolarHBondContact OE2-CG 3.37Å; E93-R104 IonicContact OE2-NE 3.43Å; E93-R104 PolarHBondContact OE2-NE 3.03Å; E93-R104 IonicContact OE2-NH2 3.26Å
94	T	86.8	Confident	89.1	Confident	80 Å²	80	75.3 Å²	75.3	49%	0.491	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-74.3	-17.3	176.7	66.6	0	0	0	0	113.1	N92 R99	N92-T94 PolarHBondContact O-N 3.45Å; N92-T94 VanDerWaalsContact O-N 3.14Å; N92-T94 PolarHBondContact OD1-N 2.92Å; N92-T94 PolarHBondContact OD1-OG1 3.45Å; T94-R99 VanDerWaalsContact CA-NH1 3.3Å
95	H	85.5	Confident	89.1	Confident	74 Å²	74	82.3 Å²	82.3	34%	0.343	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-91.1	-2.7	176.9	-61.9	100.2	0	0	0	113	I91 N92 E93 F111	I91-H95 HydrophobicContact CG2-CB 4.24Å; N92-H95 PolarHBondContact O-N 2.92Å; N92-H95 VanDerWaalsContact O-N 3.1Å; N92-H95 PolarHBondContact OD1-CE1 2.99Å; N92-H95 PolarHBondContact OD1-ND1 3.12Å; E93-H95 PolarHBondContact O-N 3.37Å; H95-F111 HydrophobicContact CB-CD2 4.22Å; H95-F111 HydrophobicContact CB-CE2 4.44Å
96	T	87.4	Confident	89.1	Confident	8 Å²	8	82.9 Å²	82.9	5%	0.049	36%	0.364	C	S	.	.	S	Bend	trans	-114.9	156.6	178.6	61.3	0	0	0	0	110.5	E93 H98 L110 F111	E93-T96 PolarHBondContact O-N 3.17Å; E93-T96 PolarHBondContact O-OG1 2.82Å; T96-H98 PolarHBondContact O-N 3.35Å; T96-H98 PolarHBondContact OG1-O 2.92Å; T96-H98 VanDerWaalsContact OG1-O 3.11Å; T96-L110 HydrophobicContact CG2-CB 3.94Å; T96-F111 HydrophobicContact CG2-CB 4.1Å
97	R	88.1	Confident	89.1	Confident	219 Å²	219	78 Å²	78	83%	0.826	35%	0.347	S	S	*	.	S	Bend	trans	-70.3	-18.4	174	-65	179.3	-178.8	-171.2	0.2	112.8	E114	R97-E114 PolarHBondContact N-OE1 3.46Å; R97-E114 PolarHBondContact N-OE2 3.38Å
98	H	87.6	Confident	89	Confident	100 Å²	100	77.4 Å²	77.4	46%	0.463	34%	0.341	S	S	.	.			trans	-93.1	149.5	-177	-57.8	-78.1	0	0	0	112.5	T96 A103 L110 E114	T96-H98 PolarHBondContact O-N 3.35Å; T96-H98 PolarHBondContact OG1-O 2.92Å; T96-H98 VanDerWaalsContact OG1-O 3.11Å; H98-A103 HydrophobicContact CB-CB 3.93Å; H98-L110 HydrophobicContact CB-CD1 4.03Å; H98-E114 IonicContact CD2-OE1 3.33Å; H98-E114 PolarHBondContact CD2-OE1 3.34Å; H98-E114 IonicContact NE2-OE1 3.45Å
99	R	89.9	Confident	89	Confident	160 Å²	160	79.7 Å²	79.7	60%	0.604	36%	0.355	S	S	*	.			trans	-128.7	151.5	179.3	-59.6	-63.4	-179.9	167.4	-1.5	110.9	E93 T94	E93-R99 PolarHBondContact O-NH1 3.24Å; T94-R99 VanDerWaalsContact CA-NH1 3.3Å
100	G	90.4	Very high	88.9	Confident	28 Å²	28	81.3 Å²	81.3	29%	0.289	36%	0.363	S	S	.	.	S	Bend	trans	110.8	-177.2	173	0	0	0	0	0	114.2	E93 L102 A103 R104	E93-G100 PolarHBondContact OE2-N 2.9Å; G100-L102 PolarHBondContact O-N 3.39Å; G100-A103 WeakPolarHBondContact O-CB 3.47Å; G100-A103 PolarHBondContact O-N 2.93Å; G100-A103 VanDerWaalsContact O-N 3.09Å; G100-R104 WeakPolarHBondContact O-CG 3.2Å; G100-R104 PolarHBondContact O-N 3.2Å
101	W	88.5	Confident	88.9	Confident	156 Å²	156	75.3 Å²	75.3	59%	0.591	34%	0.34	S	S	*	.	H	α-helix	trans	-56.8	-43.3	-170.1	178.7	93	0	0	0	113.9	R104 R105	W101-R104 PolarHBondContact O-N 3.05Å; W101-R105 VanDerWaalsContact CZ2-NH1 3.32Å; W101-R105 PolarHBondContact O-N 3.4Å
102	L	86.2	Confident	89	Confident	108 Å²	108	74.7 Å²	74.7	57%	0.565	34%	0.337	S	S	*	.	H	α-helix	trans	-67.7	-39.1	179.4	-170.6	67.5	0	0	0	111.4	G100 R104 R105 L106	G100-L102 PolarHBondContact O-N 3.39Å; L102-R104 VanDerWaalsContact C-N 3.31Å; L102-R104 PolarHBondContact O-N 3.34Å; L102-R105 PolarHBondContact O-N 2.91Å; L102-L106 HydrophobicContact CD1-CD1 3.7Å; L102-L106 HydrophobicContact CD1-CG 4.24Å; L102-L106 HydrophobicContact CG-CD1 3.97Å; L102-L106 WeakPolarHBondContact O-CB 3.34Å; L102-L106 PolarHBondContact O-N 2.58Å
103	A	87.6	Confident	89.1	Confident	4 Å²	4	78 Å²	78	3%	0.033	35%	0.354	C	S	.	.	H	α-helix	trans	-63.9	-36.1	177.2	0	0	0	0	0	112	E93 H98 G100 S107 L110	E93-A103 HydrophobicContact CB-CB 4.39Å; H98-A103 HydrophobicContact CB-CB 3.93Å; G100-A103 WeakPolarHBondContact O-CB 3.47Å; G100-A103 PolarHBondContact O-N 2.93Å; G100-A103 VanDerWaalsContact O-N 3.09Å; A103-S107 WeakPolarHBondContact O-CA 3.36Å; A103-S107 WeakPolarHBondContact O-CB 3.29Å; A103-S107 PolarHBondContact O-N 3.36Å; A103-L110 HydrophobicContact CB-CD1 4Å
104	R	87.9	Confident	89.3	Confident	149 Å²	149	78.5 Å²	78.5	56%	0.562	36%	0.357	S	S	*	.	H	α-helix	trans	-66	-38.6	174	-64.7	175.8	-163.7	146.7	5.9	112.8	E93 G100 W101 L102	E93-R104 HydrophobicContact CB-CG 4.19Å; E93-R104 VanDerWaalsContact CD-NE 3.32Å; E93-R104 HydrophobicContact CG-CG 4.18Å; E93-R104 IonicContact OE1-CZ 3.42Å; E93-R104 IonicContact OE1-NE 2.78Å; E93-R104 PolarHBondContact OE1-NE 2.78Å; E93-R104 IonicContact OE1-NH2 3.51Å; E93-R104 PolarHBondContact OE1-NH2 3.45Å; E93-R104 WeakPolarHBondContact OE2-CG 3.37Å; E93-R104 IonicContact OE2-NE 3.43Å; E93-R104 PolarHBondContact OE2-NE 3.03Å; E93-R104 IonicContact OE2-NH2 3.26Å; G100-R104 WeakPolarHBondContact O-CG 3.2Å; G100-R104 PolarHBondContact O-N 3.2Å; W101-R104 PolarHBondContact O-N 3.05Å; L102-R104 VanDerWaalsContact C-N 3.31Å; L102-R104 PolarHBondContact O-N 3.34Å
105	R	88.5	Confident	89.4	Confident	175 Å²	175	76.1 Å²	76.1	66%	0.66	34%	0.339	S	S	*	.	H	α-helix	trans	-79.9	-29	-179.3	-72.8	-166.1	171.2	-161.9	0.4	113.8	W101 L102	W101-R105 VanDerWaalsContact CZ2-NH1 3.32Å; W101-R105 PolarHBondContact O-N 3.4Å; L102-R105 PolarHBondContact O-N 2.91Å
106	L	91	Very high	89.2	Confident	75 Å²	75	76.1 Å²	76.1	39%	0.393	34%	0.341	S	S	.	.	S	Bend	trans	-110.8	21.4	-178.3	-60.4	-179.1	0	0	0	112.6	L102 Y108 V109 L110	L102-L106 HydrophobicContact CD1-CD1 3.7Å; L102-L106 HydrophobicContact CD1-CG 4.24Å; L102-L106 HydrophobicContact CG-CD1 3.97Å; L102-L106 WeakPolarHBondContact O-CB 3.34Å; L102-L106 PolarHBondContact O-N 2.58Å; L106-Y108 VanDerWaalsContact C-N 3.26Å; L106-Y108 PolarHBondContact O-N 3.2Å; L106-V109 HydrophobicContact CB-CB 4.45Å; L106-V109 PolarHBondContact O-N 3.33Å; L106-L110 HydrophobicContact CB-CD1 4.49Å; L106-L110 HydrophobicContact CB-CG 4.39Å; L106-L110 WeakPolarHBondContact O-CG 3.42Å; L106-L110 PolarHBondContact O-N 3.07Å
107	S	90.4	Very high	88.7	Confident	12 Å²	12	76.4 Å²	76.4	8%	0.084	34%	0.343	C	S	.	.	H	α-helix	trans	-53	-43.3	-174.2	62.1	0	0	0	0	112.3	I91 A103 V109 F111	I91-S107 PolarHBondContact O-OG 3.44Å; A103-S107 WeakPolarHBondContact O-CA 3.36Å; A103-S107 WeakPolarHBondContact O-CB 3.29Å; A103-S107 PolarHBondContact O-N 3.36Å; S107-V109 PolarHBondContact O-N 3.03Å; S107-F111 WeakPolarHBondContact O-CB 3.22Å; S107-F111 PolarHBondContact O-N 2.9Å
108	Y	91.4	Very high	88	Confident	38 Å²	38	70.4 Å²	70.4	15%	0.149	32%	0.324	C	S	.	.	H	α-helix	trans	-66.9	-38.7	179.3	-67.7	4.4	0	0	0	112.2	I89 I91 L106 V112 L192 K193 N196	I89-Y108 PolarHBondContact O-OH 3.42Å; I91-Y108 HydrophobicContact CB-CD1 3.74Å; I91-Y108 HydrophobicContact CB-CE1 3.67Å; I91-Y108 HydrophobicContact CG1-CE1 4.44Å; I91-Y108 HydrophobicContact CG2-CD1 4.12Å; I91-Y108 HydrophobicContact CG2-CE1 4.5Å; I91-Y108 WeakPolarHBondContact O-CE1 3.17Å; L106-Y108 VanDerWaalsContact C-N 3.26Å; L106-Y108 PolarHBondContact O-N 3.2Å; Y108-V112 WeakPolarHBondContact O-CB 3.4Å; Y108-V112 WeakPolarHBondContact O-CG2 3.37Å; Y108-V112 PolarHBondContact O-N 2.65Å; Y108-V112 VanDerWaalsContact O-N 3.16Å; Y108-L192 HydrophobicContact CD2-CB 3.82Å; Y108-L192 HydrophobicContact CE2-CB 4.08Å; Y108-L192 HydrophobicContact CG-CB 4.24Å; Y108-L192 HydrophobicContact CG-CD1 4.31Å; Y108-K193 HydrophobicContact CD2-CG 3.92Å; Y108-K193 HydrophobicContact CE2-CG 4.28Å; Y108-N196 PolarHBondContact OH-ND2 3.06Å
109	V	92.2	Very high	86.8	Confident	54 Å²	54	73.8 Å²	73.8	33%	0.327	34%	0.337	S	S	.	.	H	α-helix	trans	-67.7	-49.9	178.9	178	0	0	0	0	109.5	L106 S107 F111 V112 L113	L106-V109 HydrophobicContact CB-CB 4.45Å; L106-V109 PolarHBondContact O-N 3.33Å; S107-V109 PolarHBondContact O-N 3.03Å; V109-F111 PolarHBondContact O-N 2.8Å; V109-V112 PolarHBondContact O-N 3.35Å; V109-L113 HydrophobicContact CG1-CD1 3.9Å; V109-L113 HydrophobicContact CG1-CG 4.41Å; V109-L113 VanDerWaalsContact O-CG 3.28Å; V109-L113 WeakPolarHBondContact O-CG 3.43Å; V109-L113 PolarHBondContact O-N 2.99Å
110	L	91.8	Very high	85.6	Confident	34 Å²	34	70.6 Å²	70.6	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-60.7	-46.2	178.9	-65.1	174	0	0	0	111.3	T96 H98 A103 L106 V112 L113 E114	T96-L110 HydrophobicContact CG2-CB 3.94Å; H98-L110 HydrophobicContact CB-CD1 4.03Å; A103-L110 HydrophobicContact CB-CD1 4Å; L106-L110 HydrophobicContact CB-CD1 4.49Å; L106-L110 HydrophobicContact CB-CG 4.39Å; L106-L110 WeakPolarHBondContact O-CG 3.42Å; L106-L110 PolarHBondContact O-N 3.07Å; L110-V112 VanDerWaalsContact C-N 3.33Å; L110-V112 PolarHBondContact O-N 3.47Å; L110-L113 PolarHBondContact O-N 3.13Å; L110-E114 WeakPolarHBondContact O-CB 3.37Å; L110-E114 VanDerWaalsContact O-CG 3.3Å; L110-E114 WeakPolarHBondContact O-CG 3.43Å; L110-E114 PolarHBondContact O-N 2.94Å
111	F	92.1	Very high	84.8	Confident	10 Å²	10	70.8 Å²	70.8	4%	0.044	33%	0.326	C	S	.	.	H	α-helix	trans	-56.5	-45.8	178.3	177.2	-97.3	0	0	0	112.7	I91 H95 T96 S107 V109 E114 R115 L192 C244	I91-F111 HydrophobicContact CD1-CD1 4.41Å; I91-F111 HydrophobicContact CD1-CD2 4.14Å; I91-F111 HydrophobicContact CD1-CE1 4.11Å; I91-F111 HydrophobicContact CD1-CE2 3.81Å; I91-F111 HydrophobicContact CD1-CG 4.41Å; I91-F111 HydrophobicContact CD1-CZ 3.8Å; I91-F111 HydrophobicContact CG1-CD1 4.37Å; I91-F111 HydrophobicContact CG1-CE1 4.43Å; I91-F111 HydrophobicContact CG1-CG 4.47Å; I91-F111 HydrophobicContact CG2-CB 3.73Å; I91-F111 HydrophobicContact CG2-CD1 4.39Å; I91-F111 HydrophobicContact CG2-CD2 3.88Å; I91-F111 HydrophobicContact CG2-CG 3.74Å; H95-F111 HydrophobicContact CB-CD2 4.22Å; H95-F111 HydrophobicContact CB-CE2 4.44Å; T96-F111 HydrophobicContact CG2-CB 4.1Å; S107-F111 WeakPolarHBondContact O-CB 3.22Å; S107-F111 PolarHBondContact O-N 2.9Å; V109-F111 PolarHBondContact O-N 2.8Å; F111-E114 PolarHBondContact O-N 2.77Å; F111-R115 HydrophobicContact CE1-CG 4.46Å; F111-R115 WeakPolarHBondContact O-CG 3.49Å; F111-R115 PolarHBondContact O-N 3.33Å; F111-R115 PolarHBondContact O-NE 3.36Å; F111-L192 HydrophobicContact CD1-CD1 3.97Å; F111-L192 HydrophobicContact CE1-CD1 4.4Å; F111-C244 HydrophobicContact CE1-CB 4.28Å; F111-C244 HydrophobicContact CZ-CB 4.22Å; F111-C244 WeakPolarHBondContact CZ-O 3.32Å
112	V	91.9	Very high	84.3	Confident	5 Å²	5	64.8 Å²	64.8	3%	0.03	30%	0.304	C	S	.	.	H	α-helix	trans	-69.3	-38.9	179.9	165	0	0	0	0	112.1	Y108 V109 L110 E114 R115 R185 W189 L192 F243	Y108-V112 WeakPolarHBondContact O-CB 3.4Å; Y108-V112 WeakPolarHBondContact O-CG2 3.37Å; Y108-V112 PolarHBondContact O-N 2.65Å; Y108-V112 VanDerWaalsContact O-N 3.16Å; V109-V112 PolarHBondContact O-N 3.35Å; L110-V112 VanDerWaalsContact C-N 3.33Å; L110-V112 PolarHBondContact O-N 3.47Å; V112-E114 VanDerWaalsContact C-N 3.27Å; V112-E114 PolarHBondContact O-N 3.19Å; V112-R115 WeakPolarHBondContact O-CB 3.2Å; V112-R115 PolarHBondContact O-N 2.67Å; V112-R185 HydrophobicContact CG1-CB 3.65Å; V112-R185 HydrophobicContact CG1-CG 4.08Å; V112-R185 WeakPolarHBondContact CG1-O 3.13Å; V112-W189 HydrophobicContact CB-CB 4.47Å; V112-W189 HydrophobicContact CG1-CB 4.29Å; V112-W189 HydrophobicContact CG2-CB 4.02Å; V112-L192 HydrophobicContact CG2-CD1 3.83Å; V112-F243 HydrophobicContact CG1-CZ 4.16Å; V112-F243 HydrophobicContact CG2-CE1 4.24Å
113	L	89.9	Confident	84.2	Confident	111 Å²	111	60.9 Å²	60.9	58%	0.581	29%	0.288	S	S	*	.	H	α-helix	trans	-65.3	-33.9	175.6	-71.3	174.5	0	0	0	111.7	V109 L110 R115	V109-L113 HydrophobicContact CG1-CD1 3.9Å; V109-L113 HydrophobicContact CG1-CG 4.41Å; V109-L113 VanDerWaalsContact O-CG 3.28Å; V109-L113 WeakPolarHBondContact O-CG 3.43Å; V109-L113 PolarHBondContact O-N 2.99Å; L110-L113 PolarHBondContact O-N 3.13Å; L113-R115 VanDerWaalsContact C-N 3.28Å; L113-R115 PolarHBondContact O-N 3.33Å
114	E	89.5	Confident	84.1	Confident	48 Å²	48	67.5 Å²	67.5	22%	0.224	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-8	175.4	-70.6	176.6	-160.5	0	0	113.9	R97 H98 L110 F111 V112	R97-E114 PolarHBondContact N-OE1 3.46Å; R97-E114 PolarHBondContact N-OE2 3.38Å; H98-E114 IonicContact CD2-OE1 3.33Å; H98-E114 PolarHBondContact CD2-OE1 3.34Å; H98-E114 IonicContact NE2-OE1 3.45Å; L110-E114 WeakPolarHBondContact O-CB 3.37Å; L110-E114 VanDerWaalsContact O-CG 3.3Å; L110-E114 WeakPolarHBondContact O-CG 3.43Å; L110-E114 PolarHBondContact O-N 2.94Å; F111-E114 PolarHBondContact O-N 2.77Å; V112-E114 VanDerWaalsContact C-N 3.27Å; V112-E114 PolarHBondContact O-N 3.19Å
115	R	89.8	Confident	84	Confident	31 Å²	31	66 Å²	66	12%	0.117	32%	0.315	C	S	.	.	S	Bend	trans	-71.9	138.3	177	-65.7	-54	83.5	174.7	-1.2	111.1	F111 V112 L113 V117 R185 F243 C244 N246	F111-R115 HydrophobicContact CE1-CG 4.46Å; F111-R115 WeakPolarHBondContact O-CG 3.49Å; F111-R115 PolarHBondContact O-N 3.33Å; F111-R115 PolarHBondContact O-NE 3.36Å; V112-R115 WeakPolarHBondContact O-CB 3.2Å; V112-R115 PolarHBondContact O-N 2.67Å; L113-R115 VanDerWaalsContact C-N 3.28Å; L113-R115 PolarHBondContact O-N 3.33Å; R115-V117 PolarHBondContact O-N 3.15Å; R115-R185 PolarHBondContact O-NH2 2.94Å; R115-F243 HydrophobicContact CB-CD2 4.37Å; R115-F243 HydrophobicContact CB-CE1 4.47Å; R115-F243 HydrophobicContact CB-CE2 3.61Å; R115-F243 HydrophobicContact CB-CZ 3.67Å; R115-F243 WeakPolarHBondContact CD-O 3.48Å; R115-F243 HydrophobicContact CG-CD1 4.48Å; R115-F243 HydrophobicContact CG-CE1 3.85Å; R115-F243 HydrophobicContact CG-CE2 3.89Å; R115-F243 HydrophobicContact CG-CZ 3.52Å; R115-C244 PolarHBondContact NH1-O 3.35Å; R115-N246 WeakPolarHBondContact CA-OD1 3.4Å; R115-N246 WeakPolarHBondContact CD-OD1 3.47Å
116	D	81.1	Confident	83.9	Confident	74 Å²	74	58.1 Å²	58.1	40%	0.396	29%	0.286	S	S	.	.			trans	-76.8	116.3	179.6	-160.1	16.5	0	0	0	110.4	Q118 N246	D116-Q118 WeakPolarHBondContact OD1-CG 3.22Å; D116-Q118 PolarHBondContact OD1-NE2 2.97Å; D116-Q118 PolarHBondContact OD2-NE2 2.92Å; D116-N246 PolarHBondContact N-OD1 2.68Å; D116-N246 VanDerWaalsContact N-OD1 3.12Å
117	V	77.6	Confident	83.8	Confident	14 Å²	14	56 Å²	56	9%	0.085	28%	0.276	C	S	.	.			trans	-138.8	71.7	-178.9	-168.4	0	0	0	0	107	R115 F122 P181 I184 R185 F243	R115-V117 PolarHBondContact O-N 3.15Å; V117-F122 HydrophobicContact CG1-CE2 4.28Å; V117-F122 HydrophobicContact CG1-CZ 3.67Å; V117-P181 HydrophobicContact CG1-CB 3.73Å; V117-P181 HydrophobicContact CG1-CG 4.43Å; V117-I184 HydrophobicContact CG1-CD1 4.28Å; V117-I184 HydrophobicContact CG2-CG2 4.43Å; V117-R185 HydrophobicContact CG2-CG 4.2Å; V117-F243 HydrophobicContact CG2-CD2 4.43Å; V117-F243 HydrophobicContact CG2-CE2 3.81Å
118	Q	73.1	Confident	83.8	Confident	92 Å²	92	58.5 Å²	58.5	43%	0.43	29%	0.289	S	S	.	.			trans	-82.6	161.1	-177.9	-53.8	-165.6	13.7	0	0	111.6	D116 D120 M121 F122	D116-Q118 WeakPolarHBondContact OD1-CG 3.22Å; D116-Q118 PolarHBondContact OD1-NE2 2.97Å; D116-Q118 PolarHBondContact OD2-NE2 2.92Å; Q118-D120 VanDerWaalsContact C-N 3.35Å; Q118-D120 WeakPolarHBondContact CB-OD1 3.36Å; Q118-D120 PolarHBondContact O-N 3.12Å; Q118-M121 HydrophobicContact CB-CG 4.22Å; Q118-M121 HydrophobicContact CB-SD 4.34Å; Q118-M121 PolarHBondContact N-SD 3.49Å; Q118-M121 WeakPolarHBondContact O-CB 3.44Å; Q118-M121 PolarHBondContact O-N 3.21Å; Q118-F122 WeakPolarHBondContact O-CE2 3.34Å
119	K	62.2	Low	83.9	Confident	171 Å²	171	59.8 Å²	59.8	74%	0.743	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-76.5	-17.7	-175.8	-70.5	-177.3	179.1	177.6	0	114.1	M121 R124	K119-M121 VanDerWaalsContact C-N 3.32Å; K119-R124 PolarHBondContact O-NH2 3Å
120	D	64.3	Low	83.9	Confident	94 Å²	94	57.2 Å²	57.2	50%	0.503	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-79.1	-15.1	173.2	63.4	-36.7	0	0	0	112.7	Q118 F122	Q118-D120 VanDerWaalsContact C-N 3.35Å; Q118-D120 WeakPolarHBondContact CB-OD1 3.36Å; Q118-D120 PolarHBondContact O-N 3.12Å; D120-F122 PolarHBondContact O-N 3.4Å
121	M	73.3	Confident	83.9	Confident	31 Å²	31	55.6 Å²	55.6	15%	0.153	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-70.2	-4.9	173	-59.8	178.4	74.1	0	0	113.8	Q118 K119 K248 Q307	Q118-M121 HydrophobicContact CB-CG 4.22Å; Q118-M121 HydrophobicContact CB-SD 4.34Å; Q118-M121 PolarHBondContact N-SD 3.49Å; Q118-M121 WeakPolarHBondContact O-CB 3.44Å; Q118-M121 PolarHBondContact O-N 3.21Å; K119-M121 VanDerWaalsContact C-N 3.32Å; M121-K248 HydrophobicContact CB-CG 4.42Å; M121-K248 VanDerWaalsContact CE-CA 3.5Å; M121-K248 HydrophobicContact CE-CB 3.98Å; M121-K248 HydrophobicContact CE-CG 4.25Å; M121-K248 WeakPolarHBondContact O-CE 3.48Å; M121-Q307 PolarHBondContact O-OE1 2.89Å; M121-Q307 VanDerWaalsContact O-OE1 3.09Å
122	F	79.6	Confident	83.9	Confident	31 Å²	31	59.5 Å²	59.5	14%	0.136	30%	0.296	C	S	.	.	S	Bend	trans	-121.5	146.9	-175.8	-48.4	-59	0	0	0	111.8	V117 Q118 D120 I179 P181 I184	V117-F122 HydrophobicContact CG1-CE2 4.28Å; V117-F122 HydrophobicContact CG1-CZ 3.67Å; Q118-F122 WeakPolarHBondContact O-CE2 3.34Å; D120-F122 PolarHBondContact O-N 3.4Å; F122-I179 HydrophobicContact CB-CD1 4.4Å; F122-I179 HydrophobicContact CD1-CB 3.76Å; F122-I179 HydrophobicContact CD1-CD1 3.54Å; F122-I179 HydrophobicContact CD1-CG1 4.23Å; F122-I179 HydrophobicContact CD1-CG2 3.32Å; F122-I179 HydrophobicContact CE1-CB 4.14Å; F122-I179 HydrophobicContact CE1-CD1 4.3Å; F122-I179 HydrophobicContact CE1-CG2 3.18Å; F122-I179 HydrophobicContact CG-CB 4.21Å; F122-I179 HydrophobicContact CG-CD1 4.34Å; F122-I179 HydrophobicContact CG-CG2 4.08Å; F122-I179 HydrophobicContact CZ-CG2 3.84Å; F122-P181 HydrophobicContact CE2-CG 3.71Å; F122-P181 HydrophobicContact CZ-CG 4.23Å; F122-I184 HydrophobicContact CE1-CD1 3.65Å; F122-I184 HydrophobicContact CZ-CD1 3.77Å
123	A	82.2	Confident	84	Confident	26 Å²	26	60.8 Å²	60.8	22%	0.215	30%	0.302	C	S	.	.			trans	-66.1	143.2	176.3	0	0	0	0	0	111.4	V126 L302 Q307	A123-V126 HydrophobicContact CB-CG2 3.34Å; A123-L302 HydrophobicContact CB-CD2 3.71Å; A123-Q307 HydrophobicContact CB-CG 4.02Å
124	R	85.5	Confident	84.1	Confident	142 Å²	142	59.5 Å²	59.5	54%	0.536	30%	0.303	S	S	.	.			trans	-117.6	141.1	-177.5	-60.7	-177.6	-175	173.7	4.5	110.6	K119 V126 Q305	K119-R124 PolarHBondContact O-NH2 3Å; R124-V126 PolarHBondContact O-N 3.18Å; R124-Q305 PolarHBondContact O-NE2 3.32Å
125	N	85.6	Confident	84.1	Confident	117 Å²	117	63 Å²	63	63%	0.626	31%	0.314	S	S	*	.	S	Bend	trans	51	26.4	174.3	-58.6	-21.6	0	0	0	115.2	V127 D128 N129	N125-V127 VanDerWaalsContact C-N 3.29Å; N125-V127 PolarHBondContact O-N 3.37Å; N125-D128 PolarHBondContact O-N 2.96Å; N125-N129 WeakPolarHBondContact O-CB 3.19Å; N125-N129 VanDerWaalsContact O-CG 3.25Å; N125-N129 PolarHBondContact O-N 3.49Å; N125-N129 PolarHBondContact O-OD1 3.48Å
126	V	88.2	Confident	84.2	Confident	11 Å²	11	61.6 Å²	61.6	7%	0.067	31%	0.309	C	S	.	.	H	α-helix	trans	-57.4	-41.6	-173.5	-175.9	0	0	0	0	111.9	A123 R124 D128 N129 V130 Y298 E301 L302	A123-V126 HydrophobicContact CB-CG2 3.34Å; R124-V126 PolarHBondContact O-N 3.18Å; V126-D128 PolarHBondContact O-N 2.86Å; V126-N129 PolarHBondContact O-N 3.21Å; V126-V130 HydrophobicContact CG1-CG2 4.01Å; V126-V130 WeakPolarHBondContact O-CB 3.28Å; V126-V130 WeakPolarHBondContact O-CG2 3.36Å; V126-V130 PolarHBondContact O-N 2.99Å; V126-Y298 HydrophobicContact CG1-CD2 3.48Å; V126-Y298 VanDerWaalsContact CG1-CD2 3.48Å; V126-Y298 HydrophobicContact CG1-CE2 3.56Å; V126-E301 HydrophobicContact CG1-CB 4.38Å; V126-E301 HydrophobicContact CG1-CG 4.03Å; V126-L302 HydrophobicContact CG2-CD2 4.41Å
127	V	88.9	Confident	84.7	Confident	30 Å²	30	62.1 Å²	62.1	18%	0.182	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-47.1	-178.7	178.7	0	0	0	0	111.2	N125 L131 L172 V176	N125-V127 VanDerWaalsContact C-N 3.29Å; N125-V127 PolarHBondContact O-N 3.37Å; V127-L131 HydrophobicContact CG1-CD1 4.1Å; V127-L131 VanDerWaalsContact O-CG 3.29Å; V127-L131 WeakPolarHBondContact O-CG 3.46Å; V127-L131 PolarHBondContact O-N 3.36Å; V127-L131 VanDerWaalsContact O-N 3.1Å; V127-L172 HydrophobicContact CG1-CB 4.27Å; V127-L172 HydrophobicContact CG1-CD1 4.23Å; V127-V176 HydrophobicContact CG2-CB 4.27Å; V127-V176 HydrophobicContact CG2-CG1 4.12Å; V127-V176 HydrophobicContact CG2-CG2 3.69Å
128	D	90.4	Very high	85.3	Confident	65 Å²	65	65 Å²	65	35%	0.348	33%	0.33	S	S	.	.	H	α-helix	trans	-74.8	-37.9	-177.2	-61	-51.6	0	0	0	111.2	N125 V126 V130 L131 N132 R169	N125-D128 PolarHBondContact O-N 2.96Å; V126-D128 PolarHBondContact O-N 2.86Å; D128-V130 VanDerWaalsContact C-N 3.33Å; D128-V130 PolarHBondContact O-N 3.33Å; D128-L131 PolarHBondContact O-N 3.27Å; D128-N132 WeakPolarHBondContact O-CB 3.48Å; D128-N132 PolarHBondContact O-N 3.37Å; D128-N132 PolarHBondContact O-ND2 3.13Å; D128-R169 IonicContact OD1-CZ 3.91Å; D128-R169 IonicContact OD1-NH1 3.26Å; D128-R169 PolarHBondContact OD1-NH1 2.79Å; D128-R169 IonicContact OD1-NH2 2.9Å; D128-R169 PolarHBondContact OD1-NH2 3.44Å
129	N	92.4	Very high	86	Confident	64 Å²	64	60.8 Å²	60.8	34%	0.342	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-41.4	174.3	-68.1	-1	0	0	0	111.9	N125 V126 N132 N133 E301	N125-N129 WeakPolarHBondContact O-CB 3.19Å; N125-N129 VanDerWaalsContact O-CG 3.25Å; N125-N129 PolarHBondContact O-N 3.49Å; N125-N129 PolarHBondContact O-OD1 3.48Å; V126-N129 PolarHBondContact O-N 3.21Å; N129-N132 PolarHBondContact O-N 2.94Å; N129-N133 PolarHBondContact O-N 3.32Å; N129-E301 HydrophobicContact CB-CG 4.11Å; N129-E301 PolarHBondContact ND2-OE1 3.27Å
130	V	92.4	Very high	87.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.6	-41.8	177.7	174.1	0	0	0	0	111.3	V126 D128 N132 N133 V136 L172 L294 V297 E301	V126-V130 HydrophobicContact CG1-CG2 4.01Å; V126-V130 WeakPolarHBondContact O-CB 3.28Å; V126-V130 WeakPolarHBondContact O-CG2 3.36Å; V126-V130 PolarHBondContact O-N 2.99Å; D128-V130 VanDerWaalsContact C-N 3.33Å; D128-V130 PolarHBondContact O-N 3.33Å; V130-N132 VanDerWaalsContact C-N 3.27Å; V130-N132 PolarHBondContact O-N 3.31Å; V130-N133 WeakPolarHBondContact O-CB 3.29Å; V130-N133 PolarHBondContact O-N 3Å; V130-V136 HydrophobicContact CG1-CG2 4.15Å; V130-V136 WeakPolarHBondContact O-CB 3.27Å; V130-V136 WeakPolarHBondContact O-CG2 3.5Å; V130-L172 HydrophobicContact CB-CD1 4.19Å; V130-L172 HydrophobicContact CG1-CD1 3.92Å; V130-L172 HydrophobicContact CG1-CD2 3.9Å; V130-L294 HydrophobicContact CG1-CD2 4.07Å; V130-V297 HydrophobicContact CB-CG1 4.23Å; V130-V297 HydrophobicContact CG1-CB 4.16Å; V130-V297 HydrophobicContact CG1-CG1 3.92Å; V130-V297 HydrophobicContact CG2-CG1 4.16Å; V130-E301 HydrophobicContact CG2-CB 4.17Å
131	L	91.8	Very high	88.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68.9	-23.9	179.4	-73.6	173	0	0	0	113.8	V127 D128 R165 A168 R169 L172	V127-L131 HydrophobicContact CG1-CD1 4.1Å; V127-L131 VanDerWaalsContact O-CG 3.29Å; V127-L131 WeakPolarHBondContact O-CG 3.46Å; V127-L131 PolarHBondContact O-N 3.36Å; V127-L131 VanDerWaalsContact O-N 3.1Å; D128-L131 PolarHBondContact O-N 3.27Å; L131-R165 PolarHBondContact O-NH1 2.84Å; L131-A168 HydrophobicContact CD2-CB 3.91Å; L131-R169 HydrophobicContact CD1-CB 4.02Å; L131-R169 HydrophobicContact CD1-CG 4.24Å; L131-L172 HydrophobicContact CD1-CD1 4.32Å; L131-L172 HydrophobicContact CD2-CD1 3.71Å; L131-L172 HydrophobicContact CG-CD1 3.62Å
132	N	92.4	Very high	89.2	Confident	93 Å²	93	54.1 Å²	54.1	50%	0.497	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	6.3	178.7	-62.3	-17.3	0	0	0	112.5	D128 N129 V130 R165	D128-N132 WeakPolarHBondContact O-CB 3.48Å; D128-N132 PolarHBondContact O-N 3.37Å; D128-N132 PolarHBondContact O-ND2 3.13Å; N129-N132 PolarHBondContact O-N 2.94Å; V130-N132 VanDerWaalsContact C-N 3.27Å; V130-N132 PolarHBondContact O-N 3.31Å; N132-R165 PolarHBondContact OD1-NH2 3.06Å
133	N	93.8	Very high	89.5	Confident	31 Å²	31	53.6 Å²	53.6	17%	0.166	28%	0.282	C	S	.	.	S	Bend	trans	-79	134.6	176.9	-174.8	-80.6	0	0	0	110.5	N129 V130 R135 V136 E137 V297	N129-N133 PolarHBondContact O-N 3.32Å; V130-N133 WeakPolarHBondContact O-CB 3.29Å; V130-N133 PolarHBondContact O-N 3Å; N133-R135 PolarHBondContact O-N 3.2Å; N133-R135 VanDerWaalsContact O-N 3.14Å; N133-R135 VanDerWaalsContact OD1-CB 3.28Å; N133-R135 WeakPolarHBondContact OD1-CB 3.35Å; N133-R135 PolarHBondContact OD1-N 3.29Å; N133-V136 PolarHBondContact O-N 2.92Å; N133-E137 PolarHBondContact O-N 3.4Å; N133-V297 HydrophobicContact CB-CG1 3.53Å
134	S	91.9	Very high	89.7	Confident	85 Å²	85	52.6 Å²	52.6	59%	0.594	27%	0.274	S	S	*	.	H	α-helix	trans	-55	-34.8	-177.2	56.9	0	0	0	0	114	S138	S134-S138 WeakPolarHBondContact O-CB 3.29Å; S134-S138 PolarHBondContact O-N 3.44Å; S134-S138 PolarHBondContact O-OG 3.15Å
135	R	89.3	Confident	89.6	Confident	121 Å²	121	49.6 Å²	49.6	46%	0.457	27%	0.271	S	S	.	.	H	α-helix	trans	-67.7	-40.3	177.9	-166.1	177.8	-146.9	158.5	8.2	111.9	N133 A139 Y296 V297	N133-R135 PolarHBondContact O-N 3.2Å; N133-R135 VanDerWaalsContact O-N 3.14Å; N133-R135 VanDerWaalsContact OD1-CB 3.28Å; N133-R135 WeakPolarHBondContact OD1-CB 3.35Å; N133-R135 PolarHBondContact OD1-N 3.29Å; R135-A139 WeakPolarHBondContact O-CB 3.46Å; R135-A139 PolarHBondContact O-N 3.13Å; R135-A139 VanDerWaalsContact O-N 3.09Å; R135-Y296 VanDerWaalsContact NH1-CD1 3.34Å; R135-Y296 PolarHBondContact NH1-OH 2.93Å; R135-V297 HydrophobicContact CB-CG2 4.13Å
136	V	91.8	Very high	89.5	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-72.6	-40.4	177.2	171.3	0	0	0	0	110.4	V130 N133 S138 A139 I140 L294 V297	V130-V136 HydrophobicContact CG1-CG2 4.15Å; V130-V136 WeakPolarHBondContact O-CB 3.27Å; V130-V136 WeakPolarHBondContact O-CG2 3.5Å; N133-V136 PolarHBondContact O-N 2.92Å; V136-S138 VanDerWaalsContact C-N 3.34Å; V136-S138 PolarHBondContact O-N 3.39Å; V136-A139 PolarHBondContact O-N 3.23Å; V136-I140 HydrophobicContact CG1-CD1 3.78Å; V136-I140 HydrophobicContact CG1-CG1 4.32Å; V136-I140 WeakPolarHBondContact O-CB 3.41Å; V136-I140 WeakPolarHBondContact O-CG1 3.09Å; V136-I140 PolarHBondContact O-N 2.83Å; V136-L294 HydrophobicContact CG1-CD2 3.61Å; V136-L294 HydrophobicContact CG2-CD2 4.09Å; V136-V297 HydrophobicContact CG2-CB 3.88Å; V136-V297 HydrophobicContact CG2-CG1 4.18Å; V136-V297 HydrophobicContact CG2-CG2 3.78Å
137	E	91.6	Very high	89	Confident	85 Å²	85	55.1 Å²	55.1	40%	0.397	30%	0.296	S	S	.	.	H	α-helix	trans	-60.6	-44.2	175	-70	-177.1	159.3	0	0	111.6	N133 A139 I140 V141	N133-E137 PolarHBondContact O-N 3.4Å; E137-A139 PolarHBondContact O-N 3.45Å; E137-I140 WeakPolarHBondContact O-CB 3.39Å; E137-I140 PolarHBondContact O-N 2.86Å; E137-V141 WeakPolarHBondContact O-CG2 3.2Å; E137-V141 PolarHBondContact O-N 3.16Å
138	S	90.2	Very high	88.3	Confident	76 Å²	76	56.6 Å²	56.6	53%	0.531	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-46.1	175.4	-56.4	0	0	0	0	111.8	S134 V136 I140 V141 E142	S134-S138 WeakPolarHBondContact O-CB 3.29Å; S134-S138 PolarHBondContact O-N 3.44Å; S134-S138 PolarHBondContact O-OG 3.15Å; V136-S138 VanDerWaalsContact C-N 3.34Å; V136-S138 PolarHBondContact O-N 3.39Å; S138-I140 VanDerWaalsContact C-N 3.3Å; S138-I140 PolarHBondContact O-N 3.3Å; S138-V141 PolarHBondContact O-N 3.17Å; S138-E142 WeakPolarHBondContact O-CB 3.26Å; S138-E142 PolarHBondContact O-N 3.18Å
139	A	88.9	Confident	87.1	Confident	3 Å²	3	58.7 Å²	58.7	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-65.4	-31.9	177	0	0	0	0	0	112.9	R135 V136 E137 V143 V289	R135-A139 WeakPolarHBondContact O-CB 3.46Å; R135-A139 PolarHBondContact O-N 3.13Å; R135-A139 VanDerWaalsContact O-N 3.09Å; V136-A139 PolarHBondContact O-N 3.23Å; E137-A139 PolarHBondContact O-N 3.45Å; A139-V143 WeakPolarHBondContact O-CB 3.4Å; A139-V143 VanDerWaalsContact O-CG2 3.32Å; A139-V143 WeakPolarHBondContact O-CG2 3.49Å; A139-V143 PolarHBondContact O-N 3.29Å; A139-V143 VanDerWaalsContact O-N 3.1Å; A139-V289 HydrophobicContact CB-CG1 4.46Å
140	I	89.4	Confident	85.5	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.015	34%	0.337	C	S	.	.	H	α-helix	trans	-66.3	-43.8	174	-73.9	166.4	0	0	0	110.2	V136 E137 S138 A144 V161 V164 R165 A168 L290	V136-I140 HydrophobicContact CG1-CD1 3.78Å; V136-I140 HydrophobicContact CG1-CG1 4.32Å; V136-I140 WeakPolarHBondContact O-CB 3.41Å; V136-I140 WeakPolarHBondContact O-CG1 3.09Å; V136-I140 PolarHBondContact O-N 2.83Å; E137-I140 WeakPolarHBondContact O-CB 3.39Å; E137-I140 PolarHBondContact O-N 2.86Å; S138-I140 VanDerWaalsContact C-N 3.3Å; S138-I140 PolarHBondContact O-N 3.3Å; I140-A144 VanDerWaalsContact O-CB 3.25Å; I140-A144 WeakPolarHBondContact O-CB 2.8Å; I140-A144 PolarHBondContact O-N 3.47Å; I140-V161 HydrophobicContact CG2-CG1 4Å; I140-V164 HydrophobicContact CB-CG1 4.27Å; I140-V164 HydrophobicContact CG1-CG1 4.28Å; I140-V164 HydrophobicContact CG2-CB 4.06Å; I140-V164 HydrophobicContact CG2-CG1 3.94Å; I140-R165 HydrophobicContact CD1-CB 4.34Å; I140-R165 HydrophobicContact CD1-CG 4.32Å; I140-R165 HydrophobicContact CG2-CB 4.4Å; I140-A168 HydrophobicContact CD1-CB 4.24Å; I140-A168 HydrophobicContact CG1-CB 4.43Å; I140-L290 HydrophobicContact CG1-CD1 3.79Å
141	V	89.1	Confident	83.8	Confident	62 Å²	62	60.6 Å²	60.6	38%	0.376	34%	0.344	S	S	.	.	H	α-helix	trans	-65.1	-49.2	177.7	174	0	0	0	0	110.3	E137 S138 V143 A144 T145 V161	E137-V141 WeakPolarHBondContact O-CG2 3.2Å; E137-V141 PolarHBondContact O-N 3.16Å; S138-V141 PolarHBondContact O-N 3.17Å; V141-V143 PolarHBondContact O-N 3.41Å; V141-A144 WeakPolarHBondContact O-CA 3.28Å; V141-A144 WeakPolarHBondContact O-CB 2.93Å; V141-A144 PolarHBondContact O-N 2.69Å; V141-T145 PolarHBondContact O-N 2.84Å; V141-T145 PolarHBondContact O-OG1 3.35Å; V141-T145 VanDerWaalsContact O-OG1 3.04Å; V141-V161 HydrophobicContact CG2-CG2 4.42Å
142	E	87.2	Confident	82.1	Confident	91 Å²	91	66.8 Å²	66.8	43%	0.425	38%	0.382	S	S	.	.	H	α-helix	trans	-52.3	-52.8	177.4	-177.9	-176	174.7	0	0	111.8	S138 A144 T145 E146	S138-E142 WeakPolarHBondContact O-CB 3.26Å; S138-E142 PolarHBondContact O-N 3.18Å; E142-A144 VanDerWaalsContact C-N 3.3Å; E142-A144 PolarHBondContact O-N 3.28Å; E142-T145 PolarHBondContact O-N 3.07Å; E142-E146 WeakPolarHBondContact O-CG 3.14Å; E142-E146 PolarHBondContact O-N 3.39Å
143	V	86.4	Confident	80.4	Confident	19 Å²	19	69.3 Å²	69.3	12%	0.115	39%	0.391	C	S	.	.	H	α-helix	trans	-68.2	-29.6	179.6	173.3	0	0	0	0	112.1	A139 V141 L147 V164 L290	A139-V143 WeakPolarHBondContact O-CB 3.4Å; A139-V143 VanDerWaalsContact O-CG2 3.32Å; A139-V143 WeakPolarHBondContact O-CG2 3.49Å; A139-V143 PolarHBondContact O-N 3.29Å; A139-V143 VanDerWaalsContact O-N 3.1Å; V141-V143 PolarHBondContact O-N 3.41Å; V143-L147 HydrophobicContact CG1-CD1 4.02Å; V143-L147 WeakPolarHBondContact O-CD1 3.23Å; V143-L147 VanDerWaalsContact O-CG 3.22Å; V143-L147 WeakPolarHBondContact O-CG 3.35Å; V143-L147 PolarHBondContact O-N 3.06Å; V143-V164 HydrophobicContact CB-CG1 4.32Å; V143-V164 HydrophobicContact CG1-CG1 4.17Å; V143-V164 HydrophobicContact CG1-CG2 4.44Å; V143-L290 HydrophobicContact CG2-CB 4.21Å
144	A	86.1	Confident	78.6	Confident	5 Å²	5	72 Å²	72	4%	0.041	42%	0.418	C	S	.	.	H	α-helix	trans	-68.1	-42.1	174.2	0	0	0	0	0	111.5	I140 V141 E142 L147 D148 A160 V161 V164	I140-A144 VanDerWaalsContact O-CB 3.25Å; I140-A144 WeakPolarHBondContact O-CB 2.8Å; I140-A144 PolarHBondContact O-N 3.47Å; V141-A144 WeakPolarHBondContact O-CA 3.28Å; V141-A144 WeakPolarHBondContact O-CB 2.93Å; V141-A144 PolarHBondContact O-N 2.69Å; E142-A144 VanDerWaalsContact C-N 3.3Å; E142-A144 PolarHBondContact O-N 3.28Å; A144-L147 PolarHBondContact O-N 2.9Å; A144-D148 PolarHBondContact O-N 2.93Å; A144-A160 HydrophobicContact CB-CB 4.22Å; A144-V161 HydrophobicContact CB-CG2 3.87Å; A144-V164 HydrophobicContact CB-CG2 3.97Å
145	T	84.6	Confident	77.2	Confident	79 Å²	79	70.9 Å²	70.9	49%	0.485	42%	0.42	S	S	.	.	H	α-helix	trans	-65.1	-39.4	176.6	-52.6	0	0	0	0	111.9	V141 E142 L147 D148	V141-T145 PolarHBondContact O-N 2.84Å; V141-T145 PolarHBondContact O-OG1 3.35Å; V141-T145 VanDerWaalsContact O-OG1 3.04Å; E142-T145 PolarHBondContact O-N 3.07Å; T145-L147 VanDerWaalsContact C-N 3.34Å; T145-L147 PolarHBondContact O-N 3.23Å; T145-D148 CarbonylContact O-C 3.54Å; T145-D148 PolarHBondContact O-N 3.13Å
146	E	82	Confident	75.8	Confident	121 Å²	121	67.8 Å²	67.8	57%	0.565	41%	0.414	S	S	*	.	H	α-helix	trans	-66	-33.6	176.4	-72.3	-170.2	158.9	0	0	113.6	E142	E142-E146 WeakPolarHBondContact O-CG 3.14Å; E142-E146 PolarHBondContact O-N 3.39Å
147	L	78.1	Confident	74.6	Confident	123 Å²	123	72.1 Å²	72.1	64%	0.644	44%	0.435	S	S	*	.	H	α-helix	trans	-78.2	-23.6	-178.6	-73.7	170.3	0	0	0	113.2	V143 A144 T145 V164	V143-L147 HydrophobicContact CG1-CD1 4.02Å; V143-L147 WeakPolarHBondContact O-CD1 3.23Å; V143-L147 VanDerWaalsContact O-CG 3.22Å; V143-L147 WeakPolarHBondContact O-CG 3.35Å; V143-L147 PolarHBondContact O-N 3.06Å; A144-L147 PolarHBondContact O-N 2.9Å; T145-L147 VanDerWaalsContact C-N 3.34Å; T145-L147 PolarHBondContact O-N 3.23Å; L147-V164 HydrophobicContact CD1-CG2 4.01Å
148	D	74.7	Confident	73.9	Confident	61 Å²	61	75 Å²	75	33%	0.326	45%	0.448	S	S	.	.			trans	-145.3	77	179.4	-163.4	-7.8	0	0	0	111.5	A144 T145 A150 A151	A144-D148 PolarHBondContact O-N 2.93Å; T145-D148 CarbonylContact O-C 3.54Å; T145-D148 PolarHBondContact O-N 3.13Å; D148-A150 PolarHBondContact O-N 3.49Å; D148-A150 VanDerWaalsContact O-N 3.14Å; D148-A151 HydrophobicContact CB-CB 4.12Å; D148-A151 WeakPolarHBondContact O-CB 3.37Å; D148-A151 PolarHBondContact O-N 3.27Å; D148-A151 VanDerWaalsContact O-N 3.16Å
149	P	64.8	Low	73.6	Confident	110 Å²	110	79.2 Å²	79.2	71%	0.714	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-10.7	-178	25.2	-32.8	0	0	0	113.8
150	A	59.5	Low	73.3	Confident	83 Å²	83	80 Å²	80	69%	0.686	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-3.9	177.1	0	0	0	0	0	113.2	D148 T152	D148-A150 PolarHBondContact O-N 3.49Å; D148-A150 VanDerWaalsContact O-N 3.14Å; A150-T152 PolarHBondContact O-N 3.03Å
151	A	56.4	Low	73.1	Confident	20 Å²	20	81.7 Å²	81.7	17%	0.165	47%	0.473	C	S	.	.			trans	-78.9	65.5	178.7	0	0	0	0	0	111.9	D148 V156	D148-A151 HydrophobicContact CB-CB 4.12Å; D148-A151 WeakPolarHBondContact O-CB 3.37Å; D148-A151 PolarHBondContact O-N 3.27Å; D148-A151 VanDerWaalsContact O-N 3.16Å; A151-V156 HydrophobicContact CB-CB 4.08Å; A151-V156 HydrophobicContact CB-CG1 3.61Å
152	T	55	Low	73.1	Confident	130 Å²	130	81.2 Å²	81.2	80%	0.798	47%	0.473	S	S	*	.			trans	-90.8	-2.2	172.7	-29.7	0	0	0	0	112.5	A150	A150-T152 PolarHBondContact O-N 3.03Å
153	E	57.1	Low	73.2	Confident	146 Å²	146	84.7 Å²	84.7	68%	0.682	49%	0.486	S	S	*	.	S	Bend	trans	-90.8	128.1	173.8	-67.4	-176.1	175.9	0	0	111.3	G155 V156 E157	E153-G155 PolarHBondContact O-N 3.03Å; E153-V156 HydrophobicContact CB-CG2 4.31Å; E153-V156 PolarHBondContact O-N 3.22Å; E153-E157 PolarHBondContact O-N 3.02Å
154	A	56.8	Low	73.2	Confident	88 Å²	88	84 Å²	84	73%	0.727	48%	0.482	S	S	*	.	H	α-helix	trans	-53.6	-24.3	-173.6	0	0	0	0	0	115.4
155	G	61.2	Low	73.5	Confident	62 Å²	62	87.3 Å²	87.3	64%	0.639	49%	0.494	S	S	*	.	H	α-helix	trans	-81.1	-28.2	176.5	0	0	0	0	0	114.9	E153	E153-G155 PolarHBondContact O-N 3.03Å
156	V	60.3	Low	73.7	Confident	55 Å²	55	92.5 Å²	92.5	33%	0.333	50%	0.504	S	S	.	.	H	α-helix	trans	-83.8	-38.9	-178.5	-176.4	0	0	0	0	110.4	A151 E153 H158 K159 A160	A151-V156 HydrophobicContact CB-CB 4.08Å; A151-V156 HydrophobicContact CB-CG1 3.61Å; E153-V156 HydrophobicContact CB-CG2 4.31Å; E153-V156 PolarHBondContact O-N 3.22Å; V156-H158 PolarHBondContact O-N 2.96Å; V156-K159 WeakPolarHBondContact O-CB 3.42Å; V156-K159 PolarHBondContact O-N 3.43Å; V156-K159 VanDerWaalsContact O-N 3.14Å; V156-A160 PolarHBondContact O-N 2.83Å
157	E	67.5	Low	74	Confident	93 Å²	93	91.7 Å²	91.7	44%	0.435	50%	0.499	S	S	.	.	H	α-helix	trans	-57.5	-46	175.8	-169.8	-179.5	-178.3	0	0	111.8	E153 K159 A160 V161	E153-E157 PolarHBondContact O-N 3.02Å; E157-K159 VanDerWaalsContact C-N 3.27Å; E157-K159 PolarHBondContact O-N 3.23Å; E157-A160 PolarHBondContact O-N 2.84Å; E157-V161 WeakPolarHBondContact O-CB 3.33Å; E157-V161 WeakPolarHBondContact O-CG2 3.46Å; E157-V161 PolarHBondContact O-N 3.4Å
158	H	77.4	Confident	74.6	Confident	145 Å²	145	85.9 Å²	85.9	67%	0.671	47%	0.468	S	S	*	.	H	α-helix	trans	-62.7	-33.3	178.4	-167.7	-82.4	0	0	0	112.8	V156 S162	V156-H158 PolarHBondContact O-N 2.96Å; H158-S162 WeakPolarHBondContact O-CB 3.45Å; H158-S162 PolarHBondContact O-N 3.32Å
159	K	82.4	Confident	75.4	Confident	165 Å²	165	87.3 Å²	87.3	72%	0.717	47%	0.469	S	S	*	.	H	α-helix	trans	-73.6	-41.1	177.6	-169.5	179.9	-179.8	-177.7	0	111.5	V156 E157 S162 K163	V156-K159 WeakPolarHBondContact O-CB 3.42Å; V156-K159 PolarHBondContact O-N 3.43Å; V156-K159 VanDerWaalsContact O-N 3.14Å; E157-K159 VanDerWaalsContact C-N 3.27Å; E157-K159 PolarHBondContact O-N 3.23Å; K159-S162 PolarHBondContact O-N 3.07Å; K159-K163 PolarHBondContact O-N 2.95Å
160	A	82.9	Confident	76.5	Confident	19 Å²	19	83.2 Å²	83.2	16%	0.157	45%	0.448	C	S	.	.	H	α-helix	trans	-63	-49.2	175.4	0	0	0	0	0	111.2	A144 V156 E157 S162 K163 V164	A144-A160 HydrophobicContact CB-CB 4.22Å; V156-A160 PolarHBondContact O-N 2.83Å; E157-A160 PolarHBondContact O-N 2.84Å; A160-S162 PolarHBondContact O-N 2.9Å; A160-K163 WeakPolarHBondContact O-CB 3.25Å; A160-K163 PolarHBondContact O-N 3.31Å; A160-K163 VanDerWaalsContact O-N 3.15Å; A160-V164 WeakPolarHBondContact O-CG2 3.45Å; A160-V164 PolarHBondContact O-N 3.19Å
161	V	86.4	Confident	77.7	Confident	38 Å²	38	80.6 Å²	80.6	23%	0.23	42%	0.42	C	S	.	.	H	α-helix	trans	-58.6	-44.6	176	169.6	0	0	0	0	111.6	I140 V141 A144 E157 K163 V164 R165	I140-V161 HydrophobicContact CG2-CG1 4Å; V141-V161 HydrophobicContact CG2-CG2 4.42Å; A144-V161 HydrophobicContact CB-CG2 3.87Å; E157-V161 WeakPolarHBondContact O-CB 3.33Å; E157-V161 WeakPolarHBondContact O-CG2 3.46Å; E157-V161 PolarHBondContact O-N 3.4Å; V161-K163 VanDerWaalsContact C-N 3.33Å; V161-K163 PolarHBondContact O-N 3.23Å; V161-V164 PolarHBondContact O-N 2.9Å; V161-R165 WeakPolarHBondContact O-CB 3.3Å; V161-R165 PolarHBondContact O-N 2.88Å
162	S	87.8	Confident	79.1	Confident	53 Å²	53	79.6 Å²	79.6	37%	0.371	41%	0.413	S	S	.	.	H	α-helix	trans	-62	-39	176.8	179.6	0	0	0	0	112.7	H158 K159 A160 R165 R166	H158-S162 WeakPolarHBondContact O-CB 3.45Å; H158-S162 PolarHBondContact O-N 3.32Å; K159-S162 PolarHBondContact O-N 3.07Å; A160-S162 PolarHBondContact O-N 2.9Å; S162-R165 PolarHBondContact O-N 3.33Å; S162-R166 WeakPolarHBondContact O-CB 3.43Å; S162-R166 PolarHBondContact O-N 2.89Å
163	K	89	Confident	80.6	Confident	164 Å²	164	79.4 Å²	79.4	71%	0.713	40%	0.402	S	S	*	.	H	α-helix	trans	-63.7	-45.1	176.2	-174.2	-179.5	174.2	-175.4	0	111.3	K159 A160 V161 R166 K167	K159-K163 PolarHBondContact O-N 2.95Å; A160-K163 WeakPolarHBondContact O-CB 3.25Å; A160-K163 PolarHBondContact O-N 3.31Å; A160-K163 VanDerWaalsContact O-N 3.15Å; V161-K163 VanDerWaalsContact C-N 3.33Å; V161-K163 PolarHBondContact O-N 3.23Å; K163-R166 PolarHBondContact O-N 3.23Å; K163-K167 PolarHBondContact O-N 3.46Å
164	V	87.8	Confident	81.7	Confident	5 Å²	5	78 Å²	78	3%	0.03	40%	0.396	C	S	.	.	H	α-helix	trans	-67.5	-40.9	177.1	-179.7	0	0	0	0	111.2	I140 V143 A144 L147 A160 V161 R166 K167 A168 L290	I140-V164 HydrophobicContact CB-CG1 4.27Å; I140-V164 HydrophobicContact CG1-CG1 4.28Å; I140-V164 HydrophobicContact CG2-CB 4.06Å; I140-V164 HydrophobicContact CG2-CG1 3.94Å; V143-V164 HydrophobicContact CB-CG1 4.32Å; V143-V164 HydrophobicContact CG1-CG1 4.17Å; V143-V164 HydrophobicContact CG1-CG2 4.44Å; A144-V164 HydrophobicContact CB-CG2 3.97Å; L147-V164 HydrophobicContact CD1-CG2 4.01Å; A160-V164 WeakPolarHBondContact O-CG2 3.45Å; A160-V164 PolarHBondContact O-N 3.19Å; V161-V164 PolarHBondContact O-N 2.9Å; V164-R166 VanDerWaalsContact C-N 3.31Å; V164-R166 PolarHBondContact O-N 3.31Å; V164-K167 CarbonylContact O-C 3.53Å; V164-K167 WeakPolarHBondContact O-CA 3.35Å; V164-K167 WeakPolarHBondContact O-CB 3.49Å; V164-K167 PolarHBondContact O-N 3.12Å; V164-K167 VanDerWaalsContact O-N 3.1Å; V164-A168 WeakPolarHBondContact O-CB 3.38Å; V164-A168 PolarHBondContact O-N 2.76Å; V164-L290 HydrophobicContact CG1-CD2 3.91Å
165	R	90.9	Very high	82.9	Confident	73 Å²	73	74 Å²	74	28%	0.275	36%	0.362	S	S	.	.	H	α-helix	trans	-60.6	-38.2	174.3	-171.1	174.1	-179.9	81.9	-0.2	112.3	L131 N132 I140 V161 S162 A168 R169	L131-R165 PolarHBondContact O-NH1 2.84Å; N132-R165 PolarHBondContact OD1-NH2 3.06Å; I140-R165 HydrophobicContact CD1-CB 4.34Å; I140-R165 HydrophobicContact CD1-CG 4.32Å; I140-R165 HydrophobicContact CG2-CB 4.4Å; V161-R165 WeakPolarHBondContact O-CB 3.3Å; V161-R165 PolarHBondContact O-N 2.88Å; S162-R165 PolarHBondContact O-N 3.33Å; R165-A168 PolarHBondContact O-N 3.48Å; R165-R169 PolarHBondContact O-N 3.48Å
166	R	90.1	Very high	84	Confident	188 Å²	188	72.2 Å²	72.2	71%	0.709	34%	0.339	S	S	*	.	H	α-helix	trans	-65.2	-41.9	173.1	-169.6	-177.3	-59.9	175.2	2	111.6	S162 K163 V164 R169 G170	S162-R166 WeakPolarHBondContact O-CB 3.43Å; S162-R166 PolarHBondContact O-N 2.89Å; K163-R166 PolarHBondContact O-N 3.23Å; V164-R166 VanDerWaalsContact C-N 3.31Å; V164-R166 PolarHBondContact O-N 3.31Å; R166-R169 PolarHBondContact O-N 3.13Å; R166-G170 PolarHBondContact O-N 3.05Å
167	K	88	Confident	84.9	Confident	105 Å²	105	70.3 Å²	70.3	46%	0.457	33%	0.329	S	S	.	.	H	α-helix	trans	-61.2	-44.4	174	-173.6	-178	178.3	-174.5	0	111.3	K163 V164 R169 G170 F171	K163-K167 PolarHBondContact O-N 3.46Å; V164-K167 CarbonylContact O-C 3.53Å; V164-K167 WeakPolarHBondContact O-CA 3.35Å; V164-K167 WeakPolarHBondContact O-CB 3.49Å; V164-K167 PolarHBondContact O-N 3.12Å; V164-K167 VanDerWaalsContact O-N 3.1Å; K167-R169 PolarHBondContact O-N 3.24Å; K167-G170 PolarHBondContact O-N 3.26Å; K167-G170 VanDerWaalsContact O-N 3.16Å; K167-F171 HydrophobicContact CD-CE2 4.39Å; K167-F171 HydrophobicContact CD-CZ 4.32Å; K167-F171 VanDerWaalsContact CE-CZ 3.46Å; K167-F171 HydrophobicContact CG-CE1 4.45Å; K167-F171 HydrophobicContact CG-CE2 4.07Å; K167-F171 HydrophobicContact CG-CZ 4.01Å; K167-F171 PolarHBondContact O-N 3.17Å
168	A	89.5	Confident	85.5	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-44.6	175.5	0	0	0	0	0	112	L131 I140 V164 R165 G170 F171 L172 L290 L294	L131-A168 HydrophobicContact CD2-CB 3.91Å; I140-A168 HydrophobicContact CD1-CB 4.24Å; I140-A168 HydrophobicContact CG1-CB 4.43Å; V164-A168 WeakPolarHBondContact O-CB 3.38Å; V164-A168 PolarHBondContact O-N 2.76Å; R165-A168 PolarHBondContact O-N 3.48Å; A168-G170 VanDerWaalsContact C-N 3.33Å; A168-G170 PolarHBondContact O-N 3.47Å; A168-F171 PolarHBondContact O-N 3.04Å; A168-L172 WeakPolarHBondContact O-CG 3.37Å; A168-L172 PolarHBondContact O-N 3.02Å; A168-L290 HydrophobicContact CB-CD1 4.19Å; A168-L290 HydrophobicContact CB-CD2 4.42Å; A168-L294 HydrophobicContact CB-CD1 3.99Å; A168-L294 HydrophobicContact CB-CD2 4.26Å
169	R	92.2	Very high	85.7	Confident	91 Å²	91	65.2 Å²	65.2	34%	0.343	31%	0.309	S	S	.	.	H	α-helix	trans	-60.5	-40.9	173.7	-176.3	173.5	-73.5	-100.8	-5.2	112	D128 L131 R165 R166 K167 L172 Q173	D128-R169 IonicContact OD1-CZ 3.91Å; D128-R169 IonicContact OD1-NH1 3.26Å; D128-R169 PolarHBondContact OD1-NH1 2.79Å; D128-R169 IonicContact OD1-NH2 2.9Å; D128-R169 PolarHBondContact OD1-NH2 3.44Å; L131-R169 HydrophobicContact CD1-CB 4.02Å; L131-R169 HydrophobicContact CD1-CG 4.24Å; R165-R169 PolarHBondContact O-N 3.48Å; R166-R169 PolarHBondContact O-N 3.13Å; K167-R169 PolarHBondContact O-N 3.24Å; R169-L172 PolarHBondContact O-N 3.05Å; R169-Q173 VanDerWaalsContact O-CG 3.31Å; R169-Q173 WeakPolarHBondContact O-CG 3.31Å; R169-Q173 PolarHBondContact O-N 2.81Å
170	G	87.4	Confident	85.7	Confident	25 Å²	25	58.8 Å²	58.8	26%	0.258	29%	0.285	S	S	.	.	H	α-helix	trans	-59.9	-48.4	174.4	0	0	0	0	0	112.3	R166 K167 A168 L172 Q173 E174	R166-G170 PolarHBondContact O-N 3.05Å; K167-G170 PolarHBondContact O-N 3.26Å; K167-G170 VanDerWaalsContact O-N 3.16Å; A168-G170 VanDerWaalsContact C-N 3.33Å; A168-G170 PolarHBondContact O-N 3.47Å; G170-L172 VanDerWaalsContact C-N 3.34Å; G170-L172 PolarHBondContact O-N 3.2Å; G170-Q173 PolarHBondContact O-N 3.45Å; G170-E174 WeakPolarHBondContact O-CG 3.44Å; G170-E174 PolarHBondContact O-N 2.91Å
171	F	86.2	Confident	85.7	Confident	27 Å²	27	59.8 Å²	59.8	12%	0.118	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-42.7	175	-68.2	-18.9	0	0	0	112.5	K167 A168 E174 M175 R276 L290 L294	K167-F171 HydrophobicContact CD-CE2 4.39Å; K167-F171 HydrophobicContact CD-CZ 4.32Å; K167-F171 VanDerWaalsContact CE-CZ 3.46Å; K167-F171 HydrophobicContact CG-CE1 4.45Å; K167-F171 HydrophobicContact CG-CE2 4.07Å; K167-F171 HydrophobicContact CG-CZ 4.01Å; K167-F171 PolarHBondContact O-N 3.17Å; A168-F171 PolarHBondContact O-N 3.04Å; F171-E174 CarbonylContact O-C 3.53Å; F171-E174 WeakPolarHBondContact O-CB 3.5Å; F171-E174 PolarHBondContact O-N 3.44Å; F171-M175 VanDerWaalsContact O-CG 3.26Å; F171-M175 WeakPolarHBondContact O-CG 3.39Å; F171-M175 PolarHBondContact O-N 3.19Å; F171-R276 VanDerWaalsContact CD1-NH2 3.32Å; F171-R276 VanDerWaalsContact CZ-NH2 3.31Å; F171-L290 HydrophobicContact CD2-CD2 4.45Å; F171-L290 HydrophobicContact CE2-CD2 4.33Å; F171-L294 HydrophobicContact CB-CD1 4.07Å; F171-L294 HydrophobicContact CD2-CD1 4.19Å
172	L	86.1	Confident	85.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.5	-41.7	176.2	-73.6	173.2	0	0	0	112.3	V127 V130 L131 A168 R169 G170 E174 M175 V176 L294	V127-L172 HydrophobicContact CG1-CB 4.27Å; V127-L172 HydrophobicContact CG1-CD1 4.23Å; V130-L172 HydrophobicContact CB-CD1 4.19Å; V130-L172 HydrophobicContact CG1-CD1 3.92Å; V130-L172 HydrophobicContact CG1-CD2 3.9Å; L131-L172 HydrophobicContact CD1-CD1 4.32Å; L131-L172 HydrophobicContact CD2-CD1 3.71Å; L131-L172 HydrophobicContact CG-CD1 3.62Å; A168-L172 WeakPolarHBondContact O-CG 3.37Å; A168-L172 PolarHBondContact O-N 3.02Å; R169-L172 PolarHBondContact O-N 3.05Å; G170-L172 VanDerWaalsContact C-N 3.34Å; G170-L172 PolarHBondContact O-N 3.2Å; L172-E174 PolarHBondContact O-N 2.75Å; L172-M175 PolarHBondContact O-N 2.89Å; L172-V176 HydrophobicContact CB-CG2 4.38Å; L172-V176 VanDerWaalsContact O-CB 3.3Å; L172-V176 WeakPolarHBondContact O-CB 3.42Å; L172-V176 WeakPolarHBondContact O-CG2 3.41Å; L172-V176 PolarHBondContact O-N 3.33Å; L172-L294 HydrophobicContact CD1-CD2 3.88Å; L172-L294 HydrophobicContact CD2-CB 4.23Å; L172-L294 HydrophobicContact CD2-CD2 4.09Å; L172-L294 HydrophobicContact CG-CD2 3.92Å
173	Q	85.3	Confident	85.5	Confident	125 Å²	125	61.9 Å²	61.9	58%	0.584	30%	0.303	S	S	*	.	H	α-helix	trans	-62.1	-34.1	175.7	-74.5	175	-14.6	0	0	112.1	R169 G170 M175	R169-Q173 VanDerWaalsContact O-CG 3.31Å; R169-Q173 WeakPolarHBondContact O-CG 3.31Å; R169-Q173 PolarHBondContact O-N 2.81Å; G170-Q173 PolarHBondContact O-N 3.45Å; Q173-M175 VanDerWaalsContact C-N 3.35Å
174	E	81	Confident	85.3	Confident	116 Å²	116	54.8 Å²	54.8	54%	0.542	27%	0.273	S	S	.	.	H	α-helix	trans	-72.9	-23.3	171.4	-71.3	177.7	-170.1	0	0	113.4	G170 F171 L172 R268	G170-E174 WeakPolarHBondContact O-CG 3.44Å; G170-E174 PolarHBondContact O-N 2.91Å; F171-E174 CarbonylContact O-C 3.53Å; F171-E174 WeakPolarHBondContact O-CB 3.5Å; F171-E174 PolarHBondContact O-N 3.44Å; L172-E174 PolarHBondContact O-N 2.75Å; E174-R268 VanDerWaalsContact C-NH1 3.32Å; E174-R268 PolarHBondContact O-NH1 3.21Å; E174-R268 PolarHBondContact O-NH2 3.47Å
175	M	81.5	Confident	85.4	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.02	28%	0.283	C	S	.	.	H	α-helix	trans	-90	-49.3	-179.7	-73	177.3	58.7	0	0	112.4	F171 L172 Q173 F273 F274 Y291 L295	F171-M175 VanDerWaalsContact O-CG 3.26Å; F171-M175 WeakPolarHBondContact O-CG 3.39Å; F171-M175 PolarHBondContact O-N 3.19Å; L172-M175 PolarHBondContact O-N 2.89Å; Q173-M175 VanDerWaalsContact C-N 3.35Å; M175-F273 WeakPolarHBondContact O-CA 3.31Å; M175-F273 WeakPolarHBondContact O-CB 3.43Å; M175-F274 WeakPolarHBondContact CG-O 3.28Å; M175-F274 PolarHBondContact O-N 3.33Å; M175-Y291 HydrophobicContact CE-CE2 4.48Å; M175-Y291 HydrophobicContact CG-CE2 4.19Å; M175-Y291 HydrophobicContact SD-CD2 4.15Å; M175-Y291 HydrophobicContact SD-CE2 3.41Å; M175-Y291 WeakPolarHBondContact SD-CE2 3.43Å; M175-L295 HydrophobicContact CE-CB 3.95Å; M175-L295 HydrophobicContact CE-CD1 3.51Å; M175-L295 HydrophobicContact CE-CG 4.33Å
176	V	83.4	Confident	85.4	Confident	26 Å²	26	58.8 Å²	58.8	16%	0.158	29%	0.294	C	S	.	.	S	Bend	trans	-61	140.3	-163.4	170.7	0	0	0	0	112.4	V127 L172 R268 Y298	V127-V176 HydrophobicContact CG2-CB 4.27Å; V127-V176 HydrophobicContact CG2-CG1 4.12Å; V127-V176 HydrophobicContact CG2-CG2 3.69Å; L172-V176 HydrophobicContact CB-CG2 4.38Å; L172-V176 VanDerWaalsContact O-CB 3.3Å; L172-V176 WeakPolarHBondContact O-CB 3.42Å; L172-V176 WeakPolarHBondContact O-CG2 3.41Å; L172-V176 PolarHBondContact O-N 3.33Å; V176-R268 PolarHBondContact O-NH1 3.1Å; V176-Y298 HydrophobicContact CB-CE2 4.3Å; V176-Y298 HydrophobicContact CG2-CD2 4.05Å; V176-Y298 HydrophobicContact CG2-CE2 3.62Å
177	A	80.3	Confident	85.3	Confident	15 Å²	15	50.6 Å²	50.6	12%	0.124	26%	0.264	C	S	.	.			trans	-73.4	139.4	170.3	0	0	0	0	0	110.7	I179	A177-I179 HydrophobicContact CB-CG1 4.22Å
178	N	80.5	Confident	85.4	Confident	97 Å²	97	45.7 Å²	45.7	52%	0.519	24%	0.244	S	C	.	.			trans	-119.3	77	178.2	-179.3	-9.4	0	0	0	109.3	R268 K269	N178-R268 CarbonylContact C-O 3.58Å; N178-R268 PolarHBondContact N-O 2.91Å; N178-K269 PolarHBondContact ND2-NZ 2.87Å; N178-K269 WeakPolarHBondContact O-CA 3.43Å; N178-K269 VanDerWaalsContact O-CD 3.25Å; N178-K269 WeakPolarHBondContact O-CD 3.41Å; N178-K269 WeakPolarHBondContact O-CE 3.46Å; N178-K269 PolarHBondContact O-NZ 2.67Å; N178-K269 VanDerWaalsContact O-NZ 3.16Å; N178-K269 PolarHBondContact OD1-NZ 3.1Å
179	I	80.2	Confident	85.5	Confident	33 Å²	33	49.5 Å²	49.5	17%	0.169	26%	0.259	C	S	.	.			trans	-71.2	135.4	-168.1	-53.5	174.2	0	0	0	111.3	F122 A177 I184 H251 K269	F122-I179 HydrophobicContact CB-CD1 4.4Å; F122-I179 HydrophobicContact CD1-CB 3.76Å; F122-I179 HydrophobicContact CD1-CD1 3.54Å; F122-I179 HydrophobicContact CD1-CG1 4.23Å; F122-I179 HydrophobicContact CD1-CG2 3.32Å; F122-I179 HydrophobicContact CE1-CB 4.14Å; F122-I179 HydrophobicContact CE1-CD1 4.3Å; F122-I179 HydrophobicContact CE1-CG2 3.18Å; F122-I179 HydrophobicContact CG-CB 4.21Å; F122-I179 HydrophobicContact CG-CD1 4.34Å; F122-I179 HydrophobicContact CG-CG2 4.08Å; F122-I179 HydrophobicContact CZ-CG2 3.84Å; A177-I179 HydrophobicContact CB-CG1 4.22Å; I179-I184 HydrophobicContact CG2-CD1 3.41Å; I179-I184 VanDerWaalsContact CG2-CD1 3.41Å; I179-I184 HydrophobicContact CG2-CG1 4.32Å; I179-H251 WeakPolarHBondContact CD1-NE2 3.43Å; I179-K269 WeakPolarHBondContact CA-O 3.29Å
180	S	82.8	Confident	85.5	Confident	31 Å²	31	46.7 Å²	46.7	22%	0.217	25%	0.254	C	S	.	.			trans	-125.2	118.1	176.7	173.1	0	0	0	0	110.9	A182 F183 I184 K269	S180-A182 VanDerWaalsContact C-N 3.32Å; S180-A182 PolarHBondContact O-N 3.42Å; S180-F183 PolarHBondContact O-N 2.73Å; S180-F183 VanDerWaalsContact O-N 3.08Å; S180-F183 PolarHBondContact OG-N 3.06Å; S180-I184 WeakPolarHBondContact O-CG1 3.39Å; S180-I184 PolarHBondContact O-N 2.99Å; S180-K269 PolarHBondContact N-O 3.44Å
181	P	83.1	Confident	85.7	Confident	39 Å²	39	46.3 Å²	46.3	25%	0.253	25%	0.246	S	C	.	.	H	α-helix	trans	-57.5	-41.3	178.7	-27.4	34.6	0	0	0	113.8	V117 F122 F183 I184 R185	V117-P181 HydrophobicContact CG1-CB 3.73Å; V117-P181 HydrophobicContact CG1-CG 4.43Å; F122-P181 HydrophobicContact CE2-CG 3.71Å; F122-P181 HydrophobicContact CZ-CG 4.23Å; P181-F183 VanDerWaalsContact C-N 3.28Å; P181-F183 PolarHBondContact O-N 2.79Å; P181-I184 PolarHBondContact O-N 2.96Å; P181-R185 PolarHBondContact O-N 2.7Å; P181-R185 VanDerWaalsContact O-N 3.12Å
182	A	85.1	Confident	86	Confident	71 Å²	71	45 Å²	45	59%	0.587	24%	0.241	S	C	*	.	H	α-helix	trans	-64.6	-37.5	178.1	0	0	0	0	0	111.3	S180 R185 L186	S180-A182 VanDerWaalsContact C-N 3.32Å; S180-A182 PolarHBondContact O-N 3.42Å; A182-R185 PolarHBondContact O-N 3.18Å; A182-L186 WeakPolarHBondContact O-CB 3.44Å; A182-L186 PolarHBondContact O-N 2.87Å
183	F	84.8	Confident	86.2	Confident	65 Å²	65	50.3 Å²	50.3	29%	0.285	26%	0.264	S	S	.	.	H	α-helix	trans	-73.1	-40.2	179.5	-150.8	-102.5	0	0	0	111.8	S180 P181 R185 L186 T187 L266 K269	S180-F183 PolarHBondContact O-N 2.73Å; S180-F183 VanDerWaalsContact O-N 3.08Å; S180-F183 PolarHBondContact OG-N 3.06Å; P181-F183 VanDerWaalsContact C-N 3.28Å; P181-F183 PolarHBondContact O-N 2.79Å; F183-R185 VanDerWaalsContact C-N 3.31Å; F183-R185 PolarHBondContact O-N 3.47Å; F183-L186 PolarHBondContact O-N 3.42Å; F183-T187 WeakPolarHBondContact O-CB 3.43Å; F183-T187 PolarHBondContact O-N 3.41Å; F183-T187 PolarHBondContact O-OG1 2.87Å; F183-L266 HydrophobicContact CD1-CD1 4.16Å; F183-L266 HydrophobicContact CE1-CB 4.25Å; F183-L266 HydrophobicContact CE1-CD1 3.37Å; F183-L266 HydrophobicContact CE1-CG 4.37Å; F183-L266 HydrophobicContact CZ-CD1 4.16Å; F183-K269 HydrophobicContact CB-CB 4.25Å; F183-K269 HydrophobicContact CD1-CB 3.32Å; F183-K269 HydrophobicContact CD1-CG 4.05Å; F183-K269 HydrophobicContact CE1-CB 3.78Å; F183-K269 HydrophobicContact CE1-CG 4.28Å; F183-K269 HydrophobicContact CG-CB 3.94Å; F183-K269 HydrophobicContact CG-CG 4.35Å
184	I	85.8	Confident	86.4	Confident	15 Å²	15	47 Å²	47	8%	0.077	25%	0.25	C	C	.	.	H	α-helix	trans	-54.7	-48.5	171.6	-71.4	168.3	0	0	0	110.4	V117 F122 I179 S180 P181 T187 G188 F243 L270	V117-I184 HydrophobicContact CG1-CD1 4.28Å; V117-I184 HydrophobicContact CG2-CG2 4.43Å; F122-I184 HydrophobicContact CE1-CD1 3.65Å; F122-I184 HydrophobicContact CZ-CD1 3.77Å; I179-I184 HydrophobicContact CG2-CD1 3.41Å; I179-I184 VanDerWaalsContact CG2-CD1 3.41Å; I179-I184 HydrophobicContact CG2-CG1 4.32Å; S180-I184 WeakPolarHBondContact O-CG1 3.39Å; S180-I184 PolarHBondContact O-N 2.99Å; P181-I184 PolarHBondContact O-N 2.96Å; I184-T187 PolarHBondContact O-N 3.24Å; I184-G188 PolarHBondContact O-N 2.96Å; I184-F243 HydrophobicContact CG2-CD2 3.64Å; I184-F243 HydrophobicContact CG2-CE2 3.67Å; I184-F243 HydrophobicContact CG2-CG 4.49Å; I184-L270 HydrophobicContact CG1-CD2 4.2Å
185	R	89.5	Confident	86.9	Confident	66 Å²	66	41.7 Å²	41.7	25%	0.249	23%	0.225	C	C	.	.	H	α-helix	trans	-62	-49.9	177.8	-73.7	-173.1	177.3	105.2	1.6	111.7	V112 R115 V117 P181 A182 F183 T187 G188 W189	V112-R185 HydrophobicContact CG1-CB 3.65Å; V112-R185 HydrophobicContact CG1-CG 4.08Å; V112-R185 WeakPolarHBondContact CG1-O 3.13Å; R115-R185 PolarHBondContact O-NH2 2.94Å; V117-R185 HydrophobicContact CG2-CG 4.2Å; P181-R185 PolarHBondContact O-N 2.7Å; P181-R185 VanDerWaalsContact O-N 3.12Å; A182-R185 PolarHBondContact O-N 3.18Å; F183-R185 VanDerWaalsContact C-N 3.31Å; F183-R185 PolarHBondContact O-N 3.47Å; R185-T187 VanDerWaalsContact C-N 3.31Å; R185-T187 PolarHBondContact O-N 2.9Å; R185-G188 PolarHBondContact O-N 3.49Å; R185-W189 PolarHBondContact O-N 3.43Å
186	L	90.2	Very high	87.3	Confident	96 Å²	96	45 Å²	45	50%	0.503	24%	0.243	S	C	.	.	H	α-helix	trans	-56.8	-46.1	178.1	178.6	64.5	0	0	0	111.8	A182 F183 W189 A190	A182-L186 WeakPolarHBondContact O-CB 3.44Å; A182-L186 PolarHBondContact O-N 2.87Å; F183-L186 PolarHBondContact O-N 3.42Å; L186-W189 HydrophobicContact CD1-CE3 4.16Å; L186-W189 HydrophobicContact CD1-CZ3 4.41Å; L186-W189 PolarHBondContact O-N 3.32Å; L186-A190 WeakPolarHBondContact O-CB 3.08Å; L186-A190 PolarHBondContact O-N 3.42Å
187	T	87.9	Confident	87.5	Confident	15 Å²	15	45.7 Å²	45.7	9%	0.092	26%	0.255	C	S	.	.	H	α-helix	trans	-65.9	-42.9	177.8	-59.6	0	0	0	0	111.3	F183 I184 R185 W189 A190 L191 L266 L270	F183-T187 WeakPolarHBondContact O-CB 3.43Å; F183-T187 PolarHBondContact O-N 3.41Å; F183-T187 PolarHBondContact O-OG1 2.87Å; I184-T187 PolarHBondContact O-N 3.24Å; R185-T187 VanDerWaalsContact C-N 3.31Å; R185-T187 PolarHBondContact O-N 2.9Å; T187-W189 VanDerWaalsContact C-N 3.3Å; T187-W189 PolarHBondContact O-N 3.36Å; T187-A190 PolarHBondContact O-N 2.81Å; T187-A190 VanDerWaalsContact O-N 3.13Å; T187-L191 HydrophobicContact CG2-CD1 3.86Å; T187-L191 HydrophobicContact CG2-CG 3.97Å; T187-L191 WeakPolarHBondContact O-CB 3.5Å; T187-L191 VanDerWaalsContact O-CG 3.29Å; T187-L191 WeakPolarHBondContact O-CG 3.31Å; T187-L191 PolarHBondContact O-N 3.09Å; T187-L266 HydrophobicContact CG2-CD1 4.03Å; T187-L266 WeakPolarHBondContact OG1-CD1 3.26Å; T187-L270 HydrophobicContact CG2-CD1 3.96Å; T187-L270 HydrophobicContact CG2-CD2 3.91Å
188	G	90.3	Very high	87.9	Confident	3 Å²	3	45.4 Å²	45.4	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-57.4	-43	175.7	0	0	0	0	0	112.4	I184 R185 L192	I184-G188 PolarHBondContact O-N 2.96Å; R185-G188 PolarHBondContact O-N 3.49Å; G188-L192 PolarHBondContact O-N 3Å
189	W	92.6	Very high	88.4	Confident	80 Å²	80	41.2 Å²	41.2	30%	0.303	23%	0.228	S	C	.	.	H	α-helix	trans	-64.2	-44	173.2	170.2	83.5	0	0	0	112.7	V112 R185 L186 T187 L192 K193	V112-W189 HydrophobicContact CB-CB 4.47Å; V112-W189 HydrophobicContact CG1-CB 4.29Å; V112-W189 HydrophobicContact CG2-CB 4.02Å; R185-W189 PolarHBondContact O-N 3.43Å; L186-W189 HydrophobicContact CD1-CE3 4.16Å; L186-W189 HydrophobicContact CD1-CZ3 4.41Å; L186-W189 PolarHBondContact O-N 3.32Å; T187-W189 VanDerWaalsContact C-N 3.3Å; T187-W189 PolarHBondContact O-N 3.36Å; W189-L192 PolarHBondContact O-N 3.45Å; W189-K193 HydrophobicContact CH2-CD 4.27Å; W189-K193 HydrophobicContact CZ2-CD 3.78Å; W189-K193 PolarHBondContact O-N 3.48Å
190	A	91.5	Very high	88.9	Confident	31 Å²	31	48.2 Å²	48.2	26%	0.256	25%	0.253	S	S	.	.	H	α-helix	trans	-63.5	-43.3	178.2	0	0	0	0	0	111.4	L186 T187 K193 L194	L186-A190 WeakPolarHBondContact O-CB 3.08Å; L186-A190 PolarHBondContact O-N 3.42Å; T187-A190 PolarHBondContact O-N 2.81Å; T187-A190 VanDerWaalsContact O-N 3.13Å; A190-K193 PolarHBondContact O-N 3.26Å; A190-L194 WeakPolarHBondContact O-CB 3.48Å; A190-L194 VanDerWaalsContact O-CG 3.25Å; A190-L194 WeakPolarHBondContact O-CG 3.36Å; A190-L194 PolarHBondContact O-N 3.35Å
191	L	91.3	Very high	89.4	Confident	17 Å²	17	47 Å²	47	9%	0.089	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-40.6	177.7	-69.2	179.9	0	0	0	111.9	T187 K193 L194 F195 L236 F240	T187-L191 HydrophobicContact CG2-CD1 3.86Å; T187-L191 HydrophobicContact CG2-CG 3.97Å; T187-L191 WeakPolarHBondContact O-CB 3.5Å; T187-L191 VanDerWaalsContact O-CG 3.29Å; T187-L191 WeakPolarHBondContact O-CG 3.31Å; T187-L191 PolarHBondContact O-N 3.09Å; L191-K193 VanDerWaalsContact C-N 3.28Å; L191-K193 PolarHBondContact O-N 2.97Å; L191-L194 PolarHBondContact O-N 3.04Å; L191-F195 HydrophobicContact CB-CD2 4.39Å; L191-F195 HydrophobicContact CB-CE2 4.17Å; L191-F195 HydrophobicContact CB-CZ 4.34Å; L191-F195 HydrophobicContact CD1-CZ 4.44Å; L191-F195 HydrophobicContact CD2-CE1 3.84Å; L191-F195 HydrophobicContact CD2-CE2 4.45Å; L191-F195 HydrophobicContact CD2-CZ 3.78Å; L191-F195 HydrophobicContact CG-CZ 4.4Å; L191-F195 VanDerWaalsContact O-CB 3.24Å; L191-F195 WeakPolarHBondContact O-CB 3.45Å; L191-F195 VanDerWaalsContact O-CG 3.25Å; L191-F195 WeakPolarHBondContact O-CG 3.48Å; L191-F195 PolarHBondContact O-N 3.01Å; L191-L236 HydrophobicContact CD1-CB 4.4Å; L191-L236 HydrophobicContact CD2-CD1 4.35Å; L191-F240 HydrophobicContact CB-CD2 3.71Å; L191-F240 HydrophobicContact CB-CE2 3.84Å; L191-F240 HydrophobicContact CB-CG 4.47Å; L191-F240 HydrophobicContact CD1-CB 4.08Å; L191-F240 HydrophobicContact CD1-CD2 3.95Å; L191-F240 HydrophobicContact CD1-CG 4.31Å
192	L	92.3	Very high	90	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-54.8	-45.5	171.9	-84.6	166.9	0	0	0	111.6	I91 Y108 F111 V112 G188 W189 N196 F240	I91-L192 HydrophobicContact CG1-CD2 3.76Å; Y108-L192 HydrophobicContact CD2-CB 3.82Å; Y108-L192 HydrophobicContact CE2-CB 4.08Å; Y108-L192 HydrophobicContact CG-CB 4.24Å; Y108-L192 HydrophobicContact CG-CD1 4.31Å; F111-L192 HydrophobicContact CD1-CD1 3.97Å; F111-L192 HydrophobicContact CE1-CD1 4.4Å; V112-L192 HydrophobicContact CG2-CD1 3.83Å; G188-L192 PolarHBondContact O-N 3Å; W189-L192 PolarHBondContact O-N 3.45Å; L192-N196 WeakPolarHBondContact O-CB 3.43Å; L192-N196 PolarHBondContact O-N 3.07Å; L192-F240 HydrophobicContact CD2-CE2 4.25Å; L192-F240 HydrophobicContact CD2-CZ 3.7Å; L192-F240 HydrophobicContact CG-CE2 3.86Å; L192-F240 HydrophobicContact CG-CZ 3.83Å
193	K	90.1	Very high	90.5	Very high	111 Å²	111	43.5 Å²	43.5	48%	0.483	21%	0.213	S	C	.	.	H	α-helix	trans	-68.5	-45.3	177.5	-74.6	-165.4	170.1	-165	0	113	Y108 W189 A190 L191 G197	Y108-K193 HydrophobicContact CD2-CG 3.92Å; Y108-K193 HydrophobicContact CE2-CG 4.28Å; W189-K193 HydrophobicContact CH2-CD 4.27Å; W189-K193 HydrophobicContact CZ2-CD 3.78Å; W189-K193 PolarHBondContact O-N 3.48Å; A190-K193 PolarHBondContact O-N 3.26Å; L191-K193 VanDerWaalsContact C-N 3.28Å; L191-K193 PolarHBondContact O-N 2.97Å; K193-G197 PolarHBondContact O-N 2.83Å; K193-G197 VanDerWaalsContact O-N 3.1Å
194	L	89.4	Confident	91	Very high	56 Å²	56	40.5 Å²	40.5	29%	0.293	20%	0.199	S	C	.	.	H	α-helix	trans	-65.3	-51.7	-177.6	-73.7	173.3	0	0	0	110.7	A190 L191 N196 G197 F198 V384 L388	A190-L194 WeakPolarHBondContact O-CB 3.48Å; A190-L194 VanDerWaalsContact O-CG 3.25Å; A190-L194 WeakPolarHBondContact O-CG 3.36Å; A190-L194 PolarHBondContact O-N 3.35Å; L191-L194 PolarHBondContact O-N 3.04Å; L194-N196 PolarHBondContact O-N 2.94Å; L194-G197 WeakPolarHBondContact O-CA 3.47Å; L194-G197 PolarHBondContact O-N 3.06Å; L194-F198 HydrophobicContact CB-CE1 4.1Å; L194-F198 WeakPolarHBondContact O-CD1 3.48Å; L194-F198 WeakPolarHBondContact O-CE1 3.42Å; L194-F198 PolarHBondContact O-N 3.28Å; L194-V384 HydrophobicContact CD2-CG1 4.07Å; L194-L388 HydrophobicContact CD2-CD1 4.19Å; L194-L388 HydrophobicContact CD2-CD2 4.16Å
195	F	91.8	Very high	91.3	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-42.3	-178.5	-66.3	-8.8	0	0	0	111.6	I89 L191 G197 F198 F199 I202 I233 L237 F240	I89-F195 HydrophobicContact CG2-CB 3.73Å; I89-F195 HydrophobicContact CG2-CD2 4.24Å; L191-F195 HydrophobicContact CB-CD2 4.39Å; L191-F195 HydrophobicContact CB-CE2 4.17Å; L191-F195 HydrophobicContact CB-CZ 4.34Å; L191-F195 HydrophobicContact CD1-CZ 4.44Å; L191-F195 HydrophobicContact CD2-CE1 3.84Å; L191-F195 HydrophobicContact CD2-CE2 4.45Å; L191-F195 HydrophobicContact CD2-CZ 3.78Å; L191-F195 HydrophobicContact CG-CZ 4.4Å; L191-F195 VanDerWaalsContact O-CB 3.24Å; L191-F195 WeakPolarHBondContact O-CB 3.45Å; L191-F195 VanDerWaalsContact O-CG 3.25Å; L191-F195 WeakPolarHBondContact O-CG 3.48Å; L191-F195 PolarHBondContact O-N 3.01Å; F195-G197 PolarHBondContact O-N 3.42Å; F195-F198 HydrophobicContact CD1-CE1 4.22Å; F195-F198 HydrophobicContact CD1-CE2 4.27Å; F195-F198 AromaticContact CD1-CZ 3.58Å; F195-F198 HydrophobicContact CD1-CZ 3.58Å; F195-F198 HydrophobicContact CE1-CZ 4.1Å; F195-F198 PolarHBondContact O-N 3.39Å; F195-F199 HydrophobicContact CB-CD2 4.14Å; F195-F199 HydrophobicContact CD1-CD2 4.44Å; F195-F199 HydrophobicContact CD1-CE2 4.37Å; F195-F199 HydrophobicContact CG-CD2 4.36Å; F195-F199 WeakPolarHBondContact O-CA 3.48Å; F195-F199 WeakPolarHBondContact O-CB 3.49Å; F195-F199 PolarHBondContact O-N 2.94Å; F195-I202 HydrophobicContact CB-CD1 3.94Å; F195-I202 HydrophobicContact CD2-CD1 3.48Å; F195-I202 VanDerWaalsContact CD2-CD1 3.48Å; F195-I202 HydrophobicContact CE2-CD1 4.18Å; F195-I202 HydrophobicContact CG-CD1 3.9Å; F195-I233 HydrophobicContact CD1-CD1 4.07Å; F195-I233 HydrophobicContact CE1-CD1 3.37Å; F195-I233 HydrophobicContact CE1-CG1 3.91Å; F195-I233 HydrophobicContact CZ-CD1 3.84Å; F195-I233 HydrophobicContact CZ-CG1 3.94Å; F195-L237 HydrophobicContact CE2-CD1 4.33Å; F195-F240 AromaticContact CD2-CD1 3.91Å; F195-F240 HydrophobicContact CD2-CD1 3.91Å; F195-F240 AromaticContact CD2-CE1 3.8Å; F195-F240 HydrophobicContact CD2-CE1 3.8Å; F195-F240 HydrophobicContact CD2-CG 4.41Å; F195-F240 HydrophobicContact CD2-CZ 4.21Å; F195-F240 HydrophobicContact CE2-CB 4.34Å; F195-F240 AromaticContact CE2-CD1 3.7Å; F195-F240 HydrophobicContact CE2-CD1 3.7Å; F195-F240 HydrophobicContact CE2-CD2 4.49Å; F195-F240 HydrophobicContact CE2-CE1 4.09Å; F195-F240 AromaticContact CE2-CG 3.92Å; F195-F240 HydrophobicContact CE2-CG 3.92Å
196	N	89.8	Confident	91.5	Very high	75 Å²	75	40 Å²	40	40%	0.401	20%	0.199	S	C	.	.	H	α-helix	trans	-68.4	-11.9	173.4	-164.9	76.6	0	0	0	113.6	I89 Y108 L192 L194	I89-N196 HydrophobicContact CD1-CB 4.34Å; Y108-N196 PolarHBondContact OH-ND2 3.06Å; L192-N196 WeakPolarHBondContact O-CB 3.43Å; L192-N196 PolarHBondContact O-N 3.07Å; L194-N196 PolarHBondContact O-N 2.94Å
197	G	87.7	Confident	91.6	Very high	40 Å²	40	35.5 Å²	35.5	41%	0.412	18%	0.175	S	C	.	.	H	α-helix	trans	-85.1	-25.3	175.9	0	0	0	0	0	114.3	K193 L194 F195	K193-G197 PolarHBondContact O-N 2.83Å; K193-G197 VanDerWaalsContact O-N 3.1Å; L194-G197 WeakPolarHBondContact O-CA 3.47Å; L194-G197 PolarHBondContact O-N 3.06Å; F195-G197 PolarHBondContact O-N 3.42Å
198	F	88.7	Confident	91.9	Very high	9 Å²	9	34.8 Å²	34.8	4%	0.039	17%	0.171	C	C	.	.	H	α-helix	trans	-133.6	-12.5	-175.2	64.5	-110.2	0	0	0	115.5	L194 F195 I233 L359 M387 L388 Y392	L194-F198 HydrophobicContact CB-CE1 4.1Å; L194-F198 WeakPolarHBondContact O-CD1 3.48Å; L194-F198 WeakPolarHBondContact O-CE1 3.42Å; L194-F198 PolarHBondContact O-N 3.28Å; F195-F198 HydrophobicContact CD1-CE1 4.22Å; F195-F198 HydrophobicContact CD1-CE2 4.27Å; F195-F198 AromaticContact CD1-CZ 3.58Å; F195-F198 HydrophobicContact CD1-CZ 3.58Å; F195-F198 HydrophobicContact CE1-CZ 4.1Å; F195-F198 PolarHBondContact O-N 3.39Å; F198-I233 HydrophobicContact CE2-CD1 4.23Å; F198-I233 HydrophobicContact CZ-CD1 4.06Å; F198-L359 HydrophobicContact CD2-CD2 4.06Å; F198-L359 HydrophobicContact CE2-CD2 3.34Å; F198-L359 HydrophobicContact CE2-CG 4.45Å; F198-L359 HydrophobicContact CZ-CD2 3.79Å; F198-M387 VanDerWaalsContact CB-O 3.28Å; F198-M387 WeakPolarHBondContact CB-O 3.49Å; F198-M387 HydrophobicContact CD1-CB 4.48Å; F198-M387 HydrophobicContact CE1-CE 4.41Å; F198-M387 HydrophobicContact CZ-CE 4.28Å; F198-L388 HydrophobicContact CD1-CD2 4.08Å; F198-Y392 HydrophobicContact CB-CD2 3.99Å; F198-Y392 HydrophobicContact CB-CE2 4.32Å; F198-Y392 AromaticContact CD2-CD2 3.97Å; F198-Y392 HydrophobicContact CD2-CD2 3.97Å; F198-Y392 HydrophobicContact CG-CD2 4.32Å; F198-Y392 PolarHBondContact O-N 3.41Å
199	F	92.3	Very high	92.1	Very high	8 Å²	8	34.8 Å²	34.8	4%	0.035	17%	0.17	C	C	.	.			trans	-104	144.2	166.9	-67	-54.4	0	0	0	110.8	I89 F195 I202 I233 Y355 L359 G393 V395	I89-F199 HydrophobicContact CD1-CB 4.36Å; F195-F199 HydrophobicContact CB-CD2 4.14Å; F195-F199 HydrophobicContact CD1-CD2 4.44Å; F195-F199 HydrophobicContact CD1-CE2 4.37Å; F195-F199 HydrophobicContact CG-CD2 4.36Å; F195-F199 WeakPolarHBondContact O-CA 3.48Å; F195-F199 WeakPolarHBondContact O-CB 3.49Å; F195-F199 PolarHBondContact O-N 2.94Å; F199-I202 HydrophobicContact CD2-CD1 3.93Å; F199-I202 HydrophobicContact CD2-CG1 4.11Å; F199-I202 HydrophobicContact CE2-CD1 4.27Å; F199-I233 HydrophobicContact CE2-CD1 3.75Å; F199-I233 HydrophobicContact CZ-CD1 4.05Å; F199-Y355 HydrophobicContact CE1-CD1 4.42Å; F199-Y355 HydrophobicContact CZ-CD1 4.39Å; F199-Y355 HydrophobicContact CZ-CE1 4.13Å; F199-L359 HydrophobicContact CE1-CD1 4.14Å; F199-L359 HydrophobicContact CE1-CG 4.43Å; F199-L359 HydrophobicContact CZ-CD1 3.79Å; F199-L359 HydrophobicContact CZ-CD2 4.02Å; F199-L359 HydrophobicContact CZ-CG 4.23Å; F199-G393 WeakPolarHBondContact CA-O 3.4Å; F199-V395 HydrophobicContact CD1-CG2 3.6Å; F199-V395 HydrophobicContact CD2-CG2 4.07Å; F199-V395 HydrophobicContact CE1-CG2 3.3Å; F199-V395 HydrophobicContact CE2-CG2 3.75Å; F199-V395 HydrophobicContact CG-CG2 3.97Å; F199-V395 HydrophobicContact CZ-CG2 3.35Å
200	W	90.9	Very high	92.1	Very high	180 Å²	180	34.3 Å²	34.3	68%	0.682	17%	0.171	S	C	*	.	S	Bend	trans	-72.7	-45.6	171.1	-174.2	-85.8	0	0	0	111.5	G393	W200-G393 PolarHBondContact N-O 3.43Å
201	S	92.9	Very high	92.2	Very high	7 Å²	7	32.9 Å²	32.9	5%	0.049	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	147.7	177.3	70.5	0	0	0	0	112.1	N87 Q203 C394 V395	N87-S201 WeakPolarHBondContact ND2-CB 3.38Å; S201-Q203 WeakPolarHBondContact OG-CG 3.24Å; S201-Q203 PolarHBondContact OG-NE2 3.38Å; S201-Q203 VanDerWaalsContact OG-NE2 3.15Å; S201-C394 CarbonylContact O-C 3.59Å; S201-C394 WeakPolarHBondContact O-CA 3.48Å; S201-C394 PolarHBondContact OG-SG 3.21Å; S201-V395 PolarHBondContact O-N 3.18Å
202	I	95.2	Very high	92.4	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	102.6	166.6	-59.6	-173.4	0	0	0	106.7	N87 V88 I89 F195 F199 L237 I241 V395	N87-I202 CarbonylContact C-O 3.54Å; N87-I202 VanDerWaalsContact CA-O 3.31Å; N87-I202 WeakPolarHBondContact CA-O 3.49Å; N87-I202 PolarHBondContact OD1-N 2.9Å; N87-I202 PolarHBondContact OD1-O 3.38Å; V88-I202 HydrophobicContact CB-CB 4.44Å; V88-I202 HydrophobicContact CB-CG2 4.36Å; V88-I202 HydrophobicContact CG2-CG2 4.41Å; V88-I202 PolarHBondContact N-O 3.2Å; I89-I202 HydrophobicContact CD1-CG1 4.22Å; I89-I202 HydrophobicContact CG1-CB 4.4Å; I89-I202 HydrophobicContact CG1-CG1 4.27Å; I89-I202 HydrophobicContact CG2-CB 4.27Å; I89-I202 HydrophobicContact CG2-CD1 3.64Å; I89-I202 HydrophobicContact CG2-CG1 3.98Å; F195-I202 HydrophobicContact CB-CD1 3.94Å; F195-I202 HydrophobicContact CD2-CD1 3.48Å; F195-I202 VanDerWaalsContact CD2-CD1 3.48Å; F195-I202 HydrophobicContact CE2-CD1 4.18Å; F195-I202 HydrophobicContact CG-CD1 3.9Å; F199-I202 HydrophobicContact CD2-CD1 3.93Å; F199-I202 HydrophobicContact CD2-CG1 4.11Å; F199-I202 HydrophobicContact CE2-CD1 4.27Å; I202-L237 HydrophobicContact CD1-CD1 3.89Å; I202-L237 HydrophobicContact CG2-CD1 4Å; I202-I241 HydrophobicContact CG2-CD1 4.4Å; I202-V395 CarbonylContact C-O 3.57Å; I202-V395 WeakPolarHBondContact CA-O 3.15Å; I202-V395 HydrophobicContact CG1-CB 4.32Å; I202-V395 HydrophobicContact CG1-CG2 4.47Å
203	Q	95.1	Very high	92.3	Very high	36 Å²	36	34.6 Å²	34.6	17%	0.168	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136.3	-173	-60.7	-178	11.9	0	0	111	R86 S201 V395 R396 V397	R86-Q203 WeakPolarHBondContact O-CA 3.42Å; S201-Q203 WeakPolarHBondContact OG-CG 3.24Å; S201-Q203 PolarHBondContact OG-NE2 3.38Å; S201-Q203 VanDerWaalsContact OG-NE2 3.15Å; Q203-V395 PolarHBondContact N-O 3.35Å; Q203-R396 VanDerWaalsContact O-CD 3.32Å; Q203-R396 WeakPolarHBondContact O-CD 3.49Å; Q203-V397 PolarHBondContact O-N 3.46Å
204	I	95.1	Very high	92.4	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	149.7	169.6	64	169.3	0	0	0	110	L85 R86 V88 L209 I241 H245 V397	L85-I204 CarbonylContact C-O 3.56Å; L85-I204 WeakPolarHBondContact CA-O 3.46Å; R86-I204 HydrophobicContact CB-CG1 4.46Å; R86-I204 PolarHBondContact N-O 3.42Å; R86-I204 PolarHBondContact O-N 3.37Å; V88-I204 HydrophobicContact CG2-CB 4.29Å; V88-I204 HydrophobicContact CG2-CD1 3.68Å; V88-I204 HydrophobicContact CG2-CG1 3.66Å; V88-I204 HydrophobicContact CG2-CG2 3.72Å; I204-L209 HydrophobicContact CD1-CD2 3.9Å; I204-I241 HydrophobicContact CD1-CG2 4.13Å; I204-I241 HydrophobicContact CG2-CD1 4.03Å; I204-I241 HydrophobicContact CG2-CG2 4.19Å; I204-H245 WeakPolarHBondContact CD1-NE2 3.21Å; I204-V397 HydrophobicContact CG2-CB 4.15Å
205	H	93.8	Very high	92.6	Very high	18 Å²	18	29.9 Å²	29.9	8%	0.083	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	119.3	170.7	-168.3	-79.1	0	0	0	110.4	F59 I80 L85 G207 Q208 L209	F59-H205 AromaticContact CD2-CE1 3.85Å; F59-H205 AromaticContact CE2-CE1 3.65Å; F59-H205 AromaticContact CE2-ND1 3.78Å; I80-H205 PolarHBondContact O-CE1 3.27Å; L85-H205 HydrophobicContact CD2-CB 3.92Å; H205-G207 VanDerWaalsContact C-N 3.28Å; H205-G207 PolarHBondContact ND1-N 3Å; H205-G207 VanDerWaalsContact ND1-N 3.13Å; H205-G207 PolarHBondContact O-N 3.43Å; H205-Q208 HydrophobicContact CB-CB 4.12Å; H205-Q208 HydrophobicContact CB-CG 3.86Å; H205-Q208 PolarHBondContact ND1-N 3.24Å; H205-Q208 WeakPolarHBondContact O-CB 3.48Å; H205-Q208 PolarHBondContact O-N 3.19Å; H205-Q208 VanDerWaalsContact O-N 3.11Å; H205-L209 PolarHBondContact O-N 2.82Å
206	K	92.1	Very high	92.5	Very high	54 Å²	54	31 Å²	31	24%	0.235	15%	0.153	C	C	.	.	H	α-helix	trans	-58.3	-42.6	-176.1	-175.4	-169.9	-179.3	-167.8	0	111.4	L83 G84 R86 Q208 L209 E210	L83-K206 HydrophobicContact CB-CB 4.05Å; L83-K206 HydrophobicContact CB-CD 4.14Å; L83-K206 HydrophobicContact CB-CG 4.35Å; L83-K206 HydrophobicContact CD2-CD 4.44Å; G84-K206 PolarHBondContact O-N 3.27Å; R86-K206 HydrophobicContact CG-CB 4.43Å; K206-Q208 VanDerWaalsContact C-N 3.31Å; K206-Q208 PolarHBondContact O-N 3.05Å; K206-L209 WeakPolarHBondContact O-CB 3.37Å; K206-L209 PolarHBondContact O-N 3.49Å; K206-E210 WeakPolarHBondContact O-CG 3.26Å; K206-E210 PolarHBondContact O-N 3.02Å
207	G	92.3	Very high	92.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.5	-30.7	179.9	0	0	0	0	0	114.3	H205 E210 M211	H205-G207 VanDerWaalsContact C-N 3.28Å; H205-G207 PolarHBondContact ND1-N 3Å; H205-G207 VanDerWaalsContact ND1-N 3.13Å; H205-G207 PolarHBondContact O-N 3.43Å; G207-E210 PolarHBondContact O-N 3.29Å; G207-M211 WeakPolarHBondContact O-CG 3.31Å; G207-M211 PolarHBondContact O-N 3.27Å
208	Q	94.8	Very high	92.3	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-67.7	-43.2	175	-75.5	175.6	-13.2	0	0	110.5	F59 V60 H205 K206 E210 M211 V212 D398 F399	F59-Q208 HydrophobicContact CE2-CG 3.86Å; F59-Q208 HydrophobicContact CZ-CG 3.9Å; V60-Q208 PolarHBondContact O-NE2 3.23Å; V60-Q208 VanDerWaalsContact O-NE2 3.14Å; H205-Q208 HydrophobicContact CB-CB 4.12Å; H205-Q208 HydrophobicContact CB-CG 3.86Å; H205-Q208 PolarHBondContact ND1-N 3.24Å; H205-Q208 WeakPolarHBondContact O-CB 3.48Å; H205-Q208 PolarHBondContact O-N 3.19Å; H205-Q208 VanDerWaalsContact O-N 3.11Å; K206-Q208 VanDerWaalsContact C-N 3.31Å; K206-Q208 PolarHBondContact O-N 3.05Å; Q208-E210 PolarHBondContact O-N 3.09Å; Q208-M211 HydrophobicContact CG-CE 4.38Å; Q208-M211 WeakPolarHBondContact O-CB 3.38Å; Q208-M211 PolarHBondContact O-N 3.14Å; Q208-V212 PolarHBondContact O-N 2.87Å; Q208-D398 VanDerWaalsContact OE1-CA 3.24Å; Q208-F399 HydrophobicContact CB-CB 4.18Å; Q208-F399 WeakPolarHBondContact CB-O 3.22Å; Q208-F399 WeakPolarHBondContact CG-O 3.29Å; Q208-F399 PolarHBondContact OE1-O 3.36Å
209	L	93.8	Very high	92	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-65	-37.6	176	-172.5	74.9	0	0	0	112.7	I204 H205 K206 M211 V212 K213 H245 I247 F399	I204-L209 HydrophobicContact CD1-CD2 3.9Å; H205-L209 PolarHBondContact O-N 2.82Å; K206-L209 WeakPolarHBondContact O-CB 3.37Å; K206-L209 PolarHBondContact O-N 3.49Å; L209-M211 VanDerWaalsContact C-N 3.3Å; L209-M211 PolarHBondContact O-N 3.5Å; L209-V212 WeakPolarHBondContact O-CB 3.37Å; L209-V212 PolarHBondContact O-N 3.39Å; L209-V212 VanDerWaalsContact O-N 3.17Å; L209-K213 WeakPolarHBondContact O-CG 3.27Å; L209-K213 PolarHBondContact O-N 3.09Å; L209-H245 HydrophobicContact CD2-CB 3.71Å; L209-H245 WeakPolarHBondContact CD2-CD2 3.36Å; L209-H245 WeakPolarHBondContact CD2-ND1 3.04Å; L209-I247 HydrophobicContact CD1-CD1 3.6Å; L209-I247 HydrophobicContact CG-CD1 4.18Å; L209-F399 HydrophobicContact CD1-CE2 4.46Å
210	E	92.6	Very high	91.7	Very high	70 Å²	70	43.4 Å²	43.4	33%	0.327	21%	0.207	S	C	.	.	H	α-helix	trans	-62.5	-36	174.7	-69	-55.4	135.3	0	0	111.9	L83 K206 G207 Q208 V212 K213 K214	L83-E210 HydrophobicContact CD1-CG 4.3Å; K206-E210 WeakPolarHBondContact O-CG 3.26Å; K206-E210 PolarHBondContact O-N 3.02Å; G207-E210 PolarHBondContact O-N 3.29Å; Q208-E210 PolarHBondContact O-N 3.09Å; E210-V212 VanDerWaalsContact C-N 3.34Å; E210-V212 PolarHBondContact O-N 2.74Å; E210-K213 PolarHBondContact O-N 2.97Å; E210-K213 IonicContact OE1-NZ 3.15Å; E210-K213 PolarHBondContact OE1-NZ 2.9Å; E210-K214 WeakPolarHBondContact O-CB 3.43Å; E210-K214 PolarHBondContact O-N 3.47Å
211	M	94.5	Very high	91.7	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-41.1	171.9	-63.2	-168.1	-68.9	0	0	112.2	F59 L75 F76 I80 G207 Q208 L209 K214 A215 Q401	F59-M211 HydrophobicContact CE1-CE 4.25Å; F59-M211 HydrophobicContact CZ-CE 3.71Å; L75-M211 VanDerWaalsContact O-CG 3.3Å; L75-M211 WeakPolarHBondContact O-CG 3.31Å; F76-M211 HydrophobicContact CB-SD 4.44Å; F76-M211 HydrophobicContact CD2-SD 4.11Å; I80-M211 HydrophobicContact CD1-CG 3.53Å; I80-M211 HydrophobicContact CD1-SD 3.95Å; G207-M211 WeakPolarHBondContact O-CG 3.31Å; G207-M211 PolarHBondContact O-N 3.27Å; Q208-M211 HydrophobicContact CG-CE 4.38Å; Q208-M211 WeakPolarHBondContact O-CB 3.38Å; Q208-M211 PolarHBondContact O-N 3.14Å; L209-M211 VanDerWaalsContact C-N 3.3Å; L209-M211 PolarHBondContact O-N 3.5Å; M211-K214 PolarHBondContact O-N 3.37Å; M211-A215 WeakPolarHBondContact O-CB 3.41Å; M211-A215 PolarHBondContact O-N 3.44Å; M211-Q401 HydrophobicContact CE-CB 3.87Å; M211-Q401 HydrophobicContact CE-CG 4.43Å; M211-Q401 HydrophobicContact SD-CB 3.97Å; M211-Q401 HydrophobicContact SD-CG 3.86Å
212	V	94.7	Very high	91.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.9	-43.8	176.3	176.7	0	0	0	0	110.9	Q208 L209 E210 A215 A216 L223 F225 I247 V349 F399 P402	Q208-V212 PolarHBondContact O-N 2.87Å; L209-V212 WeakPolarHBondContact O-CB 3.37Å; L209-V212 PolarHBondContact O-N 3.39Å; L209-V212 VanDerWaalsContact O-N 3.17Å; E210-V212 VanDerWaalsContact C-N 3.34Å; E210-V212 PolarHBondContact O-N 2.74Å; V212-A215 PolarHBondContact O-N 3.33Å; V212-A216 WeakPolarHBondContact O-CB 3.4Å; V212-A216 PolarHBondContact O-N 3.05Å; V212-L223 HydrophobicContact CG1-CD2 3.83Å; V212-F225 HydrophobicContact CG1-CE1 3.97Å; V212-F225 HydrophobicContact CG1-CZ 3.99Å; V212-I247 HydrophobicContact CG1-CD1 4.29Å; V212-V349 HydrophobicContact CG2-CG1 4.18Å; V212-F399 HydrophobicContact CG2-CB 3.91Å; V212-F399 HydrophobicContact CG2-CD1 4.23Å; V212-F399 HydrophobicContact CG2-CG 4.24Å; V212-P402 HydrophobicContact CG2-CG 4.16Å
213	K	92.1	Very high	91.8	Very high	53 Å²	53	35 Å²	35	23%	0.23	18%	0.176	C	C	.	.	H	α-helix	trans	-62.2	-43.6	175.4	-71.1	178.9	-172.3	167.4	0	112.3	L209 E210 A216 T217 I247	L209-K213 WeakPolarHBondContact O-CG 3.27Å; L209-K213 PolarHBondContact O-N 3.09Å; E210-K213 PolarHBondContact O-N 2.97Å; E210-K213 IonicContact OE1-NZ 3.15Å; E210-K213 PolarHBondContact OE1-NZ 2.9Å; K213-A216 PolarHBondContact O-N 3.28Å; K213-T217 WeakPolarHBondContact O-CB 3.18Å; K213-T217 WeakPolarHBondContact O-CG2 3.47Å; K213-T217 PolarHBondContact O-N 3.43Å; K213-T217 PolarHBondContact O-OG1 3.27Å; K213-I247 HydrophobicContact CD-CD1 4.45Å; K213-I247 HydrophobicContact CG-CD1 3.48Å; K213-I247 VanDerWaalsContact CG-CD1 3.48Å; K213-I247 HydrophobicContact CG-CG1 3.79Å
214	K	91.8	Very high	91.9	Very high	69 Å²	69	33.3 Å²	33.3	30%	0.3	17%	0.168	S	C	.	.	H	α-helix	trans	-60.1	-47.5	176.7	-170.6	-179.8	178.2	-173.7	0	110.5	R74 L75 E210 M211 A216 T217 E218	R74-K214 PolarHBondContact O-NZ 3.01Å; L75-K214 HydrophobicContact CD2-CB 4.25Å; L75-K214 HydrophobicContact CD2-CD 4.01Å; L75-K214 HydrophobicContact CD2-CG 4.03Å; E210-K214 WeakPolarHBondContact O-CB 3.43Å; E210-K214 PolarHBondContact O-N 3.47Å; M211-K214 PolarHBondContact O-N 3.37Å; K214-A216 VanDerWaalsContact C-N 3.35Å; K214-A216 PolarHBondContact O-N 3.38Å; K214-T217 PolarHBondContact O-N 3.43Å; K214-T217 PolarHBondContact O-OG1 2.83Å; K214-E218 WeakPolarHBondContact CE-OE1 3.34Å; K214-E218 WeakPolarHBondContact CE-OE2 3.46Å; K214-E218 VanDerWaalsContact CG-CD 3.42Å; K214-E218 HydrophobicContact CG-CG 4.15Å; K214-E218 VanDerWaalsContact CG-OE1 3.32Å; K214-E218 WeakPolarHBondContact CG-OE1 3.33Å; K214-E218 WeakPolarHBondContact O-CB 3.32Å; K214-E218 PolarHBondContact O-N 3.13Å
215	A	92.6	Very high	92	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.2	-43.2	175.5	0	0	0	0	0	112.4	L75 M211 V212 T217 Y219 M347 P402	L75-A215 HydrophobicContact CD1-CB 4.26Å; L75-A215 HydrophobicContact CD2-CB 4.21Å; M211-A215 WeakPolarHBondContact O-CB 3.41Å; M211-A215 PolarHBondContact O-N 3.44Å; V212-A215 PolarHBondContact O-N 3.33Å; A215-T217 VanDerWaalsContact C-N 3.31Å; A215-T217 PolarHBondContact O-N 2.96Å; A215-Y219 WeakPolarHBondContact O-CB 3.47Å; A215-Y219 PolarHBondContact O-N 3.45Å; A215-M347 HydrophobicContact CB-CE 4.43Å; A215-P402 HydrophobicContact CB-CB 3.81Å; A215-P402 HydrophobicContact CB-CG 3.8Å
216	A	90.2	Very high	92.1	Very high	27 Å²	27	32.4 Å²	32.4	22%	0.223	16%	0.164	C	C	.	.	H	α-helix	trans	-66.3	-28.9	179.3	0	0	0	0	0	114	V212 K213 K214 L223 F308	V212-A216 WeakPolarHBondContact O-CB 3.4Å; V212-A216 PolarHBondContact O-N 3.05Å; K213-A216 PolarHBondContact O-N 3.28Å; K214-A216 VanDerWaalsContact C-N 3.35Å; K214-A216 PolarHBondContact O-N 3.38Å; A216-L223 HydrophobicContact CB-CD1 4.22Å; A216-L223 HydrophobicContact CB-CD2 4.19Å; A216-F308 HydrophobicContact CB-CE2 4.2Å; A216-F308 HydrophobicContact CB-CZ 3.84Å
217	T	86.9	Confident	92.2	Very high	109 Å²	109	29.9 Å²	29.9	67%	0.669	15%	0.153	S	C	*	.	H	α-helix	trans	-97.1	-39.2	-175.4	48.1	0	0	0	0	113.2	K213 K214 A215	K213-T217 WeakPolarHBondContact O-CB 3.18Å; K213-T217 WeakPolarHBondContact O-CG2 3.47Å; K213-T217 PolarHBondContact O-N 3.43Å; K213-T217 PolarHBondContact O-OG1 3.27Å; K214-T217 PolarHBondContact O-N 3.43Å; K214-T217 PolarHBondContact O-OG1 2.83Å; A215-T217 VanDerWaalsContact C-N 3.31Å; A215-T217 PolarHBondContact O-N 2.96Å
218	E	86.7	Confident	92.3	Very high	120 Å²	120	30 Å²	30	56%	0.561	15%	0.153	S	C	*	.	H	α-helix	trans	-86.5	-37.2	-173.9	-66.7	-178.6	-176.3	0	0	113.7	K214	K214-E218 WeakPolarHBondContact CE-OE1 3.34Å; K214-E218 WeakPolarHBondContact CE-OE2 3.46Å; K214-E218 VanDerWaalsContact CG-CD 3.42Å; K214-E218 HydrophobicContact CG-CG 4.15Å; K214-E218 VanDerWaalsContact CG-OE1 3.32Å; K214-E218 WeakPolarHBondContact CG-OE1 3.33Å; K214-E218 WeakPolarHBondContact O-CB 3.32Å; K214-E218 PolarHBondContact O-N 3.13Å
219	Y	82.7	Confident	92.1	Very high	55 Å²	55	30 Å²	30	22%	0.216	15%	0.153	C	C	.	.	S	Bend	trans	-84.5	-14	-173.1	-75.4	-102.5	0	0	0	113.5	R74 L75 A215 A221 M347	R74-Y219 WeakPolarHBondContact CD-OH 3.36Å; L75-Y219 HydrophobicContact CD1-CE2 4.4Å; L75-Y219 HydrophobicContact CD2-CE2 3.81Å; L75-Y219 HydrophobicContact CG-CE2 4.25Å; A215-Y219 WeakPolarHBondContact O-CB 3.47Å; A215-Y219 PolarHBondContact O-N 3.45Å; Y219-A221 PolarHBondContact O-N 3.42Å; Y219-A221 VanDerWaalsContact O-N 3.08Å; Y219-M347 HydrophobicContact CD1-CE 4.44Å; Y219-M347 HydrophobicContact CD1-SD 3.86Å; Y219-M347 HydrophobicContact CE1-CE 4.41Å; Y219-M347 HydrophobicContact CE1-SD 4.25Å; Y219-M347 HydrophobicContact CG-CG 4.47Å; Y219-M347 HydrophobicContact CG-SD 4.13Å
220	N	84.8	Confident	91.7	Very high	108 Å²	108	30.8 Å²	30.8	58%	0.578	16%	0.157	S	C	*	.			trans	45.4	39.8	-175.5	-161.8	37	0	0	0	113.1	Q306	N220-Q306 PolarHBondContact ND2-NE2 3.22Å; N220-Q306 PolarHBondContact O-NE2 2.93Å; N220-Q306 VanDerWaalsContact O-NE2 3.12Å; N220-Q306 PolarHBondContact OD1-OE1 3.16Å; N220-Q306 VanDerWaalsContact OD1-OE1 3.14Å
221	A	90.7	Very high	91.4	Very high	6 Å²	6	27.5 Å²	27.5	5%	0.05	14%	0.142	C	C	.	.			trans	-124.8	151.2	-174	0	0	0	0	0	110.4	Y219 L223 E345 M347	Y219-A221 PolarHBondContact O-N 3.42Å; Y219-A221 VanDerWaalsContact O-N 3.08Å; A221-L223 WeakPolarHBondContact O-CD1 3.29Å; A221-E345 HydrophobicContact CB-CB 4.12Å; A221-E345 HydrophobicContact CB-CG 4.15Å; A221-M347 HydrophobicContact CB-CG 4.34Å
222	P	94.3	Very high	90.6	Very high	4 Å²	4	29.2 Å²	29.2	3%	0.026	15%	0.15	C	C	.	.			trans	-64	136.1	174	27	-34.8	0	0	0	111.3	L303 Q307 E345 V346 M347	P222-L303 HydrophobicContact CB-CD2 3.93Å; P222-L303 HydrophobicContact CG-CD2 3.98Å; P222-Q307 WeakPolarHBondContact CB-O 3.29Å; P222-E345 WeakPolarHBondContact CD-O 3.28Å; P222-V346 HydrophobicContact CG-CG2 4.16Å; P222-M347 PolarHBondContact O-N 3.29Å
223	L	95.8	Very high	90.2	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	133.6	171.7	-84	66.7	0	0	0	110.4	V212 A216 A221 F225 F308 L309 M347 V349	V212-L223 HydrophobicContact CG1-CD2 3.83Å; A216-L223 HydrophobicContact CB-CD1 4.22Å; A216-L223 HydrophobicContact CB-CD2 4.19Å; A221-L223 WeakPolarHBondContact O-CD1 3.29Å; L223-F225 HydrophobicContact CB-CE2 3.94Å; L223-F225 HydrophobicContact CB-CZ 4.22Å; L223-F225 HydrophobicContact CD2-CE2 4.46Å; L223-F225 HydrophobicContact CD2-CZ 3.93Å; L223-F308 HydrophobicContact CB-CB 4.49Å; L223-F308 HydrophobicContact CB-CD1 3.86Å; L223-F308 HydrophobicContact CB-CD2 4.21Å; L223-F308 HydrophobicContact CB-CE1 4.1Å; L223-F308 HydrophobicContact CB-CE2 4.42Å; L223-F308 HydrophobicContact CB-CG 3.93Å; L223-F308 HydrophobicContact CB-CZ 4.38Å; L223-F308 HydrophobicContact CD1-CD1 4.38Å; L223-F308 HydrophobicContact CD1-CE1 3.77Å; L223-F308 HydrophobicContact CD1-CZ 3.86Å; L223-F308 HydrophobicContact CD2-CE2 4.42Å; L223-F308 HydrophobicContact CD2-CZ 4.5Å; L223-F308 HydrophobicContact CG-CE1 4.44Å; L223-F308 HydrophobicContact CG-CZ 4.47Å; L223-F308 CarbonylContact O-C 3.58Å; L223-F308 WeakPolarHBondContact O-CA 3.45Å; L223-F308 WeakPolarHBondContact O-CB 3.41Å; L223-L309 PolarHBondContact O-N 3.45Å; L223-M347 CarbonylContact C-O 3.56Å; L223-M347 WeakPolarHBondContact CA-O 3.49Å; L223-M347 HydrophobicContact CD1-CB 4.12Å; L223-M347 HydrophobicContact CG-CB 4.05Å; L223-V349 HydrophobicContact CD2-CG2 4.18Å; L223-V349 HydrophobicContact CG-CG2 4.32Å
224	V	97	Very high	90	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	105.8	174.9	-178.1	0	0	0	0	109.1	L226 L309 V334 V346 M347 V349	V224-L226 HydrophobicContact CG1-CD2 3.75Å; V224-L226 HydrophobicContact CG1-CG 4.08Å; V224-L309 CarbonylContact C-O 3.52Å; V224-L309 WeakPolarHBondContact CA-O 3.49Å; V224-L309 HydrophobicContact CG1-CB 4.44Å; V224-L309 HydrophobicContact CG2-CB 4.31Å; V224-L309 HydrophobicContact CG2-CD1 4.49Å; V224-V334 HydrophobicContact CG2-CG1 4.18Å; V224-V346 HydrophobicContact CB-CG1 4.36Å; V224-V346 HydrophobicContact CG2-CG1 3.53Å; V224-M347 PolarHBondContact N-O 3.49Å; V224-V349 PolarHBondContact O-N 3.42Å
225	F	97.2	Very high	89.5	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	124.9	176.6	-62.2	-86.5	0	0	0	110.1	V212 L223 P227 L242 P250 F308 L309 E310 V311 V349 V351 F399	V212-F225 HydrophobicContact CG1-CE1 3.97Å; V212-F225 HydrophobicContact CG1-CZ 3.99Å; L223-F225 HydrophobicContact CB-CE2 3.94Å; L223-F225 HydrophobicContact CB-CZ 4.22Å; L223-F225 HydrophobicContact CD2-CE2 4.46Å; L223-F225 HydrophobicContact CD2-CZ 3.93Å; F225-P227 VanDerWaalsContact C-CD 3.46Å; F225-P227 VanDerWaalsContact O-CD 3.3Å; F225-P227 WeakPolarHBondContact O-CD 3.3Å; F225-L242 HydrophobicContact CD2-CD1 4.3Å; F225-L242 HydrophobicContact CE1-CD1 4.15Å; F225-L242 HydrophobicContact CE1-CD2 4.26Å; F225-L242 HydrophobicContact CE2-CD1 3.74Å; F225-L242 HydrophobicContact CZ-CD1 3.66Å; F225-L242 HydrophobicContact CZ-CD2 4.06Å; F225-P250 HydrophobicContact CD2-CB 4.12Å; F225-P250 HydrophobicContact CD2-CG 4.41Å; F225-F308 HydrophobicContact CE2-CB 4.2Å; F225-F308 HydrophobicContact CE2-CD2 4.05Å; F225-F308 HydrophobicContact CE2-CG 4.4Å; F225-L309 PolarHBondContact N-O 3.31Å; F225-E310 WeakPolarHBondContact O-CA 3.28Å; F225-V311 PolarHBondContact O-N 3.13Å; F225-V349 WeakPolarHBondContact CA-O 3.44Å; F225-V349 HydrophobicContact CD1-CB 3.82Å; F225-V349 HydrophobicContact CD1-CG1 3.89Å; F225-V349 HydrophobicContact CD1-CG2 4.36Å; F225-V349 HydrophobicContact CE1-CB 4.12Å; F225-V349 HydrophobicContact CE1-CG1 4.02Å; F225-V349 HydrophobicContact CE1-CG2 4.24Å; F225-V351 HydrophobicContact CD1-CG2 4.13Å; F225-F399 HydrophobicContact CD1-CD1 4.31Å; F225-F399 HydrophobicContact CD1-CE1 4.16Å; F225-F399 HydrophobicContact CE1-CD1 4.17Å; F225-F399 HydrophobicContact CE1-CE1 4.04Å
226	L	96.4	Very high	89.2	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	79.7	-176.4	-59.9	178.1	0	0	0	110	V224 V311 L313 L331 V348 V349 V351 V471	V224-L226 HydrophobicContact CG1-CD2 3.75Å; V224-L226 HydrophobicContact CG1-CG 4.08Å; L226-V311 HydrophobicContact CD2-CB 3.81Å; L226-V311 HydrophobicContact CD2-CG1 4.47Å; L226-V311 WeakPolarHBondContact CD2-O 3.31Å; L226-L313 HydrophobicContact CB-CD1 4.46Å; L226-L313 HydrophobicContact CD1-CD1 4.23Å; L226-L313 HydrophobicContact CD2-CD1 4.47Å; L226-L313 HydrophobicContact CD2-CD2 4Å; L226-L313 HydrophobicContact CD2-CG 4.1Å; L226-L331 HydrophobicContact CD1-CD1 4.31Å; L226-V348 HydrophobicContact CD1-CG1 3.49Å; L226-V348 VanDerWaalsContact CD1-CG1 3.49Å; L226-V348 HydrophobicContact CG-CG1 4.32Å; L226-V349 PolarHBondContact N-O 2.82Å; L226-V351 PolarHBondContact O-N 3.36Å; L226-V351 VanDerWaalsContact O-N 3.13Å; L226-V471 HydrophobicContact CB-CG1 3.42Å; L226-V471 VanDerWaalsContact CB-CG1 3.42Å; L226-V471 HydrophobicContact CD1-CB 4.27Å; L226-V471 HydrophobicContact CD1-CG1 3.61Å; L226-V471 HydrophobicContact CD1-CG2 3.93Å; L226-V471 HydrophobicContact CG-CG1 4.13Å
227	P	95.2	Very high	89.3	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	153.3	-179.7	31.5	-37.2	0	0	0	114.5	F225 I238 E310 F312 V351 I353	F225-P227 VanDerWaalsContact C-CD 3.46Å; F225-P227 VanDerWaalsContact O-CD 3.3Å; F225-P227 WeakPolarHBondContact O-CD 3.3Å; P227-I238 HydrophobicContact CB-CD1 3.46Å; P227-I238 VanDerWaalsContact CB-CD1 3.46Å; P227-I238 HydrophobicContact CG-CD1 3.58Å; P227-E310 HydrophobicContact CG-CG 4.31Å; P227-F312 HydrophobicContact CB-CD1 4.38Å; P227-F312 HydrophobicContact CB-CE1 3.98Å; P227-F312 HydrophobicContact CG-CD1 3.61Å; P227-F312 HydrophobicContact CG-CE1 3.32Å; P227-F312 HydrophobicContact CG-CE2 4.25Å; P227-F312 HydrophobicContact CG-CG 4.28Å; P227-F312 HydrophobicContact CG-CZ 3.68Å; P227-V351 VanDerWaalsContact CA-O 3.3Å; P227-V351 WeakPolarHBondContact CA-O 3.43Å; P227-V351 HydrophobicContact CB-CB 4.03Å; P227-I353 HydrophobicContact CB-CD1 4.25Å
228	V	93.1	Very high	89.4	Confident	2 Å²	2	20.3 Å²	20.3	1%	0.012	10%	0.098	C	C	.	.			trans	-68.2	147.9	157.2	-64.3	0	0	0	0	110.2	E314 V351 I353 A475 N476	V228-E314 WeakPolarHBondContact CA-OE1 3.4Å; V228-V351 PolarHBondContact N-O 2.82Å; V228-V351 VanDerWaalsContact N-O 3.11Å; V228-I353 HydrophobicContact CG2-CB 4.25Å; V228-A475 HydrophobicContact CG1-CB 3.89Å; V228-N476 HydrophobicContact CG1-CB 4.48Å
229	H	90.6	Very high	89.5	Confident	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.075	C	C	.	.			trans	-115.7	105.7	-174.1	-157.6	11.3	0	0	0	112.2	S231 D234 Y235 F312 E314 R317 S318	H229-S231 PolarHBondContact CE1-O 3.49Å; H229-S231 PolarHBondContact ND1-O 2.71Å; H229-D234 WeakPolarHBondContact CA-OD2 3.48Å; H229-D234 IonicContact CE1-OD2 2.93Å; H229-D234 IonicContact CG-OD2 3.4Å; H229-D234 IonicContact ND1-OD2 2.97Å; H229-D234 PolarHBondContact ND1-OD2 3.41Å; H229-Y235 AromaticContact CE1-CE1 3.8Å; H229-Y235 AromaticContact CE1-CE2 3.99Å; H229-Y235 AromaticContact CE1-CZ 3.49Å; H229-Y235 VanDerWaalsContact CE1-CZ 3.49Å; H229-Y235 PolarHBondContact CE1-OH 2.93Å; H229-Y235 AromaticContact NE2-CE1 3.64Å; H229-Y235 AromaticContact NE2-CZ 3.24Å; H229-Y235 PolarHBondContact NE2-OH 3.26Å; H229-F312 HydrophobicContact CB-CD1 3.51Å; H229-F312 HydrophobicContact CB-CE1 4.11Å; H229-F312 HydrophobicContact CB-CG 4.35Å; H229-F312 AromaticContact CD2-CD1 3.88Å; H229-F312 AromaticContact CG-CD1 3.41Å; H229-F312 VanDerWaalsContact CG-CD1 3.41Å; H229-F312 AromaticContact CG-CE1 3.79Å; H229-F312 AromaticContact ND1-CD1 3.71Å; H229-F312 AromaticContact ND1-CE1 3.57Å; H229-E314 PolarHBondContact N-OE1 2.94Å; H229-R317 PolarHBondContact CD2-N 3.48Å; H229-R317 VanDerWaalsContact CD2-N 3.31Å; H229-R317 CarbonylContact O-C 3.45Å; H229-S318 WeakPolarHBondContact O-CB 3.41Å; H229-S318 PolarHBondContact O-N 3.26Å
230	K	86.5	Confident	89.9	Confident	19 Å²	19	12.8 Å²	12.8	8%	0.083	7%	0.066	C	C	.	.			trans	-113.7	-23.1	179.4	-65.1	-179.5	-177.1	166.1	0	113.3	D234 I353 Y355	K230-D234 PolarHBondContact N-OD2 3.27Å; K230-I353 WeakPolarHBondContact CD-O 3.48Å; K230-I353 WeakPolarHBondContact CE-O 3.45Å; K230-I353 PolarHBondContact NZ-O 3.27Å; K230-Y355 HydrophobicContact CB-CD2 4.26Å; K230-Y355 HydrophobicContact CB-CE2 4.17Å
231	S	85.1	Confident	90.3	Very high	2 Å²	2	7.7 Å²	7.7	1%	0.014	4%	0.038	C	C	.	.			trans	-151.1	154.3	-176.2	180	0	0	0	0	113.2	H229 I233 D234	H229-S231 PolarHBondContact CE1-O 3.49Å; H229-S231 PolarHBondContact ND1-O 2.71Å; S231-I233 PolarHBondContact O-N 3.23Å; S231-I233 VanDerWaalsContact O-N 3.17Å; S231-I233 WeakPolarHBondContact OG-CG2 3.5Å; S231-I233 PolarHBondContact OG-N 3.06Å; S231-D234 PolarHBondContact N-OD2 3.19Å; S231-D234 VanDerWaalsContact O-CB 3.24Å; S231-D234 WeakPolarHBondContact O-CB 3.31Å; S231-D234 PolarHBondContact O-N 2.99Å
232	H	79.1	Confident	90.4	Very high	36 Å²	36	7.4 Å²	7.4	17%	0.167	4%	0.036	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-15.2	171.3	-68.8	-37.9	0	0	0	113.8	D234 Y235 R317 E360	H232-D234 VanDerWaalsContact C-N 3.29Å; H232-Y235 HydrophobicContact CB-CE2 4.39Å; H232-Y235 AromaticContact ND1-CE2 3.83Å; H232-Y235 WeakPolarHBondContact O-CD2 3.5Å; H232-R317 PolarHBondContact CD2-NH1 2.55Å; H232-R317 PolarHBondContact NE2-NH1 2.73Å; H232-E360 WeakPolarHBondContact CA-OE1 3.46Å; H232-E360 WeakPolarHBondContact CB-OE1 3.29Å; H232-E360 IonicContact CD2-OE1 3.53Å; H232-E360 PolarHBondContact CD2-OE1 2.84Å; H232-E360 IonicContact CG-OE1 3.31Å; H232-E360 PolarHBondContact N-OE1 3.38Å; H232-E360 IonicContact ND1-OE1 2.91Å; H232-E360 IonicContact NE2-OE1 3.98Å
233	I	85.4	Confident	90.2	Very high	17 Å²	17	8 Å²	8	9%	0.087	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-20.4	172.2	-162.6	167.7	0	0	0	112.5	F195 F198 F199 S231 Y235 L236 L237 Y355 L359	F195-I233 HydrophobicContact CD1-CD1 4.07Å; F195-I233 HydrophobicContact CE1-CD1 3.37Å; F195-I233 HydrophobicContact CE1-CG1 3.91Å; F195-I233 HydrophobicContact CZ-CD1 3.84Å; F195-I233 HydrophobicContact CZ-CG1 3.94Å; F198-I233 HydrophobicContact CE2-CD1 4.23Å; F198-I233 HydrophobicContact CZ-CD1 4.06Å; F199-I233 HydrophobicContact CE2-CD1 3.75Å; F199-I233 HydrophobicContact CZ-CD1 4.05Å; S231-I233 PolarHBondContact O-N 3.23Å; S231-I233 VanDerWaalsContact O-N 3.17Å; S231-I233 WeakPolarHBondContact OG-CG2 3.5Å; S231-I233 PolarHBondContact OG-N 3.06Å; I233-Y235 PolarHBondContact O-N 3.06Å; I233-L236 PolarHBondContact O-N 2.94Å; I233-L237 PolarHBondContact O-N 3.14Å; I233-Y355 HydrophobicContact CG2-CE1 4.03Å; I233-Y355 WeakPolarHBondContact CG2-OH 3.38Å; I233-L359 HydrophobicContact CD1-CD2 3.77Å; I233-L359 HydrophobicContact CG2-CD1 4.02Å
234	D	88.8	Confident	90	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-55.3	-41	-175.2	-61.4	-20.4	0	0	0	111.4	H229 K230 S231 H232 L236 L237 I238 F312 I353 Y355	H229-D234 WeakPolarHBondContact CA-OD2 3.48Å; H229-D234 IonicContact CE1-OD2 2.93Å; H229-D234 IonicContact CG-OD2 3.4Å; H229-D234 IonicContact ND1-OD2 2.97Å; H229-D234 PolarHBondContact ND1-OD2 3.41Å; K230-D234 PolarHBondContact N-OD2 3.27Å; S231-D234 PolarHBondContact N-OD2 3.19Å; S231-D234 VanDerWaalsContact O-CB 3.24Å; S231-D234 WeakPolarHBondContact O-CB 3.31Å; S231-D234 PolarHBondContact O-N 2.99Å; H232-D234 VanDerWaalsContact C-N 3.29Å; D234-L236 PolarHBondContact O-N 3.45Å; D234-L237 PolarHBondContact O-N 2.86Å; D234-L237 VanDerWaalsContact O-N 3.12Å; D234-I238 PolarHBondContact O-N 3.16Å; D234-F312 HydrophobicContact CB-CE1 3.79Å; D234-F312 HydrophobicContact CB-CZ 3.88Å; D234-I353 HydrophobicContact CB-CD1 4.13Å; D234-Y355 WeakPolarHBondContact OD1-CE2 3.44Å; D234-Y355 PolarHBondContact OD1-OH 3.06Å
235	Y	81.4	Confident	89.7	Confident	30 Å²	30	10.1 Å²	10.1	12%	0.118	5%	0.048	C	C	.	.	H	α-helix	trans	-54.8	-36.3	177.6	-51.7	-64	0	0	0	112.8	H229 H232 I233 I252 L258 F312	H229-Y235 AromaticContact CE1-CE1 3.8Å; H229-Y235 AromaticContact CE1-CE2 3.99Å; H229-Y235 AromaticContact CE1-CZ 3.49Å; H229-Y235 VanDerWaalsContact CE1-CZ 3.49Å; H229-Y235 PolarHBondContact CE1-OH 2.93Å; H229-Y235 AromaticContact NE2-CE1 3.64Å; H229-Y235 AromaticContact NE2-CZ 3.24Å; H229-Y235 PolarHBondContact NE2-OH 3.26Å; H232-Y235 HydrophobicContact CB-CE2 4.39Å; H232-Y235 AromaticContact ND1-CE2 3.83Å; H232-Y235 WeakPolarHBondContact O-CD2 3.5Å; I233-Y235 PolarHBondContact O-N 3.06Å; Y235-I252 HydrophobicContact CD1-CG2 4.16Å; Y235-I252 VanDerWaalsContact O-CD1 3.28Å; Y235-I252 WeakPolarHBondContact O-CD1 3.41Å; Y235-L258 HydrophobicContact CD2-CD1 4.41Å; Y235-L258 HydrophobicContact CE2-CD1 3.66Å; Y235-F312 AromaticContact CD1-CD2 3.87Å; Y235-F312 HydrophobicContact CD1-CD2 3.87Å; Y235-F312 AromaticContact CD1-CE2 3.26Å; Y235-F312 HydrophobicContact CD1-CE2 3.26Å; Y235-F312 AromaticContact CD1-CZ 3.77Å; Y235-F312 HydrophobicContact CD1-CZ 3.77Å; Y235-F312 AromaticContact CE1-CD2 3.7Å; Y235-F312 HydrophobicContact CE1-CD2 3.7Å; Y235-F312 AromaticContact CE1-CE2 3.57Å; Y235-F312 HydrophobicContact CE1-CE2 3.57Å; Y235-F312 HydrophobicContact CE1-CG 4.44Å; Y235-F312 HydrophobicContact CE1-CZ 4.13Å; Y235-F312 HydrophobicContact CG-CE2 4.35Å
236	L	86.4	Confident	89.3	Confident	25 Å²	25	13.9 Å²	13.9	13%	0.131	7%	0.068	C	C	.	.	H	α-helix	trans	-90.5	-29.6	-178.3	-61.9	178.5	0	0	0	111.2	L191 I233 D234 F240 L270	L191-L236 HydrophobicContact CD1-CB 4.4Å; L191-L236 HydrophobicContact CD2-CD1 4.35Å; I233-L236 PolarHBondContact O-N 2.94Å; D234-L236 PolarHBondContact O-N 3.45Å; L236-F240 WeakPolarHBondContact O-CB 3.22Å; L236-F240 PolarHBondContact O-N 3.49Å; L236-L270 HydrophobicContact CD2-CD1 3.65Å
237	L	90.4	Very high	88.9	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-65.1	-49	-171.6	-176.9	60.2	0	0	0	112.3	F195 I202 I233 D234 F240 I241 I353 Y355 V395 V397	F195-L237 HydrophobicContact CE2-CD1 4.33Å; I202-L237 HydrophobicContact CD1-CD1 3.89Å; I202-L237 HydrophobicContact CG2-CD1 4Å; I233-L237 PolarHBondContact O-N 3.14Å; D234-L237 PolarHBondContact O-N 2.86Å; D234-L237 VanDerWaalsContact O-N 3.12Å; L237-F240 WeakPolarHBondContact O-CB 3.42Å; L237-F240 PolarHBondContact O-N 2.9Å; L237-I241 HydrophobicContact CD1-CD1 4.01Å; L237-I241 HydrophobicContact CD1-CG1 4.43Å; L237-I241 HydrophobicContact CG-CD1 4Å; L237-I241 WeakPolarHBondContact O-CD1 3.41Å; L237-I241 VanDerWaalsContact O-CG1 3.24Å; L237-I241 WeakPolarHBondContact O-CG1 3.48Å; L237-I241 PolarHBondContact O-N 3.23Å; L237-I353 HydrophobicContact CD2-CG2 4.11Å; L237-Y355 WeakPolarHBondContact CD2-OH 3.34Å; L237-V395 HydrophobicContact CD2-CG1 3.84Å; L237-V397 HydrophobicContact CD2-CG2 3.59Å; L237-V397 HydrophobicContact CG-CG2 4.06Å
238	I	90.8	Very high	88.5	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-66.4	-50	-179.2	-64.4	171.9	0	0	0	110.1	P227 D234 F240 I241 L242 V351 I353 F399	P227-I238 HydrophobicContact CB-CD1 3.46Å; P227-I238 VanDerWaalsContact CB-CD1 3.46Å; P227-I238 HydrophobicContact CG-CD1 3.58Å; D234-I238 PolarHBondContact O-N 3.16Å; I238-F240 PolarHBondContact O-N 3.32Å; I238-I241 PolarHBondContact O-N 3.26Å; I238-I241 VanDerWaalsContact O-N 3.14Å; I238-L242 HydrophobicContact CG2-CD1 3.87Å; I238-L242 HydrophobicContact CG2-CG 4.31Å; I238-L242 VanDerWaalsContact O-CG 3.32Å; I238-L242 WeakPolarHBondContact O-CG 3.08Å; I238-L242 PolarHBondContact O-N 3.28Å; I238-V351 HydrophobicContact CD1-CB 4.49Å; I238-V351 HydrophobicContact CD1-CG1 4.19Å; I238-I353 HydrophobicContact CD1-CD1 4.34Å; I238-F399 HydrophobicContact CG2-CE1 4.3Å
239	T	88.8	Confident	88.2	Confident	13 Å²	13	17 Å²	17	8%	0.08	9%	0.086	C	C	.	.	H	α-helix	trans	-54.8	-41.8	175.7	-68.4	0	0	0	0	111.9	F243 A249 E310	T239-F243 VanDerWaalsContact O-CB 3.3Å; T239-F243 WeakPolarHBondContact O-CB 3.25Å; T239-F243 PolarHBondContact O-N 3.45Å; T239-A249 HydrophobicContact CG2-CB 4.1Å; T239-E310 PolarHBondContact OG1-OE2 3.37Å
240	F	91.2	Very high	88.2	Confident	4 Å²	4	17 Å²	17	2%	0.018	9%	0.086	C	C	.	.	H	α-helix	trans	-63.7	-47.1	176.1	171.6	-103.7	0	0	0	112.8	V88 I89 L191 L192 F195 L236 L237 I238 L242 F243 C244	V88-F240 HydrophobicContact CG1-CD1 4.37Å; V88-F240 HydrophobicContact CG1-CE1 3.77Å; V88-F240 HydrophobicContact CG1-CZ 4.49Å; I89-F240 HydrophobicContact CG2-CE1 3.94Å; I89-F240 HydrophobicContact CG2-CZ 4.16Å; L191-F240 HydrophobicContact CB-CD2 3.71Å; L191-F240 HydrophobicContact CB-CE2 3.84Å; L191-F240 HydrophobicContact CB-CG 4.47Å; L191-F240 HydrophobicContact CD1-CB 4.08Å; L191-F240 HydrophobicContact CD1-CD2 3.95Å; L191-F240 HydrophobicContact CD1-CG 4.31Å; L192-F240 HydrophobicContact CD2-CE2 4.25Å; L192-F240 HydrophobicContact CD2-CZ 3.7Å; L192-F240 HydrophobicContact CG-CE2 3.86Å; L192-F240 HydrophobicContact CG-CZ 3.83Å; F195-F240 AromaticContact CD2-CD1 3.91Å; F195-F240 HydrophobicContact CD2-CD1 3.91Å; F195-F240 AromaticContact CD2-CE1 3.8Å; F195-F240 HydrophobicContact CD2-CE1 3.8Å; F195-F240 HydrophobicContact CD2-CG 4.41Å; F195-F240 HydrophobicContact CD2-CZ 4.21Å; F195-F240 HydrophobicContact CE2-CB 4.34Å; F195-F240 AromaticContact CE2-CD1 3.7Å; F195-F240 HydrophobicContact CE2-CD1 3.7Å; F195-F240 HydrophobicContact CE2-CD2 4.49Å; F195-F240 HydrophobicContact CE2-CE1 4.09Å; F195-F240 AromaticContact CE2-CG 3.92Å; F195-F240 HydrophobicContact CE2-CG 3.92Å; L236-F240 WeakPolarHBondContact O-CB 3.22Å; L236-F240 PolarHBondContact O-N 3.49Å; L237-F240 WeakPolarHBondContact O-CB 3.42Å; L237-F240 PolarHBondContact O-N 2.9Å; I238-F240 PolarHBondContact O-N 3.32Å; F240-L242 PolarHBondContact O-N 3.38Å; F240-F243 WeakPolarHBondContact O-CB 3.4Å; F240-F243 PolarHBondContact O-N 3.01Å; F240-C244 VanDerWaalsContact CZ-SG 3.57Å; F240-C244 PolarHBondContact O-N 3.07Å; F240-C244 PolarHBondContact O-SG 3.12Å
241	I	93.2	Very high	88.4	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.7	-47.1	179.2	-68.3	164.1	0	0	0	110.1	V88 I202 I204 L237 I238 F243 C244 H245 V397 F399	V88-I241 HydrophobicContact CG1-CG1 4.31Å; V88-I241 HydrophobicContact CG2-CG1 4.34Å; I202-I241 HydrophobicContact CG2-CD1 4.4Å; I204-I241 HydrophobicContact CD1-CG2 4.13Å; I204-I241 HydrophobicContact CG2-CD1 4.03Å; I204-I241 HydrophobicContact CG2-CG2 4.19Å; L237-I241 HydrophobicContact CD1-CD1 4.01Å; L237-I241 HydrophobicContact CD1-CG1 4.43Å; L237-I241 HydrophobicContact CG-CD1 4Å; L237-I241 WeakPolarHBondContact O-CD1 3.41Å; L237-I241 VanDerWaalsContact O-CG1 3.24Å; L237-I241 WeakPolarHBondContact O-CG1 3.48Å; L237-I241 PolarHBondContact O-N 3.23Å; I238-I241 PolarHBondContact O-N 3.26Å; I238-I241 VanDerWaalsContact O-N 3.14Å; I241-F243 VanDerWaalsContact C-N 3.33Å; I241-F243 PolarHBondContact O-N 3.23Å; I241-C244 PolarHBondContact O-N 3.3Å; I241-H245 PolarHBondContact O-CD2 2.97Å; I241-H245 PolarHBondContact O-N 2.75Å; I241-V397 HydrophobicContact CD1-CB 3.9Å; I241-V397 HydrophobicContact CD1-CG1 4.02Å; I241-V397 HydrophobicContact CD1-CG2 3.69Å; I241-F399 HydrophobicContact CG2-CE2 3.9Å; I241-F399 HydrophobicContact CG2-CZ 4.02Å
242	L	91.7	Very high	88.6	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-61.1	-43.1	178.8	-64	176.1	0	0	0	111.4	F225 I238 F240 C244 H245 N246 I247 P250 F399	F225-L242 HydrophobicContact CD2-CD1 4.3Å; F225-L242 HydrophobicContact CE1-CD1 4.15Å; F225-L242 HydrophobicContact CE1-CD2 4.26Å; F225-L242 HydrophobicContact CE2-CD1 3.74Å; F225-L242 HydrophobicContact CZ-CD1 3.66Å; F225-L242 HydrophobicContact CZ-CD2 4.06Å; I238-L242 HydrophobicContact CG2-CD1 3.87Å; I238-L242 HydrophobicContact CG2-CG 4.31Å; I238-L242 VanDerWaalsContact O-CG 3.32Å; I238-L242 WeakPolarHBondContact O-CG 3.08Å; I238-L242 PolarHBondContact O-N 3.28Å; F240-L242 PolarHBondContact O-N 3.38Å; L242-C244 PolarHBondContact O-N 3.16Å; L242-H245 CarbonylContact O-C 3.39Å; L242-H245 PolarHBondContact O-N 3.35Å; L242-H245 VanDerWaalsContact O-N 3.09Å; L242-N246 PolarHBondContact O-N 3.41Å; L242-I247 CarbonylContact C-O 3.58Å; L242-I247 HydrophobicContact CB-CB 4.12Å; L242-I247 HydrophobicContact CB-CG2 4.49Å; L242-I247 HydrophobicContact CD2-CB 4.04Å; L242-I247 HydrophobicContact CD2-CD1 3.86Å; L242-I247 HydrophobicContact CD2-CG2 3.95Å; L242-I247 PolarHBondContact O-N 3.35Å; L242-P250 HydrophobicContact CD1-CG 4.09Å; L242-F399 HydrophobicContact CD2-CE1 4.3Å; L242-F399 HydrophobicContact CD2-CZ 4.37Å
243	F	90.5	Very high	89.1	Confident	16 Å²	16	15.6 Å²	15.6	7%	0.07	8%	0.083	C	C	.	.	H	α-helix	trans	-58.7	-46.5	173.8	169.2	-100.6	0	0	0	112.7	V112 R115 V117 I184 T239 F240 I241 H245 N246	V112-F243 HydrophobicContact CG1-CZ 4.16Å; V112-F243 HydrophobicContact CG2-CE1 4.24Å; R115-F243 HydrophobicContact CB-CD2 4.37Å; R115-F243 HydrophobicContact CB-CE1 4.47Å; R115-F243 HydrophobicContact CB-CE2 3.61Å; R115-F243 HydrophobicContact CB-CZ 3.67Å; R115-F243 WeakPolarHBondContact CD-O 3.48Å; R115-F243 HydrophobicContact CG-CD1 4.48Å; R115-F243 HydrophobicContact CG-CE1 3.85Å; R115-F243 HydrophobicContact CG-CE2 3.89Å; R115-F243 HydrophobicContact CG-CZ 3.52Å; V117-F243 HydrophobicContact CG2-CD2 4.43Å; V117-F243 HydrophobicContact CG2-CE2 3.81Å; I184-F243 HydrophobicContact CG2-CD2 3.64Å; I184-F243 HydrophobicContact CG2-CE2 3.67Å; I184-F243 HydrophobicContact CG2-CG 4.49Å; T239-F243 VanDerWaalsContact O-CB 3.3Å; T239-F243 WeakPolarHBondContact O-CB 3.25Å; T239-F243 PolarHBondContact O-N 3.45Å; F240-F243 WeakPolarHBondContact O-CB 3.4Å; F240-F243 PolarHBondContact O-N 3.01Å; I241-F243 VanDerWaalsContact C-N 3.33Å; I241-F243 PolarHBondContact O-N 3.23Å; F243-H245 PolarHBondContact O-N 3.43Å; F243-H245 VanDerWaalsContact O-N 3.08Å; F243-N246 PolarHBondContact O-N 3.43Å
244	C	91	Very high	88.9	Confident	4 Å²	4	15 Å²	15	3%	0.027	8%	0.08	C	C	.	.	H	α-helix	trans	-58.5	-24.6	177	-77.9	0	0	0	0	112.7	V88 F111 R115 F240 I241 L242	V88-C244 HydrophobicContact CG1-CB 3.93Å; F111-C244 HydrophobicContact CE1-CB 4.28Å; F111-C244 HydrophobicContact CZ-CB 4.22Å; F111-C244 WeakPolarHBondContact CZ-O 3.32Å; R115-C244 PolarHBondContact NH1-O 3.35Å; F240-C244 VanDerWaalsContact CZ-SG 3.57Å; F240-C244 PolarHBondContact O-N 3.07Å; F240-C244 PolarHBondContact O-SG 3.12Å; I241-C244 PolarHBondContact O-N 3.3Å; L242-C244 PolarHBondContact O-N 3.16Å
245	H	90.1	Very high	88.3	Confident	43 Å²	43	16.1 Å²	16.1	20%	0.199	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	14.6	-175.8	-71.6	-71.5	0	0	0	115.3	I204 L209 I241 L242 F243 I247	I204-H245 WeakPolarHBondContact CD1-NE2 3.21Å; L209-H245 HydrophobicContact CD2-CB 3.71Å; L209-H245 WeakPolarHBondContact CD2-CD2 3.36Å; L209-H245 WeakPolarHBondContact CD2-ND1 3.04Å; I241-H245 PolarHBondContact O-CD2 2.97Å; I241-H245 PolarHBondContact O-N 2.75Å; L242-H245 CarbonylContact O-C 3.39Å; L242-H245 PolarHBondContact O-N 3.35Å; L242-H245 VanDerWaalsContact O-N 3.09Å; F243-H245 PolarHBondContact O-N 3.43Å; F243-H245 VanDerWaalsContact O-N 3.08Å; H245-I247 HydrophobicContact CB-CD1 4.38Å; H245-I247 HydrophobicContact CB-CG1 4.38Å; H245-I247 PolarHBondContact O-N 3.05Å
246	N	89.3	Confident	87.8	Confident	78 Å²	78	18 Å²	18	42%	0.417	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	32.8	-177.8	-61	-36.3	0	0	0	113	R115 D116 L242 F243	R115-N246 WeakPolarHBondContact CA-OD1 3.4Å; R115-N246 WeakPolarHBondContact CD-OD1 3.47Å; D116-N246 PolarHBondContact N-OD1 2.68Å; D116-N246 VanDerWaalsContact N-OD1 3.12Å; L242-N246 PolarHBondContact O-N 3.41Å; F243-N246 PolarHBondContact O-N 3.43Å
247	I	89.1	Confident	86.8	Confident	12 Å²	12	20.1 Å²	20.1	6%	0.062	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-98	140.4	170.2	-55.5	174	0	0	0	107.2	L209 V212 K213 L242 H245 A249 F308	L209-I247 HydrophobicContact CD1-CD1 3.6Å; L209-I247 HydrophobicContact CG-CD1 4.18Å; V212-I247 HydrophobicContact CG1-CD1 4.29Å; K213-I247 HydrophobicContact CD-CD1 4.45Å; K213-I247 HydrophobicContact CG-CD1 3.48Å; K213-I247 VanDerWaalsContact CG-CD1 3.48Å; K213-I247 HydrophobicContact CG-CG1 3.79Å; L242-I247 CarbonylContact C-O 3.58Å; L242-I247 HydrophobicContact CB-CB 4.12Å; L242-I247 HydrophobicContact CB-CG2 4.49Å; L242-I247 HydrophobicContact CD2-CB 4.04Å; L242-I247 HydrophobicContact CD2-CD1 3.86Å; L242-I247 HydrophobicContact CD2-CG2 3.95Å; L242-I247 PolarHBondContact O-N 3.35Å; H245-I247 HydrophobicContact CB-CD1 4.38Å; H245-I247 HydrophobicContact CB-CG1 4.38Å; H245-I247 PolarHBondContact O-N 3.05Å; I247-A249 PolarHBondContact O-N 3.4Å; I247-F308 HydrophobicContact CG2-CE2 3.99Å
248	K	86.9	Confident	85.5	Confident	36 Å²	36	21.1 Å²	21.1	16%	0.157	12%	0.121	C	C	.	.	P	Polyproline II helix	trans	-53.1	128.7	177.7	-177.1	179.8	-177.5	174.9	0	111	M121 Q306 F308	M121-K248 HydrophobicContact CB-CG 4.42Å; M121-K248 VanDerWaalsContact CE-CA 3.5Å; M121-K248 HydrophobicContact CE-CB 3.98Å; M121-K248 HydrophobicContact CE-CG 4.25Å; M121-K248 WeakPolarHBondContact O-CE 3.48Å; K248-Q306 PolarHBondContact NZ-O 3.42Å; K248-F308 HydrophobicContact CB-CD2 3.89Å; K248-F308 HydrophobicContact CB-CE2 3.7Å; K248-F308 HydrophobicContact CB-CZ 4.3Å; K248-F308 HydrophobicContact CD-CD1 4.5Å; K248-F308 HydrophobicContact CD-CG 4.5Å; K248-F308 HydrophobicContact CD-CZ 4.5Å; K248-F308 HydrophobicContact CG-CD2 4.34Å; K248-F308 HydrophobicContact CG-CE2 4.5Å; K248-F308 VanDerWaalsContact O-CD2 3.28Å; K248-F308 WeakPolarHBondContact O-CD2 3.5Å
249	A	85.2	Confident	84.3	Confident	21 Å²	21	25.2 Å²	25.2	17%	0.174	14%	0.142	C	C	.	.	P	Polyproline II helix	trans	-68.7	138.4	177.9	0	0	0	0	0	110.6	T239 I247	T239-A249 HydrophobicContact CG2-CB 4.1Å; I247-A249 PolarHBondContact O-N 3.4Å
250	P	90.3	Very high	83.5	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.006	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-79.5	154.9	179.3	32.7	-34.4	0	0	0	111.9	F225 L242 F308 E310	F225-P250 HydrophobicContact CD2-CB 4.12Å; F225-P250 HydrophobicContact CD2-CG 4.41Å; L242-P250 HydrophobicContact CD1-CG 4.09Å; P250-F308 CarbonylContact C-O 3.59Å; P250-F308 WeakPolarHBondContact CA-O 3.45Å; P250-F308 HydrophobicContact CB-CB 4.03Å; P250-E310 HydrophobicContact CB-CB 3.9Å; P250-E310 HydrophobicContact CG-CB 3.88Å
251	H	91.3	Very high	82.3	Confident	6 Å²	6	31 Å²	31	3%	0.028	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	122.2	165.7	-69.3	70.2	0	0	0	109.2	I179 G271 F273 L302 Q307 F308 L309 E310	I179-H251 WeakPolarHBondContact CD1-NE2 3.43Å; H251-G271 WeakPolarHBondContact CA-O 3.4Å; H251-G271 WeakPolarHBondContact CB-O 3.4Å; H251-F273 HydrophobicContact CB-CD1 4.11Å; H251-F273 HydrophobicContact CB-CE1 4.14Å; H251-L302 HydrophobicContact CB-CD1 4.13Å; H251-Q307 PolarHBondContact CE1-OE1 3.4Å; H251-F308 PolarHBondContact N-O 3.5Å; H251-L309 HydrophobicContact CB-CD2 3.96Å; H251-L309 WeakPolarHBondContact O-CA 3.37Å; H251-E310 PolarHBondContact O-N 3.01Å
252	I	89.9	Confident	81.3	Confident	6 Å²	6	36.5 Å²	36.5	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	121.8	-172.7	-52.8	161.2	0	0	0	109.6	Y235 A254 G271 G272 F273 E310	Y235-I252 HydrophobicContact CD1-CG2 4.16Å; Y235-I252 VanDerWaalsContact O-CD1 3.28Å; Y235-I252 WeakPolarHBondContact O-CD1 3.41Å; I252-A254 PolarHBondContact O-N 2.89Å; I252-A254 VanDerWaalsContact O-N 3.17Å; I252-G271 PolarHBondContact N-O 3.2Å; I252-G272 CarbonylContact O-C 3.48Å; I252-G272 VanDerWaalsContact O-CA 3.28Å; I252-G272 WeakPolarHBondContact O-CA 3.49Å; I252-F273 WeakPolarHBondContact O-CD1 3.39Å; I252-F273 PolarHBondContact O-N 3.01Å; I252-E310 HydrophobicContact CG1-CB 4.35Å
253	A	88.7	Confident	80.4	Confident	16 Å²	16	39.1 Å²	39.1	13%	0.132	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	99.8	170.5	0	0	0	0	0	110.1	F273 I275 E310 V311	A253-F273 HydrophobicContact CB-CE1 4.12Å; A253-F273 HydrophobicContact CB-CE2 4.31Å; A253-F273 HydrophobicContact CB-CZ 3.75Å; A253-I275 HydrophobicContact CB-CD1 3.75Å; A253-E310 PolarHBondContact N-O 3.16Å; A253-V311 HydrophobicContact CB-CG2 4.27Å
254	A	81.7	Confident	79.5	Confident	3 Å²	3	38.7 Å²	38.7	3%	0.025	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	139.2	-176.1	0	0	0	0	0	112.1	I252 I267 F273 F274 I275	I252-A254 PolarHBondContact O-N 2.89Å; I252-A254 VanDerWaalsContact O-N 3.17Å; A254-I267 HydrophobicContact CB-CG2 4.39Å; A254-F273 PolarHBondContact N-O 2.86Å; A254-F274 HydrophobicContact CB-CD1 4.09Å; A254-F274 HydrophobicContact CB-CE1 4.1Å; A254-F274 CarbonylContact O-C 3.58Å; A254-F274 VanDerWaalsContact O-CA 3.3Å; A254-F274 WeakPolarHBondContact O-CA 3.26Å; A254-I275 PolarHBondContact O-N 3.27Å
255	G	76.9	Confident	79	Confident	25 Å²	25	42.2 Å²	42.2	26%	0.258	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	141.7	173.6	0	0	0	0	0	112.4	N257 L258	G255-N257 PolarHBondContact O-N 2.84Å; G255-L258 PolarHBondContact O-N 2.92Å
256	N	69.9	Low	78.4	Confident	69 Å²	69	42.1 Å²	42.1	37%	0.369	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-55.2	-21.6	177.5	68.8	-19.4	0	0	0	114.9	L258 N259 I275	N256-L258 PolarHBondContact O-N 3.31Å; N256-L258 VanDerWaalsContact O-N 3.13Å; N256-N259 WeakPolarHBondContact O-CB 3.48Å; N256-N259 PolarHBondContact O-N 3.45Å; N256-I275 PolarHBondContact N-O 3.49Å
257	N	65.1	Low	77.9	Confident	69 Å²	69	39 Å²	39	37%	0.369	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-63.5	-12.5	174.4	-58.5	-74.2	0	0	0	113.9	G255 R277	G255-N257 PolarHBondContact O-N 2.84Å; N257-R277 WeakPolarHBondContact ND2-CD 3.28Å; N257-R277 VanDerWaalsContact ND2-CZ 3.26Å; N257-R277 PolarHBondContact ND2-NE 3.42Å; N257-R277 PolarHBondContact ND2-NH1 3Å; N257-R277 VanDerWaalsContact ND2-NH1 3.17Å
258	L	64.7	Low	77.6	Confident	22 Å²	22	40.3 Å²	40.3	12%	0.115	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-95	5.7	174.7	-62.7	172.1	0	0	0	112.6	Y235 G255 N256 I260 I267 F274	Y235-L258 HydrophobicContact CD2-CD1 4.41Å; Y235-L258 HydrophobicContact CE2-CD1 3.66Å; G255-L258 PolarHBondContact O-N 2.92Å; N256-L258 PolarHBondContact O-N 3.31Å; N256-L258 VanDerWaalsContact O-N 3.13Å; L258-I260 PolarHBondContact O-N 3.06Å; L258-I267 HydrophobicContact CB-CD1 4.43Å; L258-F274 HydrophobicContact CB-CE1 4.19Å
259	N	64.6	Low	77.4	Confident	85 Å²	85	40.9 Å²	40.9	46%	0.455	23%	0.228	S	C	.	.			trans	-78.6	65.9	-177.5	-170.1	18.1	0	0	0	112.5	N256 S264 F274	N256-N259 WeakPolarHBondContact O-CB 3.48Å; N256-N259 PolarHBondContact O-N 3.45Å; N259-S264 WeakPolarHBondContact OD1-CB 3.45Å; N259-S264 PolarHBondContact OD1-OG 3.16Å; N259-F274 HydrophobicContact CB-CD1 4.47Å; N259-F274 HydrophobicContact CB-CE1 4.29Å
260	I	71.6	Confident	77.1	Confident	44 Å²	44	40.4 Å²	40.4	23%	0.226	22%	0.223	C	C	.	.			trans	-93.9	129.8	171.3	-54.2	171	0	0	0	107.7	L258 I262 F263 S264 E375 L377	L258-I260 PolarHBondContact O-N 3.06Å; I260-I262 VanDerWaalsContact C-N 3.35Å; I260-I262 PolarHBondContact O-N 3.41Å; I260-F263 HydrophobicContact CB-CB 4.37Å; I260-F263 CarbonylContact O-C 3.55Å; I260-F263 PolarHBondContact O-N 3.28Å; I260-S264 WeakPolarHBondContact O-CB 3.3Å; I260-S264 PolarHBondContact O-N 2.94Å; I260-S264 PolarHBondContact O-OG 3.35Å; I260-S264 VanDerWaalsContact O-OG 3.12Å; I260-E375 WeakPolarHBondContact CD1-O 3.36Å; I260-L377 HydrophobicContact CG2-CD1 4.32Å; I260-L377 HydrophobicContact CG2-CD2 3.45Å; I260-L377 VanDerWaalsContact CG2-CD2 3.45Å; I260-L377 HydrophobicContact CG2-CG 3.69Å
261	P	67.1	Low	76.7	Confident	94 Å²	94	40.4 Å²	40.4	61%	0.61	22%	0.223	S	C	*	.	H	α-helix	trans	-46.4	-43.4	-163.1	-32.5	34.4	0	0	0	117.5	S264 T265	P261-S264 WeakPolarHBondContact CA-OG 3.4Å; P261-S264 PolarHBondContact O-OG 2.99Å; P261-T265 WeakPolarHBondContact O-CB 3.43Å; P261-T265 PolarHBondContact O-N 2.94Å; P261-T265 PolarHBondContact O-OG1 3.28Å
262	I	72.6	Confident	76.4	Confident	117 Å²	117	40.1 Å²	40.1	60%	0.6	22%	0.222	S	C	*	.	H	α-helix	trans	-74.1	-48.5	178.8	-59.3	-179	0	0	0	110.9	I260 S264 T265 L266 L377	I260-I262 VanDerWaalsContact C-N 3.35Å; I260-I262 PolarHBondContact O-N 3.41Å; I262-S264 VanDerWaalsContact C-N 3.34Å; I262-S264 PolarHBondContact O-N 3.47Å; I262-T265 PolarHBondContact O-N 3.23Å; I262-L266 PolarHBondContact O-N 2.99Å; I262-L266 VanDerWaalsContact O-N 3.1Å; I262-L377 HydrophobicContact CB-CD2 3.9Å; I262-L377 HydrophobicContact CD1-CD1 3.77Å; I262-L377 HydrophobicContact CD1-CD2 4.02Å; I262-L377 HydrophobicContact CD1-CG 4.44Å; I262-L377 HydrophobicContact CG1-CD1 3.99Å; I262-L377 HydrophobicContact CG1-CD2 4.09Å
263	F	71.4	Confident	76.2	Confident	55 Å²	55	39.9 Å²	39.9	24%	0.241	22%	0.221	C	C	.	.	H	α-helix	trans	-69.2	-34.3	-177.4	-166.5	-116.1	0	0	0	111.9	I260 L266 I267	I260-F263 HydrophobicContact CB-CB 4.37Å; I260-F263 CarbonylContact O-C 3.55Å; I260-F263 PolarHBondContact O-N 3.28Å; F263-L266 HydrophobicContact CD2-CD2 4.21Å; F263-L266 HydrophobicContact CE2-CD2 4.4Å; F263-L266 WeakPolarHBondContact O-CB 3.4Å; F263-L266 PolarHBondContact O-N 3.39Å; F263-I267 HydrophobicContact CD1-CD1 3.35Å; F263-I267 HydrophobicContact CD1-CG1 4.19Å; F263-I267 HydrophobicContact CE1-CD1 3.22Å; F263-I267 HydrophobicContact CE1-CG1 4.03Å; F263-I267 HydrophobicContact CG-CD1 4.19Å; F263-I267 HydrophobicContact CZ-CD1 3.94Å; F263-I267 HydrophobicContact CZ-CG1 4.29Å; F263-I267 WeakPolarHBondContact O-CB 3.38Å; F263-I267 VanDerWaalsContact O-CG1 3.3Å; F263-I267 WeakPolarHBondContact O-CG1 3.25Å; F263-I267 PolarHBondContact O-N 3.19Å
264	S	73.1	Confident	76	Confident	7 Å²	7	39.5 Å²	39.5	5%	0.049	22%	0.216	C	C	.	.	H	α-helix	trans	-70.8	-37	177.8	68	0	0	0	0	112.5	N259 I260 P261 I262 L266 R268	N259-S264 WeakPolarHBondContact OD1-CB 3.45Å; N259-S264 PolarHBondContact OD1-OG 3.16Å; I260-S264 WeakPolarHBondContact O-CB 3.3Å; I260-S264 PolarHBondContact O-N 2.94Å; I260-S264 PolarHBondContact O-OG 3.35Å; I260-S264 VanDerWaalsContact O-OG 3.12Å; P261-S264 WeakPolarHBondContact CA-OG 3.4Å; P261-S264 PolarHBondContact O-OG 2.99Å; I262-S264 VanDerWaalsContact C-N 3.34Å; I262-S264 PolarHBondContact O-N 3.47Å; S264-L266 VanDerWaalsContact C-N 3.34Å; S264-R268 WeakPolarHBondContact O-CB 3.31Å; S264-R268 VanDerWaalsContact O-CG 3.24Å; S264-R268 WeakPolarHBondContact O-CG 3.19Å; S264-R268 PolarHBondContact O-N 3.42Å
265	T	78.7	Confident	76	Confident	78 Å²	78	40.3 Å²	40.3	48%	0.479	22%	0.22	S	C	.	.	H	α-helix	trans	-62.3	-44.5	170.4	-57	0	0	0	0	110.5	P261 I262 R268 K269	P261-T265 WeakPolarHBondContact O-CB 3.43Å; P261-T265 PolarHBondContact O-N 2.94Å; P261-T265 PolarHBondContact O-OG1 3.28Å; I262-T265 PolarHBondContact O-N 3.23Å; T265-R268 PolarHBondContact O-N 3.39Å; T265-K269 HydrophobicContact CG2-CG 4.41Å; T265-K269 WeakPolarHBondContact O-CB 3.23Å; T265-K269 WeakPolarHBondContact O-CG 3.24Å; T265-K269 PolarHBondContact O-N 3.02Å
266	L	78.1	Confident	75.9	Confident	41 Å²	41	42.4 Å²	42.4	22%	0.215	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-52.9	176.3	171.4	68.1	0	0	0	111.9	F183 T187 I262 F263 S264 R268 K269 L270	F183-L266 HydrophobicContact CD1-CD1 4.16Å; F183-L266 HydrophobicContact CE1-CB 4.25Å; F183-L266 HydrophobicContact CE1-CD1 3.37Å; F183-L266 HydrophobicContact CE1-CG 4.37Å; F183-L266 HydrophobicContact CZ-CD1 4.16Å; T187-L266 HydrophobicContact CG2-CD1 4.03Å; T187-L266 WeakPolarHBondContact OG1-CD1 3.26Å; I262-L266 PolarHBondContact O-N 2.99Å; I262-L266 VanDerWaalsContact O-N 3.1Å; F263-L266 HydrophobicContact CD2-CD2 4.21Å; F263-L266 HydrophobicContact CE2-CD2 4.4Å; F263-L266 WeakPolarHBondContact O-CB 3.4Å; F263-L266 PolarHBondContact O-N 3.39Å; S264-L266 VanDerWaalsContact C-N 3.34Å; L266-R268 VanDerWaalsContact C-N 3.33Å; L266-R268 PolarHBondContact O-N 3.2Å; L266-K269 PolarHBondContact O-N 2.97Å; L266-K269 VanDerWaalsContact O-N 3.08Å; L266-L270 HydrophobicContact CD1-CD1 3.71Å; L266-L270 HydrophobicContact CD1-CG 4.1Å; L266-L270 HydrophobicContact CG-CD1 3.97Å; L266-L270 VanDerWaalsContact O-CG 3.3Å; L266-L270 WeakPolarHBondContact O-CG 3.47Å; L266-L270 PolarHBondContact O-N 3.11Å
267	I	79.8	Confident	75.6	Confident	12 Å²	12	44.6 Å²	44.6	6%	0.062	22%	0.223	C	C	.	.	H	α-helix	trans	-55	-48	178.4	-72.3	167.4	0	0	0	111	A254 L258 F263 K269 L270 G271 G272 F274	A254-I267 HydrophobicContact CB-CG2 4.39Å; L258-I267 HydrophobicContact CB-CD1 4.43Å; F263-I267 HydrophobicContact CD1-CD1 3.35Å; F263-I267 HydrophobicContact CD1-CG1 4.19Å; F263-I267 HydrophobicContact CE1-CD1 3.22Å; F263-I267 HydrophobicContact CE1-CG1 4.03Å; F263-I267 HydrophobicContact CG-CD1 4.19Å; F263-I267 HydrophobicContact CZ-CD1 3.94Å; F263-I267 HydrophobicContact CZ-CG1 4.29Å; F263-I267 WeakPolarHBondContact O-CB 3.38Å; F263-I267 VanDerWaalsContact O-CG1 3.3Å; F263-I267 WeakPolarHBondContact O-CG1 3.25Å; F263-I267 PolarHBondContact O-N 3.19Å; I267-K269 VanDerWaalsContact C-N 3.29Å; I267-K269 PolarHBondContact O-N 3.23Å; I267-L270 PolarHBondContact O-N 3.39Å; I267-L270 VanDerWaalsContact O-N 3.12Å; I267-G271 PolarHBondContact O-N 2.88Å; I267-G272 PolarHBondContact O-N 3.36Å; I267-F274 HydrophobicContact CB-CE2 4.39Å; I267-F274 HydrophobicContact CB-CZ 4.03Å; I267-F274 HydrophobicContact CD1-CE1 4.37Å; I267-F274 HydrophobicContact CD1-CZ 3.97Å; I267-F274 HydrophobicContact CG2-CE2 4.08Å; I267-F274 HydrophobicContact CG2-CZ 3.86Å
268	R	82.2	Confident	75.4	Confident	40 Å²	40	47.3 Å²	47.3	15%	0.151	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-39.5	178.4	-72.7	172.3	-166.5	-75.3	0.1	112.3	E174 V176 N178 S264 T265 L266 L270 G271 F274	E174-R268 VanDerWaalsContact C-NH1 3.32Å; E174-R268 PolarHBondContact O-NH1 3.21Å; E174-R268 PolarHBondContact O-NH2 3.47Å; V176-R268 PolarHBondContact O-NH1 3.1Å; N178-R268 CarbonylContact C-O 3.58Å; N178-R268 PolarHBondContact N-O 2.91Å; S264-R268 WeakPolarHBondContact O-CB 3.31Å; S264-R268 VanDerWaalsContact O-CG 3.24Å; S264-R268 WeakPolarHBondContact O-CG 3.19Å; S264-R268 PolarHBondContact O-N 3.42Å; T265-R268 PolarHBondContact O-N 3.39Å; L266-R268 VanDerWaalsContact C-N 3.33Å; L266-R268 PolarHBondContact O-N 3.2Å; R268-L270 PolarHBondContact O-N 3.41Å; R268-G271 PolarHBondContact O-N 3.16Å; R268-F274 HydrophobicContact CG-CD2 4.28Å; R268-F274 HydrophobicContact CG-CE2 3.89Å; R268-F274 VanDerWaalsContact CZ-CD2 3.45Å; R268-F274 VanDerWaalsContact NH2-CD2 3.31Å
269	K	82.7	Confident	75.1	Confident	47 Å²	47	48.6 Å²	48.6	20%	0.204	24%	0.238	C	C	.	.	H	α-helix	trans	-70	-21.2	179.6	-71.6	-81.4	157.6	-153.9	0	113.1	N178 I179 S180 F183 T265 L266 I267	N178-K269 PolarHBondContact ND2-NZ 2.87Å; N178-K269 WeakPolarHBondContact O-CA 3.43Å; N178-K269 VanDerWaalsContact O-CD 3.25Å; N178-K269 WeakPolarHBondContact O-CD 3.41Å; N178-K269 WeakPolarHBondContact O-CE 3.46Å; N178-K269 PolarHBondContact O-NZ 2.67Å; N178-K269 VanDerWaalsContact O-NZ 3.16Å; N178-K269 PolarHBondContact OD1-NZ 3.1Å; I179-K269 WeakPolarHBondContact CA-O 3.29Å; S180-K269 PolarHBondContact N-O 3.44Å; F183-K269 HydrophobicContact CB-CB 4.25Å; F183-K269 HydrophobicContact CD1-CB 3.32Å; F183-K269 HydrophobicContact CD1-CG 4.05Å; F183-K269 HydrophobicContact CE1-CB 3.78Å; F183-K269 HydrophobicContact CE1-CG 4.28Å; F183-K269 HydrophobicContact CG-CB 3.94Å; F183-K269 HydrophobicContact CG-CG 4.35Å; T265-K269 HydrophobicContact CG2-CG 4.41Å; T265-K269 WeakPolarHBondContact O-CB 3.23Å; T265-K269 WeakPolarHBondContact O-CG 3.24Å; T265-K269 PolarHBondContact O-N 3.02Å; L266-K269 PolarHBondContact O-N 2.97Å; L266-K269 VanDerWaalsContact O-N 3.08Å; I267-K269 VanDerWaalsContact C-N 3.29Å; I267-K269 PolarHBondContact O-N 3.23Å
270	L	79.4	Confident	74.3	Confident	11 Å²	11	48 Å²	48	6%	0.058	24%	0.235	C	C	.	.	H	α-helix	trans	-94.8	-5.1	176.8	-63.1	174.9	0	0	0	114.2	I184 T187 L236 L266 I267 R268	I184-L270 HydrophobicContact CG1-CD2 4.2Å; T187-L270 HydrophobicContact CG2-CD1 3.96Å; T187-L270 HydrophobicContact CG2-CD2 3.91Å; L236-L270 HydrophobicContact CD2-CD1 3.65Å; L266-L270 HydrophobicContact CD1-CD1 3.71Å; L266-L270 HydrophobicContact CD1-CG 4.1Å; L266-L270 HydrophobicContact CG-CD1 3.97Å; L266-L270 VanDerWaalsContact O-CG 3.3Å; L266-L270 WeakPolarHBondContact O-CG 3.47Å; L266-L270 PolarHBondContact O-N 3.11Å; I267-L270 PolarHBondContact O-N 3.39Å; I267-L270 VanDerWaalsContact O-N 3.12Å; R268-L270 PolarHBondContact O-N 3.41Å
271	G	80.5	Confident	73.5	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.01	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	110.6	0.6	-180	0	0	0	0	0	115.2	H251 I252 I267 R268	H251-G271 WeakPolarHBondContact CA-O 3.4Å; H251-G271 WeakPolarHBondContact CB-O 3.4Å; I252-G271 PolarHBondContact N-O 3.2Å; I267-G271 PolarHBondContact O-N 2.88Å; R268-G271 PolarHBondContact O-N 3.16Å
272	G	85.4	Confident	73	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.232	C	C	.	.			trans	-76.4	137	177.9	0	0	0	0	0	113	I252 I267	I252-G272 CarbonylContact O-C 3.48Å; I252-G272 VanDerWaalsContact O-CA 3.28Å; I252-G272 WeakPolarHBondContact O-CA 3.49Å; I267-G272 PolarHBondContact O-N 3.36Å
273	F	87	Confident	72.1	Confident	1 Å²	1	49.7 Å²	49.7	0%	0.004	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	141.5	174.2	67.5	-84.5	0	0	0	110.3	M175 H251 I252 A253 A254 I275 L295 Y298 L302 M330	M175-F273 WeakPolarHBondContact O-CA 3.31Å; M175-F273 WeakPolarHBondContact O-CB 3.43Å; H251-F273 HydrophobicContact CB-CD1 4.11Å; H251-F273 HydrophobicContact CB-CE1 4.14Å; I252-F273 WeakPolarHBondContact O-CD1 3.39Å; I252-F273 PolarHBondContact O-N 3.01Å; A253-F273 HydrophobicContact CB-CE1 4.12Å; A253-F273 HydrophobicContact CB-CE2 4.31Å; A253-F273 HydrophobicContact CB-CZ 3.75Å; A254-F273 PolarHBondContact N-O 2.86Å; F273-I275 HydrophobicContact CD2-CD1 4.23Å; F273-I275 HydrophobicContact CD2-CG1 3.89Å; F273-I275 HydrophobicContact CE2-CD1 3.54Å; F273-I275 HydrophobicContact CE2-CG1 3.72Å; F273-I275 HydrophobicContact CZ-CD1 4.21Å; F273-L295 HydrophobicContact CE2-CD1 4.12Å; F273-Y298 HydrophobicContact CB-CE1 3.93Å; F273-Y298 WeakPolarHBondContact CB-OH 3.3Å; F273-Y298 HydrophobicContact CD1-CE1 4.05Å; F273-Y298 HydrophobicContact CD2-CD1 4.19Å; F273-Y298 AromaticContact CD2-CE1 3.56Å; F273-Y298 HydrophobicContact CD2-CE1 3.56Å; F273-Y298 HydrophobicContact CE1-CE1 4.43Å; F273-Y298 HydrophobicContact CE2-CD1 4.34Å; F273-Y298 AromaticContact CE2-CE1 3.96Å; F273-Y298 HydrophobicContact CE2-CE1 3.96Å; F273-Y298 AromaticContact CG-CE1 3.59Å; F273-Y298 HydrophobicContact CG-CE1 3.59Å; F273-Y298 HydrophobicContact CZ-CE1 4.38Å; F273-L302 HydrophobicContact CE1-CD1 4.47Å; F273-M330 HydrophobicContact CE2-CE 4.27Å; F273-M330 HydrophobicContact CZ-CE 4.05Å
274	F	83.4	Confident	71.1	Confident	9 Å²	9	53.6 Å²	53.6	4%	0.039	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.2	-170.5	-73.7	-82.7	0	0	0	112.4	M175 A254 L258 N259 I267 R268	M175-F274 WeakPolarHBondContact CG-O 3.28Å; M175-F274 PolarHBondContact O-N 3.33Å; A254-F274 HydrophobicContact CB-CD1 4.09Å; A254-F274 HydrophobicContact CB-CE1 4.1Å; A254-F274 CarbonylContact O-C 3.58Å; A254-F274 VanDerWaalsContact O-CA 3.3Å; A254-F274 WeakPolarHBondContact O-CA 3.26Å; L258-F274 HydrophobicContact CB-CE1 4.19Å; N259-F274 HydrophobicContact CB-CD1 4.47Å; N259-F274 HydrophobicContact CB-CE1 4.29Å; I267-F274 HydrophobicContact CB-CE2 4.39Å; I267-F274 HydrophobicContact CB-CZ 4.03Å; I267-F274 HydrophobicContact CD1-CE1 4.37Å; I267-F274 HydrophobicContact CD1-CZ 3.97Å; I267-F274 HydrophobicContact CG2-CE2 4.08Å; I267-F274 HydrophobicContact CG2-CZ 3.86Å; R268-F274 HydrophobicContact CG-CD2 4.28Å; R268-F274 HydrophobicContact CG-CE2 3.89Å; R268-F274 VanDerWaalsContact CZ-CD2 3.45Å; R268-F274 VanDerWaalsContact NH2-CD2 3.31Å
275	I	81.9	Confident	70.2	Confident	20 Å²	20	55.8 Å²	55.8	10%	0.103	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139.1	179.8	-48.5	176.6	0	0	0	110.1	A253 A254 N256 F273 Y291 L295 M330	A253-I275 HydrophobicContact CB-CD1 3.75Å; A254-I275 PolarHBondContact O-N 3.27Å; N256-I275 PolarHBondContact N-O 3.49Å; F273-I275 HydrophobicContact CD2-CD1 4.23Å; F273-I275 HydrophobicContact CD2-CG1 3.89Å; F273-I275 HydrophobicContact CE2-CD1 3.54Å; F273-I275 HydrophobicContact CE2-CG1 3.72Å; F273-I275 HydrophobicContact CZ-CD1 4.21Å; I275-Y291 WeakPolarHBondContact CA-OH 3.33Å; I275-L295 HydrophobicContact CD1-CD1 4.2Å; I275-L295 HydrophobicContact CG1-CD1 4.12Å; I275-L295 HydrophobicContact CG2-CD1 4.5Å; I275-L295 HydrophobicContact CG2-CD2 3.86Å; I275-M330 HydrophobicContact CD1-CE 4.15Å; I275-M330 HydrophobicContact CD1-CG 4.08Å; I275-M330 HydrophobicContact CD1-SD 3.52Å; I275-M330 VanDerWaalsContact CD1-SD 3.52Å
276	R	75.6	Confident	69.3	Low	68 Å²	68	58.6 Å²	58.6	26%	0.257	30%	0.298	S	S	.	.			trans	-70.8	133.3	172	-65.6	179.2	-177.6	168.5	6.1	110.2	F171 K278 D288 Y291	F171-R276 VanDerWaalsContact CD1-NH2 3.32Å; F171-R276 VanDerWaalsContact CZ-NH2 3.31Å; R276-K278 VanDerWaalsContact C-N 3.32Å; R276-K278 PolarHBondContact O-N 2.68Å; R276-D288 IonicContact NH1-OD2 3.96Å; R276-D288 PolarHBondContact NH1-OD2 2.81Å; R276-Y291 HydrophobicContact CB-CE1 3.9Å; R276-Y291 HydrophobicContact CG-CE1 4.03Å; R276-Y291 HydrophobicContact CG-CE2 4.08Å; R276-Y291 PolarHBondContact N-OH 3.35Å
277	R	63.2	Low	68.7	Low	115 Å²	115	63.8 Å²	63.8	43%	0.434	32%	0.319	S	S	.	.	S	Bend	trans	-64.7	-33.9	177.5	-97.4	-165.3	-173.4	150.7	-3.8	113.9	N257	N257-R277 WeakPolarHBondContact ND2-CD 3.28Å; N257-R277 VanDerWaalsContact ND2-CZ 3.26Å; N257-R277 PolarHBondContact ND2-NE 3.42Å; N257-R277 PolarHBondContact ND2-NH1 3Å; N257-R277 VanDerWaalsContact ND2-NH1 3.17Å
278	K	59.7	Low	68.7	Low	126 Å²	126	64.3 Å²	64.3	55%	0.548	32%	0.322	S	S	.	.			trans	-107	105.9	173.7	-65.1	-164.8	178.1	-165.3	0	107.4	R276 E281	R276-K278 VanDerWaalsContact C-N 3.32Å; R276-K278 PolarHBondContact O-N 2.68Å; K278-E281 VanDerWaalsContact CD-CD 3.46Å; K278-E281 HydrophobicContact CD-CG 4.35Å; K278-E281 WeakPolarHBondContact CD-OE1 3.49Å; K278-E281 WeakPolarHBondContact CD-OE2 3.27Å; K278-E281 IonicContact NZ-OE1 3.37Å; K278-E281 PolarHBondContact NZ-OE1 3.17Å; K278-E281 IonicContact NZ-OE2 3.55Å; K278-E281 PolarHBondContact NZ-OE2 3.28Å
279	L	58.4	Low	68.7	Low	49 Å²	49	64.8 Å²	64.8	26%	0.257	33%	0.33	S	S	.	.	S	Bend	trans	-78.4	-12.5	176.9	-74	131.6	0	0	0	112.1	Y291 R292 L295	L279-Y291 HydrophobicContact CD2-CD1 4.15Å; L279-Y291 HydrophobicContact CD2-CE1 3.85Å; L279-R292 HydrophobicContact CB-CG 4.5Å; L279-R292 HydrophobicContact CD2-CG 4.42Å; L279-L295 HydrophobicContact CD2-CD2 3.58Å
280	D	49.4	Very low	68.9	Low	73 Å²	73	62.7 Å²	62.7	39%	0.39	32%	0.32	S	S	.	.	S	Bend	trans	-117.2	1.9	-160.7	-63	-41.1	0	0	0	115.7	K286 R292	D280-K286 CarbonylContact O-C 3.39Å; D280-K286 VanDerWaalsContact O-O 3.06Å; D280-R292 IonicContact OD1-CZ 2.77Å; D280-R292 IonicContact OD1-NH1 3.84Å; D280-R292 PolarHBondContact OD1-NH1 2.89Å; D280-R292 IonicContact OD2-NH1 2.9Å
281	E	53.5	Low	69.3	Low	116 Å²	116	62.3 Å²	62.3	54%	0.542	32%	0.318	S	S	.	.			trans	-119.9	101.6	-175.7	-69.6	175.1	-156.9	0	0	111.3	K278	K278-E281 VanDerWaalsContact CD-CD 3.46Å; K278-E281 HydrophobicContact CD-CG 4.35Å; K278-E281 WeakPolarHBondContact CD-OE1 3.49Å; K278-E281 WeakPolarHBondContact CD-OE2 3.27Å; K278-E281 IonicContact NZ-OE1 3.37Å; K278-E281 PolarHBondContact NZ-OE1 3.17Å; K278-E281 IonicContact NZ-OE2 3.55Å; K278-E281 PolarHBondContact NZ-OE2 3.28Å
282	T	57.3	Low	69.6	Low	39 Å²	39	67.5 Å²	67.5	24%	0.239	34%	0.338	C	S	.	.			trans	-67.3	161.4	145.4	56.9	0	0	0	0	109.2	D284 G285 K286 D288	T282-D284 PolarHBondContact O-N 2.9Å; T282-G285 PolarHBondContact O-N 3.08Å; T282-K286 PolarHBondContact N-O 3.37Å; T282-K286 PolarHBondContact OG1-N 2.8Å; T282-K286 VanDerWaalsContact OG1-N 3.17Å; T282-K286 PolarHBondContact OG1-O 3.21Å; T282-K286 VanDerWaalsContact OG1-O 3.08Å; T282-D288 HydrophobicContact CG2-CB 4.29Å
283	P	52.6	Low	69.8	Low	136 Å²	136	68.4 Å²	68.4	88%	0.883	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-22.5	174.9	-25.9	34.6	0	0	0	113.9
284	D	51.6	Low	70	Confident	137 Å²	137	68.3 Å²	68.3	73%	0.733	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	7	-178.3	-46.2	-53.1	0	0	0	113.8	T282 K286	T282-D284 PolarHBondContact O-N 2.9Å; D284-K286 VanDerWaalsContact C-N 3.35Å; D284-K286 PolarHBondContact O-N 3.39Å
285	G	54.6	Low	70.4	Confident	53 Å²	53	68.1 Å²	68.1	55%	0.546	34%	0.343	S	S	.	.	S	Bend	trans	76.2	12.6	176.7	0	0	0	0	0	115.9	T282	T282-G285 PolarHBondContact O-N 3.08Å
286	K	59.3	Low	70.8	Confident	136 Å²	136	68.3 Å²	68.3	59%	0.591	34%	0.342	S	S	*	.			trans	-92.1	151.8	174.3	-66.6	-175.6	179	-176.9	0	111.5	D280 T282 D284 D288	D280-K286 CarbonylContact O-C 3.39Å; D280-K286 VanDerWaalsContact O-O 3.06Å; T282-K286 PolarHBondContact N-O 3.37Å; T282-K286 PolarHBondContact OG1-N 2.8Å; T282-K286 VanDerWaalsContact OG1-N 3.17Å; T282-K286 PolarHBondContact OG1-O 3.21Å; T282-K286 VanDerWaalsContact OG1-O 3.08Å; D284-K286 VanDerWaalsContact C-N 3.35Å; D284-K286 PolarHBondContact O-N 3.39Å; K286-D288 PolarHBondContact O-N 2.83Å
287	K	65	Low	71.7	Confident	150 Å²	150	65.1 Å²	65.1	65%	0.652	33%	0.331	S	S	*	.			trans	-64.3	129.2	175.2	-66.5	178.3	-179.1	173	0	109.9	V289	K287-V289 VanDerWaalsContact C-N 3.27Å; K287-V289 PolarHBondContact O-N 2.9Å
288	D	79.2	Confident	73.1	Confident	23 Å²	23	59.8 Å²	59.8	12%	0.123	31%	0.31	C	S	.	.			trans	-76.3	79.8	174.9	-170.4	-15.9	0	0	0	109.6	R276 T282 K286 L290 Y291 R292	R276-D288 IonicContact NH1-OD2 3.96Å; R276-D288 PolarHBondContact NH1-OD2 2.81Å; T282-D288 HydrophobicContact CG2-CB 4.29Å; K286-D288 PolarHBondContact O-N 2.83Å; D288-L290 PolarHBondContact O-N 3.32Å; D288-Y291 PolarHBondContact O-N 3.18Å; D288-Y291 WeakPolarHBondContact OD1-CB 3.23Å; D288-Y291 PolarHBondContact OD1-N 3.43Å; D288-Y291 WeakPolarHBondContact OD2-CB 3.41Å; D288-R292 WeakPolarHBondContact O-CG 3.44Å; D288-R292 PolarHBondContact O-N 2.76Å
289	V	83.6	Confident	74.7	Confident	51 Å²	51	53.8 Å²	53.8	31%	0.309	28%	0.284	S	S	.	.	H	α-helix	trans	-56	-39.2	-177.5	179.5	0	0	0	0	111.2	A139 K287 S293	A139-V289 HydrophobicContact CB-CG1 4.46Å; K287-V289 VanDerWaalsContact C-N 3.27Å; K287-V289 PolarHBondContact O-N 2.9Å; V289-S293 WeakPolarHBondContact O-CB 3.05Å; V289-S293 PolarHBondContact O-N 3.35Å; V289-S293 PolarHBondContact O-OG 2.82Å
290	L	86.9	Confident	76.3	Confident	2 Å²	2	52 Å²	52	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-63	-52.6	177.9	-178.2	63.1	0	0	0	111.3	I140 V143 V164 A168 F171 D288 R292 S293 L294	I140-L290 HydrophobicContact CG1-CD1 3.79Å; V143-L290 HydrophobicContact CG2-CB 4.21Å; V164-L290 HydrophobicContact CG1-CD2 3.91Å; A168-L290 HydrophobicContact CB-CD1 4.19Å; A168-L290 HydrophobicContact CB-CD2 4.42Å; F171-L290 HydrophobicContact CD2-CD2 4.45Å; F171-L290 HydrophobicContact CE2-CD2 4.33Å; D288-L290 PolarHBondContact O-N 3.32Å; L290-R292 PolarHBondContact O-N 3.1Å; L290-S293 PolarHBondContact O-N 3.43Å; L290-L294 HydrophobicContact CD1-CD1 4.28Å; L290-L294 HydrophobicContact CD1-CG 4.44Å; L290-L294 HydrophobicContact CG-CD1 4.07Å; L290-L294 VanDerWaalsContact O-CG 3.25Å; L290-L294 WeakPolarHBondContact O-CG 3.33Å; L290-L294 PolarHBondContact O-N 2.97Å
291	Y	87.1	Confident	78.4	Confident	4 Å²	4	49 Å²	49	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-41.7	-179.5	-178.2	-99.4	0	0	0	112.3	M175 I275 R276 L279 D288 L294 L295	M175-Y291 HydrophobicContact CE-CE2 4.48Å; M175-Y291 HydrophobicContact CG-CE2 4.19Å; M175-Y291 HydrophobicContact SD-CD2 4.15Å; M175-Y291 HydrophobicContact SD-CE2 3.41Å; M175-Y291 WeakPolarHBondContact SD-CE2 3.43Å; I275-Y291 WeakPolarHBondContact CA-OH 3.33Å; R276-Y291 HydrophobicContact CB-CE1 3.9Å; R276-Y291 HydrophobicContact CG-CE1 4.03Å; R276-Y291 HydrophobicContact CG-CE2 4.08Å; R276-Y291 PolarHBondContact N-OH 3.35Å; L279-Y291 HydrophobicContact CD2-CD1 4.15Å; L279-Y291 HydrophobicContact CD2-CE1 3.85Å; D288-Y291 PolarHBondContact O-N 3.18Å; D288-Y291 WeakPolarHBondContact OD1-CB 3.23Å; D288-Y291 PolarHBondContact OD1-N 3.43Å; D288-Y291 WeakPolarHBondContact OD2-CB 3.41Å; Y291-L294 PolarHBondContact O-N 3.24Å; Y291-L295 PolarHBondContact O-N 3.09Å
292	R	86.8	Confident	80.3	Confident	110 Å²	110	43.6 Å²	43.6	42%	0.415	23%	0.233	S	C	.	.	H	α-helix	trans	-61.7	-44.6	177.3	-70.1	-178.4	71.5	98.2	8	111.5	L279 D280 D288 L290 L295 Y296	L279-R292 HydrophobicContact CB-CG 4.5Å; L279-R292 HydrophobicContact CD2-CG 4.42Å; D280-R292 IonicContact OD1-CZ 2.77Å; D280-R292 IonicContact OD1-NH1 3.84Å; D280-R292 PolarHBondContact OD1-NH1 2.89Å; D280-R292 IonicContact OD2-NH1 2.9Å; D288-R292 WeakPolarHBondContact O-CG 3.44Å; D288-R292 PolarHBondContact O-N 2.76Å; L290-R292 PolarHBondContact O-N 3.1Å; R292-L295 PolarHBondContact O-N 2.85Å; R292-Y296 VanDerWaalsContact O-CB 3.29Å; R292-Y296 WeakPolarHBondContact O-CB 3.26Å; R292-Y296 PolarHBondContact O-N 3.38Å
293	S	89.8	Confident	82	Confident	18 Å²	18	41.8 Å²	41.8	13%	0.126	22%	0.222	C	C	.	.	H	α-helix	trans	-63.4	-42	177.4	-59.5	0	0	0	0	111.8	V289 L290 Y296 V297	V289-S293 WeakPolarHBondContact O-CB 3.05Å; V289-S293 PolarHBondContact O-N 3.35Å; V289-S293 PolarHBondContact O-OG 2.82Å; L290-S293 PolarHBondContact O-N 3.43Å; S293-Y296 PolarHBondContact O-N 3.45Å; S293-V297 WeakPolarHBondContact O-CG2 3.28Å; S293-V297 PolarHBondContact O-N 3.35Å
294	L	91.7	Very high	83.9	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.9	-46	176.1	-70.2	170.7	0	0	0	112.4	V130 V136 A168 F171 L172 L290 Y291 Y298	V130-L294 HydrophobicContact CG1-CD2 4.07Å; V136-L294 HydrophobicContact CG1-CD2 3.61Å; V136-L294 HydrophobicContact CG2-CD2 4.09Å; A168-L294 HydrophobicContact CB-CD1 3.99Å; A168-L294 HydrophobicContact CB-CD2 4.26Å; F171-L294 HydrophobicContact CB-CD1 4.07Å; F171-L294 HydrophobicContact CD2-CD1 4.19Å; L172-L294 HydrophobicContact CD1-CD2 3.88Å; L172-L294 HydrophobicContact CD2-CB 4.23Å; L172-L294 HydrophobicContact CD2-CD2 4.09Å; L172-L294 HydrophobicContact CG-CD2 3.92Å; L290-L294 HydrophobicContact CD1-CD1 4.28Å; L290-L294 HydrophobicContact CD1-CG 4.44Å; L290-L294 HydrophobicContact CG-CD1 4.07Å; L290-L294 VanDerWaalsContact O-CG 3.25Å; L290-L294 WeakPolarHBondContact O-CG 3.33Å; L290-L294 PolarHBondContact O-N 2.97Å; Y291-L294 PolarHBondContact O-N 3.24Å; L294-Y298 WeakPolarHBondContact O-CB 3.29Å; L294-Y298 PolarHBondContact O-N 3.48Å
295	L	90.5	Very high	85.8	Confident	5 Å²	5	36.2 Å²	36.2	3%	0.026	18%	0.175	C	C	.	.	H	α-helix	trans	-64	-42	178	176.7	64.7	0	0	0	112.1	M175 F273 I275 L279 Y291 R292 T299 M330 I333	M175-L295 HydrophobicContact CE-CB 3.95Å; M175-L295 HydrophobicContact CE-CD1 3.51Å; M175-L295 HydrophobicContact CE-CG 4.33Å; F273-L295 HydrophobicContact CE2-CD1 4.12Å; I275-L295 HydrophobicContact CD1-CD1 4.2Å; I275-L295 HydrophobicContact CG1-CD1 4.12Å; I275-L295 HydrophobicContact CG2-CD1 4.5Å; I275-L295 HydrophobicContact CG2-CD2 3.86Å; L279-L295 HydrophobicContact CD2-CD2 3.58Å; Y291-L295 PolarHBondContact O-N 3.09Å; R292-L295 PolarHBondContact O-N 2.85Å; L295-T299 WeakPolarHBondContact O-CB 3.36Å; L295-T299 PolarHBondContact O-N 3.22Å; L295-T299 PolarHBondContact O-OG1 3.2Å; L295-M330 HydrophobicContact CD1-SD 4.35Å; L295-M330 HydrophobicContact CD2-SD 4.18Å; L295-M330 HydrophobicContact CG-SD 4.5Å; L295-I333 HydrophobicContact CD2-CD1 4.4Å; L295-I333 HydrophobicContact CG-CD1 4.19Å
296	Y	91.3	Very high	87.6	Confident	24 Å²	24	37.5 Å²	37.5	9%	0.094	17%	0.167	C	C	.	.	H	α-helix	trans	-59.5	-57.7	178.1	-174.5	-83	0	0	0	110.5	R135 R292 S293 Y298 T299 E300 I333 D336 N340	R135-Y296 VanDerWaalsContact NH1-CD1 3.34Å; R135-Y296 PolarHBondContact NH1-OH 2.93Å; R292-Y296 VanDerWaalsContact O-CB 3.29Å; R292-Y296 WeakPolarHBondContact O-CB 3.26Å; R292-Y296 PolarHBondContact O-N 3.38Å; S293-Y296 PolarHBondContact O-N 3.45Å; Y296-Y298 VanDerWaalsContact C-N 3.33Å; Y296-Y298 PolarHBondContact O-N 3.28Å; Y296-T299 PolarHBondContact O-N 3.44Å; Y296-T299 VanDerWaalsContact O-N 3.17Å; Y296-E300 HydrophobicContact CD1-CG 4.14Å; Y296-E300 HydrophobicContact CE1-CG 3.85Å; Y296-E300 WeakPolarHBondContact CE1-OE1 3.46Å; Y296-E300 WeakPolarHBondContact CE1-OE2 3.39Å; Y296-E300 PolarHBondContact O-N 2.57Å; Y296-E300 PolarHBondContact OH-OE1 2.84Å; Y296-I333 HydrophobicContact CD2-CB 4.31Å; Y296-I333 HydrophobicContact CD2-CG1 3.95Å; Y296-I333 HydrophobicContact CD2-CG2 3.82Å; Y296-I333 HydrophobicContact CE2-CG1 4.49Å; Y296-I333 HydrophobicContact CE2-CG2 4.08Å; Y296-I333 HydrophobicContact CG-CG2 4.24Å; Y296-D336 HydrophobicContact CE2-CB 4.01Å; Y296-D336 VanDerWaalsContact OH-CB 3.29Å; Y296-D336 WeakPolarHBondContact OH-CB 3.49Å; Y296-N340 PolarHBondContact OH-ND2 3.45Å
297	V	93.5	Very high	89.1	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.006	14%	0.139	C	C	.	.	H	α-helix	trans	-66.8	-33.8	-177.8	175.6	0	0	0	0	112	V130 N133 R135 V136 S293 T299 E300 E301	V130-V297 HydrophobicContact CB-CG1 4.23Å; V130-V297 HydrophobicContact CG1-CB 4.16Å; V130-V297 HydrophobicContact CG1-CG1 3.92Å; V130-V297 HydrophobicContact CG2-CG1 4.16Å; N133-V297 HydrophobicContact CB-CG1 3.53Å; R135-V297 HydrophobicContact CB-CG2 4.13Å; V136-V297 HydrophobicContact CG2-CB 3.88Å; V136-V297 HydrophobicContact CG2-CG1 4.18Å; V136-V297 HydrophobicContact CG2-CG2 3.78Å; S293-V297 WeakPolarHBondContact O-CG2 3.28Å; S293-V297 PolarHBondContact O-N 3.35Å; V297-T299 PolarHBondContact O-N 3.13Å; V297-E300 PolarHBondContact O-N 3.5Å; V297-E301 WeakPolarHBondContact O-CB 3.5Å; V297-E301 PolarHBondContact O-N 2.64Å
298	Y	93.3	Very high	90.5	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-59.7	-45.8	172.8	173	-97.7	0	0	0	112.1	V126 V176 F273 L294 Y296 E301 L302	V126-Y298 HydrophobicContact CG1-CD2 3.48Å; V126-Y298 VanDerWaalsContact CG1-CD2 3.48Å; V126-Y298 HydrophobicContact CG1-CE2 3.56Å; V176-Y298 HydrophobicContact CB-CE2 4.3Å; V176-Y298 HydrophobicContact CG2-CD2 4.05Å; V176-Y298 HydrophobicContact CG2-CE2 3.62Å; F273-Y298 HydrophobicContact CB-CE1 3.93Å; F273-Y298 WeakPolarHBondContact CB-OH 3.3Å; F273-Y298 HydrophobicContact CD1-CE1 4.05Å; F273-Y298 HydrophobicContact CD2-CD1 4.19Å; F273-Y298 AromaticContact CD2-CE1 3.56Å; F273-Y298 HydrophobicContact CD2-CE1 3.56Å; F273-Y298 HydrophobicContact CE1-CE1 4.43Å; F273-Y298 HydrophobicContact CE2-CD1 4.34Å; F273-Y298 AromaticContact CE2-CE1 3.96Å; F273-Y298 HydrophobicContact CE2-CE1 3.96Å; F273-Y298 AromaticContact CG-CE1 3.59Å; F273-Y298 HydrophobicContact CG-CE1 3.59Å; F273-Y298 HydrophobicContact CZ-CE1 4.38Å; L294-Y298 WeakPolarHBondContact O-CB 3.29Å; L294-Y298 PolarHBondContact O-N 3.48Å; Y296-Y298 VanDerWaalsContact C-N 3.33Å; Y296-Y298 PolarHBondContact O-N 3.28Å; Y298-E301 PolarHBondContact O-N 3.04Å; Y298-L302 HydrophobicContact CD1-CD1 4.18Å; Y298-L302 HydrophobicContact CE1-CD1 3.49Å; Y298-L302 VanDerWaalsContact CE1-CD1 3.49Å; Y298-L302 HydrophobicContact CE1-CG 4.21Å; Y298-L302 WeakPolarHBondContact O-CG 3.49Å; Y298-L302 PolarHBondContact O-N 2.62Å; Y298-L302 VanDerWaalsContact O-N 3.09Å
299	T	93	Very high	91.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-68.5	-41.6	180	-52.5	0	0	0	0	110.8	L295 Y296 V297 E301 L302 L303 L309 M330 I333	L295-T299 WeakPolarHBondContact O-CB 3.36Å; L295-T299 PolarHBondContact O-N 3.22Å; L295-T299 PolarHBondContact O-OG1 3.2Å; Y296-T299 PolarHBondContact O-N 3.44Å; Y296-T299 VanDerWaalsContact O-N 3.17Å; V297-T299 PolarHBondContact O-N 3.13Å; T299-E301 VanDerWaalsContact C-N 3.31Å; T299-E301 PolarHBondContact O-N 3.17Å; T299-L302 PolarHBondContact O-N 3.04Å; T299-L303 HydrophobicContact CG2-CD1 4.33Å; T299-L303 WeakPolarHBondContact O-CG 3.35Å; T299-L303 PolarHBondContact O-N 3.18Å; T299-L309 HydrophobicContact CG2-CD1 3.96Å; T299-M330 HydrophobicContact CG2-CE 4.05Å; T299-I333 HydrophobicContact CG2-CB 4.49Å; T299-I333 HydrophobicContact CG2-CG2 3.9Å
300	E	93.3	Very high	91.7	Very high	11 Å²	11	21.2 Å²	21.2	5%	0.051	9%	0.091	C	C	.	.	H	α-helix	trans	-58.4	-42.5	172.9	-74.1	-169.5	143.5	0	0	112.4	Y296 V297 L302 L303 R304 A337 V342	Y296-E300 HydrophobicContact CD1-CG 4.14Å; Y296-E300 HydrophobicContact CE1-CG 3.85Å; Y296-E300 WeakPolarHBondContact CE1-OE1 3.46Å; Y296-E300 WeakPolarHBondContact CE1-OE2 3.39Å; Y296-E300 PolarHBondContact O-N 2.57Å; Y296-E300 PolarHBondContact OH-OE1 2.84Å; V297-E300 PolarHBondContact O-N 3.5Å; E300-L302 VanDerWaalsContact C-N 3.35Å; E300-L302 PolarHBondContact O-N 3.4Å; E300-L303 PolarHBondContact O-N 3.34Å; E300-R304 WeakPolarHBondContact O-CB 3.4Å; E300-R304 PolarHBondContact O-N 2.91Å; E300-A337 HydrophobicContact CG-CB 4.06Å; E300-V342 HydrophobicContact CB-CG1 4.39Å
301	E	93.6	Very high	92	Very high	12 Å²	12	21.5 Å²	21.5	6%	0.056	9%	0.093	C	C	.	.	H	α-helix	trans	-65.2	-38.5	178.8	-175.4	58.6	-160.7	0	0	111.8	V126 N129 V130 V297 Y298 T299 R304 Q305	V126-E301 HydrophobicContact CG1-CB 4.38Å; V126-E301 HydrophobicContact CG1-CG 4.03Å; N129-E301 HydrophobicContact CB-CG 4.11Å; N129-E301 PolarHBondContact ND2-OE1 3.27Å; V130-E301 HydrophobicContact CG2-CB 4.17Å; V297-E301 WeakPolarHBondContact O-CB 3.5Å; V297-E301 PolarHBondContact O-N 2.64Å; Y298-E301 PolarHBondContact O-N 3.04Å; T299-E301 VanDerWaalsContact C-N 3.31Å; T299-E301 PolarHBondContact O-N 3.17Å; E301-R304 PolarHBondContact O-N 2.99Å; E301-R304 IonicContact OE2-CZ 3.17Å; E301-R304 IonicContact OE2-NH1 3.69Å; E301-R304 PolarHBondContact OE2-NH1 3.21Å; E301-Q305 WeakPolarHBondContact O-CG 3.28Å; E301-Q305 PolarHBondContact O-N 3.31Å; E301-Q305 PolarHBondContact OE1-NE2 3.37Å
302	L	92.9	Very high	92.2	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-62	-44.8	172.3	-69.5	-178.3	0	0	0	111.8	A123 V126 H251 F273 Y298 T299 E300 Q305 Q306 Q307 L309	A123-L302 HydrophobicContact CB-CD2 3.71Å; V126-L302 HydrophobicContact CG2-CD2 4.41Å; H251-L302 HydrophobicContact CB-CD1 4.13Å; F273-L302 HydrophobicContact CE1-CD1 4.47Å; Y298-L302 HydrophobicContact CD1-CD1 4.18Å; Y298-L302 HydrophobicContact CE1-CD1 3.49Å; Y298-L302 VanDerWaalsContact CE1-CD1 3.49Å; Y298-L302 HydrophobicContact CE1-CG 4.21Å; Y298-L302 WeakPolarHBondContact O-CG 3.49Å; Y298-L302 PolarHBondContact O-N 2.62Å; Y298-L302 VanDerWaalsContact O-N 3.09Å; T299-L302 PolarHBondContact O-N 3.04Å; E300-L302 VanDerWaalsContact C-N 3.35Å; E300-L302 PolarHBondContact O-N 3.4Å; L302-Q305 CarbonylContact O-C 3.49Å; L302-Q305 PolarHBondContact O-N 3.11Å; L302-Q306 PolarHBondContact O-N 3.43Å; L302-Q307 HydrophobicContact CB-CB 4.24Å; L302-Q307 HydrophobicContact CD2-CB 4.48Å; L302-Q307 HydrophobicContact CD2-CG 4.24Å; L302-Q307 VanDerWaalsContact O-CB 3.26Å; L302-Q307 WeakPolarHBondContact O-CB 3.2Å; L302-Q307 WeakPolarHBondContact O-CG 3.27Å; L302-Q307 PolarHBondContact O-N 3.38Å; L302-L309 HydrophobicContact CB-CD2 4.36Å; L302-L309 HydrophobicContact CD1-CD2 3.95Å
303	L	93.3	Very high	92.4	Very high	1 Å²	1	17 Å²	17	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-66.2	-41.1	178.8	-67.7	170.8	0	0	0	111.8	P222 T299 E300 Q305 Q306 L309 V334 A337 I343	P222-L303 HydrophobicContact CB-CD2 3.93Å; P222-L303 HydrophobicContact CG-CD2 3.98Å; T299-L303 HydrophobicContact CG2-CD1 4.33Å; T299-L303 WeakPolarHBondContact O-CG 3.35Å; T299-L303 PolarHBondContact O-N 3.18Å; E300-L303 PolarHBondContact O-N 3.34Å; L303-Q305 VanDerWaalsContact C-N 3.26Å; L303-Q305 PolarHBondContact O-N 2.98Å; L303-Q306 WeakPolarHBondContact O-CA 3.33Å; L303-Q306 PolarHBondContact O-N 2.89Å; L303-L309 HydrophobicContact CD2-CD1 3.66Å; L303-L309 HydrophobicContact CD2-CG 4.19Å; L303-L309 HydrophobicContact CG-CD1 4.09Å; L303-V334 HydrophobicContact CD1-CB 4.46Å; L303-V334 HydrophobicContact CD1-CG1 4.42Å; L303-V334 HydrophobicContact CD1-CG2 4.22Å; L303-A337 HydrophobicContact CD1-CB 4Å; L303-I343 HydrophobicContact CB-CD1 3.88Å; L303-I343 HydrophobicContact CB-CG2 3.98Å; L303-I343 HydrophobicContact CD1-CD1 3.89Å; L303-I343 HydrophobicContact CD2-CD1 4.49Å; L303-I343 HydrophobicContact CG-CD1 4.31Å
304	R	92.4	Very high	92.2	Very high	110 Å²	110	16.3 Å²	16.3	42%	0.415	7%	0.071	S	C	.	.	H	α-helix	trans	-59.1	-38.4	174.9	-176.4	-176.8	-70.4	124.1	0.8	111.6	E300 E301 Q306	E300-R304 WeakPolarHBondContact O-CB 3.4Å; E300-R304 PolarHBondContact O-N 2.91Å; E301-R304 PolarHBondContact O-N 2.99Å; E301-R304 IonicContact OE2-CZ 3.17Å; E301-R304 IonicContact OE2-NH1 3.69Å; E301-R304 PolarHBondContact OE2-NH1 3.21Å; R304-Q306 PolarHBondContact O-N 3.14Å
305	Q	91.6	Very high	91.7	Very high	47 Å²	47	18.1 Å²	18.1	22%	0.22	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	16.9	173.9	-62.7	-171.6	27.8	0	0	113.5	R124 E301 L302 L303 Q307	R124-Q305 PolarHBondContact O-NE2 3.32Å; E301-Q305 WeakPolarHBondContact O-CG 3.28Å; E301-Q305 PolarHBondContact O-N 3.31Å; E301-Q305 PolarHBondContact OE1-NE2 3.37Å; L302-Q305 CarbonylContact O-C 3.49Å; L302-Q305 PolarHBondContact O-N 3.11Å; L303-Q305 VanDerWaalsContact C-N 3.26Å; L303-Q305 PolarHBondContact O-N 2.98Å; Q305-Q307 HydrophobicContact CB-CG 4.11Å; Q305-Q307 PolarHBondContact O-N 3.46Å; Q305-Q307 VanDerWaalsContact O-N 3.13Å; Q305-Q307 PolarHBondContact O-NE2 3.09Å
306	Q	91.3	Very high	91.2	Very high	79 Å²	79	19.9 Å²	19.9	37%	0.369	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	35.6	178.2	-58.5	177.3	-10.9	0	0	113.2	N220 K248 L302 L303 R304	N220-Q306 PolarHBondContact ND2-NE2 3.22Å; N220-Q306 PolarHBondContact O-NE2 2.93Å; N220-Q306 VanDerWaalsContact O-NE2 3.12Å; N220-Q306 PolarHBondContact OD1-OE1 3.16Å; N220-Q306 VanDerWaalsContact OD1-OE1 3.14Å; K248-Q306 PolarHBondContact NZ-O 3.42Å; L302-Q306 PolarHBondContact O-N 3.43Å; L303-Q306 WeakPolarHBondContact O-CA 3.33Å; L303-Q306 PolarHBondContact O-N 2.89Å; R304-Q306 PolarHBondContact O-N 3.14Å
307	Q	91.8	Very high	90.9	Very high	4 Å²	4	19.5 Å²	19.5	2%	0.019	10%	0.099	C	C	.	.			trans	-80.7	141.9	176.1	-54.9	-62.4	-48.3	0	0	110	M121 A123 P222 H251 L302 Q305	M121-Q307 PolarHBondContact O-OE1 2.89Å; M121-Q307 VanDerWaalsContact O-OE1 3.09Å; A123-Q307 HydrophobicContact CB-CG 4.02Å; P222-Q307 WeakPolarHBondContact CB-O 3.29Å; H251-Q307 PolarHBondContact CE1-OE1 3.4Å; L302-Q307 HydrophobicContact CB-CB 4.24Å; L302-Q307 HydrophobicContact CD2-CB 4.48Å; L302-Q307 HydrophobicContact CD2-CG 4.24Å; L302-Q307 VanDerWaalsContact O-CB 3.26Å; L302-Q307 WeakPolarHBondContact O-CB 3.2Å; L302-Q307 WeakPolarHBondContact O-CG 3.27Å; L302-Q307 PolarHBondContact O-N 3.38Å; Q305-Q307 HydrophobicContact CB-CG 4.11Å; Q305-Q307 PolarHBondContact O-N 3.46Å; Q305-Q307 VanDerWaalsContact O-N 3.13Å; Q305-Q307 PolarHBondContact O-NE2 3.09Å
308	F	93.4	Very high	90.6	Very high	13 Å²	13	19.7 Å²	19.7	6%	0.057	10%	0.1	C	C	.	.			trans	-79	150.2	175.7	-60.8	-8.8	0	0	0	109.6	A216 L223 F225 I247 K248 P250 H251	A216-F308 HydrophobicContact CB-CE2 4.2Å; A216-F308 HydrophobicContact CB-CZ 3.84Å; L223-F308 HydrophobicContact CB-CB 4.49Å; L223-F308 HydrophobicContact CB-CD1 3.86Å; L223-F308 HydrophobicContact CB-CD2 4.21Å; L223-F308 HydrophobicContact CB-CE1 4.1Å; L223-F308 HydrophobicContact CB-CE2 4.42Å; L223-F308 HydrophobicContact CB-CG 3.93Å; L223-F308 HydrophobicContact CB-CZ 4.38Å; L223-F308 HydrophobicContact CD1-CD1 4.38Å; L223-F308 HydrophobicContact CD1-CE1 3.77Å; L223-F308 HydrophobicContact CD1-CZ 3.86Å; L223-F308 HydrophobicContact CD2-CE2 4.42Å; L223-F308 HydrophobicContact CD2-CZ 4.5Å; L223-F308 HydrophobicContact CG-CE1 4.44Å; L223-F308 HydrophobicContact CG-CZ 4.47Å; L223-F308 CarbonylContact O-C 3.58Å; L223-F308 WeakPolarHBondContact O-CA 3.45Å; L223-F308 WeakPolarHBondContact O-CB 3.41Å; F225-F308 HydrophobicContact CE2-CB 4.2Å; F225-F308 HydrophobicContact CE2-CD2 4.05Å; F225-F308 HydrophobicContact CE2-CG 4.4Å; I247-F308 HydrophobicContact CG2-CE2 3.99Å; K248-F308 HydrophobicContact CB-CD2 3.89Å; K248-F308 HydrophobicContact CB-CE2 3.7Å; K248-F308 HydrophobicContact CB-CZ 4.3Å; K248-F308 HydrophobicContact CD-CD1 4.5Å; K248-F308 HydrophobicContact CD-CG 4.5Å; K248-F308 HydrophobicContact CD-CZ 4.5Å; K248-F308 HydrophobicContact CG-CD2 4.34Å; K248-F308 HydrophobicContact CG-CE2 4.5Å; K248-F308 VanDerWaalsContact O-CD2 3.28Å; K248-F308 WeakPolarHBondContact O-CD2 3.5Å; P250-F308 CarbonylContact C-O 3.59Å; P250-F308 WeakPolarHBondContact CA-O 3.45Å; P250-F308 HydrophobicContact CB-CB 4.03Å; H251-F308 PolarHBondContact N-O 3.5Å
309	L	94.4	Very high	90.1	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	145.3	179.8	-60.6	-178	0	0	0	110.5	L223 V224 F225 H251 T299 L302 L303 V311 V334	L223-L309 PolarHBondContact O-N 3.45Å; V224-L309 CarbonylContact C-O 3.52Å; V224-L309 WeakPolarHBondContact CA-O 3.49Å; V224-L309 HydrophobicContact CG1-CB 4.44Å; V224-L309 HydrophobicContact CG2-CB 4.31Å; V224-L309 HydrophobicContact CG2-CD1 4.49Å; F225-L309 PolarHBondContact N-O 3.31Å; H251-L309 HydrophobicContact CB-CD2 3.96Å; H251-L309 WeakPolarHBondContact O-CA 3.37Å; T299-L309 HydrophobicContact CG2-CD1 3.96Å; L302-L309 HydrophobicContact CB-CD2 4.36Å; L302-L309 HydrophobicContact CD1-CD2 3.95Å; L303-L309 HydrophobicContact CD2-CD1 3.66Å; L303-L309 HydrophobicContact CD2-CG 4.19Å; L303-L309 HydrophobicContact CG-CD1 4.09Å; L309-V311 HydrophobicContact CB-CG2 4.47Å; L309-V334 HydrophobicContact CD1-CG2 4.27Å
310	E	93.9	Very high	89.7	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.5	170.1	-176.5	-176.8	145.9	0	0	108.7	F225 P227 T239 P250 H251 I252 A253 F312	F225-E310 WeakPolarHBondContact O-CA 3.28Å; P227-E310 HydrophobicContact CG-CG 4.31Å; T239-E310 PolarHBondContact OG1-OE2 3.37Å; P250-E310 HydrophobicContact CB-CB 3.9Å; P250-E310 HydrophobicContact CG-CB 3.88Å; H251-E310 PolarHBondContact O-N 3.01Å; I252-E310 HydrophobicContact CG1-CB 4.35Å; A253-E310 PolarHBondContact N-O 3.16Å; E310-F312 HydrophobicContact CG-CE2 4.16Å; E310-F312 WeakPolarHBondContact OE1-CE2 3.34Å; E310-F312 WeakPolarHBondContact OE1-CZ 3.37Å
311	V	93.1	Very high	89.4	Confident	9 Å²	9	23.1 Å²	23.1	6%	0.055	12%	0.116	C	C	.	.			trans	-133.6	118.8	-173.7	-177.6	0	0	0	0	110.7	F225 L226 A253 L309 L313 M330	F225-V311 PolarHBondContact O-N 3.13Å; L226-V311 HydrophobicContact CD2-CB 3.81Å; L226-V311 HydrophobicContact CD2-CG1 4.47Å; L226-V311 WeakPolarHBondContact CD2-O 3.31Å; A253-V311 HydrophobicContact CB-CG2 4.27Å; L309-V311 HydrophobicContact CB-CG2 4.47Å; V311-L313 HydrophobicContact CG1-CD2 4.26Å; V311-L313 PolarHBondContact O-N 2.85Å; V311-M330 HydrophobicContact CG1-CB 3.65Å; V311-M330 HydrophobicContact CG1-CG 4.22Å; V311-M330 HydrophobicContact CG2-CB 4.41Å
312	F	91.8	Very high	89.2	Confident	18 Å²	18	23.1 Å²	23.1	8%	0.079	12%	0.115	C	C	.	.			trans	-83.9	100.7	172.4	-64.5	-87.8	0	0	0	110.1	P227 H229 D234 Y235 E310 E314 G315	P227-F312 HydrophobicContact CB-CD1 4.38Å; P227-F312 HydrophobicContact CB-CE1 3.98Å; P227-F312 HydrophobicContact CG-CD1 3.61Å; P227-F312 HydrophobicContact CG-CE1 3.32Å; P227-F312 HydrophobicContact CG-CE2 4.25Å; P227-F312 HydrophobicContact CG-CG 4.28Å; P227-F312 HydrophobicContact CG-CZ 3.68Å; H229-F312 HydrophobicContact CB-CD1 3.51Å; H229-F312 HydrophobicContact CB-CE1 4.11Å; H229-F312 HydrophobicContact CB-CG 4.35Å; H229-F312 AromaticContact CD2-CD1 3.88Å; H229-F312 AromaticContact CG-CD1 3.41Å; H229-F312 VanDerWaalsContact CG-CD1 3.41Å; H229-F312 AromaticContact CG-CE1 3.79Å; H229-F312 AromaticContact ND1-CD1 3.71Å; H229-F312 AromaticContact ND1-CE1 3.57Å; D234-F312 HydrophobicContact CB-CE1 3.79Å; D234-F312 HydrophobicContact CB-CZ 3.88Å; Y235-F312 AromaticContact CD1-CD2 3.87Å; Y235-F312 HydrophobicContact CD1-CD2 3.87Å; Y235-F312 AromaticContact CD1-CE2 3.26Å; Y235-F312 HydrophobicContact CD1-CE2 3.26Å; Y235-F312 AromaticContact CD1-CZ 3.77Å; Y235-F312 HydrophobicContact CD1-CZ 3.77Å; Y235-F312 AromaticContact CE1-CD2 3.7Å; Y235-F312 HydrophobicContact CE1-CD2 3.7Å; Y235-F312 AromaticContact CE1-CE2 3.57Å; Y235-F312 HydrophobicContact CE1-CE2 3.57Å; Y235-F312 HydrophobicContact CE1-CG 4.44Å; Y235-F312 HydrophobicContact CE1-CZ 4.13Å; Y235-F312 HydrophobicContact CG-CE2 4.35Å; E310-F312 HydrophobicContact CG-CE2 4.16Å; E310-F312 WeakPolarHBondContact OE1-CE2 3.34Å; E310-F312 WeakPolarHBondContact OE1-CZ 3.37Å; F312-E314 PolarHBondContact O-N 2.94Å; F312-G315 PolarHBondContact O-N 3.46Å
313	L	90.8	Very high	88.9	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-27.7	-177.8	-63	-179.4	0	0	0	112.7	L226 V311 G315 A326 R327 L331 A468 V471 L472	L226-L313 HydrophobicContact CB-CD1 4.46Å; L226-L313 HydrophobicContact CD1-CD1 4.23Å; L226-L313 HydrophobicContact CD2-CD1 4.47Å; L226-L313 HydrophobicContact CD2-CD2 4Å; L226-L313 HydrophobicContact CD2-CG 4.1Å; V311-L313 HydrophobicContact CG1-CD2 4.26Å; V311-L313 PolarHBondContact O-N 2.85Å; L313-G315 VanDerWaalsContact C-N 3.26Å; L313-G315 PolarHBondContact O-N 3.46Å; L313-A326 HydrophobicContact CB-CB 4.26Å; L313-A326 CarbonylContact O-C 3.59Å; L313-R327 PolarHBondContact O-N 3.41Å; L313-L331 HydrophobicContact CD2-CB 4.17Å; L313-L331 HydrophobicContact CD2-CD2 4.35Å; L313-A468 HydrophobicContact CD1-CB 4.16Å; L313-V471 HydrophobicContact CD1-CB 4.27Å; L313-V471 HydrophobicContact CD1-CG1 4Å; L313-L472 HydrophobicContact CB-CD1 4.46Å; L313-L472 HydrophobicContact CB-CD2 4.22Å; L313-L472 HydrophobicContact CB-CG 4.36Å; L313-L472 HydrophobicContact CD1-CG 4.26Å
314	E	86.3	Confident	88.4	Confident	4 Å²	4	25.8 Å²	25.8	2%	0.019	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-26.3	177.5	-62.1	-177.4	-118.4	0	0	113	V228 H229 F312 T316 S324 L472	V228-E314 WeakPolarHBondContact CA-OE1 3.4Å; H229-E314 PolarHBondContact N-OE1 2.94Å; F312-E314 PolarHBondContact O-N 2.94Å; E314-T316 WeakPolarHBondContact CB-O 3Å; E314-T316 PolarHBondContact O-N 3.16Å; E314-S324 WeakPolarHBondContact OE2-CB 3.47Å; E314-S324 PolarHBondContact OE2-N 3.06Å; E314-S324 PolarHBondContact OE2-OG 3.38Å; E314-L472 HydrophobicContact CG-CD1 4.47Å; E314-L472 HydrophobicContact CG-CD2 4.19Å
315	G	80.6	Confident	88	Confident	38 Å²	38	23.2 Å²	23.2	39%	0.392	13%	0.131	S	C	.	.	S	Bend	trans	71	-13.3	-176.6	0	0	0	0	0	115.7	F312 L313	F312-G315 PolarHBondContact O-N 3.46Å; L313-G315 VanDerWaalsContact C-N 3.26Å; L313-G315 PolarHBondContact O-N 3.46Å
316	T	80.4	Confident	87.8	Confident	42 Å²	42	22.7 Å²	22.7	26%	0.258	14%	0.135	S	C	.	.	S	Bend	trans	-147.3	153.3	173.5	57.6	0	0	0	0	110.7	E314	E314-T316 WeakPolarHBondContact CB-O 3Å; E314-T316 PolarHBondContact O-N 3.16Å
317	R	85.3	Confident	87.5	Confident	16 Å²	16	26.7 Å²	26.7	6%	0.06	15%	0.147	C	C	.	.			trans	-57.1	144.5	170.2	66.4	176.8	179	-161.5	-2.9	111.4	H229 H232 E360 E366	H229-R317 PolarHBondContact CD2-N 3.48Å; H229-R317 VanDerWaalsContact CD2-N 3.31Å; H229-R317 CarbonylContact O-C 3.45Å; H232-R317 PolarHBondContact CD2-NH1 2.55Å; H232-R317 PolarHBondContact NE2-NH1 2.73Å; R317-E360 WeakPolarHBondContact CD-OE2 3.39Å; R317-E360 IonicContact CZ-OE2 2.84Å; R317-E360 IonicContact NE-OE2 3.3Å; R317-E360 IonicContact NH1-OE1 2.65Å; R317-E360 PolarHBondContact NH1-OE1 2.67Å; R317-E360 VanDerWaalsContact NH1-OE1 3.15Å; R317-E360 IonicContact NH1-OE2 3.96Å; R317-E360 PolarHBondContact NH1-OE2 2.69Å; R317-E366 IonicContact CZ-OE1 2.83Å; R317-E366 IonicContact NH2-OE1 3.45Å; R317-E366 PolarHBondContact NH2-OE1 2.66Å; R317-E366 IonicContact NH2-OE2 2.83Å
318	S	85.5	Confident	86.9	Confident	4 Å²	4	27.7 Å²	27.7	3%	0.028	16%	0.155	C	C	.	.			trans	-62.8	138	170.4	-177.9	0	0	0	0	110.5	H229 S320 G321 K322	H229-S318 WeakPolarHBondContact O-CB 3.41Å; H229-S318 PolarHBondContact O-N 3.26Å; S318-S320 PolarHBondContact OG-N 2.58Å; S318-G321 WeakPolarHBondContact OG-CA 3.28Å; S318-G321 PolarHBondContact OG-N 3.29Å; S318-K322 VanDerWaalsContact CB-O 3.28Å; S318-K322 WeakPolarHBondContact CB-O 3.19Å; S318-K322 PolarHBondContact OG-N 2.95Å; S318-K322 PolarHBondContact OG-O 2.84Å
319	R	83.6	Confident	86.5	Confident	75 Å²	75	29.1 Å²	29.1	28%	0.283	17%	0.174	S	C	.	.	S	Bend	trans	-106	-15.4	174.7	-67.3	171.4	172.4	145.4	-4.2	112.5	E366 Q367	R319-E366 IonicContact CZ-OE2 2.64Å; R319-E366 VanDerWaalsContact CZ-OE2 3.23Å; R319-E366 IonicContact NE-OE2 3.74Å; R319-E366 PolarHBondContact NE-OE2 3.05Å; R319-E366 IonicContact NH2-OE2 3.62Å; R319-E366 PolarHBondContact NH2-OE2 3.17Å; R319-Q367 PolarHBondContact O-NE2 3.21Å
320	S	85.4	Confident	86.3	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.014	18%	0.179	C	C	.	.	S	Bend	trans	-108.6	-8.8	-177.8	54.9	0	0	0	0	112.5	S318 K322 F570 N573	S318-S320 PolarHBondContact OG-N 2.58Å; S320-K322 PolarHBondContact O-N 3.23Å; S320-K322 PolarHBondContact OG-N 3.18Å; S320-F570 VanDerWaalsContact C-CD2 3.49Å; S320-N573 WeakPolarHBondContact O-CB 3.47Å; S320-N573 PolarHBondContact O-ND2 3.09Å
321	G	86.3	Confident	86.1	Confident	8 Å²	8	30.3 Å²	30.3	8%	0.082	18%	0.179	C	C	.	.	S	Bend	trans	88.1	-15	-171.5	0	0	0	0	0	113	S318 F570	S318-G321 WeakPolarHBondContact OG-CA 3.28Å; S318-G321 PolarHBondContact OG-N 3.29Å; G321-F570 VanDerWaalsContact N-CD2 3.3Å; G321-F570 VanDerWaalsContact N-CE2 3.27Å
322	K	88.8	Confident	86.1	Confident	12 Å²	12	31.4 Å²	31.4	5%	0.052	19%	0.187	C	C	.	.	S	Bend	trans	-87.8	148.5	174.9	-50.6	-178.7	-161.4	176.8	0	111.4	S318 S320 N573 F576 E631 Y778	S318-K322 VanDerWaalsContact CB-O 3.28Å; S318-K322 WeakPolarHBondContact CB-O 3.19Å; S318-K322 PolarHBondContact OG-N 2.95Å; S318-K322 PolarHBondContact OG-O 2.84Å; S320-K322 PolarHBondContact O-N 3.23Å; S320-K322 PolarHBondContact OG-N 3.18Å; K322-N573 VanDerWaalsContact CE-CG 3.48Å; K322-N573 WeakPolarHBondContact CE-OD1 3.49Å; K322-N573 HydrophobicContact CG-CB 3.88Å; K322-F576 HydrophobicContact CD-CD1 4.31Å; K322-E631 IonicContact NZ-OE2 2.79Å; K322-E631 PolarHBondContact NZ-OE2 3.46Å; K322-Y778 HydrophobicContact CD-CE1 4.47Å
323	P	85.9	Confident	86.1	Confident	39 Å²	39	31.1 Å²	31.1	25%	0.253	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-65.2	137	173.4	28.1	-34.3	0	0	0	110.9	N476	P323-N476 HydrophobicContact CG-CB 4.15Å
324	S	84.4	Confident	86.3	Confident	19 Å²	19	31.1 Å²	31.1	13%	0.133	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-80.2	159.9	177	-49.5	0	0	0	0	111.6	E314 A326	E314-S324 WeakPolarHBondContact OE2-CB 3.47Å; E314-S324 PolarHBondContact OE2-N 3.06Å; E314-S324 PolarHBondContact OE2-OG 3.38Å; S324-A326 PolarHBondContact O-N 2.72Å
325	P	84.3	Confident	86.6	Confident	56 Å²	56	31.1 Å²	31.1	36%	0.364	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-56.9	136.1	173.5	-26.7	36.1	0	0	0	112.6
326	A	86.4	Confident	87.1	Confident	37 Å²	37	31.1 Å²	31.1	31%	0.306	18%	0.178	S	C	.	.	P	Polyproline II helix	trans	-67.2	144.5	-176.9	0	0	0	0	0	113.5	L313 S324 A468 L472	L313-A326 HydrophobicContact CB-CB 4.26Å; L313-A326 CarbonylContact O-C 3.59Å; S324-A326 PolarHBondContact O-N 2.72Å; A326-A468 HydrophobicContact CB-CB 3.63Å; A326-L472 HydrophobicContact CB-CD1 3.66Å
327	R	84.8	Confident	87.7	Confident	163 Å²	163	29.1 Å²	29.1	62%	0.615	17%	0.166	S	C	*	.			trans	-112.3	96.7	167.7	-62.3	-174.4	-179.1	-148.7	-4.3	108.8	L313 G329	L313-R327 PolarHBondContact O-N 3.41Å; R327-G329 PolarHBondContact O-N 3.31Å; R327-G329 VanDerWaalsContact O-N 3.08Å
328	A	80.4	Confident	88	Confident	24 Å²	24	29.1 Å²	29.1	20%	0.198	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	12.8	-168.8	0	0	0	0	0	115.4	M330 L331 S332 I464 A468	A328-M330 PolarHBondContact O-N 2.94Å; A328-L331 HydrophobicContact CB-CB 4.45Å; A328-L331 CarbonylContact O-C 3.47Å; A328-L331 WeakPolarHBondContact O-CB 3.26Å; A328-L331 PolarHBondContact O-N 2.87Å; A328-L331 VanDerWaalsContact O-N 3.11Å; A328-S332 PolarHBondContact O-N 3.45Å; A328-I464 HydrophobicContact CB-CG2 3.43Å; A328-I464 VanDerWaalsContact CB-CG2 3.43Å; A328-A468 HydrophobicContact CB-CB 4.19Å
329	G	84.9	Confident	88.3	Confident	43 Å²	43	31.2 Å²	31.2	44%	0.443	18%	0.181	S	C	.	.	H	α-helix	trans	-64.2	-33.4	-173.2	0	0	0	0	0	115.3	R327 S332	R327-G329 PolarHBondContact O-N 3.31Å; R327-G329 VanDerWaalsContact O-N 3.08Å; G329-S332 PolarHBondContact O-OG 3.49Å
330	M	88.6	Confident	88.6	Confident	24 Å²	24	32.5 Å²	32.5	12%	0.118	19%	0.194	C	C	.	.	H	α-helix	trans	-78.1	-34.5	171.9	-75.1	-55.2	-58.3	0	0	111.9	F273 I275 L295 T299 V311 A328 S332 I333 V334	F273-M330 HydrophobicContact CE2-CE 4.27Å; F273-M330 HydrophobicContact CZ-CE 4.05Å; I275-M330 HydrophobicContact CD1-CE 4.15Å; I275-M330 HydrophobicContact CD1-CG 4.08Å; I275-M330 HydrophobicContact CD1-SD 3.52Å; I275-M330 VanDerWaalsContact CD1-SD 3.52Å; L295-M330 HydrophobicContact CD1-SD 4.35Å; L295-M330 HydrophobicContact CD2-SD 4.18Å; L295-M330 HydrophobicContact CG-SD 4.5Å; T299-M330 HydrophobicContact CG2-CE 4.05Å; V311-M330 HydrophobicContact CG1-CB 3.65Å; V311-M330 HydrophobicContact CG1-CG 4.22Å; V311-M330 HydrophobicContact CG2-CB 4.41Å; A328-M330 PolarHBondContact O-N 2.94Å; M330-S332 VanDerWaalsContact C-N 3.31Å; M330-I333 HydrophobicContact CE-CD1 4.24Å; M330-I333 PolarHBondContact O-N 3.41Å; M330-I333 HydrophobicContact SD-CD1 3.94Å; M330-V334 PolarHBondContact O-N 2.98Å
331	L	91.3	Very high	88.8	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-67.5	-34	178.3	-173.3	62.9	0	0	0	111.5	L226 L313 A328 I333 V334 V335 L467 A468	L226-L331 HydrophobicContact CD1-CD1 4.31Å; L313-L331 HydrophobicContact CD2-CB 4.17Å; L313-L331 HydrophobicContact CD2-CD2 4.35Å; A328-L331 HydrophobicContact CB-CB 4.45Å; A328-L331 CarbonylContact O-C 3.47Å; A328-L331 WeakPolarHBondContact O-CB 3.26Å; A328-L331 PolarHBondContact O-N 2.87Å; A328-L331 VanDerWaalsContact O-N 3.11Å; L331-I333 VanDerWaalsContact C-N 3.31Å; L331-I333 PolarHBondContact O-N 3.49Å; L331-V334 PolarHBondContact O-N 2.86Å; L331-V335 WeakPolarHBondContact O-CG2 3.15Å; L331-V335 PolarHBondContact O-N 3.31Å; L331-L467 HydrophobicContact CD1-CD2 4.05Å; L331-L467 HydrophobicContact CD2-CB 4.35Å; L331-L467 HydrophobicContact CD2-CD2 3.92Å; L331-L467 HydrophobicContact CD2-CG 3.99Å; L331-L467 HydrophobicContact CG-CD2 4.17Å; L331-A468 HydrophobicContact CD2-CB 3.9Å
332	S	91.6	Very high	88.9	Confident	32 Å²	32	36.8 Å²	36.8	22%	0.224	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-40.9	174.8	67.1	0	0	0	0	111.4	A328 G329 M330 V334 V335 D336	A328-S332 PolarHBondContact O-N 3.45Å; G329-S332 PolarHBondContact O-OG 3.49Å; M330-S332 VanDerWaalsContact C-N 3.31Å; S332-V334 VanDerWaalsContact C-N 3.3Å; S332-V334 PolarHBondContact O-N 2.96Å; S332-V335 PolarHBondContact O-N 3.14Å; S332-D336 WeakPolarHBondContact O-CB 3.29Å; S332-D336 PolarHBondContact O-N 3.16Å
333	I	92	Very high	89	Confident	12 Å²	12	36.5 Å²	36.5	6%	0.062	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-41.5	176.9	-55.1	170.2	0	0	0	111	L295 Y296 T299 M330 L331 D336 A337	L295-I333 HydrophobicContact CD2-CD1 4.4Å; L295-I333 HydrophobicContact CG-CD1 4.19Å; Y296-I333 HydrophobicContact CD2-CB 4.31Å; Y296-I333 HydrophobicContact CD2-CG1 3.95Å; Y296-I333 HydrophobicContact CD2-CG2 3.82Å; Y296-I333 HydrophobicContact CE2-CG1 4.49Å; Y296-I333 HydrophobicContact CE2-CG2 4.08Å; Y296-I333 HydrophobicContact CG-CG2 4.24Å; T299-I333 HydrophobicContact CG2-CB 4.49Å; T299-I333 HydrophobicContact CG2-CG2 3.9Å; M330-I333 HydrophobicContact CE-CD1 4.24Å; M330-I333 PolarHBondContact O-N 3.41Å; M330-I333 HydrophobicContact SD-CD1 3.94Å; L331-I333 VanDerWaalsContact C-N 3.31Å; L331-I333 PolarHBondContact O-N 3.49Å; I333-D336 PolarHBondContact O-N 3.24Å; I333-A337 WeakPolarHBondContact O-CB 3.48Å; I333-A337 PolarHBondContact O-N 3.32Å
334	V	94.5	Very high	89.3	Confident	2 Å²	2	40 Å²	40	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-45.5	177.5	179.1	0	0	0	0	111.2	V224 L303 L309 M330 L331 S332 A337 L338 V346 L405	V224-V334 HydrophobicContact CG2-CG1 4.18Å; L303-V334 HydrophobicContact CD1-CB 4.46Å; L303-V334 HydrophobicContact CD1-CG1 4.42Å; L303-V334 HydrophobicContact CD1-CG2 4.22Å; L309-V334 HydrophobicContact CD1-CG2 4.27Å; M330-V334 PolarHBondContact O-N 2.98Å; L331-V334 PolarHBondContact O-N 2.86Å; S332-V334 VanDerWaalsContact C-N 3.3Å; S332-V334 PolarHBondContact O-N 2.96Å; V334-A337 PolarHBondContact O-N 2.91Å; V334-L338 PolarHBondContact O-N 2.97Å; V334-V346 HydrophobicContact CG1-CB 4.49Å; V334-V346 HydrophobicContact CG1-CG1 3.94Å; V334-V346 HydrophobicContact CG1-CG2 4.17Å; V334-L405 HydrophobicContact CG1-CD2 3.94Å
335	V	93.8	Very high	89.7	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.024	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-43	177.9	170.3	0	0	0	0	110.8	L331 S332 L338 C339 L405 L409 I464 L467	L331-V335 WeakPolarHBondContact O-CG2 3.15Å; L331-V335 PolarHBondContact O-N 3.31Å; S332-V335 PolarHBondContact O-N 3.14Å; V335-L338 PolarHBondContact O-N 2.82Å; V335-C339 WeakPolarHBondContact O-CB 3.46Å; V335-C339 PolarHBondContact O-N 3.22Å; V335-C339 PolarHBondContact O-SG 3.08Å; V335-C339 VanDerWaalsContact O-SG 3.33Å; V335-L405 HydrophobicContact CG2-CD1 4.3Å; V335-L405 HydrophobicContact CG2-CD2 4.05Å; V335-L409 HydrophobicContact CG1-CD1 4.11Å; V335-L409 HydrophobicContact CG1-CD2 4.3Å; V335-I464 HydrophobicContact CB-CD1 4.27Å; V335-I464 HydrophobicContact CB-CG1 4.06Å; V335-I464 HydrophobicContact CG1-CD1 4.14Å; V335-I464 HydrophobicContact CG1-CG1 3.95Å; V335-I464 HydrophobicContact CG2-CG1 4.05Å; V335-L467 HydrophobicContact CG2-CD2 4.2Å
336	D	91.1	Very high	90.3	Very high	37 Å²	37	38.1 Å²	38.1	20%	0.198	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-41.6	178.6	-64.4	-21.3	0	0	0	111.3	Y296 S332 I333 L338 C339 N340	Y296-D336 HydrophobicContact CE2-CB 4.01Å; Y296-D336 VanDerWaalsContact OH-CB 3.29Å; Y296-D336 WeakPolarHBondContact OH-CB 3.49Å; S332-D336 WeakPolarHBondContact O-CB 3.29Å; S332-D336 PolarHBondContact O-N 3.16Å; I333-D336 PolarHBondContact O-N 3.24Å; D336-L338 VanDerWaalsContact C-N 3.26Å; D336-L338 PolarHBondContact O-N 2.99Å; D336-C339 PolarHBondContact O-N 3.47Å; D336-N340 VanDerWaalsContact O-CB 3.23Å; D336-N340 WeakPolarHBondContact O-CB 3.39Å; D336-N340 PolarHBondContact O-N 3.22Å; D336-N340 PolarHBondContact O-ND2 2.9Å
337	A	92.1	Very high	90.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.1	-39.3	176.7	0	0	0	0	0	112	E300 L303 I333 V334 V342 I343	E300-A337 HydrophobicContact CG-CB 4.06Å; L303-A337 HydrophobicContact CD1-CB 4Å; I333-A337 WeakPolarHBondContact O-CB 3.48Å; I333-A337 PolarHBondContact O-N 3.32Å; V334-A337 PolarHBondContact O-N 2.91Å; A337-V342 HydrophobicContact CB-CB 4.44Å; A337-V342 WeakPolarHBondContact O-CB 3.38Å; A337-V342 PolarHBondContact O-N 3.33Å; A337-I343 HydrophobicContact CB-CD1 3.97Å; A337-I343 HydrophobicContact CB-CG1 4.38Å; A337-I343 PolarHBondContact O-N 3.43Å
338	L	92.9	Very high	91.4	Very high	16 Å²	16	28.6 Å²	28.6	8%	0.084	19%	0.193	C	C	.	.	H	α-helix	trans	-70.8	-48.2	175.8	-178.2	65.5	0	0	0	111.7	V334 V335 D336 N340 G341 I343 L405 K406 L409	V334-L338 PolarHBondContact O-N 2.97Å; V335-L338 PolarHBondContact O-N 2.82Å; D336-L338 VanDerWaalsContact C-N 3.26Å; D336-L338 PolarHBondContact O-N 2.99Å; L338-N340 VanDerWaalsContact C-N 3.32Å; L338-N340 PolarHBondContact O-N 3.46Å; L338-G341 PolarHBondContact O-N 2.92Å; L338-G341 VanDerWaalsContact O-N 3.08Å; L338-I343 HydrophobicContact CB-CG1 4.35Å; L338-I343 HydrophobicContact CD1-CG1 4.35Å; L338-I343 WeakPolarHBondContact CD1-O 3.36Å; L338-L405 HydrophobicContact CD2-CB 3.91Å; L338-L405 HydrophobicContact CD2-CD2 3.86Å; L338-L405 HydrophobicContact CD2-CG 3.65Å; L338-K406 HydrophobicContact CD1-CB 4.5Å; L338-K406 HydrophobicContact CD2-CB 4.07Å; L338-L409 HydrophobicContact CD2-CD1 3.91Å
339	C	90.9	Very high	92.2	Very high	49 Å²	49	27.5 Å²	27.5	33%	0.331	18%	0.183	S	C	.	.	H	α-helix	trans	-62.8	-36.1	-180	-72.7	0	0	0	0	112.9	V335 D336 G341	V335-C339 WeakPolarHBondContact O-CB 3.46Å; V335-C339 PolarHBondContact O-N 3.22Å; V335-C339 PolarHBondContact O-SG 3.08Å; V335-C339 VanDerWaalsContact O-SG 3.33Å; D336-C339 PolarHBondContact O-N 3.47Å; C339-G341 PolarHBondContact O-N 3.47Å
340	N	90	Very high	92.8	Very high	102 Å²	102	25.4 Å²	25.4	55%	0.545	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-0.1	177.4	-65.3	-23.5	0	0	0	113	Y296 D336 L338 V342	Y296-N340 PolarHBondContact OH-ND2 3.45Å; D336-N340 VanDerWaalsContact O-CB 3.23Å; D336-N340 WeakPolarHBondContact O-CB 3.39Å; D336-N340 PolarHBondContact O-N 3.22Å; D336-N340 PolarHBondContact O-ND2 2.9Å; L338-N340 VanDerWaalsContact C-N 3.32Å; L338-N340 PolarHBondContact O-N 3.46Å; N340-V342 VanDerWaalsContact C-N 3.27Å; N340-V342 HydrophobicContact CB-CG2 4.28Å; N340-V342 PolarHBondContact O-N 2.99Å
341	G	88.9	Confident	93.2	Very high	61 Å²	61	24.3 Å²	24.3	63%	0.629	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	71	17.7	179.3	0	0	0	0	0	114.6	L338 C339 I343	L338-G341 PolarHBondContact O-N 2.92Å; L338-G341 VanDerWaalsContact O-N 3.08Å; C339-G341 PolarHBondContact O-N 3.47Å; G341-I343 PolarHBondContact O-N 2.92Å
342	V	88.6	Confident	93.4	Very high	39 Å²	39	24.2 Å²	24.2	24%	0.236	16%	0.156	C	C	.	.	S	Bend	trans	-65.9	-33.2	175.3	176.9	0	0	0	0	110.9	E300 A337 N340	E300-V342 HydrophobicContact CB-CG1 4.39Å; A337-V342 HydrophobicContact CB-CB 4.44Å; A337-V342 WeakPolarHBondContact O-CB 3.38Å; A337-V342 PolarHBondContact O-N 3.33Å; N340-V342 VanDerWaalsContact C-N 3.27Å; N340-V342 HydrophobicContact CB-CG2 4.28Å; N340-V342 PolarHBondContact O-N 2.99Å
343	I	91.7	Very high	93.6	Very high	6 Å²	6	22.7 Å²	22.7	3%	0.031	15%	0.145	C	C	.	.	S	Bend	trans	-133	143.8	176.2	58.8	-167.2	0	0	0	109.6	L303 A337 L338 G341 V346	L303-I343 HydrophobicContact CB-CD1 3.88Å; L303-I343 HydrophobicContact CB-CG2 3.98Å; L303-I343 HydrophobicContact CD1-CD1 3.89Å; L303-I343 HydrophobicContact CD2-CD1 4.49Å; L303-I343 HydrophobicContact CG-CD1 4.31Å; A337-I343 HydrophobicContact CB-CD1 3.97Å; A337-I343 HydrophobicContact CB-CG1 4.38Å; A337-I343 PolarHBondContact O-N 3.43Å; L338-I343 HydrophobicContact CB-CG1 4.35Å; L338-I343 HydrophobicContact CD1-CG1 4.35Å; L338-I343 WeakPolarHBondContact CD1-O 3.36Å; G341-I343 PolarHBondContact O-N 2.92Å; I343-V346 HydrophobicContact CD1-CG2 3.23Å; I343-V346 HydrophobicContact CG1-CG2 4.05Å
344	P	91.8	Very high	93.7	Very high	113 Å²	113	22.2 Å²	22.2	73%	0.734	14%	0.143	S	C	*	.	S	Bend	trans	-77.8	-27.2	-177.2	29.8	-34.9	0	0	0	113.5
345	E	93.4	Very high	93.7	Very high	34 Å²	34	22.3 Å²	22.3	16%	0.159	14%	0.143	C	C	.	.			trans	-159.8	153.8	-174.8	-174.6	57.4	-81.7	0	0	111.7	A221 P222 M347 S404 K406	A221-E345 HydrophobicContact CB-CB 4.12Å; A221-E345 HydrophobicContact CB-CG 4.15Å; P222-E345 WeakPolarHBondContact CD-O 3.28Å; E345-M347 HydrophobicContact CG-SD 4.48Å; E345-S404 PolarHBondContact OE1-OG 3.43Å; E345-S404 VanDerWaalsContact OE1-OG 3.09Å; E345-S404 WeakPolarHBondContact OE2-CB 3.14Å; E345-S404 PolarHBondContact OE2-OG 2.92Å; E345-K406 VanDerWaalsContact OE1-CB 3.31Å; E345-K406 WeakPolarHBondContact OE1-CB 3.3Å; E345-K406 PolarHBondContact OE1-N 3.38Å; E345-K406 WeakPolarHBondContact OE2-CB 3.5Å
346	V	96	Very high	93.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	14%	0.143	C	C	.	.			trans	-139.2	134.2	171.3	-179.4	0	0	0	0	109.7	P222 V224 V334 I343 L405	P222-V346 HydrophobicContact CG-CG2 4.16Å; V224-V346 HydrophobicContact CB-CG1 4.36Å; V224-V346 HydrophobicContact CG2-CG1 3.53Å; V334-V346 HydrophobicContact CG1-CB 4.49Å; V334-V346 HydrophobicContact CG1-CG1 3.94Å; V334-V346 HydrophobicContact CG1-CG2 4.17Å; I343-V346 HydrophobicContact CD1-CG2 3.23Å; I343-V346 HydrophobicContact CG1-CG2 4.05Å; V346-L405 HydrophobicContact CB-CB 4.1Å; V346-L405 HydrophobicContact CB-CD2 4.17Å; V346-L405 HydrophobicContact CG1-CD2 4.49Å; V346-L405 WeakPolarHBondContact O-CB 3.46Å; V346-L405 PolarHBondContact O-N 3.38Å
347	M	96.8	Very high	93.7	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	120.7	174.3	-61.6	-57.6	-68.1	0	0	110.5	L75 A215 Y219 A221 P222 L223 V224 E345 P402 F403	L75-M347 HydrophobicContact CD1-CE 3.79Å; A215-M347 HydrophobicContact CB-CE 4.43Å; Y219-M347 HydrophobicContact CD1-CE 4.44Å; Y219-M347 HydrophobicContact CD1-SD 3.86Å; Y219-M347 HydrophobicContact CE1-CE 4.41Å; Y219-M347 HydrophobicContact CE1-SD 4.25Å; Y219-M347 HydrophobicContact CG-CG 4.47Å; Y219-M347 HydrophobicContact CG-SD 4.13Å; A221-M347 HydrophobicContact CB-CG 4.34Å; P222-M347 PolarHBondContact O-N 3.29Å; L223-M347 CarbonylContact C-O 3.56Å; L223-M347 WeakPolarHBondContact CA-O 3.49Å; L223-M347 HydrophobicContact CD1-CB 4.12Å; L223-M347 HydrophobicContact CG-CB 4.05Å; V224-M347 PolarHBondContact N-O 3.49Å; E345-M347 HydrophobicContact CG-SD 4.48Å; M347-P402 HydrophobicContact CE-CB 3.99Å; M347-F403 CarbonylContact C-O 3.39Å; M347-F403 WeakPolarHBondContact CA-O 3.36Å
348	V	97.7	Very high	93.3	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133	178.3	179.6	0	0	0	0	110	L226 P402 F403 L405 V471	L226-V348 HydrophobicContact CD1-CG1 3.49Å; L226-V348 VanDerWaalsContact CD1-CG1 3.49Å; L226-V348 HydrophobicContact CG-CG1 4.32Å; V348-P402 WeakPolarHBondContact O-CA 3.15Å; V348-F403 HydrophobicContact CB-CD1 4.35Å; V348-F403 HydrophobicContact CB-CD2 4.25Å; V348-F403 HydrophobicContact CB-CE1 3.87Å; V348-F403 HydrophobicContact CB-CE2 3.77Å; V348-F403 HydrophobicContact CB-CZ 3.57Å; V348-F403 HydrophobicContact CG1-CE1 3.78Å; V348-F403 HydrophobicContact CG1-CE2 4.2Å; V348-F403 HydrophobicContact CG1-CZ 3.52Å; V348-F403 HydrophobicContact CG2-CE2 4.18Å; V348-F403 HydrophobicContact CG2-CZ 4.32Å; V348-F403 PolarHBondContact N-O 2.91Å; V348-F403 PolarHBondContact O-N 3.28Å; V348-L405 HydrophobicContact CG2-CB 4.08Å; V348-L405 HydrophobicContact CG2-CD1 4.32Å; V348-V471 HydrophobicContact CG1-CG2 4.03Å
349	V	97.6	Very high	92.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	94.5	-178.9	-170.2	0	0	0	0	110	V212 L223 V224 F225 L226 V351 F399 P402	V212-V349 HydrophobicContact CG2-CG1 4.18Å; L223-V349 HydrophobicContact CD2-CG2 4.18Å; L223-V349 HydrophobicContact CG-CG2 4.32Å; V224-V349 PolarHBondContact O-N 3.42Å; F225-V349 WeakPolarHBondContact CA-O 3.44Å; F225-V349 HydrophobicContact CD1-CB 3.82Å; F225-V349 HydrophobicContact CD1-CG1 3.89Å; F225-V349 HydrophobicContact CD1-CG2 4.36Å; F225-V349 HydrophobicContact CE1-CB 4.12Å; F225-V349 HydrophobicContact CE1-CG1 4.02Å; F225-V349 HydrophobicContact CE1-CG2 4.24Å; L226-V349 PolarHBondContact N-O 2.82Å; V349-V351 HydrophobicContact CG1-CG2 4.21Å; V349-F399 HydrophobicContact CG1-CD1 4.32Å; V349-P402 HydrophobicContact CG2-CB 3.93Å; V349-P402 HydrophobicContact CG2-CG 3.94Å
350	P	97.4	Very high	91.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	139.4	167	-13.1	20.6	0	0	0	111.1	T400 F403 V471 T474 A475	P350-T400 WeakPolarHBondContact CA-OG1 3.03Å; P350-T400 HydrophobicContact CB-CG2 4.1Å; P350-T400 WeakPolarHBondContact CB-OG1 3.43Å; P350-T400 WeakPolarHBondContact CD-OG1 3.42Å; P350-T400 WeakPolarHBondContact CG-OG1 3.17Å; P350-T400 WeakPolarHBondContact O-CB 3.47Å; P350-T400 WeakPolarHBondContact O-CG2 3.38Å; P350-T400 PolarHBondContact O-N 3.3Å; P350-T400 PolarHBondContact O-OG1 3.38Å; P350-F403 HydrophobicContact CG-CE1 3.92Å; P350-V471 HydrophobicContact CB-CG1 3.98Å; P350-V471 HydrophobicContact CG-CG1 4.13Å; P350-V471 HydrophobicContact CG-CG2 4.41Å; P350-T474 HydrophobicContact CG-CG2 4.41Å; P350-A475 HydrophobicContact CB-CB 3.99Å
351	V	97.3	Very high	90	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	120.8	-178.5	-175.8	0	0	0	0	111.2	F225 L226 P227 V228 I238 V349 I353 V397 D398 F399	F225-V351 HydrophobicContact CD1-CG2 4.13Å; L226-V351 PolarHBondContact O-N 3.36Å; L226-V351 VanDerWaalsContact O-N 3.13Å; P227-V351 VanDerWaalsContact CA-O 3.3Å; P227-V351 WeakPolarHBondContact CA-O 3.43Å; P227-V351 HydrophobicContact CB-CB 4.03Å; V228-V351 PolarHBondContact N-O 2.82Å; V228-V351 VanDerWaalsContact N-O 3.11Å; I238-V351 HydrophobicContact CD1-CB 4.49Å; I238-V351 HydrophobicContact CD1-CG1 4.19Å; V349-V351 HydrophobicContact CG1-CG2 4.21Å; V351-I353 HydrophobicContact CG1-CG1 4.34Å; V351-V397 HydrophobicContact CG1-CG1 3.77Å; V351-D398 WeakPolarHBondContact CA-O 3.15Å; V351-F399 HydrophobicContact CG1-CD1 4.33Å; V351-F399 HydrophobicContact CG1-CE1 4.37Å; V351-F399 HydrophobicContact CG2-CD1 3.78Å; V351-F399 HydrophobicContact CG2-CE1 4.1Å
352	G	95.9	Very high	88.6	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	141.1	171.4	0	0	0	0	0	111.6	V397 D398 A475 S479	G352-V397 WeakPolarHBondContact O-CA 3.45Å; G352-D398 PolarHBondContact N-O 3.37Å; G352-D398 PolarHBondContact O-N 3.32Å; G352-A475 VanDerWaalsContact CA-O 3.26Å; G352-A475 WeakPolarHBondContact CA-O 3.31Å; G352-S479 WeakPolarHBondContact CA-OG 3.49Å
353	I	95.3	Very high	87.6	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	130.7	176.1	-51.9	177.3	0	0	0	109	P227 V228 K230 D234 L237 I238 V351 Y355 V395 R396 V397 S479	P227-I353 HydrophobicContact CB-CD1 4.25Å; V228-I353 HydrophobicContact CG2-CB 4.25Å; K230-I353 WeakPolarHBondContact CD-O 3.48Å; K230-I353 WeakPolarHBondContact CE-O 3.45Å; K230-I353 PolarHBondContact NZ-O 3.27Å; D234-I353 HydrophobicContact CB-CD1 4.13Å; L237-I353 HydrophobicContact CD2-CG2 4.11Å; I238-I353 HydrophobicContact CD1-CD1 4.34Å; V351-I353 HydrophobicContact CG1-CG1 4.34Å; I353-Y355 HydrophobicContact CB-CE2 4.49Å; I353-Y355 HydrophobicContact CG2-CD2 4.12Å; I353-Y355 HydrophobicContact CG2-CE2 3.36Å; I353-V395 HydrophobicContact CG2-CG1 4.37Å; I353-R396 WeakPolarHBondContact CA-O 3.44Å; I353-V397 HydrophobicContact CG1-CG1 4.48Å; I353-V397 HydrophobicContact CG2-CG2 4.36Å; I353-S479 PolarHBondContact N-OG 3.17Å
354	S	94.9	Very high	86.6	Confident	2 Å²	2	18.9 Å²	18.9	1%	0.014	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	143	178	-74.4	0	0	0	0	111.7	V395 R396 A480	S354-V395 WeakPolarHBondContact O-CA 3.3Å; S354-R396 PolarHBondContact N-O 3.13Å; S354-R396 PolarHBondContact O-N 3.06Å; S354-A480 WeakPolarHBondContact CB-O 3.33Å; S354-A480 PolarHBondContact OG-O 3.39Å
355	Y	94.3	Very high	85.5	Confident	4 Å²	4	15.2 Å²	15.2	2%	0.016	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	135.9	-176.2	-66.7	-87.1	0	0	0	109.3	F199 K230 I233 D234 L237 I353 R357 I358 L359 V395	F199-Y355 HydrophobicContact CE1-CD1 4.42Å; F199-Y355 HydrophobicContact CZ-CD1 4.39Å; F199-Y355 HydrophobicContact CZ-CE1 4.13Å; K230-Y355 HydrophobicContact CB-CD2 4.26Å; K230-Y355 HydrophobicContact CB-CE2 4.17Å; I233-Y355 HydrophobicContact CG2-CE1 4.03Å; I233-Y355 WeakPolarHBondContact CG2-OH 3.38Å; D234-Y355 WeakPolarHBondContact OD1-CE2 3.44Å; D234-Y355 PolarHBondContact OD1-OH 3.06Å; L237-Y355 WeakPolarHBondContact CD2-OH 3.34Å; I353-Y355 HydrophobicContact CB-CE2 4.49Å; I353-Y355 HydrophobicContact CG2-CD2 4.12Å; I353-Y355 HydrophobicContact CG2-CE2 3.36Å; Y355-R357 VanDerWaalsContact C-N 3.33Å; Y355-I358 HydrophobicContact CD2-CG2 4.26Å; Y355-I358 HydrophobicContact CG-CG2 4.28Å; Y355-L359 HydrophobicContact CD1-CD1 4.46Å; Y355-L359 HydrophobicContact CE1-CD1 4.32Å; Y355-V395 HydrophobicContact CD1-CB 4.27Å; Y355-V395 HydrophobicContact CD1-CG1 3.85Å; Y355-V395 HydrophobicContact CD1-CG2 3.6Å; Y355-V395 HydrophobicContact CE1-CB 4.26Å; Y355-V395 HydrophobicContact CE1-CG1 3.54Å; Y355-V395 HydrophobicContact CE1-CG2 3.68Å
356	D	93.1	Very high	84.6	Confident	2 Å²	2	14.2 Å²	14.2	1%	0.011	9%	0.09	C	C	.	.	S	Bend	trans	-63.9	-45.2	165.9	-78.6	-44	0	0	0	109.9	C394 M482 S483 T484 H534 L538 Y571	D356-C394 PolarHBondContact N-O 3.16Å; D356-C394 WeakPolarHBondContact OD2-CA 3.5Å; D356-C394 VanDerWaalsContact OD2-CB 3.32Å; D356-C394 WeakPolarHBondContact OD2-CB 3.39Å; D356-C394 PolarHBondContact OD2-N 3.45Å; D356-M482 HydrophobicContact CB-CE 4.38Å; D356-M482 WeakPolarHBondContact OD1-CB 3.33Å; D356-M482 WeakPolarHBondContact OD1-CE 3.49Å; D356-S483 PolarHBondContact OD1-N 2.99Å; D356-S483 PolarHBondContact OD1-OG 3.42Å; D356-T484 HydrophobicContact CB-CG2 4.27Å; D356-T484 WeakPolarHBondContact O-CB 3.45Å; D356-T484 VanDerWaalsContact O-CG2 3.25Å; D356-T484 WeakPolarHBondContact O-CG2 3.32Å; D356-T484 PolarHBondContact O-OG1 2.73Å; D356-H534 IonicContact OD2-NE2 3.89Å; D356-L538 HydrophobicContact CB-CD1 3.54Å; D356-Y571 VanDerWaalsContact O-CE1 3.31Å; D356-Y571 WeakPolarHBondContact O-CE1 3.39Å
357	R	90.4	Very high	83.7	Confident	33 Å²	33	14.3 Å²	14.3	13%	0.125	9%	0.09	C	C	.	.	S	Bend	trans	-138.2	128.4	174.8	-164.4	-177.7	-174	156.6	13.5	111.3	Y355 Y392 L538 E567 Y571	Y355-R357 VanDerWaalsContact C-N 3.33Å; R357-Y392 HydrophobicContact CB-CD1 4.22Å; R357-Y392 HydrophobicContact CG-CD1 4.12Å; R357-Y392 PolarHBondContact N-O 3.26Å; R357-L538 PolarHBondContact NH1-O 3.36Å; R357-E567 IonicContact NH2-OE1 3.9Å; R357-Y571 WeakPolarHBondContact CA-OH 3.34Å; R357-Y571 VanDerWaalsContact CG-OH 3.29Å; R357-Y571 WeakPolarHBondContact CG-OH 3.32Å
358	I	85.4	Confident	82.9	Confident	8 Å²	8	16.4 Å²	16.4	4%	0.041	10%	0.101	C	C	.	.			trans	-73.7	146.5	173	56.3	161.9	0	0	0	110.9	Y355 E360 Y363 F570 Y571	Y355-I358 HydrophobicContact CD2-CG2 4.26Å; Y355-I358 HydrophobicContact CG-CG2 4.28Å; I358-E360 VanDerWaalsContact C-N 3.29Å; I358-E360 PolarHBondContact O-N 2.98Å; I358-Y363 HydrophobicContact CD1-CD1 3.33Å; I358-Y363 HydrophobicContact CD1-CE1 3.46Å; I358-Y363 VanDerWaalsContact CD1-CE1 3.46Å; I358-Y363 HydrophobicContact CD1-CG 4Å; I358-Y363 HydrophobicContact CG1-CD1 4.34Å; I358-Y363 HydrophobicContact CG1-CE1 4.03Å; I358-F570 HydrophobicContact CD1-CD1 4.31Å; I358-F570 HydrophobicContact CD1-CE1 3.68Å; I358-F570 HydrophobicContact CD1-CE2 4.16Å; I358-F570 HydrophobicContact CD1-CZ 3.61Å; I358-F570 HydrophobicContact CG1-CE1 3.96Å; I358-F570 HydrophobicContact CG1-CZ 4.3Å; I358-F570 HydrophobicContact CG2-CE1 3.83Å; I358-F570 HydrophobicContact CG2-CZ 3.97Å; I358-Y571 PolarHBondContact N-OH 3.23Å; I358-Y571 VanDerWaalsContact N-OH 3.11Å
359	L	73.9	Confident	81.6	Confident	18 Å²	18	17.8 Å²	17.8	9%	0.094	12%	0.116	C	C	.	.	S	Bend	trans	-77.1	-21.7	-172.5	-55.2	77.5	0	0	0	112.7	F198 F199 I233 Y355 M387 Y392	F198-L359 HydrophobicContact CD2-CD2 4.06Å; F198-L359 HydrophobicContact CE2-CD2 3.34Å; F198-L359 HydrophobicContact CE2-CG 4.45Å; F198-L359 HydrophobicContact CZ-CD2 3.79Å; F199-L359 HydrophobicContact CE1-CD1 4.14Å; F199-L359 HydrophobicContact CE1-CG 4.43Å; F199-L359 HydrophobicContact CZ-CD1 3.79Å; F199-L359 HydrophobicContact CZ-CD2 4.02Å; F199-L359 HydrophobicContact CZ-CG 4.23Å; I233-L359 HydrophobicContact CD1-CD2 3.77Å; I233-L359 HydrophobicContact CG2-CD1 4.02Å; Y355-L359 HydrophobicContact CD1-CD1 4.46Å; Y355-L359 HydrophobicContact CE1-CD1 4.32Å; L359-M387 HydrophobicContact CB-CE 3.87Å; L359-M387 HydrophobicContact CD2-CE 3.16Å; L359-M387 HydrophobicContact CG-CE 4.08Å; L359-Y392 HydrophobicContact CB-CD1 4.41Å; L359-Y392 HydrophobicContact CB-CE1 4.23Å; L359-Y392 HydrophobicContact CG-CD1 4.23Å; L359-Y392 HydrophobicContact CG-CE1 4.48Å; L359-Y392 HydrophobicContact CG-CG 4.33Å
360	E	69.9	Low	80.5	Confident	23 Å²	23	23.8 Å²	23.8	11%	0.107	14%	0.142	C	C	.	.			trans	-89.7	120.8	-167.7	-61	172.5	159.8	0	0	110	H232 R317 I358 N362 Y363	H232-E360 WeakPolarHBondContact CA-OE1 3.46Å; H232-E360 WeakPolarHBondContact CB-OE1 3.29Å; H232-E360 IonicContact CD2-OE1 3.53Å; H232-E360 PolarHBondContact CD2-OE1 2.84Å; H232-E360 IonicContact CG-OE1 3.31Å; H232-E360 PolarHBondContact N-OE1 3.38Å; H232-E360 IonicContact ND1-OE1 2.91Å; H232-E360 IonicContact NE2-OE1 3.98Å; R317-E360 WeakPolarHBondContact CD-OE2 3.39Å; R317-E360 IonicContact CZ-OE2 2.84Å; R317-E360 IonicContact NE-OE2 3.3Å; R317-E360 IonicContact NH1-OE1 2.65Å; R317-E360 PolarHBondContact NH1-OE1 2.67Å; R317-E360 VanDerWaalsContact NH1-OE1 3.15Å; R317-E360 IonicContact NH1-OE2 3.96Å; R317-E360 PolarHBondContact NH1-OE2 2.69Å; I358-E360 VanDerWaalsContact C-N 3.29Å; I358-E360 PolarHBondContact O-N 2.98Å; E360-N362 VanDerWaalsContact C-N 3.33Å; E360-Y363 WeakPolarHBondContact O-CD1 3.4Å; E360-Y363 WeakPolarHBondContact O-CE1 3.43Å
361	G	58.8	Low	79	Confident	66 Å²	66	28.9 Å²	28.9	68%	0.68	18%	0.176	S	C	*	.	S	Bend	trans	-84.8	-1.5	177.8	0	0	0	0	0	115
362	N	60.1	Low	77.4	Confident	65 Å²	65	32.4 Å²	32.4	35%	0.348	19%	0.191	S	C	.	.			trans	-92.7	-11.2	-168.7	-74.9	-9.3	0	0	0	114.4	E360 N364 S365 E366	E360-N362 VanDerWaalsContact C-N 3.33Å; N362-N364 VanDerWaalsContact C-N 3.34Å; N362-N364 PolarHBondContact O-N 3.12Å; N362-S365 PolarHBondContact O-N 2.77Å; N362-S365 VanDerWaalsContact O-N 3.08Å; N362-S365 PolarHBondContact O-OG 2.94Å; N362-E366 PolarHBondContact O-N 2.96Å; N362-E366 VanDerWaalsContact O-N 3.09Å
363	Y	67.4	Low	75.8	Confident	8 Å²	8	40.4 Å²	40.4	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-37.8	-176.5	66.5	-85.4	0	0	0	112.2	I358 E360 S365 E366 Q367 E567 F570	I358-Y363 HydrophobicContact CD1-CD1 3.33Å; I358-Y363 HydrophobicContact CD1-CE1 3.46Å; I358-Y363 VanDerWaalsContact CD1-CE1 3.46Å; I358-Y363 HydrophobicContact CD1-CG 4Å; I358-Y363 HydrophobicContact CG1-CD1 4.34Å; I358-Y363 HydrophobicContact CG1-CE1 4.03Å; E360-Y363 WeakPolarHBondContact O-CD1 3.4Å; E360-Y363 WeakPolarHBondContact O-CE1 3.43Å; Y363-S365 VanDerWaalsContact C-N 3.27Å; Y363-S365 PolarHBondContact O-N 3.28Å; Y363-E366 CarbonylContact O-C 3.57Å; Y363-E366 PolarHBondContact O-N 2.77Å; Y363-E366 VanDerWaalsContact O-N 3.1Å; Y363-Q367 WeakPolarHBondContact O-CG 3.32Å; Y363-Q367 PolarHBondContact O-N 3.03Å; Y363-E567 HydrophobicContact CE2-CB 4.19Å; Y363-E567 VanDerWaalsContact OH-CB 3.26Å; Y363-E567 WeakPolarHBondContact OH-CB 3.43Å; Y363-E567 WeakPolarHBondContact OH-CG 3.38Å; Y363-E567 PolarHBondContact OH-OE1 3.43Å; Y363-E567 VanDerWaalsContact OH-OE1 3.05Å; Y363-E567 PolarHBondContact OH-OE2 3.18Å; Y363-F570 HydrophobicContact CD2-CD2 4.41Å; Y363-F570 HydrophobicContact CE2-CB 4.32Å; Y363-F570 HydrophobicContact CE2-CG 4.44Å
364	N	70.6	Confident	74.2	Confident	20 Å²	20	46.6 Å²	46.6	11%	0.107	26%	0.259	C	S	.	.	H	α-helix	trans	-57.9	-41.2	173.2	-81	-15.1	0	0	0	111.6	N362 E366 Q367 L368 P563	N362-N364 VanDerWaalsContact C-N 3.34Å; N362-N364 PolarHBondContact O-N 3.12Å; N364-E366 VanDerWaalsContact C-N 3.35Å; N364-E366 PolarHBondContact O-N 3.06Å; N364-Q367 PolarHBondContact O-N 3.37Å; N364-L368 WeakPolarHBondContact O-CB 3.02Å; N364-L368 VanDerWaalsContact O-CG 3.24Å; N364-L368 WeakPolarHBondContact O-CG 3.32Å; N364-L368 PolarHBondContact O-N 3.26Å; N364-P563 PolarHBondContact ND2-O 3.02Å; N364-P563 VanDerWaalsContact ND2-O 3.16Å; N364-P563 PolarHBondContact OD1-O 2.67Å
365	S	69.7	Low	72.8	Confident	36 Å²	36	50.3 Å²	50.3	25%	0.252	28%	0.276	S	S	.	.	H	α-helix	trans	-67.2	-35.6	177.4	75.9	0	0	0	0	112.7	N362 Y363 L368 K370	N362-S365 PolarHBondContact O-N 2.77Å; N362-S365 VanDerWaalsContact O-N 3.08Å; N362-S365 PolarHBondContact O-OG 2.94Å; Y363-S365 VanDerWaalsContact C-N 3.27Å; Y363-S365 PolarHBondContact O-N 3.28Å; S365-L368 WeakPolarHBondContact O-CB 3.48Å; S365-L368 PolarHBondContact O-N 3.12Å; S365-K370 VanDerWaalsContact O-CB 3.24Å; S365-K370 WeakPolarHBondContact O-CB 2.97Å; S365-K370 PolarHBondContact O-N 2.77Å; S365-K370 VanDerWaalsContact O-N 3.09Å
366	E	74.3	Confident	71.7	Confident	12 Å²	12	53.5 Å²	53.5	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-72.8	-37	175.6	-67.1	-174.7	-160.2	0	0	112.1	R317 R319 N362 Y363 N364 L368 G369	R317-E366 IonicContact CZ-OE1 2.83Å; R317-E366 IonicContact NH2-OE1 3.45Å; R317-E366 PolarHBondContact NH2-OE1 2.66Å; R317-E366 IonicContact NH2-OE2 2.83Å; R319-E366 IonicContact CZ-OE2 2.64Å; R319-E366 VanDerWaalsContact CZ-OE2 3.23Å; R319-E366 IonicContact NE-OE2 3.74Å; R319-E366 PolarHBondContact NE-OE2 3.05Å; R319-E366 IonicContact NH2-OE2 3.62Å; R319-E366 PolarHBondContact NH2-OE2 3.17Å; N362-E366 PolarHBondContact O-N 2.96Å; N362-E366 VanDerWaalsContact O-N 3.09Å; Y363-E366 CarbonylContact O-C 3.57Å; Y363-E366 PolarHBondContact O-N 2.77Å; Y363-E366 VanDerWaalsContact O-N 3.1Å; N364-E366 VanDerWaalsContact C-N 3.35Å; N364-E366 PolarHBondContact O-N 3.06Å; E366-L368 PolarHBondContact O-N 2.73Å; E366-G369 PolarHBondContact O-N 2.9Å
367	Q	77.1	Confident	70.6	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.009	32%	0.316	C	S	.	.	H	α-helix	trans	-67.2	-24.8	171.7	-75.1	-163.6	-13	0	0	112.3	R319 Y363 N364 G369 F566 F757 H777	R319-Q367 PolarHBondContact O-NE2 3.21Å; Y363-Q367 WeakPolarHBondContact O-CG 3.32Å; Y363-Q367 PolarHBondContact O-N 3.03Å; N364-Q367 PolarHBondContact O-N 3.37Å; Q367-G369 PolarHBondContact O-N 2.83Å; Q367-F566 HydrophobicContact CB-CD2 3.7Å; Q367-F566 HydrophobicContact CB-CE2 4.08Å; Q367-F566 VanDerWaalsContact OE1-CD2 3.3Å; Q367-F566 VanDerWaalsContact OE1-CG 3.31Å; Q367-F757 WeakPolarHBondContact O-CE2 3.41Å; Q367-H777 WeakPolarHBondContact O-CB 3.24Å; Q367-H777 PolarHBondContact O-N 3.01Å; Q367-H777 VanDerWaalsContact O-N 3.1Å
368	L	79.7	Confident	69.9	Low	44 Å²	44	64.9 Å²	64.9	23%	0.23	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	8.7	168.4	-70.3	169.2	0	0	0	113.3	N364 S365 E366 K370 V562 F566 F757	N364-L368 WeakPolarHBondContact O-CB 3.02Å; N364-L368 VanDerWaalsContact O-CG 3.24Å; N364-L368 WeakPolarHBondContact O-CG 3.32Å; N364-L368 PolarHBondContact O-N 3.26Å; S365-L368 WeakPolarHBondContact O-CB 3.48Å; S365-L368 PolarHBondContact O-N 3.12Å; E366-L368 PolarHBondContact O-N 2.73Å; L368-K370 PolarHBondContact O-N 3.01Å; L368-V562 HydrophobicContact CD2-CG1 4.07Å; L368-F566 HydrophobicContact CD2-CE2 3.97Å; L368-F566 HydrophobicContact CG-CE2 4.37Å; L368-F757 VanDerWaalsContact O-CE1 3.27Å; L368-F757 WeakPolarHBondContact O-CE1 3.49Å; L368-F757 WeakPolarHBondContact O-CZ 3.28Å
369	G	70.6	Confident	69.4	Low	31 Å²	31	66.1 Å²	66.1	32%	0.32	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	9	178	0	0	0	0	0	114.5	E366 Q367	E366-G369 PolarHBondContact O-N 2.9Å; Q367-G369 PolarHBondContact O-N 2.83Å
370	K	73.8	Confident	69.3	Low	125 Å²	125	67.9 Å²	67.9	54%	0.543	37%	0.373	S	S	.	.			trans	-68.6	140.2	175.8	-61.2	-178.8	178.6	174.8	0	109.2	S365 L368	S365-K370 VanDerWaalsContact O-CB 3.24Å; S365-K370 WeakPolarHBondContact O-CB 2.97Å; S365-K370 PolarHBondContact O-N 2.77Å; S365-K370 VanDerWaalsContact O-N 3.09Å; L368-K370 PolarHBondContact O-N 3.01Å
371	P	66.4	Low	69.6	Low	108 Å²	108	69 Å²	69	70%	0.701	39%	0.386	S	S	*	.			trans	-61	145.9	-180	25.8	-34.1	0	0	0	110.2	K373	P371-K373 PolarHBondContact O-N 2.81Å
372	K	64.8	Low	70.5	Confident	74 Å²	74	67.8 Å²	67.8	32%	0.322	37%	0.367	S	S	.	.			trans	-58.6	115.5	176	-174.5	-179.3	-179.7	-177.7	0	108.7
373	K	62.3	Low	71.2	Confident	167 Å²	167	65.6 Å²	65.6	73%	0.726	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-81.9	128.5	171.1	-66	-173.7	178.8	-175.7	0	108.5	P371 E375	P371-K373 PolarHBondContact O-N 2.81Å; K373-E375 PolarHBondContact O-N 3.2Å
374	N	61.3	Low	71.6	Confident	131 Å²	131	67.6 Å²	67.6	70%	0.701	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-66.4	131.8	168.7	-66.8	-24.1	0	0	0	108.3
375	E	64.8	Low	72.1	Confident	80 Å²	80	71.3 Å²	71.3	37%	0.374	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-73.6	129.3	178.7	-62.3	-175.5	177.6	0	0	109.3	I260 K373 V380	I260-E375 WeakPolarHBondContact CD1-O 3.36Å; K373-E375 PolarHBondContact O-N 3.2Å; E375-V380 HydrophobicContact CB-CG2 3.93Å
376	S	71.5	Confident	72.6	Confident	70 Å²	70	77.1 Å²	77.1	49%	0.49	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-78.8	153.4	172.6	67.5	0	0	0	0	110.1	W378 G379 V380	S376-W378 PolarHBondContact O-N 3.37Å; S376-G379 CarbonylContact O-C 3.55Å; S376-G379 WeakPolarHBondContact O-CA 3.38Å; S376-G379 PolarHBondContact O-N 2.81Å; S376-G379 PolarHBondContact OG-N 3.49Å; S376-G379 VanDerWaalsContact OG-N 3.07Å; S376-V380 WeakPolarHBondContact O-CG2 3.34Å; S376-V380 PolarHBondContact O-N 3.38Å
377	L	70.6	Confident	72.7	Confident	71 Å²	71	78.2 Å²	78.2	37%	0.372	41%	0.414	S	S	.	.	H	α-helix	trans	-54.6	-40	176.8	-72.2	172.2	0	0	0	112.5	I260 I262 V380 A381	I260-L377 HydrophobicContact CG2-CD1 4.32Å; I260-L377 HydrophobicContact CG2-CD2 3.45Å; I260-L377 VanDerWaalsContact CG2-CD2 3.45Å; I260-L377 HydrophobicContact CG2-CG 3.69Å; I262-L377 HydrophobicContact CB-CD2 3.9Å; I262-L377 HydrophobicContact CD1-CD1 3.77Å; I262-L377 HydrophobicContact CD1-CD2 4.02Å; I262-L377 HydrophobicContact CD1-CG 4.44Å; I262-L377 HydrophobicContact CG1-CD1 3.99Å; I262-L377 HydrophobicContact CG1-CD2 4.09Å; L377-V380 PolarHBondContact O-N 2.87Å; L377-A381 PolarHBondContact O-N 2.94Å
378	W	74.8	Confident	72.9	Confident	203 Å²	203	81.6 Å²	81.6	77%	0.769	43%	0.432	S	S	*	.	H	α-helix	trans	-64.8	-42.3	173.6	-175.2	-105.2	0	0	0	112	S376 V380 A381 C382	S376-W378 PolarHBondContact O-N 3.37Å; W378-V380 VanDerWaalsContact C-N 3.33Å; W378-V380 PolarHBondContact O-N 2.95Å; W378-A381 PolarHBondContact O-N 2.87Å; W378-C382 VanDerWaalsContact CE2-SG 3.58Å; W378-C382 PolarHBondContact NE1-SG 3.38Å; W378-C382 WeakPolarHBondContact O-CB 3.43Å; W378-C382 PolarHBondContact O-N 3.47Å; W378-C382 PolarHBondContact O-SG 3.01Å; W378-C382 VanDerWaalsContact O-SG 3.39Å
379	G	74.5	Confident	72.9	Confident	35 Å²	35	89.7 Å²	89.7	36%	0.361	46%	0.459	S	S	.	.	H	α-helix	trans	-58.6	-42.3	173.9	0	0	0	0	0	112.7	S376 G383	S376-G379 CarbonylContact O-C 3.55Å; S376-G379 WeakPolarHBondContact O-CA 3.38Å; S376-G379 PolarHBondContact O-N 2.81Å; S376-G379 PolarHBondContact OG-N 3.49Å; S376-G379 VanDerWaalsContact OG-N 3.07Å; G379-G383 WeakPolarHBondContact O-CA 3.46Å; G379-G383 PolarHBondContact O-N 2.85Å
380	V	73.1	Confident	73.5	Confident	54 Å²	54	92.3 Å²	92.3	33%	0.327	46%	0.462	S	S	.	.	H	α-helix	trans	-65.1	-47.6	175.1	176	0	0	0	0	110.9	E375 S376 L377 W378 G383 V384	E375-V380 HydrophobicContact CB-CG2 3.93Å; S376-V380 WeakPolarHBondContact O-CG2 3.34Å; S376-V380 PolarHBondContact O-N 3.38Å; L377-V380 PolarHBondContact O-N 2.87Å; W378-V380 VanDerWaalsContact C-N 3.33Å; W378-V380 PolarHBondContact O-N 2.95Å; V380-G383 CarbonylContact O-C 3.59Å; V380-G383 WeakPolarHBondContact O-CA 3.45Å; V380-G383 PolarHBondContact O-N 3.38Å; V380-G383 VanDerWaalsContact O-N 3.08Å; V380-V384 HydrophobicContact CG1-CG2 4.47Å; V380-V384 WeakPolarHBondContact O-CG2 3.2Å; V380-V384 PolarHBondContact O-N 2.95Å
381	A	76.4	Confident	74	Confident	47 Å²	47	89.1 Å²	89.1	39%	0.388	45%	0.45	S	S	.	.	H	α-helix	trans	-61.8	-46.6	179.7	0	0	0	0	0	112.3	L377 W378 G383 V384 L385	L377-A381 PolarHBondContact O-N 2.94Å; W378-A381 PolarHBondContact O-N 2.87Å; A381-G383 VanDerWaalsContact C-N 3.26Å; A381-G383 PolarHBondContact O-N 3.21Å; A381-V384 PolarHBondContact O-N 2.89Å; A381-L385 PolarHBondContact O-N 3.2Å
382	C	76.6	Confident	75.1	Confident	40 Å²	40	84.6 Å²	84.6	27%	0.27	42%	0.419	S	S	.	.	H	α-helix	trans	-62.5	-35.6	172.1	-69.4	0	0	0	0	112	W378 R386	W378-C382 VanDerWaalsContact CE2-SG 3.58Å; W378-C382 PolarHBondContact NE1-SG 3.38Å; W378-C382 WeakPolarHBondContact O-CB 3.43Å; W378-C382 PolarHBondContact O-N 3.47Å; W378-C382 PolarHBondContact O-SG 3.01Å; W378-C382 VanDerWaalsContact O-SG 3.39Å; C382-R386 WeakPolarHBondContact O-CB 3.38Å; C382-R386 PolarHBondContact O-N 3.11Å
383	G	75.4	Confident	76.4	Confident	19 Å²	19	81.1 Å²	81.1	20%	0.196	40%	0.404	C	S	.	.	H	α-helix	trans	-57.6	-55.8	172.5	0	0	0	0	0	111.3	G379 V380 A381 L385 R386 M387	G379-G383 WeakPolarHBondContact O-CA 3.46Å; G379-G383 PolarHBondContact O-N 2.85Å; V380-G383 CarbonylContact O-C 3.59Å; V380-G383 WeakPolarHBondContact O-CA 3.45Å; V380-G383 PolarHBondContact O-N 3.38Å; V380-G383 VanDerWaalsContact O-N 3.08Å; A381-G383 VanDerWaalsContact C-N 3.26Å; A381-G383 PolarHBondContact O-N 3.21Å; G383-L385 VanDerWaalsContact C-N 3.34Å; G383-L385 PolarHBondContact O-N 2.91Å; G383-R386 CarbonylContact O-C 3.54Å; G383-R386 WeakPolarHBondContact O-CA 3.12Å; G383-R386 WeakPolarHBondContact O-CB 3.47Å; G383-R386 PolarHBondContact O-N 3.04Å; G383-M387 WeakPolarHBondContact O-CB 3.41Å; G383-M387 WeakPolarHBondContact O-CG 3.36Å; G383-M387 PolarHBondContact O-N 3.13Å
384	V	76.4	Confident	77.9	Confident	50 Å²	50	73.8 Å²	73.8	30%	0.303	37%	0.374	S	S	.	.	H	α-helix	trans	-57.6	-44.6	178.2	174	0	0	0	0	111.6	L194 V380 A381 R386 M387 L388	L194-V384 HydrophobicContact CD2-CG1 4.07Å; V380-V384 HydrophobicContact CG1-CG2 4.47Å; V380-V384 WeakPolarHBondContact O-CG2 3.2Å; V380-V384 PolarHBondContact O-N 2.95Å; A381-V384 PolarHBondContact O-N 2.89Å; V384-R386 VanDerWaalsContact C-N 3.32Å; V384-R386 PolarHBondContact O-N 2.79Å; V384-M387 WeakPolarHBondContact O-CB 3.21Å; V384-M387 PolarHBondContact O-N 3.09Å; V384-M387 VanDerWaalsContact O-N 3.16Å; V384-L388 HydrophobicContact CG1-CD1 4.24Å; V384-L388 WeakPolarHBondContact O-CG 3.4Å; V384-L388 PolarHBondContact O-N 3.05Å
385	L	80.3	Confident	79.5	Confident	99 Å²	99	67.6 Å²	67.6	52%	0.518	34%	0.341	S	S	.	.	H	α-helix	trans	-61	-40.1	175.3	-81.1	161.7	0	0	0	112.5	A381 G383 M387 R389	A381-L385 PolarHBondContact O-N 3.2Å; G383-L385 VanDerWaalsContact C-N 3.34Å; G383-L385 PolarHBondContact O-N 2.91Å; L385-M387 VanDerWaalsContact C-N 3.34Å; L385-R389 WeakPolarHBondContact O-CG 3.17Å
386	R	79.3	Confident	81	Confident	158 Å²	158	63.8 Å²	63.8	60%	0.596	32%	0.323	S	S	*	.	H	α-helix	trans	-68.6	-36.1	175	-171.8	-175.3	-60.2	156.7	1.9	111.4	C382 G383 V384 R389	C382-R386 WeakPolarHBondContact O-CB 3.38Å; C382-R386 PolarHBondContact O-N 3.11Å; G383-R386 CarbonylContact O-C 3.54Å; G383-R386 WeakPolarHBondContact O-CA 3.12Å; G383-R386 WeakPolarHBondContact O-CB 3.47Å; G383-R386 PolarHBondContact O-N 3.04Å; V384-R386 VanDerWaalsContact C-N 3.32Å; V384-R386 PolarHBondContact O-N 2.79Å; R386-R389 PolarHBondContact O-N 3.13Å
387	M	78.2	Confident	82.2	Confident	35 Å²	35	60.5 Å²	60.5	17%	0.172	30%	0.3	C	S	.	.	H	α-helix	trans	-66.4	-43.5	178.4	-67.3	157.9	67.8	0	0	111.2	F198 L359 G383 V384 L385 R389 K390 Y392	F198-M387 VanDerWaalsContact CB-O 3.28Å; F198-M387 WeakPolarHBondContact CB-O 3.49Å; F198-M387 HydrophobicContact CD1-CB 4.48Å; F198-M387 HydrophobicContact CE1-CE 4.41Å; F198-M387 HydrophobicContact CZ-CE 4.28Å; L359-M387 HydrophobicContact CB-CE 3.87Å; L359-M387 HydrophobicContact CD2-CE 3.16Å; L359-M387 HydrophobicContact CG-CE 4.08Å; G383-M387 WeakPolarHBondContact O-CB 3.41Å; G383-M387 WeakPolarHBondContact O-CG 3.36Å; G383-M387 PolarHBondContact O-N 3.13Å; V384-M387 WeakPolarHBondContact O-CB 3.21Å; V384-M387 PolarHBondContact O-N 3.09Å; V384-M387 VanDerWaalsContact O-N 3.16Å; L385-M387 VanDerWaalsContact C-N 3.34Å; M387-R389 PolarHBondContact O-N 3.3Å; M387-R389 VanDerWaalsContact O-N 3.08Å; M387-K390 PolarHBondContact O-N 2.63Å; M387-Y392 HydrophobicContact CB-CE2 3.94Å; M387-Y392 HydrophobicContact CG-CE2 4.15Å; M387-Y392 WeakPolarHBondContact CG-OH 3.35Å
388	L	80.8	Confident	83.4	Confident	73 Å²	73	57.1 Å²	57.1	38%	0.382	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.1	175	-70.3	169.4	0	0	0	114.1	L194 F198 V384	L194-L388 HydrophobicContact CD2-CD1 4.19Å; L194-L388 HydrophobicContact CD2-CD2 4.16Å; F198-L388 HydrophobicContact CD1-CD2 4.08Å; V384-L388 HydrophobicContact CG1-CD1 4.24Å; V384-L388 WeakPolarHBondContact O-CG 3.4Å; V384-L388 PolarHBondContact O-N 3.05Å
389	R	80.1	Confident	84.4	Confident	213 Å²	213	47.4 Å²	47.4	80%	0.804	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-2.7	174.8	-64.8	176.7	-172.7	177.2	1.4	113.2	L385 R386 M387	L385-R389 WeakPolarHBondContact O-CG 3.17Å; R386-R389 PolarHBondContact O-N 3.13Å; M387-R389 PolarHBondContact O-N 3.3Å; M387-R389 VanDerWaalsContact O-N 3.08Å
390	K	81.3	Confident	85.5	Confident	87 Å²	87	45.8 Å²	45.8	38%	0.378	23%	0.229	S	C	.	.	S	Bend	trans	-121.3	147.9	-177.6	-71.9	-169.2	174.6	-164.2	0	110.2	M387 Y392	M387-K390 PolarHBondContact O-N 2.63Å; K390-Y392 HydrophobicContact CB-CD2 4.46Å; K390-Y392 HydrophobicContact CB-CE2 3.78Å
391	N	84.5	Confident	86.6	Confident	57 Å²	57	43.2 Å²	43.2	31%	0.305	21%	0.213	S	C	.	.			trans	-94.3	127.6	169.3	-170.7	-3.2	0	0	0	109.1	G393 L538	N391-G393 PolarHBondContact OD1-N 2.83Å; N391-L538 WeakPolarHBondContact O-CD2 3.31Å
392	Y	89.3	Confident	87.5	Confident	14 Å²	14	41 Å²	41	6%	0.055	20%	0.195	C	C	.	.			trans	-103.8	7	176.6	-67.4	-87.9	0	0	0	113.1	F198 R357 L359 M387 K390	F198-Y392 HydrophobicContact CB-CD2 3.99Å; F198-Y392 HydrophobicContact CB-CE2 4.32Å; F198-Y392 AromaticContact CD2-CD2 3.97Å; F198-Y392 HydrophobicContact CD2-CD2 3.97Å; F198-Y392 HydrophobicContact CG-CD2 4.32Å; F198-Y392 PolarHBondContact O-N 3.41Å; R357-Y392 HydrophobicContact CB-CD1 4.22Å; R357-Y392 HydrophobicContact CG-CD1 4.12Å; R357-Y392 PolarHBondContact N-O 3.26Å; L359-Y392 HydrophobicContact CB-CD1 4.41Å; L359-Y392 HydrophobicContact CB-CE1 4.23Å; L359-Y392 HydrophobicContact CG-CD1 4.23Å; L359-Y392 HydrophobicContact CG-CE1 4.48Å; L359-Y392 HydrophobicContact CG-CG 4.33Å; M387-Y392 HydrophobicContact CB-CE2 3.94Å; M387-Y392 HydrophobicContact CG-CE2 4.15Å; M387-Y392 WeakPolarHBondContact CG-OH 3.35Å; K390-Y392 HydrophobicContact CB-CD2 4.46Å; K390-Y392 HydrophobicContact CB-CE2 3.78Å
393	G	92.5	Very high	88.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.183	C	C	.	.			trans	74.2	-143.9	179.2	0	0	0	0	0	112.1	F199 W200 N391	F199-G393 WeakPolarHBondContact CA-O 3.4Å; W200-G393 PolarHBondContact N-O 3.43Å; N391-G393 PolarHBondContact OD1-N 2.83Å
394	C	93.9	Very high	89.5	Confident	14 Å²	14	38.8 Å²	38.8	10%	0.095	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	152.9	-177	-57	0	0	0	0	112.1	S201 D356 M482	S201-C394 CarbonylContact O-C 3.59Å; S201-C394 WeakPolarHBondContact O-CA 3.48Å; S201-C394 PolarHBondContact OG-SG 3.21Å; D356-C394 PolarHBondContact N-O 3.16Å; D356-C394 WeakPolarHBondContact OD2-CA 3.5Å; D356-C394 VanDerWaalsContact OD2-CB 3.32Å; D356-C394 WeakPolarHBondContact OD2-CB 3.39Å; D356-C394 PolarHBondContact OD2-N 3.45Å; C394-M482 HydrophobicContact CB-CE 4.18Å
395	V	95.5	Very high	90.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	136.3	168.7	-171.8	0	0	0	0	108.2	F199 S201 I202 Q203 L237 I353 S354 Y355 V397	F199-V395 HydrophobicContact CD1-CG2 3.6Å; F199-V395 HydrophobicContact CD2-CG2 4.07Å; F199-V395 HydrophobicContact CE1-CG2 3.3Å; F199-V395 HydrophobicContact CE2-CG2 3.75Å; F199-V395 HydrophobicContact CG-CG2 3.97Å; F199-V395 HydrophobicContact CZ-CG2 3.35Å; S201-V395 PolarHBondContact O-N 3.18Å; I202-V395 CarbonylContact C-O 3.57Å; I202-V395 WeakPolarHBondContact CA-O 3.15Å; I202-V395 HydrophobicContact CG1-CB 4.32Å; I202-V395 HydrophobicContact CG1-CG2 4.47Å; Q203-V395 PolarHBondContact N-O 3.35Å; L237-V395 HydrophobicContact CD2-CG1 3.84Å; I353-V395 HydrophobicContact CG2-CG1 4.37Å; S354-V395 WeakPolarHBondContact O-CA 3.3Å; Y355-V395 HydrophobicContact CD1-CB 4.27Å; Y355-V395 HydrophobicContact CD1-CG1 3.85Å; Y355-V395 HydrophobicContact CD1-CG2 3.6Å; Y355-V395 HydrophobicContact CE1-CB 4.26Å; Y355-V395 HydrophobicContact CE1-CG1 3.54Å; Y355-V395 HydrophobicContact CE1-CG2 3.68Å; V395-V397 HydrophobicContact CG1-CG2 4.3Å
396	R	95.3	Very high	91.1	Very high	1 Å²	1	36.4 Å²	36.4	0%	0.004	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.6	174.2	179.8	52.4	179.3	-92.5	-11.7	109.7	Q203 I353 S354 D398 A480 M482 D521	Q203-R396 VanDerWaalsContact O-CD 3.32Å; Q203-R396 WeakPolarHBondContact O-CD 3.49Å; I353-R396 WeakPolarHBondContact CA-O 3.44Å; S354-R396 PolarHBondContact N-O 3.13Å; S354-R396 PolarHBondContact O-N 3.06Å; R396-D398 WeakPolarHBondContact CG-OD2 3.27Å; R396-D398 IonicContact CZ-OD1 2.91Å; R396-D398 VanDerWaalsContact CZ-OD1 3.26Å; R396-D398 IonicContact NE-OD1 2.66Å; R396-D398 PolarHBondContact NE-OD1 2.74Å; R396-D398 IonicContact NE-OD2 3.25Å; R396-D398 IonicContact NH2-OD1 2.69Å; R396-D398 PolarHBondContact NH2-OD1 2.9Å; R396-A480 HydrophobicContact CB-CB 4.23Å; R396-A480 HydrophobicContact CG-CB 3.53Å; R396-M482 HydrophobicContact CB-SD 4.13Å; R396-D521 IonicContact CZ-OD2 2.84Å; R396-D521 IonicContact NH1-OD2 2.79Å; R396-D521 IonicContact NH2-OD2 3.75Å; R396-D521 PolarHBondContact NH2-OD2 3.27Å
397	V	96.6	Very high	91.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.4	175.4	-177.2	0	0	0	0	108.9	Q203 I204 L237 I241 V351 G352 I353 V395 F399	Q203-V397 PolarHBondContact O-N 3.46Å; I204-V397 HydrophobicContact CG2-CB 4.15Å; L237-V397 HydrophobicContact CD2-CG2 3.59Å; L237-V397 HydrophobicContact CG-CG2 4.06Å; I241-V397 HydrophobicContact CD1-CB 3.9Å; I241-V397 HydrophobicContact CD1-CG1 4.02Å; I241-V397 HydrophobicContact CD1-CG2 3.69Å; V351-V397 HydrophobicContact CG1-CG1 3.77Å; G352-V397 WeakPolarHBondContact O-CA 3.45Å; I353-V397 HydrophobicContact CG1-CG1 4.48Å; I353-V397 HydrophobicContact CG2-CG2 4.36Å; V395-V397 HydrophobicContact CG1-CG2 4.3Å; V397-F399 HydrophobicContact CG1-CD2 4.35Å; V397-F399 HydrophobicContact CG1-CE2 3.86Å; V397-F399 HydrophobicContact CG1-CZ 4.14Å
398	D	96.1	Very high	92.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	110.1	-177.8	-65.4	-67.7	0	0	0	109.7	Q208 V351 G352 R396 S478 A480	Q208-D398 VanDerWaalsContact OE1-CA 3.24Å; V351-D398 WeakPolarHBondContact CA-O 3.15Å; G352-D398 PolarHBondContact N-O 3.37Å; G352-D398 PolarHBondContact O-N 3.32Å; R396-D398 WeakPolarHBondContact CG-OD2 3.27Å; R396-D398 IonicContact CZ-OD1 2.91Å; R396-D398 VanDerWaalsContact CZ-OD1 3.26Å; R396-D398 IonicContact NE-OD1 2.66Å; R396-D398 PolarHBondContact NE-OD1 2.74Å; R396-D398 IonicContact NE-OD2 3.25Å; R396-D398 IonicContact NH2-OD1 2.69Å; R396-D398 PolarHBondContact NH2-OD1 2.9Å; D398-S478 WeakPolarHBondContact CB-O 3.28Å; D398-A480 PolarHBondContact OD2-N 2.71Å
399	F	96.7	Very high	93.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	120.2	173.3	-65.3	-91.4	0	0	0	108.6	Q208 L209 V212 F225 I238 I241 L242 V349 V351 V397	Q208-F399 HydrophobicContact CB-CB 4.18Å; Q208-F399 WeakPolarHBondContact CB-O 3.22Å; Q208-F399 WeakPolarHBondContact CG-O 3.29Å; Q208-F399 PolarHBondContact OE1-O 3.36Å; L209-F399 HydrophobicContact CD1-CE2 4.46Å; V212-F399 HydrophobicContact CG2-CB 3.91Å; V212-F399 HydrophobicContact CG2-CD1 4.23Å; V212-F399 HydrophobicContact CG2-CG 4.24Å; F225-F399 HydrophobicContact CD1-CD1 4.31Å; F225-F399 HydrophobicContact CD1-CE1 4.16Å; F225-F399 HydrophobicContact CE1-CD1 4.17Å; F225-F399 HydrophobicContact CE1-CE1 4.04Å; I238-F399 HydrophobicContact CG2-CE1 4.3Å; I241-F399 HydrophobicContact CG2-CE2 3.9Å; I241-F399 HydrophobicContact CG2-CZ 4.02Å; L242-F399 HydrophobicContact CD2-CE1 4.3Å; L242-F399 HydrophobicContact CD2-CZ 4.37Å; V349-F399 HydrophobicContact CG1-CD1 4.32Å; V351-F399 HydrophobicContact CG1-CD1 4.33Å; V351-F399 HydrophobicContact CG1-CE1 4.37Å; V351-F399 HydrophobicContact CG2-CD1 3.78Å; V351-F399 HydrophobicContact CG2-CE1 4.1Å; V397-F399 HydrophobicContact CG1-CD2 4.35Å; V397-F399 HydrophobicContact CG1-CE2 3.86Å; V397-F399 HydrophobicContact CG1-CZ 4.14Å
400	T	96.5	Very high	93.9	Very high	1 Å²	1	18 Å²	18	1%	0.006	9%	0.087	C	C	.	.	P	Polyproline II helix	trans	-77.4	160.3	175	69.5	0	0	0	0	110.5	G61 P350 P402 T474 S478	G61-T400 CarbonylContact O-C 3.6Å; G61-T400 VanDerWaalsContact O-CA 3.24Å; G61-T400 WeakPolarHBondContact O-CA 3.42Å; G61-T400 VanDerWaalsContact O-CB 3.29Å; G61-T400 WeakPolarHBondContact O-CB 3.45Å; P350-T400 WeakPolarHBondContact CA-OG1 3.03Å; P350-T400 HydrophobicContact CB-CG2 4.1Å; P350-T400 WeakPolarHBondContact CB-OG1 3.43Å; P350-T400 WeakPolarHBondContact CD-OG1 3.42Å; P350-T400 WeakPolarHBondContact CG-OG1 3.17Å; P350-T400 WeakPolarHBondContact O-CB 3.47Å; P350-T400 WeakPolarHBondContact O-CG2 3.38Å; P350-T400 PolarHBondContact O-N 3.3Å; P350-T400 PolarHBondContact O-OG1 3.38Å; T400-P402 WeakPolarHBondContact O-CD 3.26Å; T400-T474 HydrophobicContact CG2-CG2 4.17Å; T400-S478 WeakPolarHBondContact CG2-OG 3.32Å
401	Q	96.1	Very high	94.4	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.078	C	C	.	.	P	Polyproline II helix	trans	-56.5	120.8	178.2	-179.7	172.7	3.5	0	0	109.5	G61 C63 S71 Q72 L75 M211	G61-Q401 PolarHBondContact O-N 2.88Å; C63-Q401 HydrophobicContact CB-CB 4.31Å; C63-Q401 HydrophobicContact CB-CG 4.46Å; S71-Q401 PolarHBondContact O-NE2 2.61Å; Q72-Q401 VanDerWaalsContact CA-NE2 3.32Å; Q72-Q401 PolarHBondContact O-NE2 3.28Å; L75-Q401 HydrophobicContact CB-CG 4.18Å; M211-Q401 HydrophobicContact CE-CB 3.87Å; M211-Q401 HydrophobicContact CE-CG 4.43Å; M211-Q401 HydrophobicContact SD-CB 3.97Å; M211-Q401 HydrophobicContact SD-CG 3.86Å
402	P	96.9	Very high	94.6	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.066	C	C	.	.	P	Polyproline II helix	trans	-57.9	145.9	175.7	-23.4	33.3	0	0	0	111.2	L75 V212 A215 M347 V348 V349 T400	L75-P402 HydrophobicContact CD1-CB 3.99Å; L75-P402 WeakPolarHBondContact CD1-O 3.46Å; V212-P402 HydrophobicContact CG2-CG 4.16Å; A215-P402 HydrophobicContact CB-CB 3.81Å; A215-P402 HydrophobicContact CB-CG 3.8Å; M347-P402 HydrophobicContact CE-CB 3.99Å; V348-P402 WeakPolarHBondContact O-CA 3.15Å; V349-P402 HydrophobicContact CG2-CB 3.93Å; V349-P402 HydrophobicContact CG2-CG 3.94Å; T400-P402 WeakPolarHBondContact O-CD 3.26Å
403	F	96.7	Very high	94.5	Very high	5 Å²	5	18.9 Å²	18.9	2%	0.022	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	150	174.5	66	-93.5	0	0	0	112.2	C63 T68 M347 V348 P350 L405 Y408 L467 V471	C63-F403 HydrophobicContact CB-CB 4.08Å; C63-F403 HydrophobicContact CB-CD1 4.21Å; T68-F403 HydrophobicContact CG2-CB 3.99Å; T68-F403 HydrophobicContact CG2-CD2 3.71Å; T68-F403 HydrophobicContact CG2-CE2 4.5Å; T68-F403 HydrophobicContact CG2-CG 4.09Å; M347-F403 CarbonylContact C-O 3.39Å; M347-F403 WeakPolarHBondContact CA-O 3.36Å; V348-F403 HydrophobicContact CB-CD1 4.35Å; V348-F403 HydrophobicContact CB-CD2 4.25Å; V348-F403 HydrophobicContact CB-CE1 3.87Å; V348-F403 HydrophobicContact CB-CE2 3.77Å; V348-F403 HydrophobicContact CB-CZ 3.57Å; V348-F403 HydrophobicContact CG1-CE1 3.78Å; V348-F403 HydrophobicContact CG1-CE2 4.2Å; V348-F403 HydrophobicContact CG1-CZ 3.52Å; V348-F403 HydrophobicContact CG2-CE2 4.18Å; V348-F403 HydrophobicContact CG2-CZ 4.32Å; V348-F403 PolarHBondContact N-O 2.91Å; V348-F403 PolarHBondContact O-N 3.28Å; P350-F403 HydrophobicContact CG-CE1 3.92Å; F403-L405 PolarHBondContact O-N 3.24Å; F403-Y408 HydrophobicContact CE2-CD2 4.42Å; F403-Y408 HydrophobicContact CE2-CG 4.46Å; F403-L467 HydrophobicContact CE2-CD1 4.06Å; F403-L467 HydrophobicContact CZ-CD1 3.99Å; F403-V471 HydrophobicContact CZ-CG2 4.13Å
404	S	96.6	Very high	93.9	Very high	7 Å²	7	24 Å²	24	5%	0.049	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	125.1	175.7	159.6	0	0	0	0	110.2	S71 E345 K406 E407 Y408	S71-S404 PolarHBondContact OG-N 3.03Å; E345-S404 PolarHBondContact OE1-OG 3.43Å; E345-S404 VanDerWaalsContact OE1-OG 3.09Å; E345-S404 WeakPolarHBondContact OE2-CB 3.14Å; E345-S404 PolarHBondContact OE2-OG 2.92Å; S404-K406 VanDerWaalsContact C-N 3.31Å; S404-K406 PolarHBondContact OG-N 3.38Å; S404-E407 WeakPolarHBondContact OG-CB 3.36Å; S404-E407 PolarHBondContact OG-N 3.4Å; S404-Y408 PolarHBondContact O-N 3.28Å
405	L	96.3	Very high	93.2	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.7	-37.8	173.5	-179.5	56.4	0	0	0	110.7	V334 V335 L338 V346 V348 F403 Y408 L409 L467	V334-L405 HydrophobicContact CG1-CD2 3.94Å; V335-L405 HydrophobicContact CG2-CD1 4.3Å; V335-L405 HydrophobicContact CG2-CD2 4.05Å; L338-L405 HydrophobicContact CD2-CB 3.91Å; L338-L405 HydrophobicContact CD2-CD2 3.86Å; L338-L405 HydrophobicContact CD2-CG 3.65Å; V346-L405 HydrophobicContact CB-CB 4.1Å; V346-L405 HydrophobicContact CB-CD2 4.17Å; V346-L405 HydrophobicContact CG1-CD2 4.49Å; V346-L405 WeakPolarHBondContact O-CB 3.46Å; V346-L405 PolarHBondContact O-N 3.38Å; V348-L405 HydrophobicContact CG2-CB 4.08Å; V348-L405 HydrophobicContact CG2-CD1 4.32Å; F403-L405 PolarHBondContact O-N 3.24Å; L405-Y408 WeakPolarHBondContact O-CB 3.5Å; L405-Y408 PolarHBondContact O-N 3.48Å; L405-L409 HydrophobicContact CD1-CG 4.27Å; L405-L409 HydrophobicContact CG-CD1 4.26Å; L405-L409 HydrophobicContact CG-CG 4.46Å; L405-L409 WeakPolarHBondContact O-CG 3.39Å; L405-L409 PolarHBondContact O-N 3.23Å; L405-L467 HydrophobicContact CD1-CD2 3.39Å
406	K	95	Very high	91.8	Very high	100 Å²	100	35.3 Å²	35.3	44%	0.435	17%	0.171	S	C	.	.	H	α-helix	trans	-60.1	-49.4	177.7	-175.1	178.5	176.6	179	0	111.3	L338 E345 S404 Y408 L409 D410	L338-K406 HydrophobicContact CD1-CB 4.5Å; L338-K406 HydrophobicContact CD2-CB 4.07Å; E345-K406 VanDerWaalsContact OE1-CB 3.31Å; E345-K406 WeakPolarHBondContact OE1-CB 3.3Å; E345-K406 PolarHBondContact OE1-N 3.38Å; E345-K406 WeakPolarHBondContact OE2-CB 3.5Å; S404-K406 VanDerWaalsContact C-N 3.31Å; S404-K406 PolarHBondContact OG-N 3.38Å; K406-Y408 VanDerWaalsContact C-N 3.29Å; K406-Y408 PolarHBondContact O-N 2.87Å; K406-L409 PolarHBondContact O-N 3.34Å; K406-L409 VanDerWaalsContact O-N 3.16Å; K406-D410 PolarHBondContact O-N 3.22Å
407	E	95.2	Very high	90.3	Very high	16 Å²	16	37.2 Å²	37.2	8%	0.075	18%	0.181	C	C	.	.	H	α-helix	trans	-56.3	-44.3	176.3	-177.7	-170.4	176.6	0	0	111.8	T68 P69 Q70 S71 S404 T411	T68-E407 WeakPolarHBondContact CA-OE1 3.42Å; P69-E407 VanDerWaalsContact CD-OE1 3.25Å; P69-E407 WeakPolarHBondContact CD-OE1 3.26Å; Q70-E407 WeakPolarHBondContact CA-OE1 3.48Å; Q70-E407 VanDerWaalsContact CB-OE1 3.26Å; Q70-E407 WeakPolarHBondContact CB-OE1 3.33Å; Q70-E407 PolarHBondContact N-OE1 3Å; S71-E407 VanDerWaalsContact CB-OE2 3.23Å; S71-E407 WeakPolarHBondContact CB-OE2 3.37Å; S71-E407 PolarHBondContact N-OE1 2.64Å; S71-E407 PolarHBondContact N-OE2 3.21Å; S71-E407 PolarHBondContact OG-OE2 3.43Å; S404-E407 WeakPolarHBondContact OG-CB 3.36Å; S404-E407 PolarHBondContact OG-N 3.4Å; E407-T411 WeakPolarHBondContact O-CB 3.49Å; E407-T411 PolarHBondContact O-N 3.44Å; E407-T411 PolarHBondContact O-OG1 2.83Å
408	Y	95.2	Very high	88.6	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-59.4	-49.2	177.1	177.8	-88.1	0	0	0	111.2	C67 T68 F403 S404 L405 K406 T411 Q412 V463 L467	C67-Y408 HydrophobicContact CB-CD2 3.77Å; C67-Y408 HydrophobicContact CB-CE2 3.86Å; T68-Y408 HydrophobicContact CG2-CD2 4.19Å; F403-Y408 HydrophobicContact CE2-CD2 4.42Å; F403-Y408 HydrophobicContact CE2-CG 4.46Å; S404-Y408 PolarHBondContact O-N 3.28Å; L405-Y408 WeakPolarHBondContact O-CB 3.5Å; L405-Y408 PolarHBondContact O-N 3.48Å; K406-Y408 VanDerWaalsContact C-N 3.29Å; K406-Y408 PolarHBondContact O-N 2.87Å; Y408-T411 PolarHBondContact O-N 3.49Å; Y408-Q412 HydrophobicContact CD1-CG 4Å; Y408-Q412 HydrophobicContact CE1-CG 3.54Å; Y408-Q412 HydrophobicContact CE2-CG 4.38Å; Y408-Q412 WeakPolarHBondContact O-CG 3.48Å; Y408-Q412 PolarHBondContact O-N 3.22Å; Y408-V463 HydrophobicContact CE1-CG1 4.23Å; Y408-L467 HydrophobicContact CD1-CD1 3.91Å; Y408-L467 HydrophobicContact CD2-CD1 4.29Å; Y408-L467 HydrophobicContact CE1-CB 3.8Å; Y408-L467 HydrophobicContact CE1-CD1 3.77Å; Y408-L467 HydrophobicContact CE1-CG 4.24Å; Y408-L467 HydrophobicContact CE2-CD1 4.15Å; Y408-L467 HydrophobicContact CG-CD1 4.19Å; Y408-L467 WeakPolarHBondContact OH-CA 3.23Å; Y408-L467 PolarHBondContact OH-N 3.17Å
409	L	93.6	Very high	87	Confident	5 Å²	5	47.1 Å²	47.1	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-43.6	-178.8	-66.5	176.4	0	0	0	112	V335 L338 L405 K406 T411 Q412 R413 V463	V335-L409 HydrophobicContact CG1-CD1 4.11Å; V335-L409 HydrophobicContact CG1-CD2 4.3Å; L338-L409 HydrophobicContact CD2-CD1 3.91Å; L405-L409 HydrophobicContact CD1-CG 4.27Å; L405-L409 HydrophobicContact CG-CD1 4.26Å; L405-L409 HydrophobicContact CG-CG 4.46Å; L405-L409 WeakPolarHBondContact O-CG 3.39Å; L405-L409 PolarHBondContact O-N 3.23Å; K406-L409 PolarHBondContact O-N 3.34Å; K406-L409 VanDerWaalsContact O-N 3.16Å; L409-T411 VanDerWaalsContact C-N 3.3Å; L409-T411 PolarHBondContact O-N 3.11Å; L409-Q412 PolarHBondContact O-N 2.76Å; L409-R413 WeakPolarHBondContact O-CG 3.45Å; L409-R413 PolarHBondContact O-N 3.31Å; L409-V463 HydrophobicContact CD2-CG1 3.49Å; L409-V463 VanDerWaalsContact CD2-CG1 3.49Å
410	D	92.3	Very high	85.5	Confident	70 Å²	70	51.7 Å²	51.7	37%	0.374	27%	0.273	S	S	.	.	H	α-helix	trans	-62.5	-39.4	177.6	-69.3	-23.4	0	0	0	111.4	K406 R413 S414	K406-D410 PolarHBondContact O-N 3.22Å; D410-R413 PolarHBondContact O-N 3.44Å; D410-R413 IonicContact OD1-NH1 3.56Å; D410-S414 PolarHBondContact O-N 3.48Å; D410-S414 PolarHBondContact O-OG 2.83Å; D410-S414 VanDerWaalsContact O-OG 3.09Å
411	T	91.6	Very high	84.4	Confident	30 Å²	30	57.6 Å²	57.6	18%	0.184	30%	0.304	C	S	.	.	H	α-helix	trans	-65.9	-40.2	174.4	-56.8	0	0	0	0	111.9	C67 E407 Y408 L409 S414 R415	C67-T411 WeakPolarHBondContact O-CB 3.4Å; C67-T411 PolarHBondContact O-OG1 2.77Å; E407-T411 WeakPolarHBondContact O-CB 3.49Å; E407-T411 PolarHBondContact O-N 3.44Å; E407-T411 PolarHBondContact O-OG1 2.83Å; Y408-T411 PolarHBondContact O-N 3.49Å; L409-T411 VanDerWaalsContact C-N 3.3Å; L409-T411 PolarHBondContact O-N 3.11Å; T411-S414 PolarHBondContact O-N 2.84Å; T411-R415 WeakPolarHBondContact O-CG 3.46Å
412	Q	88.9	Confident	83.7	Confident	10 Å²	10	59.7 Å²	59.7	5%	0.047	32%	0.319	C	S	.	.	H	α-helix	trans	-69.7	-32.2	177.4	-66.3	-44.4	-73	0	0	112.9	Y408 L409 S414 R415 V463	Y408-Q412 HydrophobicContact CD1-CG 4Å; Y408-Q412 HydrophobicContact CE1-CG 3.54Å; Y408-Q412 HydrophobicContact CE2-CG 4.38Å; Y408-Q412 WeakPolarHBondContact O-CG 3.48Å; Y408-Q412 PolarHBondContact O-N 3.22Å; L409-Q412 PolarHBondContact O-N 2.76Å; Q412-S414 PolarHBondContact O-N 2.89Å; Q412-R415 PolarHBondContact O-N 2.94Å; Q412-V463 HydrophobicContact CB-CG1 4.32Å; Q412-V463 HydrophobicContact CB-CG2 4.26Å; Q412-V463 HydrophobicContact CG-CG1 4.31Å
413	R	86.1	Confident	83	Confident	135 Å²	135	60.8 Å²	60.8	51%	0.509	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-34.5	173.7	-76.3	177.6	173	166.8	-7.2	112.4	L409 D410 R415 W459	L409-R413 WeakPolarHBondContact O-CG 3.45Å; L409-R413 PolarHBondContact O-N 3.31Å; D410-R413 PolarHBondContact O-N 3.44Å; D410-R413 IonicContact OD1-NH1 3.56Å; R413-R415 VanDerWaalsContact C-N 3.25Å; R413-R415 PolarHBondContact O-N 3.22Å; R413-W459 HydrophobicContact CB-CZ2 4.32Å; R413-W459 HydrophobicContact CG-CH2 3.61Å; R413-W459 HydrophobicContact CG-CZ2 3.27Å
414	S	81.4	Confident	82.4	Confident	107 Å²	107	64.6 Å²	64.6	75%	0.748	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-9.4	-179.3	-52.6	0	0	0	0	113.1	D410 T411 Q412	D410-S414 PolarHBondContact O-N 3.48Å; D410-S414 PolarHBondContact O-OG 2.83Å; D410-S414 VanDerWaalsContact O-OG 3.09Å; T411-S414 PolarHBondContact O-N 2.84Å; Q412-S414 PolarHBondContact O-N 2.89Å
415	R	79	Confident	81.8	Confident	78 Å²	78	70 Å²	70	29%	0.294	37%	0.367	S	S	.	.	S	Bend	trans	-100.5	134.2	-180	-70.5	175.7	-174.1	-153.2	-8.6	110.3	S66 T411 Q412 R413 I417	S66-R415 VanDerWaalsContact C-NH2 3.27Å; S66-R415 PolarHBondContact O-NH2 2.93Å; S66-R415 PolarHBondContact OG-NH1 3Å; S66-R415 PolarHBondContact OG-NH2 3.42Å; T411-R415 WeakPolarHBondContact O-CG 3.46Å; Q412-R415 PolarHBondContact O-N 2.94Å; R413-R415 VanDerWaalsContact C-N 3.25Å; R413-R415 PolarHBondContact O-N 3.22Å; R415-I417 PolarHBondContact O-N 2.95Å; R415-I417 VanDerWaalsContact O-N 3.13Å
416	H	66.5	Low	81.2	Confident	174 Å²	174	72 Å²	72	81%	0.806	38%	0.379	S	S	*	.			trans	-68.9	110	164.6	-157.9	-69	0	0	0	108.1	P418	H416-P418 WeakPolarHBondContact O-CD 3.36Å
417	I	63.4	Low	80.9	Confident	42 Å²	42	67.4 Å²	67.4	22%	0.215	36%	0.359	C	S	.	.			trans	-89.1	105.3	174.6	-58.2	173.2	0	0	0	106.2	R415 Q462 V463	R415-I417 PolarHBondContact O-N 2.95Å; R415-I417 VanDerWaalsContact O-N 3.13Å; I417-Q462 HydrophobicContact CG2-CG 4.06Å; I417-V463 HydrophobicContact CD1-CG2 3.69Å
418	P	61.3	Low	80.4	Confident	93 Å²	93	67.7 Å²	67.7	60%	0.604	36%	0.362	S	S	*	.			trans	-60.8	144	175.2	24.3	-31.4	0	0	0	109.7	H416 T420	H416-P418 WeakPolarHBondContact O-CD 3.36Å; P418-T420 PolarHBondContact O-N 2.9Å
419	P	61.6	Low	80	Confident	114 Å²	114	71.4 Å²	71.4	74%	0.74	39%	0.386	S	S	*	.			trans	-59.6	138.4	176.4	25.1	-32.5	0	0	0	109.8	L421	P419-L421 PolarHBondContact O-N 3.08Å
420	T	65.9	Low	79.6	Confident	97 Å²	97	75.3 Å²	75.3	60%	0.595	41%	0.41	S	S	*	.			trans	-72.4	114.4	176.2	54	0	0	0	0	109.2	P418	P418-T420 PolarHBondContact O-N 2.9Å
421	L	72.4	Confident	79.3	Confident	125 Å²	125	72.4 Å²	72.4	65%	0.654	40%	0.395	S	S	*	.			trans	-63.2	147	169.8	-66.7	171.5	0	0	0	110.4	P419	P419-L421 PolarHBondContact O-N 3.08Å
422	S	81.1	Confident	78.9	Confident	44 Å²	44	72.1 Å²	72.1	31%	0.308	39%	0.392	S	S	.	.			trans	-69.8	157.1	174.4	76.8	0	0	0	0	110.8	E424 Q425 T426	S422-E424 PolarHBondContact O-N 3.39Å; S422-Q425 PolarHBondContact O-N 3Å; S422-Q425 WeakPolarHBondContact OG-CB 3.36Å; S422-Q425 VanDerWaalsContact OG-CG 3.27Å; S422-Q425 WeakPolarHBondContact OG-CG 3.24Å; S422-Q425 PolarHBondContact OG-N 2.88Å; S422-Q425 VanDerWaalsContact OG-N 3.09Å; S422-Q425 PolarHBondContact OG-OE1 3.07Å; S422-T426 PolarHBondContact O-N 3.12Å; S422-T426 PolarHBondContact O-OG1 2.65Å
423	L	82.9	Confident	78	Confident	22 Å²	22	77.6 Å²	77.6	12%	0.115	42%	0.421	C	S	.	.	H	α-helix	trans	-61	-38	175.8	-171.4	68.6	0	0	0	110.9	T426 L427 H626 T786 E789 L790	L423-T426 PolarHBondContact O-N 3.44Å; L423-L427 HydrophobicContact CD1-CD1 3.43Å; L423-L427 VanDerWaalsContact CD1-CD1 3.43Å; L423-L427 HydrophobicContact CD1-CG 4.05Å; L423-L427 HydrophobicContact CG-CD1 3.95Å; L423-L427 WeakPolarHBondContact O-CB 3.34Å; L423-L427 PolarHBondContact O-N 3.13Å; L423-H626 HydrophobicContact CD1-CB 4.13Å; L423-H626 VanDerWaalsContact CD1-O 3.22Å; L423-H626 WeakPolarHBondContact CD1-O 3.28Å; L423-T786 HydrophobicContact CD2-CG2 3.77Å; L423-E789 HydrophobicContact CB-CB 4.3Å; L423-E789 HydrophobicContact CD2-CB 4.07Å; L423-L790 HydrophobicContact CD2-CB 4.09Å; L423-L790 HydrophobicContact CD2-CD1 4.45Å; L423-L790 HydrophobicContact CG-CD1 4.19Å
424	E	83.8	Confident	75.8	Confident	86 Å²	86	75.2 Å²	75.2	40%	0.402	43%	0.431	S	S	.	.	H	α-helix	trans	-55.8	-54.8	172.9	-172.3	176.9	-170.6	0	0	111.8	S422 T426 L427 V428 E789	S422-E424 PolarHBondContact O-N 3.39Å; E424-T426 PolarHBondContact O-N 3.3Å; E424-L427 PolarHBondContact O-N 3.26Å; E424-V428 HydrophobicContact CB-CG2 4.4Å; E424-V428 HydrophobicContact CG-CB 4.42Å; E424-V428 HydrophobicContact CG-CG2 3.77Å; E424-V428 WeakPolarHBondContact O-CB 3.06Å; E424-V428 WeakPolarHBondContact O-CG2 3.39Å; E424-V428 PolarHBondContact O-N 3.06Å; E424-E789 PolarHBondContact N-O 3.3Å
425	Q	84.3	Confident	73.6	Confident	121 Å²	121	78.4 Å²	78.4	57%	0.565	43%	0.434	S	S	*	.	H	α-helix	trans	-60.3	-33.1	179.5	-73.4	168.1	-27.6	0	0	112.7	S422	S422-Q425 PolarHBondContact O-N 3Å; S422-Q425 WeakPolarHBondContact OG-CB 3.36Å; S422-Q425 VanDerWaalsContact OG-CG 3.27Å; S422-Q425 WeakPolarHBondContact OG-CG 3.24Å; S422-Q425 PolarHBondContact OG-N 2.88Å; S422-Q425 VanDerWaalsContact OG-N 3.09Å; S422-Q425 PolarHBondContact OG-OE1 3.07Å
426	T	84.1	Confident	71.5	Confident	42 Å²	42	80.6 Å²	80.6	26%	0.258	46%	0.458	S	S	.	.	H	α-helix	trans	-80.5	-40.3	-176	-52.2	0	0	0	0	112.5	S422 L423 E424 H626	S422-T426 PolarHBondContact O-N 3.12Å; S422-T426 PolarHBondContact O-OG1 2.65Å; L423-T426 PolarHBondContact O-N 3.44Å; E424-T426 PolarHBondContact O-N 3.3Å; T426-H626 HydrophobicContact CG2-CB 4.41Å
427	L	87.7	Confident	69.8	Low	2 Å²	2	79.5 Å²	79.5	1%	0.01	46%	0.459	C	S	.	.	H	α-helix	trans	-111.5	-28.5	-167.8	-65.1	-177.1	0	0	0	114.7	L423 E424 T430 I431 G623 H626 F627 L790	L423-L427 HydrophobicContact CD1-CD1 3.43Å; L423-L427 VanDerWaalsContact CD1-CD1 3.43Å; L423-L427 HydrophobicContact CD1-CG 4.05Å; L423-L427 HydrophobicContact CG-CD1 3.95Å; L423-L427 WeakPolarHBondContact O-CB 3.34Å; L423-L427 PolarHBondContact O-N 3.13Å; E424-L427 PolarHBondContact O-N 3.26Å; L427-T430 PolarHBondContact O-N 3.1Å; L427-T430 VanDerWaalsContact O-N 3.12Å; L427-I431 HydrophobicContact CB-CD1 3.93Å; L427-I431 VanDerWaalsContact O-CG1 3.29Å; L427-I431 WeakPolarHBondContact O-CG1 3.45Å; L427-I431 PolarHBondContact O-N 3.48Å; L427-G623 WeakPolarHBondContact CD2-O 3.4Å; L427-H626 HydrophobicContact CD1-CB 4.33Å; L427-H626 HydrophobicContact CD2-CB 4.2Å; L427-H626 HydrophobicContact CG-CB 4.39Å; L427-F627 HydrophobicContact CD1-CB 3.79Å; L427-F627 HydrophobicContact CD1-CD2 4.05Å; L427-F627 HydrophobicContact CD1-CG 4.44Å; L427-L790 HydrophobicContact CB-CD1 3.77Å; L427-L790 HydrophobicContact CD1-CD1 4.25Å
428	V	85.9	Confident	68.4	Low	22 Å²	22	87 Å²	87	13%	0.133	49%	0.492	C	S	.	.	H	α-helix	trans	-60.5	-41.3	-177.1	171.3	0	0	0	0	112.8	E424 T430 I431 I432 L790	E424-V428 HydrophobicContact CB-CG2 4.4Å; E424-V428 HydrophobicContact CG-CB 4.42Å; E424-V428 HydrophobicContact CG-CG2 3.77Å; E424-V428 WeakPolarHBondContact O-CB 3.06Å; E424-V428 WeakPolarHBondContact O-CG2 3.39Å; E424-V428 PolarHBondContact O-N 3.06Å; V428-T430 VanDerWaalsContact C-N 3.25Å; V428-T430 PolarHBondContact O-N 3.23Å; V428-I431 PolarHBondContact O-N 3.44Å; V428-I432 HydrophobicContact CG1-CB 4.45Å; V428-I432 HydrophobicContact CG1-CD1 3.69Å; V428-I432 HydrophobicContact CG1-CG1 4.06Å; V428-I432 PolarHBondContact O-N 3.48Å; V428-L790 HydrophobicContact CG2-CD1 4.06Å
429	P	87	Confident	66.8	Low	80 Å²	80	85.7 Å²	85.7	52%	0.519	49%	0.49	S	S	.	.	H	α-helix	trans	-55.9	-42.2	174.4	-26.3	35.9	0	0	0	112.2	D433	P429-D433 WeakPolarHBondContact O-CA 3.43Å; P429-D433 PolarHBondContact O-N 3.38Å
430	T	84.8	Confident	65.5	Low	87 Å²	87	89.1 Å²	89.1	53%	0.534	50%	0.496	S	S	.	.	H	α-helix	trans	-72.5	-32.9	179.2	-48.6	0	0	0	0	113.4	L427 V428 Y822	L427-T430 PolarHBondContact O-N 3.1Å; L427-T430 VanDerWaalsContact O-N 3.12Å; V428-T430 VanDerWaalsContact C-N 3.25Å; V428-T430 PolarHBondContact O-N 3.23Å; T430-Y822 HydrophobicContact CG2-CE2 4.48Å
431	I	85.1	Confident	63.8	Low	9 Å²	9	93.7 Å²	93.7	5%	0.046	51%	0.508	C	S	.	.	H	α-helix	trans	-81.5	-42.1	-177.3	-68	168.1	0	0	0	111.2	L427 V428 L790 K818 L819 Y822	L427-I431 HydrophobicContact CB-CD1 3.93Å; L427-I431 VanDerWaalsContact O-CG1 3.29Å; L427-I431 WeakPolarHBondContact O-CG1 3.45Å; L427-I431 PolarHBondContact O-N 3.48Å; V428-I431 PolarHBondContact O-N 3.44Å; I431-L790 HydrophobicContact CD1-CD1 4.01Å; I431-L790 HydrophobicContact CD1-CD2 3.99Å; I431-K818 WeakPolarHBondContact O-CB 3.49Å; I431-L819 HydrophobicContact CD1-CD1 4.23Å; I431-L819 HydrophobicContact CG2-CB 4.25Å; I431-L819 HydrophobicContact CG2-CD1 4.35Å; I431-Y822 HydrophobicContact CD1-CD1 4.17Å; I431-Y822 HydrophobicContact CD1-CE1 4.3Å; I431-Y822 HydrophobicContact CD1-CG 4.43Å; I431-Y822 HydrophobicContact CG1-CD1 4.03Å; I431-Y822 HydrophobicContact CG1-CD2 3.86Å; I431-Y822 HydrophobicContact CG1-CE1 4.32Å; I431-Y822 HydrophobicContact CG1-CE2 4.16Å; I431-Y822 HydrophobicContact CG1-CG 3.8Å
432	I	84.2	Confident	61.7	Low	25 Å²	25	96.3 Å²	96.3	13%	0.128	52%	0.517	C	S	.	.	H	α-helix	trans	-94.2	-27.1	-170.9	-60.7	-170.8	0	0	0	111.9	V428 T809 F810 N815 K818	V428-I432 HydrophobicContact CG1-CB 4.45Å; V428-I432 HydrophobicContact CG1-CD1 3.69Å; V428-I432 HydrophobicContact CG1-CG1 4.06Å; V428-I432 PolarHBondContact O-N 3.48Å; I432-T809 HydrophobicContact CD1-CG2 3.3Å; I432-F810 HydrophobicContact CD1-CE1 4.16Å; I432-F810 HydrophobicContact CD1-CE2 4.11Å; I432-F810 HydrophobicContact CD1-CZ 3.79Å; I432-F810 HydrophobicContact CG1-CZ 4.33Å; I432-N815 HydrophobicContact CD1-CB 4.28Å; I432-K818 WeakPolarHBondContact O-CD 3.46Å; I432-K818 PolarHBondContact O-NZ 3.02Å
433	D	70.4	Confident	59.2	Low	124 Å²	124	96.8 Å²	96.8	66%	0.663	53%	0.529	S	S	*	.			trans	52.1	92.1	-179.8	-138.5	23.2	0	0	0	112.6	P429	P429-D433 WeakPolarHBondContact O-CA 3.43Å; P429-D433 PolarHBondContact O-N 3.38Å
434	A	38.8	Very low	56.6	Low	86 Å²	86	104.5 Å²	104.5	71%	0.711	56%	0.564	S	S	*	*			trans	-101.4	126.3	152.5	0	0	0	0	0	105.7
435	Q	34.5	Very low	53.9	Low	173 Å²	173	109.2 Å²	109.2	81%	0.808	59%	0.586	S	S	*	*			trans	-47.4	146.7	164.5	-86.4	179.7	-44.2	0	0	109.2	D437	Q435-D437 PolarHBondContact O-N 3.36Å
436	P	36.9	Very low	51.2	Low	124 Å²	124	112 Å²	112	81%	0.805	60%	0.599	S	S	*	*			trans	-71.5	88.1	174.2	31.1	-31.3	0	0	0	107.8	Q438	P436-Q438 PolarHBondContact O-N 3.29Å
437	D	29	Very low	48.5	Very low	152 Å²	152	118.6 Å²	118.6	81%	0.813	63%	0.627	S	S	*	*			trans	-63.1	119.8	149.9	-88.1	-22.5	0	0	0	105.6	Q435 A439	Q435-D437 PolarHBondContact O-N 3.36Å; D437-A439 PolarHBondContact O-N 2.96Å
438	Q	33.8	Very low	45.8	Very low	198 Å²	198	127.4 Å²	127.4	93%	0.925	67%	0.668	S	S	*	*			trans	-58.7	71.1	164	-71.7	176.1	-27	0	0	109	P436 Q440	P436-Q438 PolarHBondContact O-N 3.29Å; Q438-Q440 PolarHBondContact O-N 3.47Å
439	A	29.7	Very low	43.1	Very low	67 Å²	67	130.6 Å²	130.6	55%	0.554	69%	0.689	S	S	*	*			trans	-75.8	103.1	153.4	0	0	0	0	0	104.8	D437 F441	D437-A439 PolarHBondContact O-N 2.96Å; A439-F441 HydrophobicContact CB-CD2 4.36Å; A439-F441 HydrophobicContact CB-CE2 4.49Å; A439-F441 PolarHBondContact O-N 2.92Å
440	Q	33.9	Very low	40.4	Very low	185 Å²	185	134.6 Å²	134.6	86%	0.864	71%	0.706	S	S	*	*			trans	-46	91.3	154	-71.1	173.5	-42.2	0	0	107.5	Q438 E442	Q438-Q440 PolarHBondContact O-N 3.47Å; Q440-E442 PolarHBondContact O-N 2.81Å; Q440-E442 VanDerWaalsContact O-N 3.08Å
441	F	29.3	Very low	38	Very low	193 Å²	193	136.3 Å²	136.3	85%	0.846	72%	0.722	S	S	*	*			trans	-73.2	94.8	155.3	-94	-89.6	0	0	0	104	A439 G443	A439-F441 HydrophobicContact CB-CD2 4.36Å; A439-F441 HydrophobicContact CB-CE2 4.49Å; A439-F441 PolarHBondContact O-N 2.92Å; F441-G443 PolarHBondContact O-N 2.86Å
442	E	28.4	Very low	36	Very low	180 Å²	180	147 Å²	147	84%	0.841	76%	0.762	S	S	*	*			trans	-52.2	84.6	142.4	-71.7	-178.5	160.7	0	0	105.8	Q440 E444	Q440-E442 PolarHBondContact O-N 2.81Å; Q440-E442 VanDerWaalsContact O-N 3.08Å; E442-E444 PolarHBondContact O-N 2.97Å; E442-E444 VanDerWaalsContact O-N 3.09Å
443	G	28.6	Very low	33.7	Very low	54 Å²	54	153.5 Å²	153.5	56%	0.557	80%	0.797	S	S	*	*			trans	-58.3	112.8	154.5	0	0	0	0	0	103.9	F441 Q445	F441-G443 PolarHBondContact O-N 2.86Å; G443-Q445 PolarHBondContact O-N 2.87Å
444	E	27.5	Very low	32	Very low	185 Å²	185	154.3 Å²	154.3	86%	0.864	80%	0.8	S	S	*	*			trans	-45.3	104.3	157.1	-71.3	175.3	150.2	0	0	105.3	E442 E446	E442-E444 PolarHBondContact O-N 2.97Å; E442-E444 VanDerWaalsContact O-N 3.09Å; E444-E446 PolarHBondContact O-N 2.83Å
445	Q	27.1	Very low	32.6	Very low	185 Å²	185	154.3 Å²	154.3	86%	0.864	80%	0.795	S	S	*	*			trans	-64.2	90.3	165.7	-76.1	179.6	-7.4	0	0	103.7	G443 E447	G443-Q445 PolarHBondContact O-N 2.87Å; Q445-E447 VanDerWaalsContact C-N 3.27Å; Q445-E447 PolarHBondContact O-N 2.88Å
446	E	27.6	Very low	33.9	Very low	179 Å²	179	150.5 Å²	150.5	84%	0.836	78%	0.78	S	S	*	*			trans	-56.1	105.3	157.6	-82.5	-173.2	157.1	0	0	105.4	E444 Q448	E444-E446 PolarHBondContact O-N 2.83Å; E446-Q448 PolarHBondContact O-N 2.86Å
447	E	27.3	Very low	35.7	Very low	181 Å²	181	148.2 Å²	148.2	85%	0.846	76%	0.759	S	S	*	*			trans	-45.8	115.4	173.5	-70.5	-179.5	147.3	0	0	108.3	Q445 P449	Q445-E447 VanDerWaalsContact C-N 3.27Å; Q445-E447 PolarHBondContact O-N 2.88Å; E447-P449 WeakPolarHBondContact O-CD 3.28Å; E447-P449 VanDerWaalsContact O-N 3.14Å
448	Q	32	Very low	38.2	Very low	187 Å²	187	145.1 Å²	145.1	87%	0.874	75%	0.747	S	S	*	*			trans	-56.2	117.6	169.8	-72.6	-174.8	-7.4	0	0	108.3	E446 N450	E446-Q448 PolarHBondContact O-N 2.86Å; Q448-N450 PolarHBondContact O-N 2.69Å
449	P	29.8	Very low	40.6	Very low	89 Å²	89	138.9 Å²	138.9	58%	0.578	72%	0.715	S	S	*	*			trans	-73.4	128.7	163.1	-3	22.1	0	0	0	106	E447 S451 L454	E447-P449 WeakPolarHBondContact O-CD 3.28Å; E447-P449 VanDerWaalsContact O-N 3.14Å; P449-S451 PolarHBondContact O-N 3.13Å; P449-L454 HydrophobicContact CB-CD1 4.38Å; P449-L454 HydrophobicContact CG-CD1 3.92Å
450	N	29.1	Very low	43.1	Very low	164 Å²	164	138.4 Å²	138.4	88%	0.877	70%	0.699	S	S	*	*			trans	-31.2	113.1	168.6	-84.2	-37.4	0	0	0	111.5	Q448 R452	Q448-N450 PolarHBondContact O-N 2.69Å; N450-R452 VanDerWaalsContact C-N 3.32Å; N450-R452 PolarHBondContact O-N 2.93Å
451	S	35.6	Very low	45.7	Very low	123 Å²	123	137.6 Å²	137.6	86%	0.86	69%	0.688	S	S	*	*	S	Bend	trans	-71.6	83	-173.3	53.6	0	0	0	0	111.2	P449	P449-S451 PolarHBondContact O-N 3.13Å
452	R	41.6	Very low	48.4	Very low	233 Å²	233	130.8 Å²	130.8	88%	0.879	66%	0.658	S	S	*	*	S	Bend	trans	-133.2	-1.7	161.6	-83.2	-166.2	173.6	170.4	-0.8	116.3	N450	N450-R452 VanDerWaalsContact C-N 3.32Å; N450-R452 PolarHBondContact O-N 2.93Å
453	D	37.2	Very low	51.4	Low	161 Å²	161	122.3 Å²	122.3	86%	0.861	62%	0.619	S	S	*	*	S	Bend	trans	-157.1	23.5	-176.1	-116.4	-22.2	0	0	0	119.2
454	L	34.5	Very low	54.4	Low	142 Å²	142	120.3 Å²	120.3	74%	0.743	60%	0.595	S	S	*	*	S	Bend	trans	-102.4	92.6	174.9	-67.8	175.9	0	0	0	112.1	P449	P449-L454 HydrophobicContact CB-CD1 4.38Å; P449-L454 HydrophobicContact CG-CD1 3.92Å
455	S	51.1	Low	57.5	Low	85 Å²	85	113.2 Å²	113.2	59%	0.594	57%	0.568	S	S	*	*			trans	28.9	103.4	167.8	70.7	0	0	0	0	117.3	E457 P458	S455-E457 PolarHBondContact O-N 3.03Å; S455-P458 WeakPolarHBondContact O-CD 3.41Å
456	D	62.3	Low	60.5	Low	94 Å²	94	105 Å²	105	50%	0.503	53%	0.531	S	S	.	.	S	Bend	trans	-49.2	-7.1	170.4	-81.1	-23.7	0	0	0	117.1	R460	D456-R460 HydrophobicContact CB-CG 4.44Å; D456-R460 WeakPolarHBondContact O-CB 3.23Å; D456-R460 VanDerWaalsContact O-CG 3.28Å; D456-R460 WeakPolarHBondContact O-CG 3.33Å; D456-R460 PolarHBondContact O-N 2.79Å; D456-R460 IonicContact OD2-NH1 3.7Å; D456-R460 PolarHBondContact OD2-NH1 3.4Å
457	E	74.6	Confident	63.7	Low	76 Å²	76	96.5 Å²	96.5	36%	0.355	49%	0.491	S	S	.	.	H	α-helix	trans	-60.5	-47.4	-171.9	-83.4	-62.4	114	0	0	115.3	S455 R460 R461	S455-E457 PolarHBondContact O-N 3.03Å; E457-R460 PolarHBondContact O-N 3Å; E457-R460 IonicContact OE1-CZ 3.72Å; E457-R460 VanDerWaalsContact OE1-CZ 3.25Å; E457-R460 IonicContact OE1-NE 3.45Å; E457-R460 PolarHBondContact OE1-NE 3.47Å; E457-R460 IonicContact OE1-NH2 2.87Å; E457-R460 PolarHBondContact OE1-NH2 2.94Å; E457-R461 WeakPolarHBondContact O-CG 3.29Å; E457-R461 PolarHBondContact O-N 3.2Å; E457-R461 IonicContact OE2-CZ 3.93Å; E457-R461 IonicContact OE2-NE 2.87Å; E457-R461 IonicContact OE2-NH2 3.76Å; E457-R461 PolarHBondContact OE2-NH2 3.03Å; E457-R461 VanDerWaalsContact OE2-NH2 3.17Å
458	P	80.4	Confident	66.9	Low	86 Å²	86	87.9 Å²	87.9	56%	0.558	45%	0.451	S	S	*	.	H	α-helix	trans	-66.5	-42.7	179.5	-20.5	34.4	0	0	0	112	S455 R461 Q462	S455-P458 WeakPolarHBondContact O-CD 3.41Å; P458-R461 PolarHBondContact O-N 3.24Å; P458-Q462 WeakPolarHBondContact O-CB 3.49Å; P458-Q462 PolarHBondContact O-N 3.5Å
459	W	84	Confident	69.8	Low	68 Å²	68	84.5 Å²	84.5	26%	0.258	43%	0.433	S	S	.	.	H	α-helix	trans	-59.6	-47.6	174.6	174.1	87.2	0	0	0	110.9	R413 R461 Q462 V463	R413-W459 HydrophobicContact CB-CZ2 4.32Å; R413-W459 HydrophobicContact CG-CH2 3.61Å; R413-W459 HydrophobicContact CG-CZ2 3.27Å; W459-R461 PolarHBondContact O-N 2.84Å; W459-Q462 PolarHBondContact O-N 3.26Å; W459-V463 HydrophobicContact CD2-CG2 4Å; W459-V463 VanDerWaalsContact CE2-CG2 3.47Å; W459-V463 HydrophobicContact CG-CG2 4.37Å; W459-V463 HydrophobicContact CH2-CG2 4.32Å; W459-V463 HydrophobicContact CZ2-CB 4.42Å; W459-V463 HydrophobicContact CZ2-CG2 3.64Å; W459-V463 WeakPolarHBondContact O-CG2 3.27Å; W459-V463 PolarHBondContact O-N 3.17Å
460	R	84.1	Confident	72.9	Confident	57 Å²	57	80.7 Å²	80.7	22%	0.215	41%	0.408	C	S	.	.	H	α-helix	trans	-54.4	-50.8	176.6	-82.3	-169.4	-76.7	-100.8	1	111.5	D456 E457 Q462 V463 I464	D456-R460 HydrophobicContact CB-CG 4.44Å; D456-R460 WeakPolarHBondContact O-CB 3.23Å; D456-R460 VanDerWaalsContact O-CG 3.28Å; D456-R460 WeakPolarHBondContact O-CG 3.33Å; D456-R460 PolarHBondContact O-N 2.79Å; D456-R460 IonicContact OD2-NH1 3.7Å; D456-R460 PolarHBondContact OD2-NH1 3.4Å; E457-R460 PolarHBondContact O-N 3Å; E457-R460 IonicContact OE1-CZ 3.72Å; E457-R460 VanDerWaalsContact OE1-CZ 3.25Å; E457-R460 IonicContact OE1-NE 3.45Å; E457-R460 PolarHBondContact OE1-NE 3.47Å; E457-R460 IonicContact OE1-NH2 2.87Å; E457-R460 PolarHBondContact OE1-NH2 2.94Å; R460-Q462 VanDerWaalsContact C-N 3.34Å; R460-Q462 PolarHBondContact O-N 3.3Å; R460-V463 PolarHBondContact O-N 3.01Å; R460-I464 WeakPolarHBondContact O-CB 3.29Å; R460-I464 WeakPolarHBondContact O-CD1 3.48Å; R460-I464 WeakPolarHBondContact O-CG1 3.29Å; R460-I464 PolarHBondContact O-N 3.03Å
461	R	87.3	Confident	76.1	Confident	168 Å²	168	72.9 Å²	72.9	63%	0.634	37%	0.366	S	S	*	.	H	α-helix	trans	-60.2	-43.4	179.5	-71.7	176.9	-166.4	166	10.5	112	E457 P458 W459 A465	E457-R461 WeakPolarHBondContact O-CG 3.29Å; E457-R461 PolarHBondContact O-N 3.2Å; E457-R461 IonicContact OE2-CZ 3.93Å; E457-R461 IonicContact OE2-NE 2.87Å; E457-R461 IonicContact OE2-NH2 3.76Å; E457-R461 PolarHBondContact OE2-NH2 3.03Å; E457-R461 VanDerWaalsContact OE2-NH2 3.17Å; P458-R461 PolarHBondContact O-N 3.24Å; W459-R461 PolarHBondContact O-N 2.84Å; R461-A465 WeakPolarHBondContact O-CB 3.5Å; R461-A465 PolarHBondContact O-N 3.5Å
462	Q	87.3	Confident	78.8	Confident	49 Å²	49	67.6 Å²	67.6	23%	0.229	33%	0.328	C	S	.	.	H	α-helix	trans	-65	-45.5	179.1	-173.9	59.1	41.5	0	0	111.8	I417 P458 W459 R460 I464 A465 N466	I417-Q462 HydrophobicContact CG2-CG 4.06Å; P458-Q462 WeakPolarHBondContact O-CB 3.49Å; P458-Q462 PolarHBondContact O-N 3.5Å; W459-Q462 PolarHBondContact O-N 3.26Å; R460-Q462 VanDerWaalsContact C-N 3.34Å; R460-Q462 PolarHBondContact O-N 3.3Å; Q462-I464 PolarHBondContact O-N 3.46Å; Q462-A465 PolarHBondContact O-N 2.78Å; Q462-N466 PolarHBondContact NE2-OD1 3.24Å; Q462-N466 WeakPolarHBondContact O-CB 3.49Å; Q462-N466 PolarHBondContact O-N 3.07Å
463	V	90.3	Very high	81.3	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.012	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-40.6	179	170.7	0	0	0	0	111.5	Y408 L409 Q412 I417 W459 R460 N466 L467	Y408-V463 HydrophobicContact CE1-CG1 4.23Å; L409-V463 HydrophobicContact CD2-CG1 3.49Å; L409-V463 VanDerWaalsContact CD2-CG1 3.49Å; Q412-V463 HydrophobicContact CB-CG1 4.32Å; Q412-V463 HydrophobicContact CB-CG2 4.26Å; Q412-V463 HydrophobicContact CG-CG1 4.31Å; I417-V463 HydrophobicContact CD1-CG2 3.69Å; W459-V463 HydrophobicContact CD2-CG2 4Å; W459-V463 VanDerWaalsContact CE2-CG2 3.47Å; W459-V463 HydrophobicContact CG-CG2 4.37Å; W459-V463 HydrophobicContact CH2-CG2 4.32Å; W459-V463 HydrophobicContact CZ2-CB 4.42Å; W459-V463 HydrophobicContact CZ2-CG2 3.64Å; W459-V463 WeakPolarHBondContact O-CG2 3.27Å; W459-V463 PolarHBondContact O-N 3.17Å; R460-V463 PolarHBondContact O-N 3.01Å; V463-N466 PolarHBondContact O-N 2.86Å; V463-L467 WeakPolarHBondContact O-CB 3.31Å; V463-L467 PolarHBondContact O-N 3.34Å
464	I	92.3	Very high	84.1	Confident	12 Å²	12	51.9 Å²	51.9	6%	0.062	26%	0.26	C	S	.	.	H	α-helix	trans	-62.9	-43.6	174.7	-71	161.6	0	0	0	110.9	A328 V335 R460 Q462 L467 A468	A328-I464 HydrophobicContact CB-CG2 3.43Å; A328-I464 VanDerWaalsContact CB-CG2 3.43Å; V335-I464 HydrophobicContact CB-CD1 4.27Å; V335-I464 HydrophobicContact CB-CG1 4.06Å; V335-I464 HydrophobicContact CG1-CD1 4.14Å; V335-I464 HydrophobicContact CG1-CG1 3.95Å; V335-I464 HydrophobicContact CG2-CG1 4.05Å; R460-I464 WeakPolarHBondContact O-CB 3.29Å; R460-I464 WeakPolarHBondContact O-CD1 3.48Å; R460-I464 WeakPolarHBondContact O-CG1 3.29Å; R460-I464 PolarHBondContact O-N 3.03Å; Q462-I464 PolarHBondContact O-N 3.46Å; I464-L467 PolarHBondContact O-N 3.45Å; I464-A468 WeakPolarHBondContact O-CB 3.35Å; I464-A468 PolarHBondContact O-N 3.08Å
465	A	91.2	Very high	87	Confident	36 Å²	36	45.1 Å²	45.1	30%	0.298	23%	0.225	S	C	.	.	H	α-helix	trans	-64	-42.3	176.5	0	0	0	0	0	111.9	R461 Q462 A468 K469	R461-A465 WeakPolarHBondContact O-CB 3.5Å; R461-A465 PolarHBondContact O-N 3.5Å; Q462-A465 PolarHBondContact O-N 2.78Å; A465-A468 PolarHBondContact O-N 3.37Å; A465-K469 WeakPolarHBondContact O-CG 3.42Å; A465-K469 PolarHBondContact O-N 2.9Å
466	N	91.6	Very high	89	Confident	13 Å²	13	42 Å²	42	7%	0.07	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-44.7	175.7	-75.1	-8.6	0	0	0	111.3	Q462 V463 A468 K469 H470 P637	Q462-N466 PolarHBondContact NE2-OD1 3.24Å; Q462-N466 WeakPolarHBondContact O-CB 3.49Å; Q462-N466 PolarHBondContact O-N 3.07Å; V463-N466 PolarHBondContact O-N 2.86Å; N466-A468 VanDerWaalsContact C-N 3.31Å; N466-A468 PolarHBondContact O-N 3.3Å; N466-K469 PolarHBondContact O-N 3.4Å; N466-H470 VanDerWaalsContact O-CB 3.29Å; N466-H470 WeakPolarHBondContact O-CB 3.41Å; N466-H470 PolarHBondContact O-N 3.27Å; N466-P637 HydrophobicContact CB-CB 4.03Å; N466-P637 HydrophobicContact CB-CG 4Å; N466-P637 VanDerWaalsContact O-CG 3.31Å; N466-P637 WeakPolarHBondContact O-CG 3.41Å
467	L	94.5	Very high	90.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.7	-45.9	175.3	178	61.9	0	0	0	111	L331 V335 F403 L405 Y408 V463 I464 K469 H470 V471	L331-L467 HydrophobicContact CD1-CD2 4.05Å; L331-L467 HydrophobicContact CD2-CB 4.35Å; L331-L467 HydrophobicContact CD2-CD2 3.92Å; L331-L467 HydrophobicContact CD2-CG 3.99Å; L331-L467 HydrophobicContact CG-CD2 4.17Å; V335-L467 HydrophobicContact CG2-CD2 4.2Å; F403-L467 HydrophobicContact CE2-CD1 4.06Å; F403-L467 HydrophobicContact CZ-CD1 3.99Å; L405-L467 HydrophobicContact CD1-CD2 3.39Å; Y408-L467 HydrophobicContact CD1-CD1 3.91Å; Y408-L467 HydrophobicContact CD2-CD1 4.29Å; Y408-L467 HydrophobicContact CE1-CB 3.8Å; Y408-L467 HydrophobicContact CE1-CD1 3.77Å; Y408-L467 HydrophobicContact CE1-CG 4.24Å; Y408-L467 HydrophobicContact CE2-CD1 4.15Å; Y408-L467 HydrophobicContact CG-CD1 4.19Å; Y408-L467 WeakPolarHBondContact OH-CA 3.23Å; Y408-L467 PolarHBondContact OH-N 3.17Å; V463-L467 WeakPolarHBondContact O-CB 3.31Å; V463-L467 PolarHBondContact O-N 3.34Å; I464-L467 PolarHBondContact O-N 3.45Å; L467-K469 PolarHBondContact O-N 2.95Å; L467-H470 PolarHBondContact O-N 3.36Å; L467-V471 HydrophobicContact CD1-CG2 4.06Å; L467-V471 HydrophobicContact CG-CG2 4.44Å; L467-V471 WeakPolarHBondContact O-CB 3.48Å; L467-V471 VanDerWaalsContact O-CG2 3.26Å; L467-V471 WeakPolarHBondContact O-CG2 3.24Å; L467-V471 PolarHBondContact O-N 3.44Å
468	A	94.5	Very high	91.4	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-44.2	178.7	0	0	0	0	0	112.5	L313 A326 A328 L331 I464 A465 N466 L472	L313-A468 HydrophobicContact CD1-CB 4.16Å; A326-A468 HydrophobicContact CB-CB 3.63Å; A328-A468 HydrophobicContact CB-CB 4.19Å; L331-A468 HydrophobicContact CD2-CB 3.9Å; I464-A468 WeakPolarHBondContact O-CB 3.35Å; I464-A468 PolarHBondContact O-N 3.08Å; A465-A468 PolarHBondContact O-N 3.37Å; N466-A468 VanDerWaalsContact C-N 3.31Å; N466-A468 PolarHBondContact O-N 3.3Å; A468-L472 WeakPolarHBondContact O-CG 3.45Å; A468-L472 PolarHBondContact O-N 3.26Å; A468-L472 VanDerWaalsContact O-N 3.08Å
469	K	92.9	Very high	92.1	Very high	116 Å²	116	35.4 Å²	35.4	50%	0.504	16%	0.159	S	C	.	.	H	α-helix	trans	-62	-44.7	174.4	-72.8	176.8	-178.2	179.3	0	111.6	A465 N466 L467 L472 F473 P637	A465-K469 WeakPolarHBondContact O-CG 3.42Å; A465-K469 PolarHBondContact O-N 2.9Å; N466-K469 PolarHBondContact O-N 3.4Å; L467-K469 PolarHBondContact O-N 2.95Å; K469-L472 PolarHBondContact O-N 3.22Å; K469-F473 VanDerWaalsContact O-CB 3.28Å; K469-F473 WeakPolarHBondContact O-CB 3.48Å; K469-F473 PolarHBondContact O-N 3.5Å; K469-P637 HydrophobicContact CB-CG 4.4Å
470	H	94.3	Very high	92.6	Very high	9 Å²	9	32.2 Å²	32.2	4%	0.042	15%	0.147	C	C	.	.	H	α-helix	trans	-62.6	-45.5	-179.8	-171.3	-66.8	0	0	0	111.8	C64 N466 L467 F473 T474 P637	C64-H470 VanDerWaalsContact CB-NE2 3.32Å; C64-H470 WeakPolarHBondContact CB-NE2 3.38Å; N466-H470 VanDerWaalsContact O-CB 3.29Å; N466-H470 WeakPolarHBondContact O-CB 3.41Å; N466-H470 PolarHBondContact O-N 3.27Å; L467-H470 PolarHBondContact O-N 3.36Å; H470-F473 PolarHBondContact O-N 3.23Å; H470-T474 PolarHBondContact ND1-OG1 2.77Å; H470-T474 WeakPolarHBondContact O-CB 3.43Å; H470-T474 PolarHBondContact O-N 3.34Å; H470-T474 PolarHBondContact O-OG1 3.44Å; H470-P637 HydrophobicContact CB-CG 3.89Å
471	V	95.6	Very high	93.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.3	-49.9	177.7	167.2	0	0	0	0	111	L226 L313 V348 P350 F403 L467 F473 T474 A475	L226-V471 HydrophobicContact CB-CG1 3.42Å; L226-V471 VanDerWaalsContact CB-CG1 3.42Å; L226-V471 HydrophobicContact CD1-CB 4.27Å; L226-V471 HydrophobicContact CD1-CG1 3.61Å; L226-V471 HydrophobicContact CD1-CG2 3.93Å; L226-V471 HydrophobicContact CG-CG1 4.13Å; L313-V471 HydrophobicContact CD1-CB 4.27Å; L313-V471 HydrophobicContact CD1-CG1 4Å; V348-V471 HydrophobicContact CG1-CG2 4.03Å; P350-V471 HydrophobicContact CB-CG1 3.98Å; P350-V471 HydrophobicContact CG-CG1 4.13Å; P350-V471 HydrophobicContact CG-CG2 4.41Å; F403-V471 HydrophobicContact CZ-CG2 4.13Å; L467-V471 HydrophobicContact CD1-CG2 4.06Å; L467-V471 HydrophobicContact CG-CG2 4.44Å; L467-V471 WeakPolarHBondContact O-CB 3.48Å; L467-V471 VanDerWaalsContact O-CG2 3.26Å; L467-V471 WeakPolarHBondContact O-CG2 3.24Å; L467-V471 PolarHBondContact O-N 3.44Å; V471-F473 VanDerWaalsContact C-N 3.33Å; V471-F473 PolarHBondContact O-N 2.95Å; V471-T474 PolarHBondContact O-N 2.97Å; V471-A475 WeakPolarHBondContact O-CB 3.4Å; V471-A475 PolarHBondContact O-N 2.6Å
472	L	94.1	Very high	93.7	Very high	12 Å²	12	21.5 Å²	21.5	6%	0.063	11%	0.107	C	C	.	.	H	α-helix	trans	-61.9	-41.8	178.9	-76	-177.5	0	0	0	111.9	L313 E314 A326 A468 K469 T474 A475 N476	L313-L472 HydrophobicContact CB-CD1 4.46Å; L313-L472 HydrophobicContact CB-CD2 4.22Å; L313-L472 HydrophobicContact CB-CG 4.36Å; L313-L472 HydrophobicContact CD1-CG 4.26Å; E314-L472 HydrophobicContact CG-CD1 4.47Å; E314-L472 HydrophobicContact CG-CD2 4.19Å; A326-L472 HydrophobicContact CB-CD1 3.66Å; A468-L472 WeakPolarHBondContact O-CG 3.45Å; A468-L472 PolarHBondContact O-N 3.26Å; A468-L472 VanDerWaalsContact O-N 3.08Å; K469-L472 PolarHBondContact O-N 3.22Å; L472-T474 VanDerWaalsContact C-N 3.35Å; L472-A475 PolarHBondContact O-N 3.22Å; L472-N476 VanDerWaalsContact O-CB 3.29Å; L472-N476 WeakPolarHBondContact O-CB 3.49Å; L472-N476 PolarHBondContact O-N 3.2Å
473	F	94.3	Very high	94.1	Very high	42 Å²	42	19.2 Å²	19.2	18%	0.184	10%	0.096	C	C	.	.	H	α-helix	trans	-59.6	-46.9	175	-177.9	-89.2	0	0	0	111.1	K469 H470 V471 N476 K477 A633 P636	K469-F473 VanDerWaalsContact O-CB 3.28Å; K469-F473 WeakPolarHBondContact O-CB 3.48Å; K469-F473 PolarHBondContact O-N 3.5Å; H470-F473 PolarHBondContact O-N 3.23Å; V471-F473 VanDerWaalsContact C-N 3.33Å; V471-F473 PolarHBondContact O-N 2.95Å; F473-N476 PolarHBondContact O-N 3.45Å; F473-K477 HydrophobicContact CE1-CD 3.97Å; F473-K477 HydrophobicContact CZ-CD 4.42Å; F473-K477 VanDerWaalsContact O-CB 3.26Å; F473-K477 WeakPolarHBondContact O-CB 3.44Å; F473-K477 PolarHBondContact O-N 3.19Å; F473-A633 HydrophobicContact CD2-CB 4.14Å; F473-P636 HydrophobicContact CD1-CB 3.88Å; F473-P636 HydrophobicContact CD1-CG 4.24Å; F473-P636 HydrophobicContact CE1-CB 4.24Å; F473-P636 HydrophobicContact CE1-CG 4.08Å; F473-P636 HydrophobicContact CG-CB 4.27Å
474	T	95.4	Very high	94.4	Very high	21 Å²	21	19.1 Å²	19.1	13%	0.129	10%	0.096	C	C	.	.	H	α-helix	trans	-64.4	-46.2	-179.6	-53	0	0	0	0	111.4	P350 T400 H470 V471 L472 K477 S478	P350-T474 HydrophobicContact CG-CG2 4.41Å; T400-T474 HydrophobicContact CG2-CG2 4.17Å; H470-T474 PolarHBondContact ND1-OG1 2.77Å; H470-T474 WeakPolarHBondContact O-CB 3.43Å; H470-T474 PolarHBondContact O-N 3.34Å; H470-T474 PolarHBondContact O-OG1 3.44Å; V471-T474 PolarHBondContact O-N 2.97Å; L472-T474 VanDerWaalsContact C-N 3.35Å; T474-K477 PolarHBondContact O-N 3.19Å; T474-S478 WeakPolarHBondContact O-CB 3.33Å; T474-S478 PolarHBondContact O-N 2.84Å; T474-S478 PolarHBondContact O-OG 2.86Å; T474-S478 VanDerWaalsContact O-OG 3.12Å
475	A	95.3	Very high	94.7	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.9	-40.1	178.8	0	0	0	0	0	112.5	V228 P350 G352 V471 L472 S478 S479	V228-A475 HydrophobicContact CG1-CB 3.89Å; P350-A475 HydrophobicContact CB-CB 3.99Å; G352-A475 VanDerWaalsContact CA-O 3.26Å; G352-A475 WeakPolarHBondContact CA-O 3.31Å; V471-A475 WeakPolarHBondContact O-CB 3.4Å; V471-A475 PolarHBondContact O-N 2.6Å; L472-A475 PolarHBondContact O-N 3.22Å; A475-S478 PolarHBondContact O-OG 2.81Å; A475-S478 VanDerWaalsContact O-OG 3.07Å; A475-S479 PolarHBondContact O-N 3.35Å; A475-S479 PolarHBondContact O-OG 3.45Å
476	N	93.8	Very high	95	Very high	21 Å²	21	17.3 Å²	17.3	11%	0.112	8%	0.081	C	C	.	.	H	α-helix	trans	-69.3	-46.2	175.9	-169.2	62.4	0	0	0	111.2	V228 P323 L472 F473 S478 S479 H577	V228-N476 HydrophobicContact CG1-CB 4.48Å; P323-N476 HydrophobicContact CG-CB 4.15Å; L472-N476 VanDerWaalsContact O-CB 3.29Å; L472-N476 WeakPolarHBondContact O-CB 3.49Å; L472-N476 PolarHBondContact O-N 3.2Å; F473-N476 PolarHBondContact O-N 3.45Å; N476-S478 VanDerWaalsContact C-N 3.26Å; N476-S478 PolarHBondContact O-N 3.5Å; N476-S479 VanDerWaalsContact O-CB 3.28Å; N476-S479 WeakPolarHBondContact O-CB 3.05Å; N476-S479 PolarHBondContact O-N 3.12Å; N476-H577 WeakPolarHBondContact ND2-CB 3.5Å; N476-H577 PolarHBondContact O-NE2 3.49Å
477	K	93.3	Very high	95.3	Very high	109 Å²	109	16.7 Å²	16.7	47%	0.474	8%	0.078	S	C	.	.	H	α-helix	trans	-60.9	-33.3	177.4	-177	173.5	-178.7	174.1	0	112.8	F473 T474 S479 F520	F473-K477 HydrophobicContact CE1-CD 3.97Å; F473-K477 HydrophobicContact CZ-CD 4.42Å; F473-K477 VanDerWaalsContact O-CB 3.26Å; F473-K477 WeakPolarHBondContact O-CB 3.44Å; F473-K477 PolarHBondContact O-N 3.19Å; T474-K477 PolarHBondContact O-N 3.19Å; K477-S479 VanDerWaalsContact C-N 3.33Å; K477-F520 HydrophobicContact CG-CE1 3.99Å; K477-F520 HydrophobicContact CG-CZ 4.23Å; K477-F520 WeakPolarHBondContact O-CE1 3.5Å
478	S	93.9	Very high	95.4	Very high	4 Å²	4	16.7 Å²	16.7	3%	0.028	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-8.4	177.2	66.3	0	0	0	0	114.3	D398 T400 T474 A475 N476 A480	D398-S478 WeakPolarHBondContact CB-O 3.28Å; T400-S478 WeakPolarHBondContact CG2-OG 3.32Å; T474-S478 WeakPolarHBondContact O-CB 3.33Å; T474-S478 PolarHBondContact O-N 2.84Å; T474-S478 PolarHBondContact O-OG 2.86Å; T474-S478 VanDerWaalsContact O-OG 3.12Å; A475-S478 PolarHBondContact O-OG 2.81Å; A475-S478 VanDerWaalsContact O-OG 3.07Å; N476-S478 VanDerWaalsContact C-N 3.26Å; N476-S478 PolarHBondContact O-N 3.5Å; S478-A480 PolarHBondContact O-N 2.8Å
479	S	94.6	Very high	95.6	Very high	3 Å²	3	16.7 Å²	16.7	2%	0.021	8%	0.077	C	C	.	.	S	Bend	trans	-72.5	123.9	-178.7	-65.5	0	0	0	0	110	G352 I353 A475 N476 K477	G352-S479 WeakPolarHBondContact CA-OG 3.49Å; I353-S479 PolarHBondContact N-OG 3.17Å; A475-S479 PolarHBondContact O-N 3.35Å; A475-S479 PolarHBondContact O-OG 3.45Å; N476-S479 VanDerWaalsContact O-CB 3.28Å; N476-S479 WeakPolarHBondContact O-CB 3.05Å; N476-S479 PolarHBondContact O-N 3.12Å; K477-S479 VanDerWaalsContact C-N 3.33Å
480	A	94.9	Very high	95.8	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.008	5%	0.053	C	C	.	.	P	Polyproline II helix	trans	-62.1	147	180	0	0	0	0	0	113.3	S354 R396 D398 S478 D521	S354-A480 WeakPolarHBondContact CB-O 3.33Å; S354-A480 PolarHBondContact OG-O 3.39Å; R396-A480 HydrophobicContact CB-CB 4.23Å; R396-A480 HydrophobicContact CG-CB 3.53Å; D398-A480 PolarHBondContact OD2-N 2.71Å; S478-A480 PolarHBondContact O-N 2.8Å; A480-D521 WeakPolarHBondContact CA-O 3.49Å
481	V	96.6	Very high	95.9	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.051	C	C	.	.	B	Isolated β-bridge	trans	-83.3	125.7	174.1	-179.1	0	0	0	0	110.1	H485 I486 I515 D521 L522 G523 L575 V578	V481-H485 HydrophobicContact CG1-CB 4.08Å; V481-I486 HydrophobicContact CG1-CD1 4.36Å; V481-I486 HydrophobicContact CG1-CG1 3.91Å; V481-I515 HydrophobicContact CB-CG2 4.28Å; V481-I515 HydrophobicContact CG1-CD1 3.97Å; V481-I515 HydrophobicContact CG2-CG2 3.96Å; V481-D521 PolarHBondContact N-O 2.8Å; V481-L522 HydrophobicContact CB-CD2 4.22Å; V481-L522 CarbonylContact O-C 3.6Å; V481-L522 WeakPolarHBondContact O-CA 3.4Å; V481-G523 PolarHBondContact O-N 2.97Å; V481-L575 HydrophobicContact CG1-CD1 3.5Å; V481-L575 HydrophobicContact CG1-CG 4.22Å; V481-V578 HydrophobicContact CG2-CG2 4.07Å
482	M	96.7	Very high	95.8	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.052	C	C	.	.	P	Polyproline II helix	trans	-90.1	163.8	-178.3	-53.9	-54.8	-62.8	0	0	111.8	D356 C394 R396 T484 H485 I486	D356-M482 HydrophobicContact CB-CE 4.38Å; D356-M482 WeakPolarHBondContact OD1-CB 3.33Å; D356-M482 WeakPolarHBondContact OD1-CE 3.49Å; C394-M482 HydrophobicContact CB-CE 4.18Å; R396-M482 HydrophobicContact CB-SD 4.13Å; M482-T484 PolarHBondContact O-N 3.15Å; M482-H485 PolarHBondContact N-ND1 3.38Å; M482-H485 VanDerWaalsContact N-ND1 3.13Å; M482-H485 WeakPolarHBondContact O-CB 3.45Å; M482-H485 PolarHBondContact O-N 3.11Å; M482-I486 PolarHBondContact O-N 3.18Å
483	S	96.7	Very high	95.8	Very high	1 Å²	1	10.5 Å²	10.5	1%	0.007	5%	0.05	C	C	.	.	H	α-helix	trans	-66.6	-39.5	-176.4	61.2	0	0	0	0	111.8	D356 H485 I486 V487 F524 V531	D356-S483 PolarHBondContact OD1-N 2.99Å; D356-S483 PolarHBondContact OD1-OG 3.42Å; S483-H485 VanDerWaalsContact C-N 3.28Å; S483-H485 PolarHBondContact O-N 3.18Å; S483-I486 PolarHBondContact O-N 2.87Å; S483-V487 PolarHBondContact O-N 3.28Å; S483-V487 VanDerWaalsContact O-N 3.1Å; S483-F524 VanDerWaalsContact N-CD1 3.34Å; S483-V531 VanDerWaalsContact CB-CG1 3.43Å
484	T	96.8	Very high	95.8	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-63.3	-31.9	175.6	55.4	0	0	0	0	112.8	D356 M482 A488 A535 L538 L539	D356-T484 HydrophobicContact CB-CG2 4.27Å; D356-T484 WeakPolarHBondContact O-CB 3.45Å; D356-T484 VanDerWaalsContact O-CG2 3.25Å; D356-T484 WeakPolarHBondContact O-CG2 3.32Å; D356-T484 PolarHBondContact O-OG1 2.73Å; M482-T484 PolarHBondContact O-N 3.15Å; T484-A488 WeakPolarHBondContact O-CB 3.48Å; T484-A488 PolarHBondContact O-N 3.05Å; T484-A535 HydrophobicContact CG2-CB 4.13Å; T484-L538 HydrophobicContact CG2-CB 4.06Å; T484-L538 HydrophobicContact CG2-CD1 4.01Å; T484-L539 HydrophobicContact CG2-CD1 4.42Å; T484-L539 HydrophobicContact CG2-CG 4.19Å
485	H	97.6	Very high	95.7	Very high	11 Å²	11	9.9 Å²	9.9	5%	0.051	5%	0.045	C	C	.	.	H	α-helix	trans	-63.5	-46.3	175.7	-54.9	164.3	0	0	0	111	V481 M482 S483 C489 Y571 L575	V481-H485 HydrophobicContact CG1-CB 4.08Å; M482-H485 PolarHBondContact N-ND1 3.38Å; M482-H485 VanDerWaalsContact N-ND1 3.13Å; M482-H485 WeakPolarHBondContact O-CB 3.45Å; M482-H485 PolarHBondContact O-N 3.11Å; S483-H485 VanDerWaalsContact C-N 3.28Å; S483-H485 PolarHBondContact O-N 3.18Å; H485-C489 VanDerWaalsContact O-CB 3.23Å; H485-C489 WeakPolarHBondContact O-CB 3.39Å; H485-C489 PolarHBondContact O-N 3.14Å; H485-Y571 WeakPolarHBondContact CA-O 3.22Å; H485-Y571 WeakPolarHBondContact CB-O 3.44Å; H485-Y571 PolarHBondContact CD2-O 2.96Å; H485-L575 HydrophobicContact CB-CD1 3.31Å
486	I	97.9	Very high	95.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-65.5	-49.5	-179.1	-62	177.1	0	0	0	110.3	V481 M482 S483 A488 C489 L490 F508 M511 K512 I515 L522 F524 L575	V481-I486 HydrophobicContact CG1-CD1 4.36Å; V481-I486 HydrophobicContact CG1-CG1 3.91Å; M482-I486 PolarHBondContact O-N 3.18Å; S483-I486 PolarHBondContact O-N 2.87Å; I486-A488 PolarHBondContact O-N 3.35Å; I486-C489 PolarHBondContact O-N 3.02Å; I486-L490 HydrophobicContact CG2-CD1 3.9Å; I486-L490 HydrophobicContact CG2-CG 4.37Å; I486-L490 WeakPolarHBondContact O-CG 3.46Å; I486-L490 PolarHBondContact O-N 3.33Å; I486-F508 HydrophobicContact CB-CD2 3.87Å; I486-F508 HydrophobicContact CB-CE2 3.66Å; I486-F508 HydrophobicContact CD1-CE2 3.99Å; I486-F508 HydrophobicContact CD1-CZ 4.12Å; I486-F508 HydrophobicContact CG1-CE2 4.38Å; I486-F508 HydrophobicContact CG2-CD2 3.34Å; I486-F508 HydrophobicContact CG2-CE2 3.66Å; I486-F508 HydrophobicContact CG2-CG 4.11Å; I486-M511 HydrophobicContact CG2-CB 3.92Å; I486-M511 HydrophobicContact CG2-CG 3.77Å; I486-K512 HydrophobicContact CD1-CB 4.41Å; I486-I515 HydrophobicContact CD1-CD1 3.6Å; I486-I515 HydrophobicContact CG1-CD1 3.73Å; I486-L522 HydrophobicContact CD1-CD2 4.46Å; I486-F524 HydrophobicContact CD1-CE1 3.92Å; I486-F524 HydrophobicContact CD1-CZ 3.63Å; I486-L575 HydrophobicContact CG1-CD1 4.07Å; I486-L575 HydrophobicContact CG1-CD2 4.3Å
487	V	97.7	Very high	95.4	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61.3	-45.7	-179.9	172.7	0	0	0	0	111	S483 C489 L490 L491 F508 V532 A535 L536 L539	S483-V487 PolarHBondContact O-N 3.28Å; S483-V487 VanDerWaalsContact O-N 3.1Å; V487-C489 PolarHBondContact O-N 3.49Å; V487-L490 PolarHBondContact O-N 3.09Å; V487-L491 HydrophobicContact CG1-CD1 3.83Å; V487-L491 HydrophobicContact CG1-CG 4.27Å; V487-L491 WeakPolarHBondContact O-CB 3.38Å; V487-L491 VanDerWaalsContact O-CG 3.27Å; V487-L491 WeakPolarHBondContact O-CG 3.48Å; V487-L491 PolarHBondContact O-N 3.01Å; V487-F508 HydrophobicContact CG2-CD2 3.84Å; V487-F508 HydrophobicContact CG2-CE2 4.04Å; V487-V532 HydrophobicContact CG2-CG2 4.44Å; V487-A535 HydrophobicContact CB-CB 4.22Å; V487-A535 HydrophobicContact CG2-CB 3.73Å; V487-L536 HydrophobicContact CG1-CD2 3.87Å; V487-L536 HydrophobicContact CG1-CG 4.49Å; V487-L539 HydrophobicContact CB-CD1 4.38Å; V487-L539 HydrophobicContact CG1-CD1 4.12Å
488	A	97.1	Very high	95.4	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-62.1	-42	177.8	0	0	0	0	0	112.4	T484 I486 L491 L492 L539 L568	T484-A488 WeakPolarHBondContact O-CB 3.48Å; T484-A488 PolarHBondContact O-N 3.05Å; I486-A488 PolarHBondContact O-N 3.35Å; A488-L491 PolarHBondContact O-N 3.32Å; A488-L492 WeakPolarHBondContact O-CB 3.49Å; A488-L492 WeakPolarHBondContact O-CG 3.46Å; A488-L492 PolarHBondContact O-N 3.27Å; A488-L539 HydrophobicContact CB-CD1 4.43Å; A488-L568 HydrophobicContact CB-CD2 4.02Å; A488-L568 WeakPolarHBondContact CB-O 3.29Å
489	C	97.3	Very high	95.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.2	-46.6	176.2	-178.9	0	0	0	0	112.2	H485 I486 V487 L492 Y493 L575	H485-C489 VanDerWaalsContact O-CB 3.23Å; H485-C489 WeakPolarHBondContact O-CB 3.39Å; H485-C489 PolarHBondContact O-N 3.14Å; I486-C489 PolarHBondContact O-N 3.02Å; V487-C489 PolarHBondContact O-N 3.49Å; C489-L492 PolarHBondContact O-N 3.01Å; C489-Y493 HydrophobicContact CB-CD2 4.47Å; C489-Y493 WeakPolarHBondContact O-CB 3.42Å; C489-Y493 VanDerWaalsContact O-CD2 3.27Å; C489-Y493 WeakPolarHBondContact O-CD2 3.35Å; C489-Y493 PolarHBondContact O-N 3.07Å; C489-L575 HydrophobicContact CB-CB 4.46Å; C489-L575 HydrophobicContact CB-CD1 4.5Å; C489-L575 HydrophobicContact CB-CD2 3.85Å
490	L	97.1	Very high	95.4	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.4	-44.1	178.1	-72.1	173.7	0	0	0	111.5	I486 V487 L492 R494 H495 L504 D507 F508 M511	I486-L490 HydrophobicContact CG2-CD1 3.9Å; I486-L490 HydrophobicContact CG2-CG 4.37Å; I486-L490 WeakPolarHBondContact O-CG 3.46Å; I486-L490 PolarHBondContact O-N 3.33Å; V487-L490 PolarHBondContact O-N 3.09Å; L490-L492 PolarHBondContact O-N 3.06Å; L490-R494 HydrophobicContact CD2-CB 4.43Å; L490-R494 CarbonylContact O-C 3.6Å; L490-R494 WeakPolarHBondContact O-CA 3.47Å; L490-R494 WeakPolarHBondContact O-CB 3.25Å; L490-R494 PolarHBondContact O-N 3.31Å; L490-H495 PolarHBondContact O-N 3.35Å; L490-L504 HydrophobicContact CB-CD1 4.18Å; L490-L504 HydrophobicContact CD1-CD1 4.19Å; L490-D507 HydrophobicContact CD1-CB 4.21Å; L490-D507 HydrophobicContact CD2-CB 4.29Å; L490-F508 HydrophobicContact CD1-CB 4.2Å; L490-M511 HydrophobicContact CD2-CE 3.82Å
491	L	96.4	Very high	95.3	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.5	-37.3	179.1	-69.9	176.8	0	0	0	112.8	V487 A488 H495 R496 V499 V543 I556 P558	V487-L491 HydrophobicContact CG1-CD1 3.83Å; V487-L491 HydrophobicContact CG1-CG 4.27Å; V487-L491 WeakPolarHBondContact O-CB 3.38Å; V487-L491 VanDerWaalsContact O-CG 3.27Å; V487-L491 WeakPolarHBondContact O-CG 3.48Å; V487-L491 PolarHBondContact O-N 3.01Å; A488-L491 PolarHBondContact O-N 3.32Å; L491-H495 CarbonylContact O-C 3.37Å; L491-H495 VanDerWaalsContact O-C 3.3Å; L491-R496 VanDerWaalsContact O-CA 3.23Å; L491-R496 WeakPolarHBondContact O-CA 3.46Å; L491-R496 PolarHBondContact O-N 3.1Å; L491-V499 HydrophobicContact CD2-CG1 4.38Å; L491-V543 HydrophobicContact CD1-CG1 4.44Å; L491-V543 HydrophobicContact CD1-CG2 3.79Å; L491-I556 HydrophobicContact CD1-CG2 4.37Å; L491-I556 HydrophobicContact CD2-CG2 3.91Å; L491-P558 HydrophobicContact CB-CB 4.49Å
492	L	95	Very high	95.2	Very high	3 Å²	3	21.8 Å²	21.8	2%	0.016	12%	0.117	C	C	.	.	H	α-helix	trans	-79	-43.5	180	-71.6	179.9	0	0	0	113.2	A488 C489 L490 L565 L568 N569	A488-L492 WeakPolarHBondContact O-CB 3.49Å; A488-L492 WeakPolarHBondContact O-CG 3.46Å; A488-L492 PolarHBondContact O-N 3.27Å; C489-L492 PolarHBondContact O-N 3.01Å; L490-L492 PolarHBondContact O-N 3.06Å; L492-L565 HydrophobicContact CD2-CD2 4Å; L492-L568 HydrophobicContact CD1-CB 3.79Å; L492-L568 HydrophobicContact CD2-CB 4.09Å; L492-L568 HydrophobicContact CD2-CD1 4.18Å; L492-L568 HydrophobicContact CG-CB 4.01Å; L492-N569 HydrophobicContact CD1-CB 4.29Å
493	Y	94.3	Very high	95.1	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.016	13%	0.129	C	C	.	.	H	α-helix	trans	-106.6	-17.7	-165.7	-54.3	-58.4	0	0	0	114.4	C489 R724 L725 P728	C489-Y493 HydrophobicContact CB-CD2 4.47Å; C489-Y493 WeakPolarHBondContact O-CB 3.42Å; C489-Y493 VanDerWaalsContact O-CD2 3.27Å; C489-Y493 WeakPolarHBondContact O-CD2 3.35Å; C489-Y493 PolarHBondContact O-N 3.07Å; Y493-R724 HydrophobicContact CD1-CB 4.31Å; Y493-R724 VanDerWaalsContact CD1-O 3.3Å; Y493-R724 WeakPolarHBondContact CD1-O 3.45Å; Y493-R724 WeakPolarHBondContact CE1-O 3.41Å; Y493-R724 WeakPolarHBondContact O-CD 3.32Å; Y493-R724 PolarHBondContact O-NH1 3.36Å; Y493-L725 HydrophobicContact CD2-CD2 3.48Å; Y493-L725 VanDerWaalsContact CD2-CD2 3.48Å; Y493-L725 HydrophobicContact CE2-CD2 3.79Å; Y493-L725 HydrophobicContact CG-CD2 3.99Å; Y493-P728 HydrophobicContact CE1-CG 3.84Å
494	R	92.7	Very high	95	Very high	29 Å²	29	24.5 Å²	24.5	11%	0.109	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-49.1	175.7	-163.2	175.1	-171.1	138	-5.2	112.6	L490 D507 E717	L490-R494 HydrophobicContact CD2-CB 4.43Å; L490-R494 CarbonylContact O-C 3.6Å; L490-R494 WeakPolarHBondContact O-CA 3.47Å; L490-R494 WeakPolarHBondContact O-CB 3.25Å; L490-R494 PolarHBondContact O-N 3.31Å; R494-D507 IonicContact NE-OD2 2.67Å; R494-E717 IonicContact CZ-OE1 3.64Å; R494-E717 IonicContact CZ-OE2 2.94Å; R494-E717 IonicContact NE-OE1 3.77Å; R494-E717 PolarHBondContact NE-OE1 3.43Å; R494-E717 IonicContact NH2-OE1 3.1Å; R494-E717 PolarHBondContact NH2-OE1 3.02Å; R494-E717 IonicContact NH2-OE2 2.82Å; R494-E717 PolarHBondContact NH2-OE2 3.01Å
495	H	94.3	Very high	95	Very high	21 Å²	21	25.7 Å²	25.7	10%	0.097	14%	0.136	C	C	.	.			trans	-113.5	39	-165.6	-65.5	-46.3	0	0	0	114	L490 L491 Q497 G498 V499 D507	L490-H495 PolarHBondContact O-N 3.35Å; L491-H495 CarbonylContact O-C 3.37Å; L491-H495 VanDerWaalsContact O-C 3.3Å; H495-Q497 PolarHBondContact O-N 2.94Å; H495-G498 PolarHBondContact O-N 2.82Å; H495-V499 HydrophobicContact CB-CB 3.79Å; H495-V499 HydrophobicContact CB-CG1 3.7Å; H495-D507 IonicContact CD2-OD2 2.67Å; H495-D507 IonicContact CE1-OD2 3.97Å; H495-D507 PolarHBondContact CE1-OD2 3.48Å; H495-D507 IonicContact NE2-OD2 3.77Å; H495-D507 PolarHBondContact NE2-OD2 3.4Å
496	R	90.8	Very high	94.8	Very high	68 Å²	68	28.8 Å²	28.8	26%	0.257	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-26.6	-172.8	-165.8	166.7	-179.2	-166.2	-10.6	114.6	L491 G498 P558 A770	L491-R496 VanDerWaalsContact O-CA 3.23Å; L491-R496 WeakPolarHBondContact O-CA 3.46Å; L491-R496 PolarHBondContact O-N 3.1Å; R496-G498 VanDerWaalsContact C-N 3.31Å; R496-P558 HydrophobicContact CG-CG 4.47Å; R496-P558 WeakPolarHBondContact O-CG 3.33Å; R496-A770 PolarHBondContact NH1-O 3.1Å; R496-A770 PolarHBondContact NH2-O 3.15Å
497	Q	90.9	Very high	94.7	Very high	169 Å²	169	28.9 Å²	28.9	79%	0.79	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.5	175.9	-57.3	-57.2	-22.9	0	0	113.3	H495	H495-Q497 PolarHBondContact O-N 2.94Å
498	G	93	Very high	94.6	Very high	23 Å²	23	28.9 Å²	28.9	24%	0.237	15%	0.151	C	C	.	.			trans	102.2	157.4	-175.1	0	0	0	0	0	113.2	H495 R496 I556	H495-G498 PolarHBondContact O-N 2.82Å; R496-G498 VanDerWaalsContact C-N 3.31Å; G498-I556 CarbonylContact C-O 3.54Å; G498-I556 WeakPolarHBondContact CA-O 3.33Å
499	V	95.1	Very high	94.5	Very high	12 Å²	12	32.5 Å²	32.5	7%	0.073	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	150.2	-175	62.2	0	0	0	0	110.7	L491 H495 K503 L504 T555 I556	L491-V499 HydrophobicContact CD2-CG1 4.38Å; H495-V499 HydrophobicContact CB-CB 3.79Å; H495-V499 HydrophobicContact CB-CG1 3.7Å; V499-K503 HydrophobicContact CG2-CB 3.74Å; V499-K503 HydrophobicContact CG2-CG 3.75Å; V499-L504 HydrophobicContact CG1-CB 3.91Å; V499-L504 HydrophobicContact CG1-CD1 4.23Å; V499-L504 HydrophobicContact CG1-CD2 4.5Å; V499-L504 HydrophobicContact CG1-CG 4.44Å; V499-T555 WeakPolarHBondContact O-CA 3.17Å; V499-I556 PolarHBondContact N-O 3.33Å; V499-I556 PolarHBondContact O-N 3.47Å
500	A	94.6	Very high	94.2	Very high	27 Å²	27	33 Å²	33	22%	0.223	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	145.8	170.7	0	0	0	0	0	111.2	S502 K503 L504 E553	A500-S502 VanDerWaalsContact C-N 3.27Å; A500-S502 PolarHBondContact O-N 3.47Å; A500-K503 PolarHBondContact O-N 2.84Å; A500-K503 VanDerWaalsContact O-N 3.16Å; A500-L504 PolarHBondContact O-N 3.06Å; A500-E553 HydrophobicContact CB-CG 4.17Å
501	L	93.7	Very high	94	Very high	21 Å²	21	33.5 Å²	33.5	11%	0.11	17%	0.172	C	C	.	.	H	α-helix	trans	-55.3	-43.3	180	-176.8	57.5	0	0	0	112.5	K503 L504 V505 V532 M533 L536 F554 I556	L501-K503 VanDerWaalsContact C-N 3.34Å; L501-K503 PolarHBondContact O-N 2.79Å; L501-L504 PolarHBondContact O-N 2.76Å; L501-V505 HydrophobicContact CD1-CG2 4.21Å; L501-V505 HydrophobicContact CG-CG2 4.46Å; L501-V505 WeakPolarHBondContact O-CG2 3.43Å; L501-V505 PolarHBondContact O-N 3.46Å; L501-V532 HydrophobicContact CD1-CG1 4.05Å; L501-M533 HydrophobicContact CD1-SD 4Å; L501-M533 HydrophobicContact CD2-SD 3.72Å; L501-L536 HydrophobicContact CD1-CD1 3.99Å; L501-F554 HydrophobicContact CB-CB 4.45Å; L501-F554 HydrophobicContact CD2-CD2 4.29Å; L501-F554 PolarHBondContact N-O 3.22Å; L501-I556 HydrophobicContact CB-CD1 3.55Å; L501-I556 HydrophobicContact CD1-CD1 3.71Å; L501-I556 HydrophobicContact CG-CD1 4.19Å
502	S	93.2	Very high	93.9	Very high	68 Å²	68	35.2 Å²	35.2	48%	0.476	18%	0.18	S	C	.	.	H	α-helix	trans	-54.6	-49	178	57.2	0	0	0	0	111.7	A500 V505 E506 E553	A500-S502 VanDerWaalsContact C-N 3.27Å; A500-S502 PolarHBondContact O-N 3.47Å; S502-V505 PolarHBondContact O-N 3.3Å; S502-E506 PolarHBondContact O-N 3.26Å; S502-E506 VanDerWaalsContact O-N 3.09Å; S502-E553 WeakPolarHBondContact CB-OE1 3.35Å; S502-E553 PolarHBondContact OG-OE1 3Å
503	K	94.1	Very high	93.6	Very high	59 Å²	59	36.4 Å²	36.4	26%	0.257	19%	0.185	S	C	.	.	H	α-helix	trans	-69.5	-37.3	178.6	-177.5	53.5	176.7	157.1	0	112.5	V499 A500 L501 V505 E506 D507	V499-K503 HydrophobicContact CG2-CB 3.74Å; V499-K503 HydrophobicContact CG2-CG 3.75Å; A500-K503 PolarHBondContact O-N 2.84Å; A500-K503 VanDerWaalsContact O-N 3.16Å; L501-K503 VanDerWaalsContact C-N 3.34Å; L501-K503 PolarHBondContact O-N 2.79Å; K503-V505 VanDerWaalsContact C-N 3.32Å; K503-V505 PolarHBondContact O-N 3.41Å; K503-E506 VanDerWaalsContact CD-OE2 3.24Å; K503-E506 WeakPolarHBondContact CD-OE2 3.37Å; K503-E506 VanDerWaalsContact NZ-CD 3.32Å; K503-E506 IonicContact NZ-OE1 3.74Å; K503-E506 PolarHBondContact NZ-OE1 2.85Å; K503-E506 IonicContact NZ-OE2 3.47Å; K503-E506 PolarHBondContact NZ-OE2 3.15Å; K503-E506 PolarHBondContact O-N 3.4Å; K503-D507 WeakPolarHBondContact CE-OD1 3.2Å; K503-D507 WeakPolarHBondContact CE-OD2 3.47Å; K503-D507 IonicContact NZ-OD1 2.82Å; K503-D507 PolarHBondContact NZ-OD1 2.89Å; K503-D507 IonicContact NZ-OD2 3.67Å; K503-D507 PolarHBondContact O-N 3.35Å
504	L	96	Very high	93.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-41	174.4	-178.2	61.2	0	0	0	111.7	L490 V499 A500 L501 D507 F508 V532 L536 I556	L490-L504 HydrophobicContact CB-CD1 4.18Å; L490-L504 HydrophobicContact CD1-CD1 4.19Å; V499-L504 HydrophobicContact CG1-CB 3.91Å; V499-L504 HydrophobicContact CG1-CD1 4.23Å; V499-L504 HydrophobicContact CG1-CD2 4.5Å; V499-L504 HydrophobicContact CG1-CG 4.44Å; A500-L504 PolarHBondContact O-N 3.06Å; L501-L504 PolarHBondContact O-N 2.76Å; L504-D507 PolarHBondContact O-N 3.19Å; L504-F508 WeakPolarHBondContact O-CB 3.3Å; L504-F508 PolarHBondContact O-N 2.93Å; L504-V532 HydrophobicContact CD2-CG1 3.98Å; L504-V532 HydrophobicContact CG-CG1 4.21Å; L504-L536 HydrophobicContact CD2-CD1 4.34Å; L504-L536 HydrophobicContact CD2-CD2 4.35Å; L504-I556 HydrophobicContact CD2-CB 4.4Å; L504-I556 HydrophobicContact CD2-CD1 4.28Å; L504-I556 HydrophobicContact CD2-CG2 4.31Å
505	V	96.1	Very high	93.3	Very high	25 Å²	25	35.8 Å²	35.8	15%	0.152	18%	0.183	C	C	.	.	H	α-helix	trans	-66	-40.6	177	172.9	0	0	0	0	111.5	L501 S502 K503 F508 F509 E529 V532	L501-V505 HydrophobicContact CD1-CG2 4.21Å; L501-V505 HydrophobicContact CG-CG2 4.46Å; L501-V505 WeakPolarHBondContact O-CG2 3.43Å; L501-V505 PolarHBondContact O-N 3.46Å; S502-V505 PolarHBondContact O-N 3.3Å; K503-V505 VanDerWaalsContact C-N 3.32Å; K503-V505 PolarHBondContact O-N 3.41Å; V505-F508 PolarHBondContact O-N 2.82Å; V505-F509 PolarHBondContact O-N 2.97Å; V505-E529 HydrophobicContact CG1-CB 4.27Å; V505-E529 HydrophobicContact CG2-CB 4.47Å; V505-E529 HydrophobicContact CG2-CG 4.5Å; V505-V532 HydrophobicContact CG2-CB 4.02Å; V505-V532 HydrophobicContact CG2-CG1 4.06Å; V505-V532 HydrophobicContact CG2-CG2 4.13Å
506	E	94.4	Very high	93.1	Very high	76 Å²	76	36.2 Å²	36.2	36%	0.355	19%	0.186	S	C	.	.	H	α-helix	trans	-59.6	-52.3	173.5	-168	-155.9	155.7	0	0	110.9	S39 S502 K503 F508 F509 N510	S39-E506 PolarHBondContact OG-OE1 2.89Å; S502-E506 PolarHBondContact O-N 3.26Å; S502-E506 VanDerWaalsContact O-N 3.09Å; K503-E506 VanDerWaalsContact CD-OE2 3.24Å; K503-E506 WeakPolarHBondContact CD-OE2 3.37Å; K503-E506 VanDerWaalsContact NZ-CD 3.32Å; K503-E506 IonicContact NZ-OE1 3.74Å; K503-E506 PolarHBondContact NZ-OE1 2.85Å; K503-E506 IonicContact NZ-OE2 3.47Å; K503-E506 PolarHBondContact NZ-OE2 3.15Å; K503-E506 PolarHBondContact O-N 3.4Å; E506-F508 VanDerWaalsContact C-N 3.29Å; E506-F508 PolarHBondContact O-N 3.26Å; E506-F509 WeakPolarHBondContact O-CB 3.34Å; E506-F509 PolarHBondContact O-N 2.85Å; E506-F509 VanDerWaalsContact O-N 3.16Å; E506-N510 WeakPolarHBondContact O-CB 3.18Å; E506-N510 PolarHBondContact O-N 3Å; E506-N510 PolarHBondContact O-ND2 3Å; E506-N510 VanDerWaalsContact O-ND2 3.12Å
507	D	94.9	Very high	92.9	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-68	-30.4	-178.2	-68.8	-19.7	0	0	0	112.6	L490 R494 H495 K503 L504 N510 M511	L490-D507 HydrophobicContact CD1-CB 4.21Å; L490-D507 HydrophobicContact CD2-CB 4.29Å; R494-D507 IonicContact NE-OD2 2.67Å; H495-D507 IonicContact CD2-OD2 2.67Å; H495-D507 IonicContact CE1-OD2 3.97Å; H495-D507 PolarHBondContact CE1-OD2 3.48Å; H495-D507 IonicContact NE2-OD2 3.77Å; H495-D507 PolarHBondContact NE2-OD2 3.4Å; K503-D507 WeakPolarHBondContact CE-OD1 3.2Å; K503-D507 WeakPolarHBondContact CE-OD2 3.47Å; K503-D507 IonicContact NZ-OD1 2.82Å; K503-D507 PolarHBondContact NZ-OD1 2.89Å; K503-D507 IonicContact NZ-OD2 3.67Å; K503-D507 PolarHBondContact O-N 3.35Å; L504-D507 PolarHBondContact O-N 3.19Å; D507-N510 PolarHBondContact O-N 3.28Å; D507-M511 VanDerWaalsContact O-CB 3.31Å; D507-M511 WeakPolarHBondContact O-CB 3.43Å; D507-M511 PolarHBondContact O-N 3.21Å
508	F	96.3	Very high	92.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.4	-47.7	170.5	179.2	-84.3	0	0	0	111.5	I486 V487 L490 L504 V505 E506 N510 M511 K512 F524 V531 V532	I486-F508 HydrophobicContact CB-CD2 3.87Å; I486-F508 HydrophobicContact CB-CE2 3.66Å; I486-F508 HydrophobicContact CD1-CE2 3.99Å; I486-F508 HydrophobicContact CD1-CZ 4.12Å; I486-F508 HydrophobicContact CG1-CE2 4.38Å; I486-F508 HydrophobicContact CG2-CD2 3.34Å; I486-F508 HydrophobicContact CG2-CE2 3.66Å; I486-F508 HydrophobicContact CG2-CG 4.11Å; V487-F508 HydrophobicContact CG2-CD2 3.84Å; V487-F508 HydrophobicContact CG2-CE2 4.04Å; L490-F508 HydrophobicContact CD1-CB 4.2Å; L504-F508 WeakPolarHBondContact O-CB 3.3Å; L504-F508 PolarHBondContact O-N 2.93Å; V505-F508 PolarHBondContact O-N 2.82Å; E506-F508 VanDerWaalsContact C-N 3.29Å; E506-F508 PolarHBondContact O-N 3.26Å; F508-N510 VanDerWaalsContact C-N 3.27Å; F508-N510 PolarHBondContact O-N 2.91Å; F508-M511 PolarHBondContact O-N 3.19Å; F508-K512 VanDerWaalsContact O-CB 3.26Å; F508-K512 WeakPolarHBondContact O-CB 3.45Å; F508-K512 PolarHBondContact O-N 2.93Å; F508-F524 AromaticContact CE1-CE2 3.79Å; F508-F524 HydrophobicContact CE1-CE2 3.79Å; F508-F524 HydrophobicContact CE1-CZ 4.03Å; F508-F524 HydrophobicContact CE2-CZ 4.42Å; F508-F524 HydrophobicContact CZ-CD2 4.4Å; F508-F524 HydrophobicContact CZ-CE1 4.24Å; F508-F524 AromaticContact CZ-CE2 3.57Å; F508-F524 HydrophobicContact CZ-CE2 3.57Å; F508-F524 AromaticContact CZ-CZ 3.48Å; F508-F524 HydrophobicContact CZ-CZ 3.48Å; F508-F524 VanDerWaalsContact CZ-CZ 3.48Å; F508-V531 HydrophobicContact CE1-CB 4.41Å; F508-V531 HydrophobicContact CE1-CG1 3.96Å; F508-V531 HydrophobicContact CE2-CG1 4.38Å; F508-V531 HydrophobicContact CZ-CB 4.4Å; F508-V531 HydrophobicContact CZ-CG1 3.51Å; F508-V532 HydrophobicContact CB-CG2 3.63Å; F508-V532 HydrophobicContact CD1-CG2 3.79Å; F508-V532 HydrophobicContact CD2-CG2 3.62Å; F508-V532 HydrophobicContact CE1-CG2 4.36Å; F508-V532 HydrophobicContact CE2-CG2 4.21Å; F508-V532 HydrophobicContact CG-CG2 3.39Å
509	F	94.6	Very high	92.6	Very high	76 Å²	76	30.9 Å²	30.9	33%	0.333	16%	0.164	S	C	.	.	H	α-helix	trans	-57.9	-45.6	177.2	174.1	-91.7	0	0	0	110.6	V505 E506 K512 E513	V505-F509 PolarHBondContact O-N 2.97Å; E506-F509 WeakPolarHBondContact O-CB 3.34Å; E506-F509 PolarHBondContact O-N 2.85Å; E506-F509 VanDerWaalsContact O-N 3.16Å; F509-K512 WeakPolarHBondContact O-CB 3.4Å; F509-K512 PolarHBondContact O-N 2.75Å; F509-E513 HydrophobicContact CD1-CG 4.43Å; F509-E513 HydrophobicContact CE1-CG 3.95Å; F509-E513 HydrophobicContact CZ-CG 4.07Å; F509-E513 WeakPolarHBondContact O-CG 3.48Å; F509-E513 PolarHBondContact O-N 3.4Å; F509-E513 VanDerWaalsContact O-N 3.11Å
510	N	90.8	Very high	92.5	Very high	11 Å²	11	31 Å²	31	6%	0.059	16%	0.163	C	C	.	.	H	α-helix	trans	-63.7	-47.5	179.5	-69.5	-24.7	0	0	0	112.7	L41 E506 D507 F508 K512 E513 E514	L41-N510 HydrophobicContact CB-CB 3.48Å; L41-N510 VanDerWaalsContact CB-CB 3.48Å; L41-N510 WeakPolarHBondContact CB-ND2 3.39Å; L41-N510 HydrophobicContact CD1-CB 3.44Å; L41-N510 VanDerWaalsContact CD1-CB 3.44Å; L41-N510 VanDerWaalsContact CD1-ND2 3.29Å; L41-N510 WeakPolarHBondContact CD1-ND2 3.31Å; L41-N510 HydrophobicContact CD2-CB 3.81Å; L41-N510 HydrophobicContact CG-CB 3.69Å; E506-N510 WeakPolarHBondContact O-CB 3.18Å; E506-N510 PolarHBondContact O-N 3Å; E506-N510 PolarHBondContact O-ND2 3Å; E506-N510 VanDerWaalsContact O-ND2 3.12Å; D507-N510 PolarHBondContact O-N 3.28Å; F508-N510 VanDerWaalsContact C-N 3.27Å; F508-N510 PolarHBondContact O-N 2.91Å; N510-K512 VanDerWaalsContact C-N 3.26Å; N510-K512 PolarHBondContact O-N 3.27Å; N510-E513 PolarHBondContact O-N 3.4Å; N510-E513 VanDerWaalsContact O-N 3.16Å; N510-E514 PolarHBondContact O-N 2.86Å; N510-E514 VanDerWaalsContact O-N 3.07Å
511	M	93.6	Very high	92.4	Very high	10 Å²	10	30 Å²	30	5%	0.049	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-38	176	-174.4	61.9	70.4	0	0	111.7	I486 L490 D507 F508 E514 I515 L575 F579 F721	I486-M511 HydrophobicContact CG2-CB 3.92Å; I486-M511 HydrophobicContact CG2-CG 3.77Å; L490-M511 HydrophobicContact CD2-CE 3.82Å; D507-M511 VanDerWaalsContact O-CB 3.31Å; D507-M511 WeakPolarHBondContact O-CB 3.43Å; D507-M511 PolarHBondContact O-N 3.21Å; F508-M511 PolarHBondContact O-N 3.19Å; M511-E514 PolarHBondContact O-N 3.39Å; M511-I515 HydrophobicContact CG-CD1 4.05Å; M511-I515 WeakPolarHBondContact O-CD1 3.46Å; M511-I515 VanDerWaalsContact O-CG1 3.25Å; M511-I515 WeakPolarHBondContact O-CG1 3.5Å; M511-I515 PolarHBondContact O-N 2.88Å; M511-L575 HydrophobicContact CG-CD2 3.93Å; M511-L575 HydrophobicContact SD-CD2 3.99Å; M511-F579 HydrophobicContact SD-CE1 4.49Å; M511-F579 HydrophobicContact SD-CE2 3.65Å; M511-F579 HydrophobicContact SD-CZ 3.46Å; M511-F579 WeakPolarHBondContact SD-CZ 3.24Å; M511-F721 HydrophobicContact CE-CE1 3.84Å; M511-F721 HydrophobicContact CE-CE2 4Å; M511-F721 HydrophobicContact CE-CZ 3.45Å; M511-F721 VanDerWaalsContact CE-CZ 3.45Å
512	K	92.6	Very high	92.4	Very high	37 Å²	37	29.3 Å²	29.3	16%	0.161	15%	0.151	C	C	.	.	H	α-helix	trans	-60.8	-42.7	175.7	179.6	-148.2	69.7	168.6	0	111.6	I486 F508 F509 N510 I515 L516 L522 F524	I486-K512 HydrophobicContact CD1-CB 4.41Å; F508-K512 VanDerWaalsContact O-CB 3.26Å; F508-K512 WeakPolarHBondContact O-CB 3.45Å; F508-K512 PolarHBondContact O-N 2.93Å; F509-K512 WeakPolarHBondContact O-CB 3.4Å; F509-K512 PolarHBondContact O-N 2.75Å; N510-K512 VanDerWaalsContact C-N 3.26Å; N510-K512 PolarHBondContact O-N 3.27Å; K512-I515 PolarHBondContact O-N 3.4Å; K512-L516 WeakPolarHBondContact O-CG 3.3Å; K512-L516 PolarHBondContact O-N 3.42Å; K512-L522 HydrophobicContact CD-CD1 4.05Å; K512-L522 HydrophobicContact CG-CD1 3.34Å; K512-L522 HydrophobicContact CG-CD2 4.41Å; K512-F524 HydrophobicContact CD-CE2 4.28Å; K512-F524 HydrophobicContact CG-CE2 4.23Å; K512-F524 HydrophobicContact CG-CZ 4.21Å
513	E	89.1	Confident	92.4	Very high	27 Å²	27	26.1 Å²	26.1	13%	0.126	13%	0.128	C	C	.	.	H	α-helix	trans	-66.2	-39.9	175.2	-63.2	-56.3	133.6	0	0	112.1	F509 N510 I515 L516 S517	F509-E513 HydrophobicContact CD1-CG 4.43Å; F509-E513 HydrophobicContact CE1-CG 3.95Å; F509-E513 HydrophobicContact CZ-CG 4.07Å; F509-E513 WeakPolarHBondContact O-CG 3.48Å; F509-E513 PolarHBondContact O-N 3.4Å; F509-E513 VanDerWaalsContact O-N 3.11Å; N510-E513 PolarHBondContact O-N 3.4Å; N510-E513 VanDerWaalsContact O-N 3.16Å; E513-I515 VanDerWaalsContact C-N 3.31Å; E513-I515 PolarHBondContact O-N 2.93Å; E513-L516 PolarHBondContact O-N 2.91Å; E513-S517 PolarHBondContact O-N 2.9Å
514	E	88.3	Confident	92.3	Very high	20 Å²	20	24.4 Å²	24.4	9%	0.093	12%	0.121	C	C	.	.	H	α-helix	trans	-63.7	-32.7	176.3	-72.3	-59	133.8	0	0	113.7	L41 N510 M511 S517 R518 F579	L41-E514 HydrophobicContact CD2-CG 4.23Å; N510-E514 PolarHBondContact O-N 2.86Å; N510-E514 VanDerWaalsContact O-N 3.07Å; M511-E514 PolarHBondContact O-N 3.39Å; E514-S517 PolarHBondContact O-OG 3.48Å; E514-R518 WeakPolarHBondContact O-CG 3.46Å; E514-R518 PolarHBondContact O-NH1 3.12Å; E514-R518 IonicContact OE2-CZ 3.21Å; E514-R518 IonicContact OE2-NH1 3.68Å; E514-R518 PolarHBondContact OE2-NH1 2.91Å; E514-R518 IonicContact OE2-NH2 2.58Å; E514-F579 HydrophobicContact CB-CZ 4.3Å
515	I	92.8	Very high	92	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.9	-44.6	174.9	-69.5	159.8	0	0	0	110.1	V481 I486 M511 K512 E513 S517 R518 F520 L522 L575 V578 F579	V481-I515 HydrophobicContact CB-CG2 4.28Å; V481-I515 HydrophobicContact CG1-CD1 3.97Å; V481-I515 HydrophobicContact CG2-CG2 3.96Å; I486-I515 HydrophobicContact CD1-CD1 3.6Å; I486-I515 HydrophobicContact CG1-CD1 3.73Å; M511-I515 HydrophobicContact CG-CD1 4.05Å; M511-I515 WeakPolarHBondContact O-CD1 3.46Å; M511-I515 VanDerWaalsContact O-CG1 3.25Å; M511-I515 WeakPolarHBondContact O-CG1 3.5Å; M511-I515 PolarHBondContact O-N 2.88Å; K512-I515 PolarHBondContact O-N 3.4Å; E513-I515 VanDerWaalsContact C-N 3.31Å; E513-I515 PolarHBondContact O-N 2.93Å; I515-S517 VanDerWaalsContact C-N 3.34Å; I515-S517 PolarHBondContact O-N 2.86Å; I515-R518 PolarHBondContact O-N 2.95Å; I515-F520 HydrophobicContact CG2-CB 3.56Å; I515-F520 PolarHBondContact O-N 3.14Å; I515-L522 HydrophobicContact CB-CD2 4.34Å; I515-L522 HydrophobicContact CD1-CD2 4.43Å; I515-L522 HydrophobicContact CG2-CD2 3.81Å; I515-L575 HydrophobicContact CD1-CD2 4.13Å; I515-L575 HydrophobicContact CD1-CG 4.32Å; I515-V578 HydrophobicContact CG1-CG1 4.29Å; I515-F579 HydrophobicContact CG1-CE2 4.37Å; I515-F579 HydrophobicContact CG1-CZ 4.41Å
516	L	90.2	Very high	91.6	Very high	30 Å²	30	30.9 Å²	30.9	16%	0.157	18%	0.178	C	C	.	.	H	α-helix	trans	-66.5	-35.4	179	-69.8	170.6	0	0	0	112.1	P58 K512 E513 R518 D519 L522	P58-L516 HydrophobicContact CG-CD2 4.42Å; K512-L516 WeakPolarHBondContact O-CG 3.3Å; K512-L516 PolarHBondContact O-N 3.42Å; E513-L516 PolarHBondContact O-N 2.91Å; L516-R518 PolarHBondContact O-N 2.96Å; L516-D519 PolarHBondContact O-N 3.11Å; L516-D519 VanDerWaalsContact O-N 3.16Å; L516-L522 HydrophobicContact CD1-CD1 3.87Å; L516-L522 HydrophobicContact CD2-CD1 3.85Å; L516-L522 HydrophobicContact CD2-CG 4.01Å; L516-L522 HydrophobicContact CG-CD1 3.84Å; L516-L522 HydrophobicContact CG-CG 4.32Å
517	S	86.4	Confident	91.4	Very high	31 Å²	31	31.5 Å²	31.5	22%	0.217	18%	0.184	C	C	.	.	H	α-helix	trans	-63.3	-29.5	177.2	73.5	0	0	0	0	112.4	R55 E513 E514 I515 D519 Y655	R55-S517 PolarHBondContact NH2-O 2.99Å; E513-S517 PolarHBondContact O-N 2.9Å; E514-S517 PolarHBondContact O-OG 3.48Å; I515-S517 VanDerWaalsContact C-N 3.34Å; I515-S517 PolarHBondContact O-N 2.86Å; S517-D519 VanDerWaalsContact C-N 3.3Å; S517-D519 PolarHBondContact O-N 2.86Å; S517-Y655 PolarHBondContact OG-OH 2.68Å
518	R	88.8	Confident	91.4	Very high	23 Å²	23	32.1 Å²	32.1	9%	0.087	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	13	176.9	-68.6	172	176.1	70.1	-2.6	114.4	E514 I515 L516 F520 V578 F579 D582 Y655	E514-R518 WeakPolarHBondContact O-CG 3.46Å; E514-R518 PolarHBondContact O-NH1 3.12Å; E514-R518 IonicContact OE2-CZ 3.21Å; E514-R518 IonicContact OE2-NH1 3.68Å; E514-R518 PolarHBondContact OE2-NH1 2.91Å; E514-R518 IonicContact OE2-NH2 2.58Å; I515-R518 PolarHBondContact O-N 2.95Å; L516-R518 PolarHBondContact O-N 2.96Å; R518-F520 VanDerWaalsContact C-N 3.33Å; R518-F520 HydrophobicContact CB-CD2 3.83Å; R518-F520 HydrophobicContact CB-CE2 4.16Å; R518-F520 VanDerWaalsContact O-CD2 3.27Å; R518-F520 WeakPolarHBondContact O-CD2 3.46Å; R518-F520 PolarHBondContact O-N 2.77Å; R518-V578 HydrophobicContact CB-CG1 4.44Å; R518-F579 VanDerWaalsContact CZ-CE1 3.48Å; R518-D582 IonicContact CZ-OD2 3.71Å; R518-D582 IonicContact NE-OD2 2.64Å; R518-D582 PolarHBondContact NE-OD2 2.91Å; R518-D582 IonicContact NH2-OD2 2.81Å; R518-D582 PolarHBondContact NH2-OD2 2.79Å; R518-D582 VanDerWaalsContact NH2-OD2 3.1Å; R518-Y655 PolarHBondContact NH1-OH 3.32Å; R518-Y655 VanDerWaalsContact NH2-CE2 3.28Å
519	D	89.8	Confident	91.3	Very high	94 Å²	94	37 Å²	37	50%	0.503	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	34.7	179.6	-63.4	-42	0	0	0	114.8	R55 P58 V60 L516 S517	R55-D519 IonicContact NH2-OD1 3Å; R55-D519 PolarHBondContact NH2-OD1 2.95Å; P58-D519 HydrophobicContact CB-CB 4.35Å; V60-D519 WeakPolarHBondContact CG1-O 3.48Å; L516-D519 PolarHBondContact O-N 3.11Å; L516-D519 VanDerWaalsContact O-N 3.16Å; S517-D519 VanDerWaalsContact C-N 3.3Å; S517-D519 PolarHBondContact O-N 2.86Å
520	F	92.7	Very high	91.3	Very high	14 Å²	14	38.5 Å²	38.5	6%	0.061	22%	0.222	C	C	.	.			trans	-99.7	140.6	167.2	-72	-89.2	0	0	0	110.8	P58 K477 I515 R518 H577 V578	P58-F520 WeakPolarHBondContact CG-O 3.42Å; K477-F520 HydrophobicContact CG-CE1 3.99Å; K477-F520 HydrophobicContact CG-CZ 4.23Å; K477-F520 WeakPolarHBondContact O-CE1 3.5Å; I515-F520 HydrophobicContact CG2-CB 3.56Å; I515-F520 PolarHBondContact O-N 3.14Å; R518-F520 VanDerWaalsContact C-N 3.33Å; R518-F520 HydrophobicContact CB-CD2 3.83Å; R518-F520 HydrophobicContact CB-CE2 4.16Å; R518-F520 VanDerWaalsContact O-CD2 3.27Å; R518-F520 WeakPolarHBondContact O-CD2 3.46Å; R518-F520 PolarHBondContact O-N 2.77Å; F520-H577 AromaticContact CD1-NE2 3.76Å; F520-H577 AromaticContact CE1-CD2 3.33Å; F520-H577 WeakPolarHBondContact CE1-CD2 3.28Å; F520-H577 AromaticContact CE1-NE2 3.28Å; F520-H577 VanDerWaalsContact CE1-NE2 3.28Å; F520-H577 WeakPolarHBondContact CE1-NE2 3.32Å; F520-H577 AromaticContact CZ-CD2 3.85Å; F520-V578 HydrophobicContact CD1-CG2 3.98Å; F520-V578 HydrophobicContact CD2-CB 4.29Å; F520-V578 HydrophobicContact CD2-CG1 3.79Å; F520-V578 HydrophobicContact CD2-CG2 4Å; F520-V578 HydrophobicContact CE1-CG2 4.08Å; F520-V578 HydrophobicContact CE2-CB 4.14Å; F520-V578 HydrophobicContact CE2-CG1 3.92Å; F520-V578 HydrophobicContact CE2-CG2 4.08Å; F520-V578 HydrophobicContact CG-CG1 4.44Å; F520-V578 HydrophobicContact CG-CG2 3.94Å; F520-V578 HydrophobicContact CZ-CB 4.43Å; F520-V578 HydrophobicContact CZ-CG2 4.11Å
521	D	93.1	Very high	91.5	Very high	8 Å²	8	38.7 Å²	38.7	4%	0.043	22%	0.224	C	C	.	.			trans	-88.4	161.5	174.9	-168.8	23	0	0	0	111.4	R57 V60 R396 A480 V481	R57-D521 IonicContact CZ-OD1 2.89Å; R57-D521 IonicContact NH1-OD1 3.66Å; R57-D521 PolarHBondContact NH1-OD1 3.19Å; V60-D521 HydrophobicContact CG1-CB 4.16Å; V60-D521 HydrophobicContact CG2-CB 4.15Å; R396-D521 IonicContact CZ-OD2 2.84Å; R396-D521 IonicContact NH1-OD2 2.79Å; R396-D521 IonicContact NH2-OD2 3.75Å; R396-D521 PolarHBondContact NH2-OD2 3.27Å; A480-D521 WeakPolarHBondContact CA-O 3.49Å; V481-D521 PolarHBondContact N-O 2.8Å
522	L	93.9	Very high	91.7	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.031	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-113	139.1	-177.7	-58.6	169.1	0	0	0	111	R57 V481 I486 K512 I515 L516 F524	R57-L522 PolarHBondContact NH1-O 3.11Å; V481-L522 HydrophobicContact CB-CD2 4.22Å; V481-L522 CarbonylContact O-C 3.6Å; V481-L522 WeakPolarHBondContact O-CA 3.4Å; I486-L522 HydrophobicContact CD1-CD2 4.46Å; K512-L522 HydrophobicContact CD-CD1 4.05Å; K512-L522 HydrophobicContact CG-CD1 3.34Å; K512-L522 HydrophobicContact CG-CD2 4.41Å; I515-L522 HydrophobicContact CB-CD2 4.34Å; I515-L522 HydrophobicContact CD1-CD2 4.43Å; I515-L522 HydrophobicContact CG2-CD2 3.81Å; L516-L522 HydrophobicContact CD1-CD1 3.87Å; L516-L522 HydrophobicContact CD2-CD1 3.85Å; L516-L522 HydrophobicContact CD2-CG 4.01Å; L516-L522 HydrophobicContact CG-CD1 3.84Å; L516-L522 HydrophobicContact CG-CG 4.32Å; L522-F524 HydrophobicContact CB-CD1 4.46Å; L522-F524 HydrophobicContact CB-CE1 4.2Å; L522-F524 HydrophobicContact CB-CZ 4.33Å; L522-F524 HydrophobicContact CD1-CE2 4.44Å; L522-F524 HydrophobicContact CD1-CZ 4.26Å; L522-F524 HydrophobicContact CD2-CE1 4.1Å; L522-F524 HydrophobicContact CD2-CZ 4Å; L522-F524 HydrophobicContact CG-CZ 4.44Å; L522-F524 PolarHBondContact O-N 2.8Å
523	G	92.4	Very high	91.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-79.8	2.6	178.2	0	0	0	0	0	115.2	V481	V481-G523 PolarHBondContact O-N 2.97Å
524	F	92.3	Very high	92	Very high	23 Å²	23	42.3 Å²	42.3	10%	0.101	24%	0.242	C	C	.	.			trans	-138.9	165.4	-174.1	60	-91.4	0	0	0	111.5	R57 S483 I486 F508 K512 L522 V531	R57-F524 PolarHBondContact NH2-O 3.32Å; S483-F524 VanDerWaalsContact N-CD1 3.34Å; I486-F524 HydrophobicContact CD1-CE1 3.92Å; I486-F524 HydrophobicContact CD1-CZ 3.63Å; F508-F524 AromaticContact CE1-CE2 3.79Å; F508-F524 HydrophobicContact CE1-CE2 3.79Å; F508-F524 HydrophobicContact CE1-CZ 4.03Å; F508-F524 HydrophobicContact CE2-CZ 4.42Å; F508-F524 HydrophobicContact CZ-CD2 4.4Å; F508-F524 HydrophobicContact CZ-CE1 4.24Å; F508-F524 AromaticContact CZ-CE2 3.57Å; F508-F524 HydrophobicContact CZ-CE2 3.57Å; F508-F524 AromaticContact CZ-CZ 3.48Å; F508-F524 HydrophobicContact CZ-CZ 3.48Å; F508-F524 VanDerWaalsContact CZ-CZ 3.48Å; K512-F524 HydrophobicContact CD-CE2 4.28Å; K512-F524 HydrophobicContact CG-CE2 4.23Å; K512-F524 HydrophobicContact CG-CZ 4.21Å; L522-F524 HydrophobicContact CB-CD1 4.46Å; L522-F524 HydrophobicContact CB-CE1 4.2Å; L522-F524 HydrophobicContact CB-CZ 4.33Å; L522-F524 HydrophobicContact CD1-CE2 4.44Å; L522-F524 HydrophobicContact CD1-CZ 4.26Å; L522-F524 HydrophobicContact CD2-CE1 4.1Å; L522-F524 HydrophobicContact CD2-CZ 4Å; L522-F524 HydrophobicContact CG-CZ 4.44Å; L522-F524 PolarHBondContact O-N 2.8Å; F524-V531 HydrophobicContact CB-CG1 4.4Å; F524-V531 HydrophobicContact CD2-CB 4.47Å; F524-V531 HydrophobicContact CD2-CG1 3.59Å; F524-V531 HydrophobicContact CD2-CG2 4.14Å; F524-V531 HydrophobicContact CE2-CG1 3.99Å; F524-V531 HydrophobicContact CG-CG1 3.96Å
525	S	88.1	Confident	92.4	Very high	93 Å²	93	41.4 Å²	41.4	65%	0.65	24%	0.238	S	C	*	.			trans	-151.1	162	175.9	59	0	0	0	0	110.2
526	G	87.9	Confident	92.5	Very high	68 Å²	68	42 Å²	42	70%	0.701	24%	0.241	S	C	*	.	S	Bend	trans	117.8	-165.4	177.1	0	0	0	0	0	112.3
527	N	91.6	Very high	92.7	Very high	90 Å²	90	46.6 Å²	46.6	48%	0.481	26%	0.262	S	S	.	.			trans	-67.7	134.3	175.7	-177	-10.7	0	0	0	110.2	E529 D530 V531	N527-E529 PolarHBondContact O-N 3.26Å; N527-E529 PolarHBondContact OD1-N 2.77Å; N527-D530 PolarHBondContact O-N 3.41Å; N527-V531 VanDerWaalsContact O-CG2 3.28Å; N527-V531 WeakPolarHBondContact O-CG2 3.49Å; N527-V531 PolarHBondContact O-N 3.46Å
528	S	93.6	Very high	93	Very high	13 Å²	13	45.2 Å²	45.2	9%	0.091	25%	0.252	C	S	.	.	H	α-helix	trans	-56.7	-36.5	178.2	-61.8	0	0	0	0	112.9	V531 V532	S528-V531 PolarHBondContact O-N 2.76Å; S528-V532 WeakPolarHBondContact O-CB 3.4Å; S528-V532 VanDerWaalsContact O-CG2 3.24Å; S528-V532 WeakPolarHBondContact O-CG2 3.31Å; S528-V532 PolarHBondContact O-N 2.97Å
529	E	94	Very high	93.1	Very high	102 Å²	102	44.2 Å²	44.2	48%	0.477	25%	0.248	S	C	.	.	H	α-helix	trans	-62.5	-51	-179.2	-173.7	173.5	-170.8	0	0	111.6	V505 N527 V531 V532 M533	V505-E529 HydrophobicContact CG1-CB 4.27Å; V505-E529 HydrophobicContact CG2-CB 4.47Å; V505-E529 HydrophobicContact CG2-CG 4.5Å; N527-E529 PolarHBondContact O-N 3.26Å; N527-E529 PolarHBondContact OD1-N 2.77Å; E529-V531 VanDerWaalsContact C-N 3.29Å; E529-V531 PolarHBondContact O-N 2.85Å; E529-V532 PolarHBondContact O-N 3.24Å; E529-M533 WeakPolarHBondContact O-CG 3.48Å; E529-M533 PolarHBondContact O-N 3.28Å
530	D	94.9	Very high	93.1	Very high	109 Å²	109	44.5 Å²	44.5	58%	0.583	25%	0.25	S	C	*	.	H	α-helix	trans	-60.6	-40.2	177.7	-63.3	-44.3	0	0	0	111.7	N527 M533 H534	N527-D530 PolarHBondContact O-N 3.41Å; D530-M533 PolarHBondContact O-N 3Å; D530-H534 WeakPolarHBondContact O-CB 3.36Å; D530-H534 PolarHBondContact O-N 3.45Å
531	V	95.8	Very high	92.8	Very high	15 Å²	15	48.7 Å²	48.7	9%	0.091	27%	0.273	C	S	.	.	H	α-helix	trans	-67.7	-41.7	179.6	175	0	0	0	0	111.3	S483 F508 F524 N527 S528 E529 H534 A535	S483-V531 VanDerWaalsContact CB-CG1 3.43Å; F508-V531 HydrophobicContact CE1-CB 4.41Å; F508-V531 HydrophobicContact CE1-CG1 3.96Å; F508-V531 HydrophobicContact CE2-CG1 4.38Å; F508-V531 HydrophobicContact CZ-CB 4.4Å; F508-V531 HydrophobicContact CZ-CG1 3.51Å; F524-V531 HydrophobicContact CB-CG1 4.4Å; F524-V531 HydrophobicContact CD2-CB 4.47Å; F524-V531 HydrophobicContact CD2-CG1 3.59Å; F524-V531 HydrophobicContact CD2-CG2 4.14Å; F524-V531 HydrophobicContact CE2-CG1 3.99Å; F524-V531 HydrophobicContact CG-CG1 3.96Å; N527-V531 VanDerWaalsContact O-CG2 3.28Å; N527-V531 WeakPolarHBondContact O-CG2 3.49Å; N527-V531 PolarHBondContact O-N 3.46Å; S528-V531 PolarHBondContact O-N 2.76Å; E529-V531 VanDerWaalsContact C-N 3.29Å; E529-V531 PolarHBondContact O-N 2.85Å; V531-H534 WeakPolarHBondContact O-CB 3.35Å; V531-H534 PolarHBondContact O-N 3.49Å; V531-A535 WeakPolarHBondContact O-CB 3.5Å; V531-A535 PolarHBondContact O-N 3.4Å
532	V	96.6	Very high	92.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.1	-45.2	176.1	168.6	0	0	0	0	110.2	V487 L501 L504 V505 F508 S528 E529 H534 A535 L536	V487-V532 HydrophobicContact CG2-CG2 4.44Å; L501-V532 HydrophobicContact CD1-CG1 4.05Å; L504-V532 HydrophobicContact CD2-CG1 3.98Å; L504-V532 HydrophobicContact CG-CG1 4.21Å; V505-V532 HydrophobicContact CG2-CB 4.02Å; V505-V532 HydrophobicContact CG2-CG1 4.06Å; V505-V532 HydrophobicContact CG2-CG2 4.13Å; F508-V532 HydrophobicContact CB-CG2 3.63Å; F508-V532 HydrophobicContact CD1-CG2 3.79Å; F508-V532 HydrophobicContact CD2-CG2 3.62Å; F508-V532 HydrophobicContact CE1-CG2 4.36Å; F508-V532 HydrophobicContact CE2-CG2 4.21Å; F508-V532 HydrophobicContact CG-CG2 3.39Å; S528-V532 WeakPolarHBondContact O-CB 3.4Å; S528-V532 VanDerWaalsContact O-CG2 3.24Å; S528-V532 WeakPolarHBondContact O-CG2 3.31Å; S528-V532 PolarHBondContact O-N 2.97Å; E529-V532 PolarHBondContact O-N 3.24Å; V532-H534 VanDerWaalsContact C-N 3.3Å; V532-H534 PolarHBondContact O-N 2.87Å; V532-A535 PolarHBondContact O-N 3.37Å; V532-L536 HydrophobicContact CG1-CD1 3.9Å; V532-L536 HydrophobicContact CG1-CG 4.27Å; V532-L536 WeakPolarHBondContact O-CB 3.35Å; V532-L536 VanDerWaalsContact O-CG 3.29Å; V532-L536 WeakPolarHBondContact O-CG 3.32Å; V532-L536 PolarHBondContact O-N 3.28Å
533	M	94.6	Very high	92.7	Very high	93 Å²	93	48.5 Å²	48.5	46%	0.458	27%	0.272	S	S	.	.	H	α-helix	trans	-61.1	-40.1	176.4	-70.3	-60.8	-73.1	0	0	112	L501 E529 D530 L536 H537	L501-M533 HydrophobicContact CD1-SD 4Å; L501-M533 HydrophobicContact CD2-SD 3.72Å; E529-M533 WeakPolarHBondContact O-CG 3.48Å; E529-M533 PolarHBondContact O-N 3.28Å; D530-M533 PolarHBondContact O-N 3Å; M533-L536 PolarHBondContact O-N 3.06Å; M533-L536 HydrophobicContact SD-CD1 4.35Å; M533-H537 WeakPolarHBondContact O-CB 3.19Å; M533-H537 PolarHBondContact O-N 3.42Å
534	H	94.4	Very high	92.6	Very high	57 Å²	57	53.4 Å²	53.4	26%	0.264	30%	0.295	S	S	.	.	H	α-helix	trans	-60.7	-48.2	173.1	179.2	68.8	0	0	0	112.1	D356 D530 V531 V532 L536 H537 L538	D356-H534 IonicContact OD2-NE2 3.89Å; D530-H534 WeakPolarHBondContact O-CB 3.36Å; D530-H534 PolarHBondContact O-N 3.45Å; V531-H534 WeakPolarHBondContact O-CB 3.35Å; V531-H534 PolarHBondContact O-N 3.49Å; V532-H534 VanDerWaalsContact C-N 3.3Å; V532-H534 PolarHBondContact O-N 2.87Å; H534-L536 PolarHBondContact O-N 3.04Å; H534-H537 WeakPolarHBondContact O-CB 3.39Å; H534-H537 PolarHBondContact O-N 3.35Å; H534-L538 WeakPolarHBondContact NE2-CD1 3.39Å; H534-L538 WeakPolarHBondContact O-CG 3.38Å; H534-L538 PolarHBondContact O-N 3.37Å; H534-L538 VanDerWaalsContact O-N 3.08Å
535	A	95.9	Very high	92.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-42.7	178.6	0	0	0	0	0	112.1	T484 V487 V531 V532 H537 L538 L539	T484-A535 HydrophobicContact CG2-CB 4.13Å; V487-A535 HydrophobicContact CB-CB 4.22Å; V487-A535 HydrophobicContact CG2-CB 3.73Å; V531-A535 WeakPolarHBondContact O-CB 3.5Å; V531-A535 PolarHBondContact O-N 3.4Å; V532-A535 PolarHBondContact O-N 3.37Å; A535-H537 VanDerWaalsContact C-N 3.33Å; A535-H537 PolarHBondContact O-N 3.31Å; A535-L538 PolarHBondContact O-N 3.11Å; A535-L539 WeakPolarHBondContact O-CB 2.98Å; A535-L539 WeakPolarHBondContact O-CG 3.44Å; A535-L539 PolarHBondContact O-N 3.06Å
536	L	95.4	Very high	92.4	Very high	14 Å²	14	55.5 Å²	55.5	7%	0.073	31%	0.306	C	S	.	.	H	α-helix	trans	-61.4	-40.9	175.4	-70.2	173	0	0	0	111.6	V487 L501 L504 V532 M533 H534 L538 L539 D540 V543 I556	V487-L536 HydrophobicContact CG1-CD2 3.87Å; V487-L536 HydrophobicContact CG1-CG 4.49Å; L501-L536 HydrophobicContact CD1-CD1 3.99Å; L504-L536 HydrophobicContact CD2-CD1 4.34Å; L504-L536 HydrophobicContact CD2-CD2 4.35Å; V532-L536 HydrophobicContact CG1-CD1 3.9Å; V532-L536 HydrophobicContact CG1-CG 4.27Å; V532-L536 WeakPolarHBondContact O-CB 3.35Å; V532-L536 VanDerWaalsContact O-CG 3.29Å; V532-L536 WeakPolarHBondContact O-CG 3.32Å; V532-L536 PolarHBondContact O-N 3.28Å; M533-L536 PolarHBondContact O-N 3.06Å; M533-L536 HydrophobicContact SD-CD1 4.35Å; H534-L536 PolarHBondContact O-N 3.04Å; L536-L538 VanDerWaalsContact C-N 3.33Å; L536-L538 PolarHBondContact O-N 2.73Å; L536-L539 CarbonylContact O-C 3.3Å; L536-L539 PolarHBondContact O-N 3.19Å; L536-D540 PolarHBondContact O-N 3.41Å; L536-V543 HydrophobicContact CD2-CG1 4.17Å; L536-I556 HydrophobicContact CD1-CD1 4.49Å; L536-I556 HydrophobicContact CD1-CG1 4.11Å; L536-I556 HydrophobicContact CD2-CG2 3.73Å
537	H	93.5	Very high	92.1	Very high	126 Å²	126	55.9 Å²	55.9	58%	0.583	30%	0.297	S	S	*	.	H	α-helix	trans	-63	-37.9	175.4	-176	69.6	0	0	0	112.8	M533 H534 A535 L539 D540	M533-H537 WeakPolarHBondContact O-CB 3.19Å; M533-H537 PolarHBondContact O-N 3.42Å; H534-H537 WeakPolarHBondContact O-CB 3.39Å; H534-H537 PolarHBondContact O-N 3.35Å; A535-H537 VanDerWaalsContact C-N 3.33Å; A535-H537 PolarHBondContact O-N 3.31Å; H537-L539 VanDerWaalsContact C-N 3.32Å; H537-D540 WeakPolarHBondContact O-CB 3.16Å
538	L	92.6	Very high	91	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-69.9	-31.7	175.2	-67	-179.5	0	0	0	112.6	D356 R357 N391 T484 H534 A535 L536	D356-L538 HydrophobicContact CB-CD1 3.54Å; R357-L538 PolarHBondContact NH1-O 3.36Å; N391-L538 WeakPolarHBondContact O-CD2 3.31Å; T484-L538 HydrophobicContact CG2-CB 4.06Å; T484-L538 HydrophobicContact CG2-CD1 4.01Å; H534-L538 WeakPolarHBondContact NE2-CD1 3.39Å; H534-L538 WeakPolarHBondContact O-CG 3.38Å; H534-L538 PolarHBondContact O-N 3.37Å; H534-L538 VanDerWaalsContact O-N 3.08Å; A535-L538 PolarHBondContact O-N 3.11Å; L536-L538 VanDerWaalsContact C-N 3.33Å; L536-L538 PolarHBondContact O-N 2.73Å
539	L	92.8	Very high	89.3	Confident	1 Å²	1	62 Å²	62	1%	0.005	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	13.1	-179.9	-63.8	174.8	0	0	0	114	T484 V487 A488 A535 L536 H537 N541 C542 V543 L568 Y571	T484-L539 HydrophobicContact CG2-CD1 4.42Å; T484-L539 HydrophobicContact CG2-CG 4.19Å; V487-L539 HydrophobicContact CB-CD1 4.38Å; V487-L539 HydrophobicContact CG1-CD1 4.12Å; A488-L539 HydrophobicContact CB-CD1 4.43Å; A535-L539 WeakPolarHBondContact O-CB 2.98Å; A535-L539 WeakPolarHBondContact O-CG 3.44Å; A535-L539 PolarHBondContact O-N 3.06Å; L536-L539 CarbonylContact O-C 3.3Å; L536-L539 PolarHBondContact O-N 3.19Å; H537-L539 VanDerWaalsContact C-N 3.32Å; L539-N541 VanDerWaalsContact C-N 3.26Å; L539-N541 PolarHBondContact O-N 3.19Å; L539-C542 WeakPolarHBondContact O-CA 3.35Å; L539-C542 WeakPolarHBondContact O-CB 3.43Å; L539-C542 PolarHBondContact O-N 2.72Å; L539-V543 HydrophobicContact CB-CG2 4.18Å; L539-V543 PolarHBondContact O-N 3.37Å; L539-L568 HydrophobicContact CD1-CD2 4.32Å; L539-Y571 HydrophobicContact CD2-CD2 3.58Å; L539-Y571 HydrophobicContact CD2-CE2 3.82Å; L539-Y571 HydrophobicContact CD2-CG 4.34Å
540	D	88.3	Confident	87.7	Confident	101 Å²	101	68.5 Å²	68.5	54%	0.54	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-49.7	-39.2	-171.9	-176.8	57.9	0	0	0	114.5	L536 H537 C542 V543	L536-D540 PolarHBondContact O-N 3.41Å; H537-D540 WeakPolarHBondContact O-CB 3.16Å; D540-C542 PolarHBondContact O-N 3Å; D540-C542 VanDerWaalsContact O-N 3.12Å; D540-V543 PolarHBondContact O-N 3.31Å
541	N	86.8	Confident	85.8	Confident	102 Å²	102	68.8 Å²	68.8	55%	0.545	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-67.5	-13.8	178	-67.3	-24.6	0	0	0	114.4	L539	L539-N541 VanDerWaalsContact C-N 3.26Å; L539-N541 PolarHBondContact O-N 3.19Å
542	C	90.9	Very high	84.3	Confident	0 Å²	0	75 Å²	75	0%	0	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-110.4	-6.1	-172.2	-61	0	0	0	0	113.6	L539 D540 S559 A564 E567 L568	L539-C542 WeakPolarHBondContact O-CA 3.35Å; L539-C542 WeakPolarHBondContact O-CB 3.43Å; L539-C542 PolarHBondContact O-N 2.72Å; D540-C542 PolarHBondContact O-N 3Å; D540-C542 VanDerWaalsContact O-N 3.12Å; C542-S559 VanDerWaalsContact O-CB 3.31Å; C542-S559 WeakPolarHBondContact O-CB 3.28Å; C542-S559 PolarHBondContact O-N 3.37Å; C542-A564 HydrophobicContact CB-CB 4.21Å; C542-E567 VanDerWaalsContact SG-CB 3.59Å; C542-E567 WeakPolarHBondContact SG-CG 3.31Å; C542-E567 PolarHBondContact SG-OE2 2.91Å; C542-L568 HydrophobicContact CB-CD1 4.15Å; C542-L568 HydrophobicContact CB-CD2 3.8Å; C542-L568 HydrophobicContact CB-CG 3.72Å
543	V	93.3	Very high	83.5	Confident	10 Å²	10	78.6 Å²	78.6	6%	0.061	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140	-168.3	-178.2	0	0	0	0	109.2	L491 L536 L539 D540 V545 I556 A557 L568	L491-V543 HydrophobicContact CD1-CG1 4.44Å; L491-V543 HydrophobicContact CD1-CG2 3.79Å; L536-V543 HydrophobicContact CD2-CG1 4.17Å; L539-V543 HydrophobicContact CB-CG2 4.18Å; L539-V543 PolarHBondContact O-N 3.37Å; D540-V543 PolarHBondContact O-N 3.31Å; V543-V545 HydrophobicContact CG1-CG2 4.44Å; V543-I556 HydrophobicContact CG1-CG2 3.27Å; V543-A557 WeakPolarHBondContact CA-O 3.43Å; V543-L568 HydrophobicContact CG2-CD2 4.49Å
544	H	91.7	Very high	83.2	Confident	102 Å²	102	78.6 Å²	78.6	47%	0.472	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.3	170.7	-64	-56.4	0	0	0	108.8	A557 S559	H544-A557 PolarHBondContact N-O 3.43Å; H544-A557 PolarHBondContact O-N 2.94Å; H544-S559 WeakPolarHBondContact NE2-CB 3.38Å; H544-S559 PolarHBondContact NE2-OG 2.91Å; H544-S559 VanDerWaalsContact NE2-OG 3.08Å
545	V	89.1	Confident	83.1	Confident	81 Å²	81	78 Å²	78	49%	0.491	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	115	172.8	-175.4	0	0	0	0	107.5	V543 F554 T555	V543-V545 HydrophobicContact CG1-CG2 4.44Å; V545-F554 HydrophobicContact CG1-CB 4.05Å; V545-F554 HydrophobicContact CG1-CD1 3.97Å; V545-F554 HydrophobicContact CG1-CG 4.31Å; V545-T555 WeakPolarHBondContact CA-O 3.34Å
546	T	86.6	Confident	83	Confident	80 Å²	80	78 Å²	78	49%	0.491	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	134.2	176.5	53.9	0	0	0	0	109.8	T555	T546-T555 PolarHBondContact N-O 2.87Å; T546-T555 PolarHBondContact O-N 3.5Å
547	S	81.1	Confident	83	Confident	75 Å²	75	78.6 Å²	78.6	52%	0.524	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	131.8	171.1	-170.2	0	0	0	0	108.6
548	T	68.9	Low	83.1	Confident	62 Å²	62	73.1 Å²	73.1	38%	0.38	39%	0.388	S	S	.	.			trans	-80.7	133.4	170.8	59.7	0	0	0	0	109.5	R550 N551 E553	T548-R550 PolarHBondContact O-N 3.08Å; T548-N551 VanDerWaalsContact O-O 3.13Å; T548-E553 PolarHBondContact OG1-O 3.1Å
549	N	57	Low	83	Confident	171 Å²	171	73.2 Å²	73.2	91%	0.914	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	5.6	-173.4	-87.9	-17.5	0	0	0	115.1
550	R	61.2	Low	82.9	Confident	237 Å²	237	81.4 Å²	81.4	89%	0.894	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.5	-9.5	-175	-71.6	-173.4	172.5	178.6	-2.6	115.3	T548	T548-R550 PolarHBondContact O-N 3.08Å
551	N	54.5	Low	83	Confident	116 Å²	116	80.2 Å²	80.2	62%	0.62	42%	0.422	S	S	*	.	S	Bend	trans	-142.1	151.6	175.1	-82.2	-15.2	0	0	0	110.2	T548 E553	T548-N551 VanDerWaalsContact O-O 3.13Å; N551-E553 HydrophobicContact CB-CB 4.44Å; N551-E553 PolarHBondContact O-N 3.05Å
552	T	65.1	Low	83.1	Confident	144 Å²	144	76.4 Å²	76.4	88%	0.883	40%	0.402	S	S	*	.	S	Bend	trans	-65.3	19.8	173.6	48.7	0	0	0	0	114.2
553	E	79.7	Confident	83.1	Confident	76 Å²	76	79.1 Å²	79.1	36%	0.355	42%	0.419	S	S	.	.			trans	-107.1	125.1	-171.9	-165.3	167.4	-147.5	0	0	110.9	A500 S502 T548 N551	A500-E553 HydrophobicContact CB-CG 4.17Å; S502-E553 WeakPolarHBondContact CB-OE1 3.35Å; S502-E553 PolarHBondContact OG-OE1 3Å; T548-E553 PolarHBondContact OG1-O 3.1Å; N551-E553 HydrophobicContact CB-CB 4.44Å; N551-E553 PolarHBondContact O-N 3.05Å
554	F	87.9	Confident	83	Confident	93 Å²	93	78.8 Å²	78.8	41%	0.408	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	132.7	179.3	-60.7	-78.7	0	0	0	110.5	L501 V545	L501-F554 HydrophobicContact CB-CB 4.45Å; L501-F554 HydrophobicContact CD2-CD2 4.29Å; L501-F554 PolarHBondContact N-O 3.22Å; V545-F554 HydrophobicContact CG1-CB 4.05Å; V545-F554 HydrophobicContact CG1-CD1 3.97Å; V545-F554 HydrophobicContact CG1-CG 4.31Å
555	T	92.7	Very high	83	Confident	44 Å²	44	74.5 Å²	74.5	27%	0.27	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.1	169.8	-56.2	0	0	0	0	109.2	V499 V545 T546	V499-T555 WeakPolarHBondContact O-CA 3.17Å; V545-T555 WeakPolarHBondContact CA-O 3.34Å; T546-T555 PolarHBondContact N-O 2.87Å; T546-T555 PolarHBondContact O-N 3.5Å
556	I	95	Very high	83.2	Confident	2 Å²	2	70.6 Å²	70.6	1%	0.01	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.4	-179.9	-60.7	101.7	0	0	0	108.7	L491 G498 V499 L501 L504 L536 V543	L491-I556 HydrophobicContact CD1-CG2 4.37Å; L491-I556 HydrophobicContact CD2-CG2 3.91Å; G498-I556 CarbonylContact C-O 3.54Å; G498-I556 WeakPolarHBondContact CA-O 3.33Å; V499-I556 PolarHBondContact N-O 3.33Å; V499-I556 PolarHBondContact O-N 3.47Å; L501-I556 HydrophobicContact CB-CD1 3.55Å; L501-I556 HydrophobicContact CD1-CD1 3.71Å; L501-I556 HydrophobicContact CG-CD1 4.19Å; L504-I556 HydrophobicContact CD2-CB 4.4Å; L504-I556 HydrophobicContact CD2-CD1 4.28Å; L504-I556 HydrophobicContact CD2-CG2 4.31Å; L536-I556 HydrophobicContact CD1-CD1 4.49Å; L536-I556 HydrophobicContact CD1-CG1 4.11Å; L536-I556 HydrophobicContact CD2-CG2 3.73Å; V543-I556 HydrophobicContact CG1-CG2 3.27Å
557	A	94.5	Very high	83.4	Confident	26 Å²	26	67.7 Å²	67.7	22%	0.215	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	145.2	175.4	0	0	0	0	0	111.5	V543 H544	V543-A557 WeakPolarHBondContact CA-O 3.43Å; H544-A557 PolarHBondContact N-O 3.43Å; H544-A557 PolarHBondContact O-N 2.94Å
558	P	94.8	Very high	84.1	Confident	10 Å²	10	64.1 Å²	64.1	7%	0.065	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	143.6	173.4	28.8	-34.2	0	0	0	110.9	L491 R496 L568	L491-P558 HydrophobicContact CB-CB 4.49Å; R496-P558 HydrophobicContact CG-CG 4.47Å; R496-P558 WeakPolarHBondContact O-CG 3.33Å; P558-L568 HydrophobicContact CB-CD1 3.69Å
559	S	92.3	Very high	85.3	Confident	5 Å²	5	61.6 Å²	61.6	4%	0.035	32%	0.315	C	S	.	.			trans	-68.6	135.3	172.5	-175.9	0	0	0	0	110.7	C542 H544 T561 L565	C542-S559 VanDerWaalsContact O-CB 3.31Å; C542-S559 WeakPolarHBondContact O-CB 3.28Å; C542-S559 PolarHBondContact O-N 3.37Å; H544-S559 WeakPolarHBondContact NE2-CB 3.38Å; H544-S559 PolarHBondContact NE2-OG 2.91Å; H544-S559 VanDerWaalsContact NE2-OG 3.08Å; S559-T561 PolarHBondContact O-N 2.96Å; S559-T561 PolarHBondContact OG-OG1 3.37Å; S559-L565 VanDerWaalsContact O-CD2 3.31Å; S559-L565 WeakPolarHBondContact O-CD2 3.47Å; S559-L565 WeakPolarHBondContact O-CG 3.47Å
560	K	88.9	Confident	87	Confident	173 Å²	173	53.8 Å²	53.8	75%	0.752	27%	0.273	S	S	*	.			trans	-81.7	0.5	-179.1	-60.5	-175.3	179.9	-177.3	0	113.5
561	T	90.7	Very high	88.6	Confident	76 Å²	76	42.6 Å²	42.6	47%	0.466	23%	0.231	S	C	.	.	S	Bend	trans	-73.4	139	178.3	66.5	0	0	0	0	110.4	S559 P563 A564 L565	S559-T561 PolarHBondContact O-N 2.96Å; S559-T561 PolarHBondContact OG-OG1 3.37Å; T561-P563 VanDerWaalsContact C-CD 3.5Å; T561-A564 PolarHBondContact O-N 2.73Å; T561-A564 VanDerWaalsContact O-N 3.09Å; T561-A564 VanDerWaalsContact OG1-CB 3.24Å; T561-A564 WeakPolarHBondContact OG1-CB 3.38Å; T561-L565 PolarHBondContact O-N 3.06Å
562	V	90.1	Very high	90.5	Very high	22 Å²	22	37.2 Å²	37.2	13%	0.133	20%	0.202	C	C	.	.	H	α-helix	trans	-52.4	-46.3	-179.7	176.7	0	0	0	0	112.6	L368 A564 L565 F566 L761 T764	L368-V562 HydrophobicContact CD2-CG1 4.07Å; V562-A564 VanDerWaalsContact C-N 3.33Å; V562-A564 PolarHBondContact O-N 3.49Å; V562-L565 PolarHBondContact O-N 3.03Å; V562-F566 HydrophobicContact CG1-CD1 4.05Å; V562-F566 HydrophobicContact CG1-CD2 4.18Å; V562-F566 HydrophobicContact CG1-CE1 3.63Å; V562-F566 HydrophobicContact CG1-CE2 3.79Å; V562-F566 HydrophobicContact CG1-CG 4.31Å; V562-F566 HydrophobicContact CG1-CZ 3.48Å; V562-F566 VanDerWaalsContact CG1-CZ 3.48Å; V562-F566 WeakPolarHBondContact O-CB 3.5Å; V562-F566 WeakPolarHBondContact O-CD1 3.37Å; V562-F566 WeakPolarHBondContact O-CG 3.34Å; V562-F566 PolarHBondContact O-N 3.04Å; V562-L761 HydrophobicContact CG1-CD1 3.96Å; V562-L761 HydrophobicContact CG2-CD1 4.39Å; V562-T764 HydrophobicContact CG2-CG2 3.93Å
563	P	90.1	Very high	91.9	Very high	56 Å²	56	30.8 Å²	30.8	36%	0.364	16%	0.162	S	C	.	.	H	α-helix	trans	-63	-35.9	179.1	-22.7	35.3	0	0	0	113.9	N364 T561 E567	N364-P563 PolarHBondContact ND2-O 3.02Å; N364-P563 VanDerWaalsContact ND2-O 3.16Å; N364-P563 PolarHBondContact OD1-O 2.67Å; T561-P563 VanDerWaalsContact C-CD 3.5Å; P563-E567 PolarHBondContact O-N 3.23Å
564	A	91.1	Very high	92.5	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.033	15%	0.149	C	C	.	.	H	α-helix	trans	-70.2	-42.3	177.8	0	0	0	0	0	111.9	C542 T561 V562 F566 E567 L568	C542-A564 HydrophobicContact CB-CB 4.21Å; T561-A564 PolarHBondContact O-N 2.73Å; T561-A564 VanDerWaalsContact O-N 3.09Å; T561-A564 VanDerWaalsContact OG1-CB 3.24Å; T561-A564 WeakPolarHBondContact OG1-CB 3.38Å; V562-A564 VanDerWaalsContact C-N 3.33Å; V562-A564 PolarHBondContact O-N 3.49Å; A564-F566 VanDerWaalsContact C-N 3.28Å; A564-F566 PolarHBondContact O-N 3.37Å; A564-E567 PolarHBondContact O-N 3Å; A564-L568 WeakPolarHBondContact O-CG 3.37Å; A564-L568 PolarHBondContact O-N 2.91Å
565	L	92.3	Very high	92.8	Very high	11 Å²	11	23.1 Å²	23.1	6%	0.058	13%	0.13	C	C	.	.	H	α-helix	trans	-62.4	-38.1	175.6	-67	176.3	0	0	0	111.5	L492 S559 T561 V562 L568 N569	L492-L565 HydrophobicContact CD2-CD2 4Å; S559-L565 VanDerWaalsContact O-CD2 3.31Å; S559-L565 WeakPolarHBondContact O-CD2 3.47Å; S559-L565 WeakPolarHBondContact O-CG 3.47Å; T561-L565 PolarHBondContact O-N 3.06Å; V562-L565 PolarHBondContact O-N 3.03Å; L565-L568 PolarHBondContact O-N 3.28Å; L565-N569 VanDerWaalsContact O-CB 3.24Å; L565-N569 WeakPolarHBondContact O-CB 3.45Å; L565-N569 PolarHBondContact O-N 2.86Å
566	F	92.7	Very high	92.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.7	-41.9	175.9	-81.4	19.1	0	0	0	112.3	Q367 L368 V562 A564 N569 F570 G772 A775 T776	Q367-F566 HydrophobicContact CB-CD2 3.7Å; Q367-F566 HydrophobicContact CB-CE2 4.08Å; Q367-F566 VanDerWaalsContact OE1-CD2 3.3Å; Q367-F566 VanDerWaalsContact OE1-CG 3.31Å; L368-F566 HydrophobicContact CD2-CE2 3.97Å; L368-F566 HydrophobicContact CG-CE2 4.37Å; V562-F566 HydrophobicContact CG1-CD1 4.05Å; V562-F566 HydrophobicContact CG1-CD2 4.18Å; V562-F566 HydrophobicContact CG1-CE1 3.63Å; V562-F566 HydrophobicContact CG1-CE2 3.79Å; V562-F566 HydrophobicContact CG1-CG 4.31Å; V562-F566 HydrophobicContact CG1-CZ 3.48Å; V562-F566 VanDerWaalsContact CG1-CZ 3.48Å; V562-F566 WeakPolarHBondContact O-CB 3.5Å; V562-F566 WeakPolarHBondContact O-CD1 3.37Å; V562-F566 WeakPolarHBondContact O-CG 3.34Å; V562-F566 PolarHBondContact O-N 3.04Å; A564-F566 VanDerWaalsContact C-N 3.28Å; A564-F566 PolarHBondContact O-N 3.37Å; F566-N569 PolarHBondContact O-N 2.71Å; F566-F570 PolarHBondContact O-N 3.47Å; F566-G772 WeakPolarHBondContact CE1-O 3.49Å; F566-A775 HydrophobicContact CZ-CB 4.47Å; F566-A775 WeakPolarHBondContact CZ-O 3.48Å; F566-T776 HydrophobicContact CD1-CG2 3.71Å; F566-T776 HydrophobicContact CD2-CG2 4.26Å; F566-T776 HydrophobicContact CE1-CG2 3.66Å; F566-T776 HydrophobicContact CE2-CG2 4.22Å; F566-T776 HydrophobicContact CG-CG2 4.02Å; F566-T776 HydrophobicContact CZ-CG2 3.94Å
567	E	91.9	Very high	92.5	Very high	18 Å²	18	23 Å²	23	8%	0.084	13%	0.126	C	C	.	.	H	α-helix	trans	-66.3	-45.1	173.8	174.8	156.2	-161.7	0	0	112.4	R357 Y363 C542 P563 A564 N569 F570 Y571	R357-E567 IonicContact NH2-OE1 3.9Å; Y363-E567 HydrophobicContact CE2-CB 4.19Å; Y363-E567 VanDerWaalsContact OH-CB 3.26Å; Y363-E567 WeakPolarHBondContact OH-CB 3.43Å; Y363-E567 WeakPolarHBondContact OH-CG 3.38Å; Y363-E567 PolarHBondContact OH-OE1 3.43Å; Y363-E567 VanDerWaalsContact OH-OE1 3.05Å; Y363-E567 PolarHBondContact OH-OE2 3.18Å; C542-E567 VanDerWaalsContact SG-CB 3.59Å; C542-E567 WeakPolarHBondContact SG-CG 3.31Å; C542-E567 PolarHBondContact SG-OE2 2.91Å; P563-E567 PolarHBondContact O-N 3.23Å; A564-E567 PolarHBondContact O-N 3Å; E567-N569 VanDerWaalsContact C-N 3.33Å; E567-N569 PolarHBondContact O-N 3.44Å; E567-F570 WeakPolarHBondContact O-CB 3.37Å; E567-F570 PolarHBondContact O-N 3.42Å; E567-Y571 HydrophobicContact CG-CD2 4.16Å; E567-Y571 HydrophobicContact CG-CE2 3.75Å; E567-Y571 WeakPolarHBondContact O-CD2 3.49Å; E567-Y571 PolarHBondContact O-N 2.86Å
568	L	93.9	Very high	92.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.8	-43.2	173.8	-70.9	171.7	0	0	0	111.4	A488 L492 L539 C542 V543 P558 A564 L565 F570 Y571 S572	A488-L568 HydrophobicContact CB-CD2 4.02Å; A488-L568 WeakPolarHBondContact CB-O 3.29Å; L492-L568 HydrophobicContact CD1-CB 3.79Å; L492-L568 HydrophobicContact CD2-CB 4.09Å; L492-L568 HydrophobicContact CD2-CD1 4.18Å; L492-L568 HydrophobicContact CG-CB 4.01Å; L539-L568 HydrophobicContact CD1-CD2 4.32Å; C542-L568 HydrophobicContact CB-CD1 4.15Å; C542-L568 HydrophobicContact CB-CD2 3.8Å; C542-L568 HydrophobicContact CB-CG 3.72Å; V543-L568 HydrophobicContact CG2-CD2 4.49Å; P558-L568 HydrophobicContact CB-CD1 3.69Å; A564-L568 WeakPolarHBondContact O-CG 3.37Å; A564-L568 PolarHBondContact O-N 2.91Å; L565-L568 PolarHBondContact O-N 3.28Å; L568-F570 VanDerWaalsContact C-N 3.31Å; L568-F570 PolarHBondContact O-N 3.41Å; L568-Y571 PolarHBondContact O-N 2.92Å; L568-S572 WeakPolarHBondContact O-CB 3.47Å; L568-S572 PolarHBondContact O-N 3.43Å; L568-S572 PolarHBondContact O-OG 2.85Å
569	N	94.2	Very high	92.4	Very high	9 Å²	9	21.6 Å²	21.6	5%	0.048	12%	0.115	C	C	.	.	H	α-helix	trans	-60.8	-43.5	178.6	-176.6	23.6	0	0	0	110.7	L492 L565 F566 E567 Y571 S572 N573 E773	L492-N569 HydrophobicContact CD1-CB 4.29Å; L565-N569 VanDerWaalsContact O-CB 3.24Å; L565-N569 WeakPolarHBondContact O-CB 3.45Å; L565-N569 PolarHBondContact O-N 2.86Å; F566-N569 PolarHBondContact O-N 2.71Å; E567-N569 VanDerWaalsContact C-N 3.33Å; E567-N569 PolarHBondContact O-N 3.44Å; N569-Y571 VanDerWaalsContact C-N 3.33Å; N569-Y571 PolarHBondContact O-N 2.95Å; N569-S572 WeakPolarHBondContact CA-OG 3.47Å; N569-S572 PolarHBondContact O-N 3.03Å; N569-S572 PolarHBondContact O-OG 3.21Å; N569-N573 PolarHBondContact O-N 3.17Å; N569-N573 PolarHBondContact O-ND2 2.81Å; N569-N573 PolarHBondContact OD1-ND2 2.97Å; N569-E773 HydrophobicContact CB-CB 3.75Å; N569-E773 HydrophobicContact CB-CG 4.19Å
570	F	93.4	Very high	92.5	Very high	8 Å²	8	21.8 Å²	21.8	4%	0.035	12%	0.115	C	C	.	.	H	α-helix	trans	-52.8	-48.5	175.5	177.6	-85.3	0	0	0	112.4	S320 G321 I358 Y363 F566 E567 L568	S320-F570 VanDerWaalsContact C-CD2 3.49Å; G321-F570 VanDerWaalsContact N-CD2 3.3Å; G321-F570 VanDerWaalsContact N-CE2 3.27Å; I358-F570 HydrophobicContact CD1-CD1 4.31Å; I358-F570 HydrophobicContact CD1-CE1 3.68Å; I358-F570 HydrophobicContact CD1-CE2 4.16Å; I358-F570 HydrophobicContact CD1-CZ 3.61Å; I358-F570 HydrophobicContact CG1-CE1 3.96Å; I358-F570 HydrophobicContact CG1-CZ 4.3Å; I358-F570 HydrophobicContact CG2-CE1 3.83Å; I358-F570 HydrophobicContact CG2-CZ 3.97Å; Y363-F570 HydrophobicContact CD2-CD2 4.41Å; Y363-F570 HydrophobicContact CE2-CB 4.32Å; Y363-F570 HydrophobicContact CE2-CG 4.44Å; F566-F570 PolarHBondContact O-N 3.47Å; E567-F570 WeakPolarHBondContact O-CB 3.37Å; E567-F570 PolarHBondContact O-N 3.42Å; L568-F570 VanDerWaalsContact C-N 3.31Å; L568-F570 PolarHBondContact O-N 3.41Å
571	Y	94.5	Very high	92.9	Very high	2 Å²	2	14.1 Å²	14.1	1%	0.008	8%	0.083	C	C	.	.	H	α-helix	trans	-73.7	-38	178.9	-67.8	-65.9	0	0	0	112.6	D356 R357 I358 H485 L539 E567 L568 N569 N573 G574	D356-Y571 VanDerWaalsContact O-CE1 3.31Å; D356-Y571 WeakPolarHBondContact O-CE1 3.39Å; R357-Y571 WeakPolarHBondContact CA-OH 3.34Å; R357-Y571 VanDerWaalsContact CG-OH 3.29Å; R357-Y571 WeakPolarHBondContact CG-OH 3.32Å; I358-Y571 PolarHBondContact N-OH 3.23Å; I358-Y571 VanDerWaalsContact N-OH 3.11Å; H485-Y571 WeakPolarHBondContact CA-O 3.22Å; H485-Y571 WeakPolarHBondContact CB-O 3.44Å; H485-Y571 PolarHBondContact CD2-O 2.96Å; L539-Y571 HydrophobicContact CD2-CD2 3.58Å; L539-Y571 HydrophobicContact CD2-CE2 3.82Å; L539-Y571 HydrophobicContact CD2-CG 4.34Å; E567-Y571 HydrophobicContact CG-CD2 4.16Å; E567-Y571 HydrophobicContact CG-CE2 3.75Å; E567-Y571 WeakPolarHBondContact O-CD2 3.49Å; E567-Y571 PolarHBondContact O-N 2.86Å; L568-Y571 PolarHBondContact O-N 2.92Å; N569-Y571 VanDerWaalsContact C-N 3.33Å; N569-Y571 PolarHBondContact O-N 2.95Å; Y571-N573 PolarHBondContact O-N 3.35Å; Y571-G574 PolarHBondContact O-N 3.31Å
572	S	95.2	Very high	93.1	Very high	3 Å²	3	10.5 Å²	10.5	2%	0.021	6%	0.061	C	C	.	.	H	α-helix	trans	-61.7	-30.6	178.6	78.2	0	0	0	0	112.6	L568 N569 G574 L575	L568-S572 WeakPolarHBondContact O-CB 3.47Å; L568-S572 PolarHBondContact O-N 3.43Å; L568-S572 PolarHBondContact O-OG 2.85Å; N569-S572 WeakPolarHBondContact CA-OG 3.47Å; N569-S572 PolarHBondContact O-N 3.03Å; N569-S572 PolarHBondContact O-OG 3.21Å; S572-G574 PolarHBondContact O-N 3.18Å; S572-L575 PolarHBondContact O-N 2.78Å
573	N	93.6	Very high	93.4	Very high	8 Å²	8	9.5 Å²	9.5	4%	0.043	6%	0.055	C	C	.	.	H	α-helix	trans	-62	-15.1	176.1	-78.3	-43.4	0	0	0	113.3	S320 K322 N569 Y571 L575 F576	S320-N573 WeakPolarHBondContact O-CB 3.47Å; S320-N573 PolarHBondContact O-ND2 3.09Å; K322-N573 VanDerWaalsContact CE-CG 3.48Å; K322-N573 WeakPolarHBondContact CE-OD1 3.49Å; K322-N573 HydrophobicContact CG-CB 3.88Å; N569-N573 PolarHBondContact O-N 3.17Å; N569-N573 PolarHBondContact O-ND2 2.81Å; N569-N573 PolarHBondContact OD1-ND2 2.97Å; Y571-N573 PolarHBondContact O-N 3.35Å; N573-L575 PolarHBondContact O-N 3.12Å; N573-F576 VanDerWaalsContact O-CB 3.3Å; N573-F576 WeakPolarHBondContact O-CB 3.46Å; N573-F576 PolarHBondContact O-N 2.79Å; N573-F576 VanDerWaalsContact O-N 3.16Å
574	G	92.8	Very high	93.7	Very high	8 Å²	8	6.8 Å²	6.8	8%	0.082	4%	0.037	C	C	.	.	H	α-helix	trans	-60.1	-25.5	167.7	0	0	0	0	0	114.1	Y571 S572 H577	Y571-G574 PolarHBondContact O-N 3.31Å; S572-G574 PolarHBondContact O-N 3.18Å; G574-H577 PolarHBondContact O-CE1 3.25Å; G574-H577 PolarHBondContact O-ND1 3.08Å; G574-H577 VanDerWaalsContact O-ND1 3.14Å
575	L	94.2	Very high	94	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-95.4	-11.4	174.4	-86.3	72.3	0	0	0	113	V481 H485 I486 C489 M511 I515 S572 N573 H577 V578 F579	V481-L575 HydrophobicContact CG1-CD1 3.5Å; V481-L575 HydrophobicContact CG1-CG 4.22Å; H485-L575 HydrophobicContact CB-CD1 3.31Å; I486-L575 HydrophobicContact CG1-CD1 4.07Å; I486-L575 HydrophobicContact CG1-CD2 4.3Å; C489-L575 HydrophobicContact CB-CB 4.46Å; C489-L575 HydrophobicContact CB-CD1 4.5Å; C489-L575 HydrophobicContact CB-CD2 3.85Å; M511-L575 HydrophobicContact CG-CD2 3.93Å; M511-L575 HydrophobicContact SD-CD2 3.99Å; I515-L575 HydrophobicContact CD1-CD2 4.13Å; I515-L575 HydrophobicContact CD1-CG 4.32Å; S572-L575 PolarHBondContact O-N 2.78Å; N573-L575 PolarHBondContact O-N 3.12Å; L575-H577 VanDerWaalsContact C-N 3.3Å; L575-H577 PolarHBondContact O-N 2.89Å; L575-V578 WeakPolarHBondContact O-CB 3.5Å; L575-V578 PolarHBondContact O-N 2.99Å; L575-F579 HydrophobicContact CB-CD2 4.4Å; L575-F579 HydrophobicContact CD2-CE2 4.07Å; L575-F579 HydrophobicContact CG-CE2 4.45Å; L575-F579 PolarHBondContact O-N 3.5Å
576	F	91	Very high	94.1	Very high	12 Å²	12	6.1 Å²	6.1	5%	0.053	3%	0.033	C	C	.	.	H	α-helix	trans	-55.7	-46.3	-172.5	-164.2	-106.6	0	0	0	112	K322 N573 V578 F579 I580 V632 L726 V729	K322-F576 HydrophobicContact CD-CD1 4.31Å; N573-F576 VanDerWaalsContact O-CB 3.3Å; N573-F576 WeakPolarHBondContact O-CB 3.46Å; N573-F576 PolarHBondContact O-N 2.79Å; N573-F576 VanDerWaalsContact O-N 3.16Å; F576-V578 VanDerWaalsContact C-N 3.26Å; F576-V578 PolarHBondContact O-N 3.48Å; F576-F579 PolarHBondContact O-N 2.95Å; F576-I580 HydrophobicContact CD1-CD1 4.34Å; F576-I580 HydrophobicContact CE1-CD1 3.68Å; F576-I580 HydrophobicContact CE1-CG1 4.42Å; F576-I580 HydrophobicContact CE2-CD1 4.46Å; F576-I580 HydrophobicContact CZ-CD1 3.75Å; F576-I580 VanDerWaalsContact O-CB 3.28Å; F576-I580 WeakPolarHBondContact O-CB 3.47Å; F576-I580 PolarHBondContact O-N 3.14Å; F576-V632 HydrophobicContact CD1-CB 4.22Å; F576-V632 HydrophobicContact CD1-CG2 4.07Å; F576-V632 HydrophobicContact CE1-CB 3.77Å; F576-V632 HydrophobicContact CE1-CG1 3.86Å; F576-V632 HydrophobicContact CE1-CG2 4.07Å; F576-L726 HydrophobicContact CE2-CD2 3.95Å; F576-L726 HydrophobicContact CZ-CD2 3.63Å; F576-V729 HydrophobicContact CZ-CG2 4.5Å
577	H	90.1	Very high	94.3	Very high	32 Å²	32	6.1 Å²	6.1	15%	0.148	3%	0.033	C	C	.	.	H	α-helix	trans	-72.1	-13.5	179.8	72	-74.7	0	0	0	114.8	N476 F520 G574 L575	N476-H577 WeakPolarHBondContact ND2-CB 3.5Å; N476-H577 PolarHBondContact O-NE2 3.49Å; F520-H577 AromaticContact CD1-NE2 3.76Å; F520-H577 AromaticContact CE1-CD2 3.33Å; F520-H577 WeakPolarHBondContact CE1-CD2 3.28Å; F520-H577 AromaticContact CE1-NE2 3.28Å; F520-H577 VanDerWaalsContact CE1-NE2 3.28Å; F520-H577 WeakPolarHBondContact CE1-NE2 3.32Å; F520-H577 AromaticContact CZ-CD2 3.85Å; G574-H577 PolarHBondContact O-CE1 3.25Å; G574-H577 PolarHBondContact O-ND1 3.08Å; G574-H577 VanDerWaalsContact O-ND1 3.14Å; L575-H577 VanDerWaalsContact C-N 3.3Å; L575-H577 PolarHBondContact O-N 2.89Å
578	V	93.8	Very high	94.5	Very high	7 Å²	7	5.2 Å²	5.2	4%	0.042	3%	0.029	C	C	.	.	H	α-helix	trans	-77.6	-39.7	176.1	-179.9	0	0	0	0	110.6	V481 I515 R518 F520 L575 F576	V481-V578 HydrophobicContact CG2-CG2 4.07Å; I515-V578 HydrophobicContact CG1-CG1 4.29Å; R518-V578 HydrophobicContact CB-CG1 4.44Å; F520-V578 HydrophobicContact CD1-CG2 3.98Å; F520-V578 HydrophobicContact CD2-CB 4.29Å; F520-V578 HydrophobicContact CD2-CG1 3.79Å; F520-V578 HydrophobicContact CD2-CG2 4Å; F520-V578 HydrophobicContact CE1-CG2 4.08Å; F520-V578 HydrophobicContact CE2-CB 4.14Å; F520-V578 HydrophobicContact CE2-CG1 3.92Å; F520-V578 HydrophobicContact CE2-CG2 4.08Å; F520-V578 HydrophobicContact CG-CG1 4.44Å; F520-V578 HydrophobicContact CG-CG2 3.94Å; F520-V578 HydrophobicContact CZ-CB 4.43Å; F520-V578 HydrophobicContact CZ-CG2 4.11Å; L575-V578 WeakPolarHBondContact O-CB 3.5Å; L575-V578 PolarHBondContact O-N 2.99Å; F576-V578 VanDerWaalsContact C-N 3.26Å; F576-V578 PolarHBondContact O-N 3.48Å
579	F	94.6	Very high	94.5	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-110.4	-0.9	-172.3	-63.9	-79.2	0	0	0	114	M511 E514 I515 R518 L575 F576 S581 D582 A583 L722 L725	M511-F579 HydrophobicContact SD-CE1 4.49Å; M511-F579 HydrophobicContact SD-CE2 3.65Å; M511-F579 HydrophobicContact SD-CZ 3.46Å; M511-F579 WeakPolarHBondContact SD-CZ 3.24Å; E514-F579 HydrophobicContact CB-CZ 4.3Å; I515-F579 HydrophobicContact CG1-CE2 4.37Å; I515-F579 HydrophobicContact CG1-CZ 4.41Å; R518-F579 VanDerWaalsContact CZ-CE1 3.48Å; L575-F579 HydrophobicContact CB-CD2 4.4Å; L575-F579 HydrophobicContact CD2-CE2 4.07Å; L575-F579 HydrophobicContact CG-CE2 4.45Å; L575-F579 PolarHBondContact O-N 3.5Å; F576-F579 PolarHBondContact O-N 2.95Å; F579-S581 PolarHBondContact O-N 3.28Å; F579-D582 PolarHBondContact O-N 3.18Å; F579-D582 VanDerWaalsContact O-N 3.07Å; F579-A583 WeakPolarHBondContact O-CB 3.34Å; F579-A583 PolarHBondContact O-N 3.21Å; F579-L722 HydrophobicContact CB-CD2 4.11Å; F579-L722 HydrophobicContact CD1-CD2 4.05Å; F579-L722 HydrophobicContact CG-CD2 4.42Å; F579-L725 HydrophobicContact CB-CD1 3.59Å; F579-L725 HydrophobicContact CG-CD1 4.24Å
580	I	94.4	Very high	94.4	Very high	9 Å²	9	5.9 Å²	5.9	5%	0.046	3%	0.033	C	C	.	.	H	α-helix	trans	-56.8	-43.2	-170.4	-174.7	59.1	0	0	0	113.9	F576 D582 A583 I584 V632 V634 L726	F576-I580 HydrophobicContact CD1-CD1 4.34Å; F576-I580 HydrophobicContact CE1-CD1 3.68Å; F576-I580 HydrophobicContact CE1-CG1 4.42Å; F576-I580 HydrophobicContact CE2-CD1 4.46Å; F576-I580 HydrophobicContact CZ-CD1 3.75Å; F576-I580 VanDerWaalsContact O-CB 3.28Å; F576-I580 WeakPolarHBondContact O-CB 3.47Å; F576-I580 PolarHBondContact O-N 3.14Å; I580-D582 VanDerWaalsContact C-N 3.31Å; I580-D582 PolarHBondContact O-N 3.06Å; I580-A583 PolarHBondContact O-N 3.28Å; I580-I584 HydrophobicContact CD1-CD1 4.09Å; I580-I584 HydrophobicContact CD1-CG1 4.14Å; I580-I584 HydrophobicContact CG1-CD1 3.97Å; I580-I584 HydrophobicContact CG1-CG1 4.44Å; I580-I584 VanDerWaalsContact O-CG1 3.31Å; I580-I584 WeakPolarHBondContact O-CG1 3.31Å; I580-I584 PolarHBondContact O-N 3Å; I580-V632 HydrophobicContact CB-CG2 4.49Å; I580-V632 HydrophobicContact CD1-CG1 3.78Å; I580-V632 HydrophobicContact CG1-CB 4.47Å; I580-V632 HydrophobicContact CG1-CG1 3.69Å; I580-V632 HydrophobicContact CG1-CG2 4.05Å; I580-V632 HydrophobicContact CG2-CG2 4.42Å; I580-V634 HydrophobicContact CG1-CG2 4.1Å; I580-L726 HydrophobicContact CD1-CD2 3.77Å
581	S	95.4	Very high	94.3	Very high	12 Å²	12	5.6 Å²	5.6	8%	0.084	3%	0.032	C	C	.	.	H	α-helix	trans	-62.9	-42	178.8	54.6	0	0	0	0	111.4	F579 I584 I585 R651	F579-S581 PolarHBondContact O-N 3.28Å; S581-I584 PolarHBondContact O-N 3Å; S581-I585 WeakPolarHBondContact O-CG1 3.15Å; S581-I585 PolarHBondContact O-N 3.46Å; S581-I585 VanDerWaalsContact O-N 3.17Å; S581-R651 PolarHBondContact OG-NH2 3.27Å
582	D	95.3	Very high	94.1	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-71.3	-37.8	-177.8	-54.6	2	0	0	0	109.6	R518 F579 I580 I585 A586 R651 L722	R518-D582 IonicContact CZ-OD2 3.71Å; R518-D582 IonicContact NE-OD2 2.64Å; R518-D582 PolarHBondContact NE-OD2 2.91Å; R518-D582 IonicContact NH2-OD2 2.81Å; R518-D582 PolarHBondContact NH2-OD2 2.79Å; R518-D582 VanDerWaalsContact NH2-OD2 3.1Å; F579-D582 PolarHBondContact O-N 3.18Å; F579-D582 VanDerWaalsContact O-N 3.07Å; I580-D582 VanDerWaalsContact C-N 3.31Å; I580-D582 PolarHBondContact O-N 3.06Å; D582-I585 PolarHBondContact O-N 3.03Å; D582-A586 WeakPolarHBondContact O-CB 3.44Å; D582-A586 PolarHBondContact O-N 2.82Å; D582-R651 IonicContact OD1-CZ 3.33Å; D582-R651 IonicContact OD1-NE 3.3Å; D582-R651 IonicContact OD1-NH2 3.6Å; D582-R651 PolarHBondContact OD1-NH2 3.08Å; D582-L722 HydrophobicContact CB-CD1 3.99Å; D582-L722 HydrophobicContact CB-CD2 3.99Å
583	A	96.1	Very high	93.8	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-65	-41.9	175.1	0	0	0	0	0	112.9	F579 I580 I585 A586 C587 L722 L725 L726	F579-A583 WeakPolarHBondContact O-CB 3.34Å; F579-A583 PolarHBondContact O-N 3.21Å; I580-A583 PolarHBondContact O-N 3.28Å; A583-I585 VanDerWaalsContact C-N 3.35Å; A583-A586 PolarHBondContact O-N 3.5Å; A583-C587 WeakPolarHBondContact O-CB 3.38Å; A583-C587 PolarHBondContact O-N 3.44Å; A583-L722 VanDerWaalsContact CB-O 3.29Å; A583-L722 WeakPolarHBondContact CB-O 3.4Å; A583-L725 HydrophobicContact CB-CB 4.4Å; A583-L725 HydrophobicContact CB-CD1 4.45Å; A583-L726 HydrophobicContact CB-CD1 4.01Å; A583-L726 HydrophobicContact CB-CG 4.04Å
584	I	97.2	Very high	93.4	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-63	-43	175.5	-70.7	170.6	0	0	0	110.4	I580 S581 S588 A621 L624 V634 F645 L726	I580-I584 HydrophobicContact CD1-CD1 4.09Å; I580-I584 HydrophobicContact CD1-CG1 4.14Å; I580-I584 HydrophobicContact CG1-CD1 3.97Å; I580-I584 HydrophobicContact CG1-CG1 4.44Å; I580-I584 VanDerWaalsContact O-CG1 3.31Å; I580-I584 WeakPolarHBondContact O-CG1 3.31Å; I580-I584 PolarHBondContact O-N 3Å; S581-I584 PolarHBondContact O-N 3Å; I584-S588 VanDerWaalsContact O-CB 3.28Å; I584-S588 WeakPolarHBondContact O-CB 3.29Å; I584-S588 PolarHBondContact O-N 2.55Å; I584-S588 PolarHBondContact O-OG 3.18Å; I584-A621 HydrophobicContact CG2-CB 3.78Å; I584-A621 WeakPolarHBondContact CG2-O 3.49Å; I584-L624 HydrophobicContact CG2-CB 4.24Å; I584-L624 HydrophobicContact CG2-CD2 4.12Å; I584-L624 HydrophobicContact CG2-CG 4.31Å; I584-V634 HydrophobicContact CD1-CG2 3.6Å; I584-F645 HydrophobicContact CB-CE1 3.97Å; I584-F645 HydrophobicContact CB-CZ 4.36Å; I584-F645 HydrophobicContact CD1-CE1 4.26Å; I584-F645 HydrophobicContact CD1-CZ 4.11Å; I584-F645 HydrophobicContact CG2-CE1 3.71Å; I584-F645 HydrophobicContact CG2-CZ 3.75Å; I584-L726 HydrophobicContact CG1-CD1 3.91Å
585	I	96.9	Very high	93	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61	-46.7	174.6	-67.3	-67.4	0	0	0	110.7	S581 D582 A583 C587 S588 A589 L617 A621 F645 A648 V649 L652	S581-I585 WeakPolarHBondContact O-CG1 3.15Å; S581-I585 PolarHBondContact O-N 3.46Å; S581-I585 VanDerWaalsContact O-N 3.17Å; D582-I585 PolarHBondContact O-N 3.03Å; A583-I585 VanDerWaalsContact C-N 3.35Å; I585-C587 PolarHBondContact O-N 2.91Å; I585-S588 PolarHBondContact O-N 3.13Å; I585-S588 VanDerWaalsContact O-N 3.16Å; I585-A589 WeakPolarHBondContact O-CB 3.47Å; I585-A589 PolarHBondContact O-N 2.94Å; I585-L617 HydrophobicContact CD1-CG 4.43Å; I585-L617 HydrophobicContact CG2-CD1 4.44Å; I585-L617 HydrophobicContact CG2-CD2 4.07Å; I585-L617 HydrophobicContact CG2-CG 4.45Å; I585-A621 HydrophobicContact CD1-CB 3.73Å; I585-F645 HydrophobicContact CD1-CB 4.06Å; I585-F645 HydrophobicContact CD1-CD1 3.91Å; I585-F645 HydrophobicContact CD1-CG 4.2Å; I585-F645 HydrophobicContact CG1-CD1 4.03Å; I585-A648 HydrophobicContact CG1-CB 4.03Å; I585-V649 HydrophobicContact CD1-CG2 3.81Å; I585-V649 HydrophobicContact CG1-CG2 4.37Å; I585-V649 HydrophobicContact CG2-CG2 4.31Å; I585-L652 HydrophobicContact CB-CD1 4.13Å; I585-L652 HydrophobicContact CG2-CD1 3.61Å
586	A	95.4	Very high	92.4	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-63.4	-40.2	-178.6	0	0	0	0	0	113.3	D582 A583 L590 F719 L722 Q723	D582-A586 WeakPolarHBondContact O-CB 3.44Å; D582-A586 PolarHBondContact O-N 2.82Å; A583-A586 PolarHBondContact O-N 3.5Å; A586-L590 PolarHBondContact O-N 3.46Å; A586-L590 VanDerWaalsContact O-N 3.15Å; A586-F719 HydrophobicContact CB-CD2 3.97Å; A586-F719 HydrophobicContact CB-CE1 4.27Å; A586-F719 HydrophobicContact CB-CE2 3.7Å; A586-F719 HydrophobicContact CB-CG 4.39Å; A586-F719 HydrophobicContact CB-CZ 3.88Å; A586-L722 HydrophobicContact CB-CB 3.74Å; A586-L722 HydrophobicContact CB-CD1 4.29Å; A586-Q723 HydrophobicContact CB-CG 3.9Å; A586-Q723 PolarHBondContact O-NE2 2.93Å
587	C	96.3	Very high	91.8	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-68.5	-36.1	173	-78.4	0	0	0	0	112.6	A583 I585 L590 A591 L624 L726 F826	A583-C587 WeakPolarHBondContact O-CB 3.38Å; A583-C587 PolarHBondContact O-N 3.44Å; I585-C587 PolarHBondContact O-N 2.91Å; C587-L590 WeakPolarHBondContact O-CB 3.37Å; C587-L590 PolarHBondContact O-N 3.05Å; C587-A591 PolarHBondContact O-N 3.49Å; C587-L624 HydrophobicContact CB-CD2 3.84Å; C587-L726 HydrophobicContact CB-CD1 4.36Å; C587-F826 HydrophobicContact CB-CB 4.34Å
588	S	95.9	Very high	91	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-71.6	-38.1	179.3	-58.1	0	0	0	0	112	I584 I585 A591 L592 A621	I584-S588 VanDerWaalsContact O-CB 3.28Å; I584-S588 WeakPolarHBondContact O-CB 3.29Å; I584-S588 PolarHBondContact O-N 2.55Å; I584-S588 PolarHBondContact O-OG 3.18Å; I585-S588 PolarHBondContact O-N 3.13Å; I585-S588 VanDerWaalsContact O-N 3.16Å; S588-A591 PolarHBondContact O-N 3.12Å; S588-L592 WeakPolarHBondContact O-CG 3.32Å; S588-L592 PolarHBondContact O-N 3.06Å; S588-A621 WeakPolarHBondContact OG-CA 3.46Å; S588-A621 PolarHBondContact OG-N 3.17Å
589	A	93.4	Very high	89.7	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.6	-44.3	170.8	0	0	0	0	0	111	I585 A591 L592 L593 L612 L617 F719	I585-A589 WeakPolarHBondContact O-CB 3.47Å; I585-A589 PolarHBondContact O-N 2.94Å; A589-A591 VanDerWaalsContact C-N 3.29Å; A589-A591 PolarHBondContact O-N 3.11Å; A589-L592 PolarHBondContact O-N 3.3Å; A589-L593 VanDerWaalsContact O-CG 3.25Å; A589-L593 WeakPolarHBondContact O-CG 3.44Å; A589-L593 PolarHBondContact O-N 3.37Å; A589-L612 HydrophobicContact CB-CD1 4.11Å; A589-L617 HydrophobicContact CB-CD1 3.89Å; A589-F719 HydrophobicContact CB-CE1 4.3Å; A589-F719 HydrophobicContact CB-CZ 3.71Å
590	L	92.1	Very high	88	Confident	23 Å²	23	28.6 Å²	28.6	12%	0.12	16%	0.163	C	C	.	.	H	α-helix	trans	-56.5	-43.1	174.3	178.7	63.3	0	0	0	112.2	A586 C587 R594 L828	A586-L590 PolarHBondContact O-N 3.46Å; A586-L590 VanDerWaalsContact O-N 3.15Å; C587-L590 WeakPolarHBondContact O-CB 3.37Å; C587-L590 PolarHBondContact O-N 3.05Å; L590-R594 WeakPolarHBondContact O-CG 3.45Å; L590-R594 PolarHBondContact O-N 3.48Å; L590-R594 VanDerWaalsContact O-N 3.13Å; L590-L828 HydrophobicContact CD2-CB 4.31Å; L590-L828 HydrophobicContact CD2-CD1 4.21Å
591	A	91.7	Very high	86.1	Confident	2 Å²	2	34.2 Å²	34.2	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-62.6	-44.6	177.8	0	0	0	0	0	111.9	C587 S588 A589 R594 E595 G825 F826	C587-A591 PolarHBondContact O-N 3.49Å; S588-A591 PolarHBondContact O-N 3.12Å; A589-A591 VanDerWaalsContact C-N 3.29Å; A589-A591 PolarHBondContact O-N 3.11Å; A591-R594 PolarHBondContact O-N 3.12Å; A591-E595 WeakPolarHBondContact O-CG 3.48Å; A591-E595 PolarHBondContact O-N 2.79Å; A591-G825 WeakPolarHBondContact CA-O 3.47Å; A591-F826 HydrophobicContact CB-CD1 3.71Å; A591-F826 HydrophobicContact CB-CE1 3.82Å; A591-F826 HydrophobicContact CB-CG 4.36Å
592	L	90.7	Very high	84.1	Confident	7 Å²	7	42.5 Å²	42.5	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-66.2	-42.6	178.4	-70.6	175.2	0	0	0	112.8	S588 A589 R594 E595 Q596 L612 L617 K620	S588-L592 WeakPolarHBondContact O-CG 3.32Å; S588-L592 PolarHBondContact O-N 3.06Å; A589-L592 PolarHBondContact O-N 3.3Å; L592-R594 PolarHBondContact O-N 2.91Å; L592-E595 PolarHBondContact O-N 3.38Å; L592-Q596 PolarHBondContact O-N 2.8Å; L592-L612 HydrophobicContact CB-CD2 3.79Å; L592-L612 HydrophobicContact CD1-CD2 4.38Å; L592-L617 HydrophobicContact CD1-CB 4.05Å; L592-L617 HydrophobicContact CD1-CD1 4.15Å; L592-K620 HydrophobicContact CG-CG 4.47Å
593	L	88.1	Confident	81.5	Confident	41 Å²	41	45 Å²	45	22%	0.215	26%	0.26	C	S	.	.	H	α-helix	trans	-60.3	-36.6	176.7	-68.6	173.8	0	0	0	111.6	A589 A597 I610 L612 V709	A589-L593 VanDerWaalsContact O-CG 3.25Å; A589-L593 WeakPolarHBondContact O-CG 3.44Å; A589-L593 PolarHBondContact O-N 3.37Å; L593-A597 WeakPolarHBondContact O-CB 3.26Å; L593-A597 PolarHBondContact O-N 3.07Å; L593-I610 HydrophobicContact CD2-CB 3.88Å; L593-I610 HydrophobicContact CD2-CD1 4.21Å; L593-I610 HydrophobicContact CD2-CG2 3.29Å; L593-L612 HydrophobicContact CD2-CD1 4.23Å; L593-L612 HydrophobicContact CD2-CD2 3.86Å; L593-L612 HydrophobicContact CD2-CG 4.17Å; L593-L612 HydrophobicContact CG-CD1 4.44Å; L593-L612 HydrophobicContact CG-CD2 4.21Å; L593-V709 HydrophobicContact CD1-CG2 4.5Å
594	R	86.3	Confident	79	Confident	77 Å²	77	54.3 Å²	54.3	29%	0.291	30%	0.304	S	S	.	.	H	α-helix	trans	-71.2	-38.9	176.1	-76.1	174.6	171.8	176	-1.3	113	L590 A591 L592 Q596 A597 A598 L824 G825 T827	L590-R594 WeakPolarHBondContact O-CG 3.45Å; L590-R594 PolarHBondContact O-N 3.48Å; L590-R594 VanDerWaalsContact O-N 3.13Å; A591-R594 PolarHBondContact O-N 3.12Å; L592-R594 PolarHBondContact O-N 2.91Å; R594-Q596 VanDerWaalsContact C-N 3.32Å; R594-A597 PolarHBondContact O-N 2.77Å; R594-A598 WeakPolarHBondContact O-CB 3.34Å; R594-A598 PolarHBondContact O-N 3.02Å; R594-L824 PolarHBondContact NH1-O 3.43Å; R594-G825 PolarHBondContact NH1-O 3.29Å; R594-T827 PolarHBondContact NH1-O 3.44Å; R594-T827 PolarHBondContact NH2-O 2.77Å
595	E	84.6	Confident	76.7	Confident	76 Å²	76	63.7 Å²	63.7	36%	0.355	35%	0.348	S	S	.	.	H	α-helix	trans	-60.9	-43.8	175	-75	169.1	-167.1	0	0	110.6	A591 L592 A598 S599 K620	A591-E595 WeakPolarHBondContact O-CG 3.48Å; A591-E595 PolarHBondContact O-N 2.79Å; L592-E595 PolarHBondContact O-N 3.38Å; E595-A598 PolarHBondContact O-N 2.9Å; E595-S599 PolarHBondContact O-N 3.33Å; E595-S599 PolarHBondContact O-OG 3.48Å; E595-K620 IonicContact OE1-NZ 3.86Å; E595-K620 PolarHBondContact OE1-NZ 3.5Å; E595-K620 IonicContact OE2-NZ 2.65Å
596	Q	81.3	Confident	73.8	Confident	43 Å²	43	67 Å²	67	20%	0.201	38%	0.383	C	S	.	.	H	α-helix	trans	-65.8	-45.1	177	-72.3	169.6	-39.1	0	0	112.3	L592 R594 A598 S599 E600 I610 L611	L592-Q596 PolarHBondContact O-N 2.8Å; R594-Q596 VanDerWaalsContact C-N 3.32Å; Q596-A598 PolarHBondContact O-N 2.87Å; Q596-S599 PolarHBondContact O-N 3.02Å; Q596-S599 VanDerWaalsContact O-N 3.07Å; Q596-E600 PolarHBondContact O-N 3.24Å; Q596-I610 HydrophobicContact CB-CG2 4.48Å; Q596-L611 PolarHBondContact NE2-O 3.27Å
597	A	78.7	Confident	71.3	Confident	48 Å²	48	70.4 Å²	70.4	40%	0.397	42%	0.417	S	S	.	.	H	α-helix	trans	-61.8	-31.1	176.5	0	0	0	0	0	113	L593 R594 V601	L593-A597 WeakPolarHBondContact O-CB 3.26Å; L593-A597 PolarHBondContact O-N 3.07Å; R594-A597 PolarHBondContact O-N 2.77Å; A597-V601 WeakPolarHBondContact O-CG2 3.19Å
598	A	71.9	Confident	69.1	Low	66 Å²	66	75.9 Å²	75.9	55%	0.545	45%	0.453	S	S	.	.	H	α-helix	trans	-71.6	-33.4	174.7	0	0	0	0	0	112.4	R594 E595 Q596	R594-A598 WeakPolarHBondContact O-CB 3.34Å; R594-A598 PolarHBondContact O-N 3.02Å; E595-A598 PolarHBondContact O-N 2.9Å; Q596-A598 PolarHBondContact O-N 2.87Å
599	S	66.7	Low	67.2	Low	85 Å²	85	78.6 Å²	78.6	59%	0.594	47%	0.471	S	S	*	.	H	α-helix	trans	-76.8	-32.7	177.5	-60.1	0	0	0	0	113.5	E595 Q596 V601 E602	E595-S599 PolarHBondContact O-N 3.33Å; E595-S599 PolarHBondContact O-OG 3.48Å; Q596-S599 PolarHBondContact O-N 3.02Å; Q596-S599 VanDerWaalsContact O-N 3.07Å; S599-V601 VanDerWaalsContact C-N 3.3Å; S599-V601 PolarHBondContact O-N 3.45Å; S599-E602 PolarHBondContact O-N 3.16Å
600	E	59.7	Low	66.2	Low	111 Å²	111	81.1 Å²	81.1	52%	0.519	49%	0.485	S	S	.	.	H	α-helix	trans	-70.2	-22.5	178.7	-75	176.7	-174	0	0	113.6	Q596 E602 G603	Q596-E600 PolarHBondContact O-N 3.24Å; E600-E602 PolarHBondContact O-N 2.85Å; E600-E602 VanDerWaalsContact O-N 3.11Å; E600-G603 PolarHBondContact O-N 2.73Å
601	V	55.5	Low	65.8	Low	128 Å²	128	81.6 Å²	81.6	78%	0.776	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-13.5	175.3	176.4	0	0	0	0	112	A597 S599	A597-V601 WeakPolarHBondContact O-CG2 3.19Å; S599-V601 VanDerWaalsContact C-N 3.3Å; S599-V601 PolarHBondContact O-N 3.45Å
602	E	52.5	Low	65.5	Low	185 Å²	185	81.6 Å²	81.6	86%	0.864	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-2.6	177.2	-63.6	-173.5	163.4	0	0	114.5	S599 E600	S599-E602 PolarHBondContact O-N 3.16Å; E600-E602 PolarHBondContact O-N 2.85Å; E600-E602 VanDerWaalsContact O-N 3.11Å
603	G	41.6	Very low	65.5	Low	52 Å²	52	81.7 Å²	81.7	54%	0.536	49%	0.488	S	S	.	.	S	Bend	trans	-138.3	140.1	-177.8	0	0	0	0	0	114.7	E600	E600-G603 PolarHBondContact O-N 2.73Å
604	E	43.6	Very low	65.7	Low	196 Å²	196	80.6 Å²	80.6	92%	0.916	48%	0.482	S	S	*	.			trans	-67.9	134.8	-174.1	-78.7	-175.7	148.6	0	0	115.5
605	Q	47	Very low	65.9	Low	197 Å²	197	81.3 Å²	81.3	92%	0.921	49%	0.489	S	S	*	.			trans	27.8	104.6	151.8	-61.1	-170.9	11.1	0	0	120.4
606	G	36.3	Very low	66.2	Low	71 Å²	71	83.4 Å²	83.4	73%	0.732	49%	0.493	S	S	*	.			trans	-155.7	140.2	151.7	0	0	0	0	0	109.6
607	G	43.4	Very low	66.7	Low	70 Å²	70	81.4 Å²	81.4	72%	0.722	48%	0.484	S	S	*	.			trans	-60.1	157.6	-171	0	0	0	0	0	115.6	S609	G607-S609 PolarHBondContact O-N 3.41Å
608	P	49.9	Very low	67.5	Low	116 Å²	116	79.2 Å²	79.2	75%	0.753	47%	0.465	S	S	*	.			trans	-87.4	78	-160	36.3	-33.9	0	0	0	111.1
609	S	56.1	Low	68.5	Low	56 Å²	56	82.4 Å²	82.4	39%	0.392	46%	0.463	S	S	.	.			trans	-98.9	80.1	160.3	132.6	0	0	0	0	106.4	G607 L611 K708	G607-S609 PolarHBondContact O-N 3.41Å; S609-L611 PolarHBondContact O-N 3.17Å; S609-K708 WeakPolarHBondContact OG-CE 3.22Å; S609-K708 PolarHBondContact OG-NZ 3.3Å; S609-K708 VanDerWaalsContact OG-NZ 3.1Å
610	I	72.4	Confident	69.7	Low	54 Å²	54	80.4 Å²	80.4	28%	0.277	44%	0.444	S	S	.	.			trans	-72.1	100.3	-177.3	-52.6	174.5	0	0	0	108.4	L593 Q596	L593-I610 HydrophobicContact CD2-CB 3.88Å; L593-I610 HydrophobicContact CD2-CD1 4.21Å; L593-I610 HydrophobicContact CD2-CG2 3.29Å; Q596-I610 HydrophobicContact CB-CG2 4.48Å
611	L	82.9	Confident	71.4	Confident	32 Å²	32	75.1 Å²	75.1	17%	0.168	42%	0.419	C	S	.	.			trans	-83	128.9	-180	-71.2	164.4	0	0	0	110.4	Q596 S609 A661 D664 L668 Y706 K708	Q596-L611 PolarHBondContact NE2-O 3.27Å; S609-L611 PolarHBondContact O-N 3.17Å; L611-A661 HydrophobicContact CD2-CB 3.42Å; L611-A661 VanDerWaalsContact CD2-CB 3.42Å; L611-D664 HydrophobicContact CD1-CB 4Å; L611-D664 HydrophobicContact CD2-CB 4.34Å; L611-L668 HydrophobicContact CD1-CD1 3.68Å; L611-Y706 HydrophobicContact CB-CD1 4.07Å; L611-K708 HydrophobicContact CD2-CD 4.24Å; L611-K708 HydrophobicContact CD2-CG 3.96Å
612	L	86.7	Confident	73.2	Confident	2 Å²	2	69 Å²	69	1%	0.01	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	116.2	176.5	-65.3	174.9	0	0	0	109.9	A589 L592 L593 Q614 Y706 L707 V709	A589-L612 HydrophobicContact CB-CD1 4.11Å; L592-L612 HydrophobicContact CB-CD2 3.79Å; L592-L612 HydrophobicContact CD1-CD2 4.38Å; L593-L612 HydrophobicContact CD2-CD1 4.23Å; L593-L612 HydrophobicContact CD2-CD2 3.86Å; L593-L612 HydrophobicContact CD2-CG 4.17Å; L593-L612 HydrophobicContact CG-CD1 4.44Å; L593-L612 HydrophobicContact CG-CD2 4.21Å; L612-Q614 PolarHBondContact O-N 3.08Å; L612-Y706 CarbonylContact O-C 3.53Å; L612-Y706 WeakPolarHBondContact O-CA 3.21Å; L612-L707 HydrophobicContact CB-CB 4.39Å; L612-L707 WeakPolarHBondContact CB-O 3.11Å; L612-L707 PolarHBondContact N-O 3.1Å; L612-L707 PolarHBondContact O-N 3.5Å; L612-V709 HydrophobicContact CD1-CG2 4.01Å
613	S	89.9	Confident	75.1	Confident	9 Å²	9	60.9 Å²	60.9	6%	0.063	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	126.5	168.3	148.3	0	0	0	0	110	E615 R616 L617 D704	S613-E615 VanDerWaalsContact C-N 3.31Å; S613-E615 PolarHBondContact O-N 3.43Å; S613-E615 PolarHBondContact OG-N 3.35Å; S613-R616 PolarHBondContact O-N 3Å; S613-R616 WeakPolarHBondContact OG-CB 3.24Å; S613-R616 WeakPolarHBondContact OG-CG 2.88Å; S613-R616 PolarHBondContact OG-N 2.74Å; S613-L617 WeakPolarHBondContact O-CB 3.2Å; S613-L617 PolarHBondContact O-N 3.46Å; S613-D704 WeakPolarHBondContact CB-OD2 3.47Å; S613-D704 PolarHBondContact OG-OD2 3.09Å
614	Q	91.8	Very high	77.7	Confident	19 Å²	19	58.4 Å²	58.4	9%	0.089	32%	0.323	C	S	.	.	H	α-helix	trans	-62	-42.6	178.3	177.8	172.9	-17.6	0	0	110.4	L612 L617 I618 H646 V649 D704 R705 L707	L612-Q614 PolarHBondContact O-N 3.08Å; Q614-L617 PolarHBondContact O-N 3.37Å; Q614-I618 HydrophobicContact CG-CD1 3.85Å; Q614-I618 HydrophobicContact CG-CG1 4.49Å; Q614-I618 VanDerWaalsContact O-CG1 3.31Å; Q614-I618 WeakPolarHBondContact O-CG1 3.38Å; Q614-I618 PolarHBondContact O-N 2.67Å; Q614-H646 PolarHBondContact NE2-ND1 2.9Å; Q614-V649 HydrophobicContact CG-CG1 4.34Å; Q614-D704 PolarHBondContact N-OD1 2.65Å; Q614-R705 HydrophobicContact CB-CB 4.23Å; Q614-R705 WeakPolarHBondContact CB-O 3.26Å; Q614-R705 PolarHBondContact N-O 2.66Å; Q614-L707 HydrophobicContact CB-CD1 3.92Å; Q614-L707 HydrophobicContact CB-CG 4.23Å; Q614-L707 HydrophobicContact CG-CD1 4.18Å
615	E	90.3	Very high	80.1	Confident	92 Å²	92	49.4 Å²	49.4	43%	0.43	28%	0.281	S	S	.	.	H	α-helix	trans	-63.6	-46.3	179.3	-161.3	-171.5	175	0	0	111.8	S613 L617 I618 R619 D704	S613-E615 VanDerWaalsContact C-N 3.31Å; S613-E615 PolarHBondContact O-N 3.43Å; S613-E615 PolarHBondContact OG-N 3.35Å; E615-L617 VanDerWaalsContact C-N 3.32Å; E615-L617 PolarHBondContact O-N 3.49Å; E615-I618 PolarHBondContact O-N 3.1Å; E615-R619 WeakPolarHBondContact O-CG 3.22Å; E615-R619 PolarHBondContact O-N 3.48Å; E615-R619 IonicContact OE1-CZ 2.76Å; E615-R619 VanDerWaalsContact OE1-CZ 3.3Å; E615-R619 IonicContact OE1-NE 3.1Å; E615-R619 PolarHBondContact OE1-NE 3.27Å; E615-R619 IonicContact OE1-NH2 3.53Å; E615-R619 PolarHBondContact OE1-NH2 3.09Å; E615-R619 IonicContact OE2-CZ 2.83Å; E615-R619 IonicContact OE2-NH2 3.48Å; E615-R619 PolarHBondContact OE2-NH2 3.44Å; E615-D704 WeakPolarHBondContact CB-OD1 3.37Å; E615-D704 PolarHBondContact N-OD1 3.08Å
616	R	91.2	Very high	82.2	Confident	120 Å²	120	42.9 Å²	42.9	45%	0.453	25%	0.251	S	S	.	.	H	α-helix	trans	-60.5	-41.3	176	-73.5	-179.1	66.2	-168.7	-0.3	111.8	S613 R619 K620	S613-R616 PolarHBondContact O-N 3Å; S613-R616 WeakPolarHBondContact OG-CB 3.24Å; S613-R616 WeakPolarHBondContact OG-CG 2.88Å; S613-R616 PolarHBondContact OG-N 2.74Å; R616-R619 PolarHBondContact O-N 3.16Å; R616-K620 WeakPolarHBondContact O-CB 3.09Å; R616-K620 PolarHBondContact O-N 3.31Å
617	L	93.6	Very high	85	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-45.8	176.5	176.8	61.1	0	0	0	111.6	I585 A589 L592 S613 Q614 E615 K620 A621 V649 L707	I585-L617 HydrophobicContact CD1-CG 4.43Å; I585-L617 HydrophobicContact CG2-CD1 4.44Å; I585-L617 HydrophobicContact CG2-CD2 4.07Å; I585-L617 HydrophobicContact CG2-CG 4.45Å; A589-L617 HydrophobicContact CB-CD1 3.89Å; L592-L617 HydrophobicContact CD1-CB 4.05Å; L592-L617 HydrophobicContact CD1-CD1 4.15Å; S613-L617 WeakPolarHBondContact O-CB 3.2Å; S613-L617 PolarHBondContact O-N 3.46Å; Q614-L617 PolarHBondContact O-N 3.37Å; E615-L617 VanDerWaalsContact C-N 3.32Å; E615-L617 PolarHBondContact O-N 3.49Å; L617-K620 PolarHBondContact O-N 3.38Å; L617-A621 VanDerWaalsContact O-CB 3.3Å; L617-A621 WeakPolarHBondContact O-CB 3.31Å; L617-A621 PolarHBondContact O-N 3.33Å; L617-V649 HydrophobicContact CD2-CG2 4.24Å; L617-L707 HydrophobicContact CD2-CD1 4.18Å
618	I	94.3	Very high	87.3	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.015	18%	0.182	C	C	.	.	H	α-helix	trans	-68.3	-42.2	-179.8	-68.4	172.9	0	0	0	111.2	Q614 E615 K620 A621 A622 Y642 F645 H646 V649	Q614-I618 HydrophobicContact CG-CD1 3.85Å; Q614-I618 HydrophobicContact CG-CG1 4.49Å; Q614-I618 VanDerWaalsContact O-CG1 3.31Å; Q614-I618 WeakPolarHBondContact O-CG1 3.38Å; Q614-I618 PolarHBondContact O-N 2.67Å; E615-I618 PolarHBondContact O-N 3.1Å; I618-K620 VanDerWaalsContact C-N 3.34Å; I618-K620 PolarHBondContact O-N 2.79Å; I618-A621 PolarHBondContact O-N 3.05Å; I618-A622 WeakPolarHBondContact O-CB 3.24Å; I618-A622 PolarHBondContact O-N 3Å; I618-Y642 HydrophobicContact CG2-CD1 3.52Å; I618-Y642 HydrophobicContact CG2-CE1 4.14Å; I618-Y642 HydrophobicContact CG2-CG 4.44Å; I618-F645 HydrophobicContact CG1-CB 4.33Å; I618-F645 HydrophobicContact CG2-CB 4.05Å; I618-H646 WeakPolarHBondContact CD1-CE1 3.04Å; I618-H646 VanDerWaalsContact CD1-ND1 3.34Å; I618-H646 WeakPolarHBondContact CD1-ND1 3.41Å; I618-V649 HydrophobicContact CG1-CG2 4.31Å
619	R	92.4	Very high	89.2	Confident	133 Å²	133	34.4 Å²	34.4	50%	0.502	17%	0.168	S	C	.	.	H	α-helix	trans	-61.2	-42.8	174.7	-68	-175.6	-155.4	159.2	0.1	111.4	E615 R616 A622 G623 Y642	E615-R619 WeakPolarHBondContact O-CG 3.22Å; E615-R619 PolarHBondContact O-N 3.48Å; E615-R619 IonicContact OE1-CZ 2.76Å; E615-R619 VanDerWaalsContact OE1-CZ 3.3Å; E615-R619 IonicContact OE1-NE 3.1Å; E615-R619 PolarHBondContact OE1-NE 3.27Å; E615-R619 IonicContact OE1-NH2 3.53Å; E615-R619 PolarHBondContact OE1-NH2 3.09Å; E615-R619 IonicContact OE2-CZ 2.83Å; E615-R619 IonicContact OE2-NH2 3.48Å; E615-R619 PolarHBondContact OE2-NH2 3.44Å; R616-R619 PolarHBondContact O-N 3.16Å; R619-A622 WeakPolarHBondContact O-CB 3.13Å; R619-A622 PolarHBondContact O-N 3.45Å; R619-G623 PolarHBondContact O-N 2.91Å; R619-Y642 HydrophobicContact CG-CE1 4.45Å
620	K	93	Very high	90.8	Very high	42 Å²	42	32.3 Å²	32.3	18%	0.183	15%	0.153	C	C	.	.	H	α-helix	trans	-63.3	-42.1	176.4	-163	76.9	168.2	-164.1	0	111.6	L592 E595 R616 L617 I618 G623 L624 F826	L592-K620 HydrophobicContact CG-CG 4.47Å; E595-K620 IonicContact OE1-NZ 3.86Å; E595-K620 PolarHBondContact OE1-NZ 3.5Å; E595-K620 IonicContact OE2-NZ 2.65Å; R616-K620 WeakPolarHBondContact O-CB 3.09Å; R616-K620 PolarHBondContact O-N 3.31Å; L617-K620 PolarHBondContact O-N 3.38Å; I618-K620 VanDerWaalsContact C-N 3.34Å; I618-K620 PolarHBondContact O-N 2.79Å; K620-G623 PolarHBondContact O-N 2.69Å; K620-L624 PolarHBondContact O-N 3.09Å; K620-F826 HydrophobicContact CD-CE1 4.41Å; K620-F826 HydrophobicContact CD-CZ 4.23Å; K620-F826 HydrophobicContact CG-CE1 3.86Å; K620-F826 HydrophobicContact CG-CZ 4.13Å
621	A	95.5	Very high	91.7	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-40.2	174.6	0	0	0	0	0	112.9	I584 I585 S588 L617 I618 L624 S625 F645	I584-A621 HydrophobicContact CG2-CB 3.78Å; I584-A621 WeakPolarHBondContact CG2-O 3.49Å; I585-A621 HydrophobicContact CD1-CB 3.73Å; S588-A621 WeakPolarHBondContact OG-CA 3.46Å; S588-A621 PolarHBondContact OG-N 3.17Å; L617-A621 VanDerWaalsContact O-CB 3.3Å; L617-A621 WeakPolarHBondContact O-CB 3.31Å; L617-A621 PolarHBondContact O-N 3.33Å; I618-A621 PolarHBondContact O-N 3.05Å; A621-L624 PolarHBondContact O-N 3.38Å; A621-S625 WeakPolarHBondContact O-CB 3.39Å; A621-S625 PolarHBondContact O-N 2.88Å; A621-F645 HydrophobicContact CB-CD1 4.21Å; A621-F645 HydrophobicContact CB-CD2 4.05Å; A621-F645 HydrophobicContact CB-CE1 4.36Å; A621-F645 HydrophobicContact CB-CE2 4.2Å; A621-F645 HydrophobicContact CB-CG 4.1Å; A621-F645 HydrophobicContact CB-CZ 4.38Å
622	A	93.5	Very high	91.8	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.008	14%	0.14	C	C	.	.	H	α-helix	trans	-60	-45.1	172.6	0	0	0	0	0	111.5	I618 R619 L624 S625 H626 I641 Y642	I618-A622 WeakPolarHBondContact O-CB 3.24Å; I618-A622 PolarHBondContact O-N 3Å; R619-A622 WeakPolarHBondContact O-CB 3.13Å; R619-A622 PolarHBondContact O-N 3.45Å; A622-L624 PolarHBondContact O-N 2.96Å; A622-S625 WeakPolarHBondContact O-CB 3.46Å; A622-S625 PolarHBondContact O-N 2.81Å; A622-H626 PolarHBondContact O-CD2 2.98Å; A622-H626 PolarHBondContact O-N 3.22Å; A622-I641 HydrophobicContact CB-CD1 3.68Å; A622-I641 HydrophobicContact CB-CG1 4.42Å; A622-Y642 HydrophobicContact CB-CE1 4.11Å; A622-Y642 HydrophobicContact CB-CE2 4.41Å
623	G	92.8	Very high	91.8	Very high	14 Å²	14	32.4 Å²	32.4	14%	0.144	16%	0.163	C	C	.	.	H	α-helix	trans	-58.2	-47.1	174.5	0	0	0	0	0	113.2	L427 R619 K620 S625 H626 F627 Y822	L427-G623 WeakPolarHBondContact CD2-O 3.4Å; R619-G623 PolarHBondContact O-N 2.91Å; K620-G623 PolarHBondContact O-N 2.69Å; G623-S625 PolarHBondContact O-N 3.35Å; G623-H626 PolarHBondContact O-N 3.48Å; G623-F627 PolarHBondContact O-N 3Å; G623-Y822 PolarHBondContact O-OH 3.44Å
624	L	94.8	Very high	91.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.3	-39.4	175.6	180	58.7	0	0	0	112.1	I584 C587 K620 A621 A622 F627 L628 L726 L730 F826	I584-L624 HydrophobicContact CG2-CB 4.24Å; I584-L624 HydrophobicContact CG2-CD2 4.12Å; I584-L624 HydrophobicContact CG2-CG 4.31Å; C587-L624 HydrophobicContact CB-CD2 3.84Å; K620-L624 PolarHBondContact O-N 3.09Å; A621-L624 PolarHBondContact O-N 3.38Å; A622-L624 PolarHBondContact O-N 2.96Å; L624-F627 HydrophobicContact CD1-CD1 4.48Å; L624-F627 WeakPolarHBondContact O-CB 3.29Å; L624-F627 PolarHBondContact O-N 3.41Å; L624-L628 HydrophobicContact CD1-CD1 3.91Å; L624-L628 HydrophobicContact CD1-CG 4.1Å; L624-L628 HydrophobicContact CG-CD1 4.08Å; L624-L628 WeakPolarHBondContact O-CG 3.24Å; L624-L628 PolarHBondContact O-N 2.95Å; L624-L726 HydrophobicContact CD2-CD1 4.39Å; L624-L730 HydrophobicContact CD1-CD2 4.17Å; L624-F826 HydrophobicContact CB-CD1 4.45Å; L624-F826 HydrophobicContact CB-CE1 4.02Å; L624-F826 HydrophobicContact CB-CZ 4.16Å; L624-F826 HydrophobicContact CD1-CD1 4.41Å; L624-F826 HydrophobicContact CD1-CD2 4.14Å; L624-F826 HydrophobicContact CD1-CE2 4.41Å; L624-F826 HydrophobicContact CD1-CG 4.14Å; L624-F826 HydrophobicContact CD2-CB 4.45Å; L624-F826 HydrophobicContact CD2-CD1 3.73Å; L624-F826 HydrophobicContact CD2-CE1 4.13Å; L624-F826 HydrophobicContact CD2-CG 4.11Å; L624-F826 HydrophobicContact CG-CD1 4.42Å; L624-F826 HydrophobicContact CG-CE1 4.49Å
625	S	94.2	Very high	91.8	Very high	7 Å²	7	32.6 Å²	32.6	5%	0.049	17%	0.168	C	C	.	.	H	α-helix	trans	-61.9	-44	176.2	-170.6	0	0	0	0	112.2	A621 A622 G623 F627 L628 T629 V634	A621-S625 WeakPolarHBondContact O-CB 3.39Å; A621-S625 PolarHBondContact O-N 2.88Å; A622-S625 WeakPolarHBondContact O-CB 3.46Å; A622-S625 PolarHBondContact O-N 2.81Å; G623-S625 PolarHBondContact O-N 3.35Å; S625-F627 VanDerWaalsContact C-N 3.32Å; S625-L628 CarbonylContact O-C 3.6Å; S625-L628 PolarHBondContact O-N 3.34Å; S625-T629 PolarHBondContact O-N 3.39Å; S625-T629 PolarHBondContact O-OG1 2.99Å; S625-V634 WeakPolarHBondContact OG-CG2 3.5Å
626	H	92.1	Very high	91.8	Very high	59 Å²	59	28.8 Å²	28.8	27%	0.273	15%	0.151	S	C	.	.	H	α-helix	trans	-61.7	-43.9	175.7	-74.2	-55.8	0	0	0	110.8	L423 T426 L427 A622 G623 L628 T629 I641	L423-H626 HydrophobicContact CD1-CB 4.13Å; L423-H626 VanDerWaalsContact CD1-O 3.22Å; L423-H626 WeakPolarHBondContact CD1-O 3.28Å; T426-H626 HydrophobicContact CG2-CB 4.41Å; L427-H626 HydrophobicContact CD1-CB 4.33Å; L427-H626 HydrophobicContact CD2-CB 4.2Å; L427-H626 HydrophobicContact CG-CB 4.39Å; A622-H626 PolarHBondContact O-CD2 2.98Å; A622-H626 PolarHBondContact O-N 3.22Å; G623-H626 PolarHBondContact O-N 3.48Å; H626-L628 PolarHBondContact O-N 3.14Å; H626-T629 WeakPolarHBondContact CA-OG1 3.42Å; H626-T629 WeakPolarHBondContact O-CB 3.47Å; H626-T629 PolarHBondContact O-N 2.99Å; H626-T629 PolarHBondContact O-OG1 3.44Å; H626-I641 WeakPolarHBondContact NE2-CD1 3.37Å
627	F	93.6	Very high	91.7	Very high	1 Å²	1	25.5 Å²	25.5	0%	0.004	15%	0.145	C	C	.	.	H	α-helix	trans	-59.2	-35.2	177	-174.1	-106.6	0	0	0	112.8	L427 G623 L624 S625 Y733 T786 L790 Y822 I823	L427-F627 HydrophobicContact CD1-CB 3.79Å; L427-F627 HydrophobicContact CD1-CD2 4.05Å; L427-F627 HydrophobicContact CD1-CG 4.44Å; G623-F627 PolarHBondContact O-N 3Å; L624-F627 HydrophobicContact CD1-CD1 4.48Å; L624-F627 WeakPolarHBondContact O-CB 3.29Å; L624-F627 PolarHBondContact O-N 3.41Å; S625-F627 VanDerWaalsContact C-N 3.32Å; F627-Y733 HydrophobicContact CD1-CD1 4.42Å; F627-Y733 AromaticContact CE1-CD1 3.4Å; F627-Y733 HydrophobicContact CE1-CD1 3.4Å; F627-Y733 VanDerWaalsContact CE1-CD1 3.4Å; F627-Y733 AromaticContact CE1-CE1 3.92Å; F627-Y733 HydrophobicContact CE1-CE1 3.92Å; F627-Y733 HydrophobicContact CE1-CG 4.11Å; F627-Y733 HydrophobicContact CE2-CD1 4.42Å; F627-Y733 AromaticContact CZ-CD1 3.42Å; F627-Y733 HydrophobicContact CZ-CD1 3.42Å; F627-Y733 VanDerWaalsContact CZ-CD1 3.42Å; F627-Y733 HydrophobicContact CZ-CE1 4.03Å; F627-Y733 HydrophobicContact CZ-CG 4.35Å; F627-T786 WeakPolarHBondContact O-CG2 3.34Å; F627-L790 HydrophobicContact CE2-CD2 4.18Å; F627-Y822 HydrophobicContact CD2-CE1 4.24Å; F627-Y822 HydrophobicContact CG-CE1 4.28Å; F627-I823 HydrophobicContact CE1-CG1 4.09Å; F627-I823 HydrophobicContact CE2-CG1 4.49Å; F627-I823 HydrophobicContact CZ-CD1 3.81Å; F627-I823 HydrophobicContact CZ-CG1 3.67Å
628	L	93	Very high	91.4	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.01	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	13.4	-179.3	-61.7	178.9	0	0	0	114.4	L624 S625 H626 N630 E631 V632 L726 V729	L624-L628 HydrophobicContact CD1-CD1 3.91Å; L624-L628 HydrophobicContact CD1-CG 4.1Å; L624-L628 HydrophobicContact CG-CD1 4.08Å; L624-L628 WeakPolarHBondContact O-CG 3.24Å; L624-L628 PolarHBondContact O-N 2.95Å; S625-L628 CarbonylContact O-C 3.6Å; S625-L628 PolarHBondContact O-N 3.34Å; H626-L628 PolarHBondContact O-N 3.14Å; L628-N630 PolarHBondContact O-N 2.94Å; L628-N630 VanDerWaalsContact O-N 3.08Å; L628-E631 HydrophobicContact CD2-CG 4.47Å; L628-E631 WeakPolarHBondContact O-CB 3.22Å; L628-E631 PolarHBondContact O-N 3.34Å; L628-V632 PolarHBondContact O-N 3.49Å; L628-L726 HydrophobicContact CD1-CD1 4.37Å; L628-L726 HydrophobicContact CD1-CD2 3.95Å; L628-V729 HydrophobicContact CD2-CG1 3.87Å
629	T	89.6	Confident	91.2	Very high	76 Å²	76	30.1 Å²	30.1	47%	0.466	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-31.7	-175.5	-61.8	0	0	0	0	113.7	S625 H626	S625-T629 PolarHBondContact O-N 3.39Å; S625-T629 PolarHBondContact O-OG1 2.99Å; H626-T629 WeakPolarHBondContact CA-OG1 3.42Å; H626-T629 WeakPolarHBondContact O-CB 3.47Å; H626-T629 PolarHBondContact O-N 2.99Å; H626-T629 PolarHBondContact O-OG1 3.44Å
630	N	89.9	Confident	91	Very high	13 Å²	13	27.1 Å²	27.1	7%	0.07	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-15.7	178.4	-73.6	-50.4	0	0	0	114.1	L628 N782 R785 T786 E789	L628-N630 PolarHBondContact O-N 2.94Å; L628-N630 VanDerWaalsContact O-N 3.08Å; N630-N782 PolarHBondContact O-ND2 3.26Å; N630-R785 PolarHBondContact OD1-NE 2.86Å; N630-T786 PolarHBondContact ND2-OG1 2.75Å; N630-T786 VanDerWaalsContact ND2-OG1 3.12Å; N630-E789 PolarHBondContact ND2-OE2 3.43Å
631	E	89.9	Confident	90.9	Very high	5 Å²	5	26.7 Å²	26.7	2%	0.023	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-39.6	179.3	-71.5	-64	142.2	0	0	112.1	K322 L628 V729 Y733 L779 N782	K322-E631 IonicContact NZ-OE2 2.79Å; K322-E631 PolarHBondContact NZ-OE2 3.46Å; L628-E631 HydrophobicContact CD2-CG 4.47Å; L628-E631 WeakPolarHBondContact O-CB 3.22Å; L628-E631 PolarHBondContact O-N 3.34Å; E631-V729 HydrophobicContact CG-CG1 3.83Å; E631-Y733 HydrophobicContact CG-CE2 4.29Å; E631-L779 WeakPolarHBondContact OE1-CD2 3.27Å; E631-L779 WeakPolarHBondContact OE2-CD2 3.47Å; E631-N782 WeakPolarHBondContact OE1-CB 3.37Å; E631-N782 PolarHBondContact OE1-ND2 2.92Å
632	V	85.8	Confident	90.7	Very high	23 Å²	23	31.8 Å²	31.8	14%	0.139	19%	0.186	C	C	.	.			trans	-158.4	139.9	-172.6	63.1	0	0	0	0	112.2	F576 I580 L628 V634	F576-V632 HydrophobicContact CD1-CB 4.22Å; F576-V632 HydrophobicContact CD1-CG2 4.07Å; F576-V632 HydrophobicContact CE1-CB 3.77Å; F576-V632 HydrophobicContact CE1-CG1 3.86Å; F576-V632 HydrophobicContact CE1-CG2 4.07Å; I580-V632 HydrophobicContact CB-CG2 4.49Å; I580-V632 HydrophobicContact CD1-CG1 3.78Å; I580-V632 HydrophobicContact CG1-CB 4.47Å; I580-V632 HydrophobicContact CG1-CG1 3.69Å; I580-V632 HydrophobicContact CG1-CG2 4.05Å; I580-V632 HydrophobicContact CG2-CG2 4.42Å; L628-V632 PolarHBondContact O-N 3.49Å; V632-V634 HydrophobicContact CG1-CG2 4.31Å
633	A	86.8	Confident	90.7	Very high	61 Å²	61	36.6 Å²	36.6	50%	0.504	21%	0.208	S	C	.	.			trans	-86.4	112.9	166.7	0	0	0	0	0	109.2	F473	F473-A633 HydrophobicContact CD2-CB 4.14Å
634	V	90.4	Very high	90.7	Very high	13 Å²	13	36.6 Å²	36.6	8%	0.079	21%	0.205	C	C	.	.			trans	-79.9	-33.6	178.8	-179.7	0	0	0	0	111.7	I580 I584 S625 V632 V644 F645	I580-V634 HydrophobicContact CG1-CG2 4.1Å; I584-V634 HydrophobicContact CD1-CG2 3.6Å; S625-V634 WeakPolarHBondContact OG-CG2 3.5Å; V632-V634 HydrophobicContact CG1-CG2 4.31Å; V634-V644 HydrophobicContact CG1-CG1 3.92Å; V634-F645 HydrophobicContact CG1-CE1 4.17Å; V634-F645 HydrophobicContact CG1-CZ 4.06Å
635	A	90.3	Very high	90.7	Very high	20 Å²	20	36.6 Å²	36.6	17%	0.165	21%	0.205	C	C	.	.	S	Bend	trans	-132.8	150.1	-178.2	0	0	0	0	0	111.3	I641 V644	A635-I641 HydrophobicContact CB-CG2 4.21Å; A635-V644 HydrophobicContact CB-CG2 3.79Å
636	P	90.6	Very high	90.7	Very high	12 Å²	12	40 Å²	40	8%	0.078	22%	0.22	C	C	.	.			trans	-67.8	155.7	163.9	31.9	-33.5	0	0	0	109.8	F473 C638 Q639	F473-P636 HydrophobicContact CD1-CB 3.88Å; F473-P636 HydrophobicContact CD1-CG 4.24Å; F473-P636 HydrophobicContact CE1-CB 4.24Å; F473-P636 HydrophobicContact CE1-CG 4.08Å; F473-P636 HydrophobicContact CG-CB 4.27Å; P636-C638 PolarHBondContact O-N 3.09Å; P636-Q639 HydrophobicContact CG-CB 3.91Å; P636-Q639 PolarHBondContact O-N 3.32Å
637	P	89	Confident	90.7	Very high	50 Å²	50	41 Å²	41	33%	0.325	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.7	-175.1	25.9	-34	0	0	0	114.6	N466 K469 H470	N466-P637 HydrophobicContact CB-CB 4.03Å; N466-P637 HydrophobicContact CB-CG 4Å; N466-P637 VanDerWaalsContact O-CG 3.31Å; N466-P637 WeakPolarHBondContact O-CG 3.41Å; K469-P637 HydrophobicContact CB-CG 4.4Å; H470-P637 HydrophobicContact CB-CG 3.89Å
638	C	88.6	Confident	90.8	Very high	34 Å²	34	40.9 Å²	40.9	23%	0.23	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-0	176.5	62.6	0	0	0	0	114	C67 P636	C67-C638 WeakPolarHBondContact SG-CB 3.16Å; P636-C638 PolarHBondContact O-N 3.09Å
639	Q	89.1	Confident	90.8	Very high	67 Å²	67	40.8 Å²	40.8	31%	0.313	23%	0.226	S	C	.	.	S	Bend	trans	-124.6	140.8	-179.6	-172.7	177.9	9.9	0	0	109.3	P636 Q643 V644	P636-Q639 HydrophobicContact CG-CB 3.91Å; P636-Q639 PolarHBondContact O-N 3.32Å; Q639-Q643 HydrophobicContact CG-CB 4.4Å; Q639-V644 HydrophobicContact CG-CG2 4.06Å
640	T	89.1	Confident	91	Very high	70 Å²	70	39.7 Å²	39.7	43%	0.429	22%	0.222	S	C	.	.			trans	-79	145.1	176.8	69.9	0	0	0	0	110.4	Y642 Q643 V644	T640-Y642 PolarHBondContact O-N 3.5Å; T640-Q643 PolarHBondContact O-N 3.02Å; T640-Q643 VanDerWaalsContact OG1-CG 3.22Å; T640-Q643 WeakPolarHBondContact OG1-CG 3.46Å; T640-Q643 PolarHBondContact OG1-N 3.45Å; T640-V644 PolarHBondContact O-N 2.81Å
641	I	90.8	Very high	91	Very high	32 Å²	32	42 Å²	42	16%	0.164	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-32.4	176.3	57.2	173.9	0	0	0	112	A622 H626 A635 Q643 V644 F645	A622-I641 HydrophobicContact CB-CD1 3.68Å; A622-I641 HydrophobicContact CB-CG1 4.42Å; H626-I641 WeakPolarHBondContact NE2-CD1 3.37Å; A635-I641 HydrophobicContact CB-CG2 4.21Å; I641-Q643 PolarHBondContact O-N 2.9Å; I641-V644 PolarHBondContact O-N 3.25Å; I641-F645 HydrophobicContact CB-CD2 4.44Å; I641-F645 HydrophobicContact CB-CE2 4.08Å; I641-F645 WeakPolarHBondContact O-CD2 3.47Å; I641-F645 WeakPolarHBondContact O-CG 3.5Å; I641-F645 PolarHBondContact O-N 2.66Å
642	Y	91.6	Very high	91	Very high	108 Å²	108	41.8 Å²	41.8	42%	0.424	23%	0.228	S	C	.	.	H	α-helix	trans	-59.5	-46.6	176.4	-70.1	-88.2	0	0	0	111.1	I618 R619 A622 T640 V644 F645 H646	I618-Y642 HydrophobicContact CG2-CD1 3.52Å; I618-Y642 HydrophobicContact CG2-CE1 4.14Å; I618-Y642 HydrophobicContact CG2-CG 4.44Å; R619-Y642 HydrophobicContact CG-CE1 4.45Å; A622-Y642 HydrophobicContact CB-CE1 4.11Å; A622-Y642 HydrophobicContact CB-CE2 4.41Å; T640-Y642 PolarHBondContact O-N 3.5Å; Y642-V644 VanDerWaalsContact C-N 3.33Å; Y642-V644 PolarHBondContact O-N 3.3Å; Y642-F645 PolarHBondContact O-N 2.79Å; Y642-F645 VanDerWaalsContact O-N 3.13Å; Y642-H646 PolarHBondContact O-CD2 3.15Å; Y642-H646 PolarHBondContact O-N 3.22Å
643	Q	91.8	Very high	91.2	Very high	101 Å²	101	43 Å²	43	47%	0.472	23%	0.234	S	C	.	.	H	α-helix	trans	-58	-45.1	175.2	-74.9	167.9	-7.2	0	0	111.7	Q639 T640 I641 F645 H646 D647	Q639-Q643 HydrophobicContact CG-CB 4.4Å; T640-Q643 PolarHBondContact O-N 3.02Å; T640-Q643 VanDerWaalsContact OG1-CG 3.22Å; T640-Q643 WeakPolarHBondContact OG1-CG 3.46Å; T640-Q643 PolarHBondContact OG1-N 3.45Å; I641-Q643 PolarHBondContact O-N 2.9Å; Q643-F645 VanDerWaalsContact C-N 3.26Å; Q643-F645 PolarHBondContact O-N 2.9Å; Q643-H646 PolarHBondContact O-N 3.46Å; Q643-D647 VanDerWaalsContact O-CG 3.3Å; Q643-D647 PolarHBondContact O-N 2.7Å
644	V	92.8	Very high	91.2	Very high	15 Å²	15	47 Å²	47	9%	0.091	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-37.2	178	178.4	0	0	0	0	111.8	V634 A635 Q639 T640 I641 Y642 A648	V634-V644 HydrophobicContact CG1-CG1 3.92Å; A635-V644 HydrophobicContact CB-CG2 3.79Å; Q639-V644 HydrophobicContact CG-CG2 4.06Å; T640-V644 PolarHBondContact O-N 2.81Å; I641-V644 PolarHBondContact O-N 3.25Å; Y642-V644 VanDerWaalsContact C-N 3.33Å; Y642-V644 PolarHBondContact O-N 3.3Å; V644-A648 WeakPolarHBondContact O-CB 3.47Å; V644-A648 PolarHBondContact O-N 2.84Å
645	F	95.8	Very high	90.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-76.7	-35.2	177.8	-69.1	-43.5	0	0	0	113.5	I584 I585 I618 A621 V634 I641 Y642 Q643 D647 A648 V649	I584-F645 HydrophobicContact CB-CE1 3.97Å; I584-F645 HydrophobicContact CB-CZ 4.36Å; I584-F645 HydrophobicContact CD1-CE1 4.26Å; I584-F645 HydrophobicContact CD1-CZ 4.11Å; I584-F645 HydrophobicContact CG2-CE1 3.71Å; I584-F645 HydrophobicContact CG2-CZ 3.75Å; I585-F645 HydrophobicContact CD1-CB 4.06Å; I585-F645 HydrophobicContact CD1-CD1 3.91Å; I585-F645 HydrophobicContact CD1-CG 4.2Å; I585-F645 HydrophobicContact CG1-CD1 4.03Å; I618-F645 HydrophobicContact CG1-CB 4.33Å; I618-F645 HydrophobicContact CG2-CB 4.05Å; A621-F645 HydrophobicContact CB-CD1 4.21Å; A621-F645 HydrophobicContact CB-CD2 4.05Å; A621-F645 HydrophobicContact CB-CE1 4.36Å; A621-F645 HydrophobicContact CB-CE2 4.2Å; A621-F645 HydrophobicContact CB-CG 4.1Å; A621-F645 HydrophobicContact CB-CZ 4.38Å; V634-F645 HydrophobicContact CG1-CE1 4.17Å; V634-F645 HydrophobicContact CG1-CZ 4.06Å; I641-F645 HydrophobicContact CB-CD2 4.44Å; I641-F645 HydrophobicContact CB-CE2 4.08Å; I641-F645 WeakPolarHBondContact O-CD2 3.47Å; I641-F645 WeakPolarHBondContact O-CG 3.5Å; I641-F645 PolarHBondContact O-N 2.66Å; Y642-F645 PolarHBondContact O-N 2.79Å; Y642-F645 VanDerWaalsContact O-N 3.13Å; Q643-F645 VanDerWaalsContact C-N 3.26Å; Q643-F645 PolarHBondContact O-N 2.9Å; F645-D647 VanDerWaalsContact C-N 3.31Å; F645-D647 PolarHBondContact O-N 3.42Å; F645-A648 PolarHBondContact O-N 3.44Å; F645-V649 WeakPolarHBondContact O-CG2 3.38Å; F645-V649 PolarHBondContact O-N 3.46Å
646	H	94.2	Very high	90.5	Very high	79 Å²	79	48.6 Å²	48.6	37%	0.366	25%	0.252	S	S	.	.	H	α-helix	trans	-59.1	-44.3	168.4	-81.1	-77.5	0	0	0	111.2	Q614 I618 Y642 Q643 A648 V649 S650	Q614-H646 PolarHBondContact NE2-ND1 2.9Å; I618-H646 WeakPolarHBondContact CD1-CE1 3.04Å; I618-H646 VanDerWaalsContact CD1-ND1 3.34Å; I618-H646 WeakPolarHBondContact CD1-ND1 3.41Å; Y642-H646 PolarHBondContact O-CD2 3.15Å; Y642-H646 PolarHBondContact O-N 3.22Å; Q643-H646 PolarHBondContact O-N 3.46Å; H646-A648 VanDerWaalsContact C-N 3.32Å; H646-A648 PolarHBondContact O-N 3.08Å; H646-V649 PolarHBondContact O-N 3.03Å; H646-S650 WeakPolarHBondContact O-CB 3.5Å; H646-S650 PolarHBondContact O-N 3.41Å; H646-S650 PolarHBondContact O-OG 2.89Å
647	D	92.8	Very high	90.4	Very high	78 Å²	78	48.2 Å²	48.2	42%	0.417	25%	0.249	S	C	.	.	H	α-helix	trans	-63.4	-39.2	175.7	-65.8	-19.8	0	0	0	111.3	Q643 F645 S650 R651	Q643-D647 VanDerWaalsContact O-CG 3.3Å; Q643-D647 PolarHBondContact O-N 2.7Å; F645-D647 VanDerWaalsContact C-N 3.31Å; F645-D647 PolarHBondContact O-N 3.42Å; D647-S650 PolarHBondContact O-N 3.37Å; D647-R651 WeakPolarHBondContact O-CG 3.5Å; D647-R651 PolarHBondContact O-N 2.95Å; D647-R651 PolarHBondContact O-NH1 2.75Å
648	A	94.3	Very high	90.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-45.1	177.9	0	0	0	0	0	112.7	I585 V644 F645 H646 S650 R651 L652	I585-A648 HydrophobicContact CG1-CB 4.03Å; V644-A648 WeakPolarHBondContact O-CB 3.47Å; V644-A648 PolarHBondContact O-N 2.84Å; F645-A648 PolarHBondContact O-N 3.44Å; H646-A648 VanDerWaalsContact C-N 3.32Å; H646-A648 PolarHBondContact O-N 3.08Å; A648-S650 VanDerWaalsContact C-N 3.34Å; A648-R651 VanDerWaalsContact CA-NH2 3.29Å; A648-R651 PolarHBondContact O-N 3.12Å; A648-L652 WeakPolarHBondContact O-CG 3.35Å; A648-L652 PolarHBondContact O-N 3.09Å
649	V	94.6	Very high	90.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-46.4	173.6	170.6	0	0	0	0	110.1	I585 Q614 L617 I618 F645 H646 R651 L652 I653 L658 L707	I585-V649 HydrophobicContact CD1-CG2 3.81Å; I585-V649 HydrophobicContact CG1-CG2 4.37Å; I585-V649 HydrophobicContact CG2-CG2 4.31Å; Q614-V649 HydrophobicContact CG-CG1 4.34Å; L617-V649 HydrophobicContact CD2-CG2 4.24Å; I618-V649 HydrophobicContact CG1-CG2 4.31Å; F645-V649 WeakPolarHBondContact O-CG2 3.38Å; F645-V649 PolarHBondContact O-N 3.46Å; H646-V649 PolarHBondContact O-N 3.03Å; V649-R651 VanDerWaalsContact C-N 3.32Å; V649-R651 PolarHBondContact O-N 3.25Å; V649-L652 PolarHBondContact O-N 3.25Å; V649-L652 VanDerWaalsContact O-N 3.12Å; V649-I653 HydrophobicContact CG1-CD1 3.79Å; V649-I653 HydrophobicContact CG1-CG1 4.37Å; V649-I653 WeakPolarHBondContact O-CG1 3.39Å; V649-I653 PolarHBondContact O-N 2.92Å; V649-L658 HydrophobicContact CG1-CD1 4.47Å; V649-L707 HydrophobicContact CG1-CD1 3.73Å
650	S	92.1	Very high	90.1	Very high	53 Å²	53	47.7 Å²	47.7	37%	0.371	24%	0.239	S	C	.	.	H	α-helix	trans	-59.5	-41.7	178.5	-57.7	0	0	0	0	112.1	H646 D647 A648 I653 Q654	H646-S650 WeakPolarHBondContact O-CB 3.5Å; H646-S650 PolarHBondContact O-N 3.41Å; H646-S650 PolarHBondContact O-OG 2.89Å; D647-S650 PolarHBondContact O-N 3.37Å; A648-S650 VanDerWaalsContact C-N 3.34Å; S650-I653 PolarHBondContact O-N 2.97Å; S650-Q654 VanDerWaalsContact O-CG 3.26Å; S650-Q654 WeakPolarHBondContact O-CG 3.3Å; S650-Q654 PolarHBondContact O-N 3.3Å
651	R	90.1	Very high	89.7	Confident	61 Å²	61	44.6 Å²	44.6	23%	0.23	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-44.4	173.5	-75.3	-171.8	-54.5	-87.9	3.1	112.4	S581 D582 D647 A648 V649 I653 Q654 Y655	S581-R651 PolarHBondContact OG-NH2 3.27Å; D582-R651 IonicContact OD1-CZ 3.33Å; D582-R651 IonicContact OD1-NE 3.3Å; D582-R651 IonicContact OD1-NH2 3.6Å; D582-R651 PolarHBondContact OD1-NH2 3.08Å; D647-R651 WeakPolarHBondContact O-CG 3.5Å; D647-R651 PolarHBondContact O-N 2.95Å; D647-R651 PolarHBondContact O-NH1 2.75Å; A648-R651 VanDerWaalsContact CA-NH2 3.29Å; A648-R651 PolarHBondContact O-N 3.12Å; V649-R651 VanDerWaalsContact C-N 3.32Å; V649-R651 PolarHBondContact O-N 3.25Å; R651-I653 VanDerWaalsContact C-N 3.27Å; R651-I653 PolarHBondContact O-N 3.23Å; R651-Q654 WeakPolarHBondContact O-CB 3.39Å; R651-Q654 PolarHBondContact O-N 3.43Å; R651-Y655 HydrophobicContact CB-CE2 4.3Å; R651-Y655 VanDerWaalsContact O-CD2 3.29Å; R651-Y655 WeakPolarHBondContact O-CD2 3.49Å; R651-Y655 VanDerWaalsContact O-CG 3.24Å; R651-Y655 PolarHBondContact O-N 2.85Å
652	L	90.6	Very high	88.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.6	-31.3	178.3	-70.4	172.7	0	0	0	112.4	I585 A648 V649 G656 V657 L658 F718 L722	I585-L652 HydrophobicContact CB-CD1 4.13Å; I585-L652 HydrophobicContact CG2-CD1 3.61Å; A648-L652 WeakPolarHBondContact O-CG 3.35Å; A648-L652 PolarHBondContact O-N 3.09Å; V649-L652 PolarHBondContact O-N 3.25Å; V649-L652 VanDerWaalsContact O-N 3.12Å; L652-G656 PolarHBondContact O-N 3.37Å; L652-V657 HydrophobicContact CD2-CB 4.37Å; L652-V657 HydrophobicContact CD2-CG1 4.46Å; L652-V657 PolarHBondContact O-N 2.95Å; L652-L658 HydrophobicContact CB-CB 4.49Å; L652-L658 HydrophobicContact CB-CD1 3.77Å; L652-L658 HydrophobicContact CB-CG 3.98Å; L652-L658 HydrophobicContact CD1-CD1 4.07Å; L652-L658 PolarHBondContact O-N 3.5Å; L652-L658 VanDerWaalsContact O-N 3.15Å; L652-F718 HydrophobicContact CD2-CE1 4.34Å; L652-L722 HydrophobicContact CD2-CD1 4.1Å
653	I	89.9	Confident	86.9	Confident	49 Å²	49	53.9 Å²	53.9	25%	0.251	27%	0.267	S	S	.	.	H	α-helix	trans	-67.4	-47.1	170.5	-66.5	167	0	0	0	110.6	V649 S650 R651 Y655 G656 L658 V660 L707	V649-I653 HydrophobicContact CG1-CD1 3.79Å; V649-I653 HydrophobicContact CG1-CG1 4.37Å; V649-I653 WeakPolarHBondContact O-CG1 3.39Å; V649-I653 PolarHBondContact O-N 2.92Å; S650-I653 PolarHBondContact O-N 2.97Å; R651-I653 VanDerWaalsContact C-N 3.27Å; R651-I653 PolarHBondContact O-N 3.23Å; I653-Y655 PolarHBondContact O-N 3.46Å; I653-G656 PolarHBondContact O-N 3.31Å; I653-L658 WeakPolarHBondContact CA-O 3.04Å; I653-L658 HydrophobicContact CG1-CB 3.88Å; I653-V660 HydrophobicContact CD1-CG2 4.24Å; I653-L707 HydrophobicContact CD1-CD2 3.85Å; I653-L707 HydrophobicContact CG1-CD2 4.44Å
654	Q	86.9	Confident	85.1	Confident	145 Å²	145	50.9 Å²	50.9	68%	0.678	25%	0.254	S	S	*	.	H	α-helix	trans	-60.2	-32.5	176.7	-72.7	168.8	4.1	0	0	112.7	S650 R651 G656	S650-Q654 VanDerWaalsContact O-CG 3.26Å; S650-Q654 WeakPolarHBondContact O-CG 3.3Å; S650-Q654 PolarHBondContact O-N 3.3Å; R651-Q654 WeakPolarHBondContact O-CB 3.39Å; R651-Q654 PolarHBondContact O-N 3.43Å; Q654-G656 PolarHBondContact O-N 2.85Å
655	Y	82.8	Confident	83.3	Confident	37 Å²	37	53.2 Å²	53.2	15%	0.145	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-6.5	173.9	-62.4	-28.7	0	0	0	114	S517 R518 R651 I653 V657 H715	S517-Y655 PolarHBondContact OG-OH 2.68Å; R518-Y655 PolarHBondContact NH1-OH 3.32Å; R518-Y655 VanDerWaalsContact NH2-CE2 3.28Å; R651-Y655 HydrophobicContact CB-CE2 4.3Å; R651-Y655 VanDerWaalsContact O-CD2 3.29Å; R651-Y655 WeakPolarHBondContact O-CD2 3.49Å; R651-Y655 VanDerWaalsContact O-CG 3.24Å; R651-Y655 PolarHBondContact O-N 2.85Å; I653-Y655 PolarHBondContact O-N 3.46Å; Y655-V657 PolarHBondContact O-N 2.92Å; Y655-H715 PolarHBondContact O-NE2 3.17Å
656	G	83.9	Confident	81.3	Confident	30 Å²	30	61.6 Å²	61.6	31%	0.309	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	10.7	-176.4	0	0	0	0	0	114.1	L652 I653 Q654 S710 H715	L652-G656 PolarHBondContact O-N 3.37Å; I653-G656 PolarHBondContact O-N 3.31Å; Q654-G656 PolarHBondContact O-N 2.85Å; G656-S710 VanDerWaalsContact O-CB 3.26Å; G656-S710 WeakPolarHBondContact O-CB 3.49Å; G656-H715 PolarHBondContact O-CE1 3.33Å; G656-H715 PolarHBondContact O-ND1 2.99Å
657	V	87.2	Confident	79.3	Confident	3 Å²	3	66.1 Å²	66.1	2%	0.018	32%	0.324	C	S	.	.	S	Bend	trans	-75.1	-36.9	175.9	-179.2	0	0	0	0	110.1	L652 Y655 S710 F718 F719	L652-V657 HydrophobicContact CD2-CB 4.37Å; L652-V657 HydrophobicContact CD2-CG1 4.46Å; L652-V657 PolarHBondContact O-N 2.95Å; Y655-V657 PolarHBondContact O-N 2.92Å; V657-S710 PolarHBondContact O-N 3.36Å; V657-F718 HydrophobicContact CG2-CD1 3.99Å; V657-F718 HydrophobicContact CG2-CE1 4.48Å; V657-F719 HydrophobicContact CG1-CB 4.38Å; V657-F719 HydrophobicContact CG1-CD2 3.65Å; V657-F719 HydrophobicContact CG1-CE2 4.32Å; V657-F719 HydrophobicContact CG1-CG 4.4Å
658	L	88.9	Confident	77.4	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	146.8	169.2	-61.2	177.5	0	0	0	109	V649 L652 I653 L707 K708 V709	V649-L658 HydrophobicContact CG1-CD1 4.47Å; L652-L658 HydrophobicContact CB-CB 4.49Å; L652-L658 HydrophobicContact CB-CD1 3.77Å; L652-L658 HydrophobicContact CB-CG 3.98Å; L652-L658 HydrophobicContact CD1-CD1 4.07Å; L652-L658 PolarHBondContact O-N 3.5Å; L652-L658 VanDerWaalsContact O-N 3.15Å; I653-L658 WeakPolarHBondContact CA-O 3.04Å; I653-L658 HydrophobicContact CG1-CB 3.88Å; L658-L707 HydrophobicContact CD1-CD1 4.43Å; L658-K708 CarbonylContact C-O 3.58Å; L658-K708 WeakPolarHBondContact CA-O 3.44Å; L658-V709 HydrophobicContact CD2-CB 4.5Å; L658-V709 HydrophobicContact CD2-CG2 3.89Å
659	Y	87.6	Confident	75	Confident	96 Å²	96	68.7 Å²	68.7	38%	0.376	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	148	172	56.3	-80.7	0	0	0	110.5	L707 K708 V709	Y659-L707 CarbonylContact O-C 3.54Å; Y659-L707 VanDerWaalsContact O-CA 3.32Å; Y659-L707 WeakPolarHBondContact O-CA 3.49Å; Y659-K708 HydrophobicContact CD1-CB 4.06Å; Y659-K708 VanDerWaalsContact CD1-O 3.26Å; Y659-K708 WeakPolarHBondContact CD1-O 3.36Å; Y659-K708 HydrophobicContact CD2-CB 3.82Å; Y659-K708 HydrophobicContact CD2-CD 4.29Å; Y659-K708 HydrophobicContact CE1-CB 3.52Å; Y659-K708 HydrophobicContact CE2-CB 3.3Å; Y659-K708 HydrophobicContact CE2-CD 3.39Å; Y659-K708 HydrophobicContact CE2-CG 3.91Å; Y659-K708 HydrophobicContact CG-CB 4.18Å; Y659-K708 PolarHBondContact N-O 2.84Å; Y659-K708 PolarHBondContact O-N 2.92Å; Y659-K708 WeakPolarHBondContact OH-CB 3.03Å; Y659-V709 WeakPolarHBondContact CE1-O 3.47Å
660	V	85.6	Confident	72.6	Confident	44 Å²	44	74.6 Å²	74.6	27%	0.267	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	127	175.9	178.4	0	0	0	0	107.6	I653 E662 L707	I653-V660 HydrophobicContact CD1-CG2 4.24Å; V660-E662 HydrophobicContact CG1-CG 4.33Å; V660-E662 PolarHBondContact O-N 3.17Å; V660-E662 VanDerWaalsContact O-N 3.15Å; V660-L707 HydrophobicContact CG2-CD2 4.06Å
661	A	80.3	Confident	70.1	Confident	5 Å²	5	76.1 Å²	76.1	4%	0.041	39%	0.388	C	S	.	.			trans	-79.1	93.5	174.9	0	0	0	0	0	108.4	L611 D664 Q665 Y706 K708	L611-A661 HydrophobicContact CD2-CB 3.42Å; L611-A661 VanDerWaalsContact CD2-CB 3.42Å; A661-D664 HydrophobicContact CB-CB 4.46Å; A661-Q665 WeakPolarHBondContact O-CG 3.18Å; A661-Q665 PolarHBondContact O-NE2 2.95Å; A661-Y706 PolarHBondContact N-O 3.36Å; A661-K708 HydrophobicContact CB-CD 4.04Å; A661-K708 HydrophobicContact CB-CG 4.24Å
662	E	67.3	Low	67.9	Low	156 Å²	156	79.5 Å²	79.5	73%	0.729	42%	0.419	S	S	*	.	S	Bend	trans	-74.3	-40.1	-178.5	-67.1	179.6	173.8	0	0	111.9	V660 D664 Q665	V660-E662 HydrophobicContact CG1-CG 4.33Å; V660-E662 PolarHBondContact O-N 3.17Å; V660-E662 VanDerWaalsContact O-N 3.15Å; E662-D664 PolarHBondContact O-N 3.09Å; E662-Q665 PolarHBondContact O-N 2.94Å
663	E	56.1	Low	65.6	Low	179 Å²	179	85.1 Å²	85.1	84%	0.836	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-28.6	-177	-64	176.3	173.3	0	0	113.8
664	D	54.1	Low	63.3	Low	38 Å²	38	91.3 Å²	91.3	20%	0.203	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-4.5	-177.5	-55.3	-51.4	0	0	0	113.2	L611 A661 E662 L668 K708	L611-D664 HydrophobicContact CD1-CB 4Å; L611-D664 HydrophobicContact CD2-CB 4.34Å; A661-D664 HydrophobicContact CB-CB 4.46Å; E662-D664 PolarHBondContact O-N 3.09Å; D664-L668 HydrophobicContact CB-CD1 4.22Å; D664-L668 WeakPolarHBondContact O-CD1 3.48Å; D664-L668 WeakPolarHBondContact O-CG 3.28Å; D664-L668 PolarHBondContact O-N 3.02Å; D664-K708 VanDerWaalsContact OD2-CE 3.27Å; D664-K708 WeakPolarHBondContact OD2-CE 3.35Å; D664-K708 IonicContact OD2-NZ 2.84Å; D664-K708 PolarHBondContact OD2-NZ 3.38Å
665	Q	55.6	Low	60.8	Low	64 Å²	64	92.6 Å²	92.6	30%	0.299	49%	0.487	S	S	.	.	H	α-helix	trans	-74.5	-29.5	-177.8	-87.6	171.7	53.4	0	0	113.4	A661 E662 T669	A661-Q665 WeakPolarHBondContact O-CG 3.18Å; A661-Q665 PolarHBondContact O-NE2 2.95Å; E662-Q665 PolarHBondContact O-N 2.94Å; Q665-T669 PolarHBondContact O-OG1 3.44Å
666	E	52.9	Low	58.5	Low	175 Å²	175	96.8 Å²	96.8	82%	0.818	52%	0.518	S	S	*	.	H	α-helix	trans	-74.5	-28.4	-180	-66.6	-174.3	170.5	0	0	112.5
667	E	51.8	Low	56.3	Low	174 Å²	174	106.2 Å²	106.2	81%	0.813	55%	0.545	S	S	*	.	H	α-helix	trans	-87.3	-25.8	178.8	-70.7	-170.8	164.5	0	0	113.8
668	L	52.8	Low	53.8	Low	80 Å²	80	111.5 Å²	111.5	42%	0.419	58%	0.579	S	S	.	*	H	α-helix	trans	-97.6	-5.7	-172.9	-70.9	167.6	0	0	0	114.5	L611 D664 Y706	L611-L668 HydrophobicContact CD1-CD1 3.68Å; D664-L668 HydrophobicContact CB-CD1 4.22Å; D664-L668 WeakPolarHBondContact O-CD1 3.48Å; D664-L668 WeakPolarHBondContact O-CG 3.28Å; D664-L668 PolarHBondContact O-N 3.02Å; L668-Y706 HydrophobicContact CB-CE2 4.4Å
669	T	44.3	Very low	51.4	Low	53 Å²	53	121 Å²	121	33%	0.325	62%	0.621	S	S	.	*	S	Bend	trans	-87.4	120.4	174.9	35.5	0	0	0	0	110	Q665 S671	Q665-T669 PolarHBondContact O-OG1 3.44Å; T669-S671 PolarHBondContact O-N 3.19Å; T669-S671 VanDerWaalsContact O-N 3.12Å
670	P	43.3	Very low	48.9	Very low	123 Å²	123	125.6 Å²	125.6	80%	0.799	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-65.1	118.1	174.7	15.3	-14.8	0	0	0	109.1
671	S	40.1	Very low	46.7	Very low	85 Å²	85	133 Å²	133	59%	0.594	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-63.9	133.6	172	63.4	0	0	0	0	109.7	T669 T673	T669-S671 PolarHBondContact O-N 3.19Å; T669-S671 VanDerWaalsContact O-N 3.12Å; S671-T673 PolarHBondContact O-N 2.89Å
672	P	43.8	Very low	44.6	Very low	133 Å²	133	138.8 Å²	138.8	86%	0.864	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	16.3	-176.9	30.6	-34.9	0	0	0	114.6
673	T	43.1	Very low	43.1	Very low	117 Å²	117	140.2 Å²	140.2	72%	0.718	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	0.5	-169.6	15.4	0	0	0	0	117.1	S671	S671-T673 PolarHBondContact O-N 2.89Å
674	E	40	Very low	42.5	Very low	179 Å²	179	136.9 Å²	136.9	84%	0.836	71%	0.709	S	S	*	*			trans	-138.5	58.5	-179.9	-66.5	-165.8	167.4	0	0	114
675	E	34.3	Very low	41.4	Very low	173 Å²	173	143.5 Å²	143.5	81%	0.808	74%	0.744	S	S	*	*			trans	-109	120	151.5	-78.8	-161.1	162.6	0	0	109.8	W677	E675-W677 PolarHBondContact O-N 2.75Å
676	P	34.8	Very low	40.3	Very low	124 Å²	124	145.3 Å²	145.3	81%	0.805	76%	0.763	S	S	*	*			trans	-73.9	100.5	176.7	28.9	-29.4	0	0	0	108.6
677	W	38.5	Very low	39.5	Very low	229 Å²	229	148.3 Å²	148.3	87%	0.867	77%	0.767	S	S	*	*			trans	-44.3	131.2	170.2	-70.6	85.4	0	0	0	111.1	E675 K679	E675-W677 PolarHBondContact O-N 2.75Å; W677-K679 PolarHBondContact O-N 2.71Å
678	P	35	Very low	38.7	Very low	114 Å²	114	151.6 Å²	151.6	74%	0.74	77%	0.772	S	S	*	*			trans	-64.4	107.5	176	23.3	-29.6	0	0	0	109.6	K680	P678-K680 PolarHBondContact O-N 3.25Å
679	K	37.3	Very low	37.9	Very low	201 Å²	201	152.1 Å²	152.1	87%	0.874	78%	0.782	S	S	*	*			trans	-66.2	95.6	170.9	-72.7	180	178	175.8	0	109.5	W677	W677-K679 PolarHBondContact O-N 2.71Å
680	K	36	Very low	37.9	Very low	192 Å²	192	156.2 Å²	156.2	84%	0.835	80%	0.803	S	S	*	*			trans	178.4	98	145	-99.5	163.5	-173.5	-175.1	0	110.1	P678	P678-K680 PolarHBondContact O-N 3.25Å
681	F	38.8	Very low	37.7	Very low	198 Å²	198	159 Å²	159	87%	0.868	81%	0.805	S	S	*	*			trans	-119	137.6	145.8	-78	-78.9	0	0	0	108.1
682	P	36.3	Very low	37.9	Very low	128 Å²	128	164 Å²	164	83%	0.831	82%	0.819	S	S	*	*			trans	-71.7	149.4	168.8	28.9	-29.2	0	0	0	111
683	E	35.5	Very low	37.7	Very low	186 Å²	186	164.7 Å²	164.7	87%	0.869	82%	0.815	S	S	*	*			trans	-62.7	179.6	-171.3	-128.2	178.9	-162.5	0	0	115.5
684	P	43.9	Very low	37.9	Very low	109 Å²	109	167.8 Å²	167.8	71%	0.708	82%	0.821	S	S	*	*				-114	154.9	-102	38	-22.7	0	0	0	113.6
685	L	31.5	Very low	38	Very low	177 Å²	177	167 Å²	167	93%	0.927	82%	0.823	S	S	*	*			trans	-116.3	131.2	157.1	-81.6	167.7	0	0	0	109.8
686	S	32.7	Very low	38.2	Very low	101 Å²	101	162.9 Å²	162.9	71%	0.706	81%	0.814	S	S	*	*			trans	-75.5	132.2	-161.5	55.5	0	0	0	0	114.8
687	W	35.2	Very low	38.5	Very low	239 Å²	239	164.9 Å²	164.9	91%	0.905	82%	0.818	S	S	*	*			trans	15.7	130.4	141.9	-62.3	96.2	0	0	0	120.8
688	R	34.8	Very low	38.5	Very low	242 Å²	242	163.5 Å²	163.5	91%	0.913	82%	0.818	S	S	*	*				165.4	145.4	117.5	-89.7	175.6	-175.2	-135.9	1.1	108.8
689	S	37.2	Very low	38.6	Very low	91 Å²	91	162.1 Å²	162.1	64%	0.636	82%	0.816	S	S	*	*			cis	-163.6	149.9	-5.7	56.8	0	0	0	0	107.5
690	D	43.4	Very low	38.8	Very low	140 Å²	140	161.5 Å²	161.5	75%	0.749	82%	0.816	S	S	*	*			trans	34	108.3	136.7	-48	-18.7	0	0	0	118.6
691	E	38.8	Very low	39.2	Very low	182 Å²	182	160.9 Å²	160.9	85%	0.85	82%	0.816	S	S	*	*				-145.9	123.6	126.3	-73.7	-68.8	151.1	0	0	106.3	D693	E691-D693 PolarHBondContact O-N 3.15Å
692	E	44.5	Very low	39.8	Very low	188 Å²	188	160.2 Å²	160.2	88%	0.879	82%	0.816	S	S	*	*			trans	-74.2	95.8	172.7	-68.1	171.1	161	0	0	108.6	E694	E692-E694 PolarHBondContact O-N 2.93Å
693	D	39.2	Very low	41.1	Very low	149 Å²	149	162.8 Å²	162.8	80%	0.797	81%	0.809	S	S	*	*			trans	-95.1	76.1	163.3	-80.4	-27.7	0	0	0	109.1	E691 D695	E691-D693 PolarHBondContact O-N 3.15Å; D693-D695 PolarHBondContact O-N 3.38Å; D693-D695 VanDerWaalsContact O-N 3.1Å
694	E	47.4	Very low	43	Very low	181 Å²	181	156.3 Å²	156.3	85%	0.846	78%	0.78	S	S	*	*			trans	-69.5	86.1	152.9	-75.2	-170.3	162.8	0	0	107.8	E692	E692-E694 PolarHBondContact O-N 2.93Å
695	D	42.3	Very low	44.9	Very low	163 Å²	163	157.8 Å²	157.8	87%	0.872	77%	0.772	S	S	*	*			trans	174.3	66.7	154.2	-87.2	-18.3	0	0	0	109.3	D693	D693-D695 PolarHBondContact O-N 3.38Å; D693-D695 VanDerWaalsContact O-N 3.1Å
696	S	38.1	Very low	47.6	Very low	87 Å²	87	152.6 Å²	152.6	61%	0.608	74%	0.74	S	S	*	*			trans	-125.5	78.3	166.4	172.6	0	0	0	0	109.9	F698	S696-F698 PolarHBondContact O-N 2.64Å
697	D	42.2	Very low	50.3	Low	166 Å²	166	147.8 Å²	147.8	89%	0.888	71%	0.707	S	S	*	*			trans	-64.1	19.1	157.9	-80.4	-13.4	0	0	0	112.6	A699	D697-A699 VanDerWaalsContact C-N 3.35Å; D697-A699 PolarHBondContact O-N 2.78Å
698	F	39.2	Very low	52.8	Low	200 Å²	200	137.8 Å²	137.8	88%	0.877	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	25.7	-177.1	-105	-83.5	0	0	0	114	S696	S696-F698 PolarHBondContact O-N 2.64Å
699	A	37.1	Very low	55.3	Low	84 Å²	84	127.8 Å²	127.8	69%	0.694	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.1	38.6	175.1	0	0	0	0	0	114	D697 E701	D697-A699 VanDerWaalsContact C-N 3.35Å; D697-A699 PolarHBondContact O-N 2.78Å; A699-E701 PolarHBondContact O-N 2.89Å; A699-E701 VanDerWaalsContact O-N 3.13Å
700	E	40.5	Very low	57.7	Low	189 Å²	189	124.1 Å²	124.1	88%	0.883	61%	0.61	S	S	*	*			trans	-75.2	91.1	149.3	-80	-166.9	167.2	0	0	107.3	Q702	E700-Q702 PolarHBondContact O-N 2.9Å
701	E	44.1	Very low	59.8	Low	178 Å²	178	124 Å²	124	83%	0.832	61%	0.608	S	S	*	*			trans	-48.7	112.4	160.4	-75.7	-178.4	159	0	0	107.4	A699 R703	A699-E701 PolarHBondContact O-N 2.89Å; A699-E701 VanDerWaalsContact O-N 3.13Å; E701-R703 VanDerWaalsContact C-N 3.29Å; E701-R703 PolarHBondContact O-N 3.17Å
702	Q	52.3	Low	62.1	Low	184 Å²	184	117 Å²	117	86%	0.86	58%	0.579	S	S	*	*			trans	-65.9	90.9	-172.2	-155.2	170.3	15.4	0	0	108.3	E700 D704	E700-Q702 PolarHBondContact O-N 2.9Å; Q702-D704 PolarHBondContact O-N 3.03Å
703	R	62.7	Low	64.1	Low	182 Å²	182	112.1 Å²	112.1	69%	0.687	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-52.5	131.1	-177.3	-67.4	-175.9	-177.9	-169.3	1.9	109.6	E701 R705	E701-R703 VanDerWaalsContact C-N 3.29Å; E701-R703 PolarHBondContact O-N 3.17Å; R703-R705 PolarHBondContact O-N 3.22Å
704	D	76.3	Confident	66.2	Low	51 Å²	51	108 Å²	108	27%	0.273	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-60.6	134.6	177.3	-170.8	19.2	0	0	0	109.6	S613 Q614 E615 Q702	S613-D704 WeakPolarHBondContact CB-OD2 3.47Å; S613-D704 PolarHBondContact OG-OD2 3.09Å; Q614-D704 PolarHBondContact N-OD1 2.65Å; E615-D704 WeakPolarHBondContact CB-OD1 3.37Å; E615-D704 PolarHBondContact N-OD1 3.08Å; Q702-D704 PolarHBondContact O-N 3.03Å
705	R	84.2	Confident	68	Low	140 Å²	140	100.5 Å²	100.5	53%	0.528	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-98.4	130.3	-176.6	-66.8	-179.5	179.6	-177.5	-1.7	109.1	Q614 R703	Q614-R705 HydrophobicContact CB-CB 4.23Å; Q614-R705 WeakPolarHBondContact CB-O 3.26Å; Q614-R705 PolarHBondContact N-O 2.66Å; R703-R705 PolarHBondContact O-N 3.22Å
706	Y	88.1	Confident	70.2	Confident	67 Å²	67	96.9 Å²	96.9	26%	0.263	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	133.8	174.7	-69.2	-92.2	0	0	0	111.3	L611 L612 A661 L668	L611-Y706 HydrophobicContact CB-CD1 4.07Å; L612-Y706 CarbonylContact O-C 3.53Å; L612-Y706 WeakPolarHBondContact O-CA 3.21Å; A661-Y706 PolarHBondContact N-O 3.36Å; L668-Y706 HydrophobicContact CB-CE2 4.4Å
707	L	89.3	Confident	72.6	Confident	0 Å²	0	96.5 Å²	96.5	0%	0	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	148.2	-173.9	-55.2	175.3	0	0	0	110.2	L612 Q614 L617 V649 I653 L658 Y659 V660	L612-L707 HydrophobicContact CB-CB 4.39Å; L612-L707 WeakPolarHBondContact CB-O 3.11Å; L612-L707 PolarHBondContact N-O 3.1Å; L612-L707 PolarHBondContact O-N 3.5Å; Q614-L707 HydrophobicContact CB-CD1 3.92Å; Q614-L707 HydrophobicContact CB-CG 4.23Å; Q614-L707 HydrophobicContact CG-CD1 4.18Å; L617-L707 HydrophobicContact CD2-CD1 4.18Å; V649-L707 HydrophobicContact CG1-CD1 3.73Å; I653-L707 HydrophobicContact CD1-CD2 3.85Å; I653-L707 HydrophobicContact CG1-CD2 4.44Å; L658-L707 HydrophobicContact CD1-CD1 4.43Å; Y659-L707 CarbonylContact O-C 3.54Å; Y659-L707 VanDerWaalsContact O-CA 3.32Å; Y659-L707 WeakPolarHBondContact O-CA 3.49Å; V660-L707 HydrophobicContact CG2-CD2 4.06Å
708	K	88	Confident	74.9	Confident	29 Å²	29	89.3 Å²	89.3	13%	0.126	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	150.5	170.3	-70.8	173.3	178.4	171.7	0	109.8	S609 L611 L658 Y659 A661 D664	S609-K708 WeakPolarHBondContact OG-CE 3.22Å; S609-K708 PolarHBondContact OG-NZ 3.3Å; S609-K708 VanDerWaalsContact OG-NZ 3.1Å; L611-K708 HydrophobicContact CD2-CD 4.24Å; L611-K708 HydrophobicContact CD2-CG 3.96Å; L658-K708 CarbonylContact C-O 3.58Å; L658-K708 WeakPolarHBondContact CA-O 3.44Å; Y659-K708 HydrophobicContact CD1-CB 4.06Å; Y659-K708 VanDerWaalsContact CD1-O 3.26Å; Y659-K708 WeakPolarHBondContact CD1-O 3.36Å; Y659-K708 HydrophobicContact CD2-CB 3.82Å; Y659-K708 HydrophobicContact CD2-CD 4.29Å; Y659-K708 HydrophobicContact CE1-CB 3.52Å; Y659-K708 HydrophobicContact CE2-CB 3.3Å; Y659-K708 HydrophobicContact CE2-CD 3.39Å; Y659-K708 HydrophobicContact CE2-CG 3.91Å; Y659-K708 HydrophobicContact CG-CB 4.18Å; Y659-K708 PolarHBondContact N-O 2.84Å; Y659-K708 PolarHBondContact O-N 2.92Å; Y659-K708 WeakPolarHBondContact OH-CB 3.03Å; A661-K708 HydrophobicContact CB-CD 4.04Å; A661-K708 HydrophobicContact CB-CG 4.24Å; D664-K708 VanDerWaalsContact OD2-CE 3.27Å; D664-K708 WeakPolarHBondContact OD2-CE 3.35Å; D664-K708 IonicContact OD2-NZ 2.84Å; D664-K708 PolarHBondContact OD2-NZ 3.38Å
709	V	86.9	Confident	77.2	Confident	32 Å²	32	80.3 Å²	80.3	19%	0.194	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.7	177.5	-175.6	0	0	0	0	109.4	L593 L612 L658 Y659	L593-V709 HydrophobicContact CD1-CG2 4.5Å; L612-V709 HydrophobicContact CD1-CG2 4.01Å; L658-V709 HydrophobicContact CD2-CB 4.5Å; L658-V709 HydrophobicContact CD2-CG2 3.89Å; Y659-V709 WeakPolarHBondContact CE1-O 3.47Å
710	S	87.4	Confident	79.9	Confident	14 Å²	14	78.1 Å²	78.1	10%	0.098	37%	0.371	C	S	.	.			trans	-59.7	138.7	179.1	161.9	0	0	0	0	112.5	G656 V657 S712 H715	G656-S710 VanDerWaalsContact O-CB 3.26Å; G656-S710 WeakPolarHBondContact O-CB 3.49Å; V657-S710 PolarHBondContact O-N 3.36Å; S710-S712 PolarHBondContact OG-N 2.76Å; S710-H715 WeakPolarHBondContact OG-CB 3.46Å; S710-H715 PolarHBondContact OG-ND1 3.42Å
711	L	86.6	Confident	82.4	Confident	137 Å²	137	69.3 Å²	69.3	72%	0.717	33%	0.33	S	S	*	.			trans	-89.7	-5.4	176.9	-61.1	178	0	0	0	114.1
712	S	88.3	Confident	84.8	Confident	35 Å²	35	60.8 Å²	60.8	25%	0.245	29%	0.29	C	S	.	.			trans	-59.2	134.6	174.5	135.8	0	0	0	0	110.3	S710 E714 H715 Q716	S710-S712 PolarHBondContact OG-N 2.76Å; S712-E714 PolarHBondContact O-N 3Å; S712-E714 PolarHBondContact OG-N 3.09Å; S712-E714 PolarHBondContact OG-OE2 3.38Å; S712-H715 PolarHBondContact O-N 2.79Å; S712-H715 PolarHBondContact OG-N 2.97Å; S712-Q716 WeakPolarHBondContact O-CG 3.47Å; S712-Q716 PolarHBondContact O-N 2.87Å
713	P	86.7	Confident	86.8	Confident	87 Å²	87	52.4 Å²	52.4	57%	0.565	25%	0.251	S	S	*	.	H	α-helix	trans	-61.4	-31.5	-173.5	21.7	-30.3	0	0	0	112.1	E717	P713-E717 PolarHBondContact O-N 3Å
714	E	81.7	Confident	88.4	Confident	61 Å²	61	48 Å²	48	29%	0.285	23%	0.234	S	C	.	.	H	α-helix	trans	-84.3	-29.5	-177.1	-41.7	83.6	175	0	0	112.2	V40 S712 Q716 E717 F718	V40-E714 HydrophobicContact CB-CB 3.28Å; V40-E714 HydrophobicContact CB-CG 4.32Å; V40-E714 HydrophobicContact CG1-CB 4.47Å; V40-E714 HydrophobicContact CG2-CB 3.36Å; V40-E714 HydrophobicContact CG2-CG 4.27Å; S712-E714 PolarHBondContact O-N 3Å; S712-E714 PolarHBondContact OG-N 3.09Å; S712-E714 PolarHBondContact OG-OE2 3.38Å; E714-Q716 VanDerWaalsContact C-N 3.34Å; E714-E717 PolarHBondContact O-N 2.92Å; E714-F718 PolarHBondContact O-N 3.29Å; E714-F718 VanDerWaalsContact O-N 3.1Å
715	H	86.3	Confident	89.2	Confident	24 Å²	24	45.9 Å²	45.9	11%	0.111	22%	0.223	C	C	.	.	H	α-helix	trans	-65.4	-40.1	167	-69.9	149.9	0	0	0	110.8	V40 Y655 G656 S710 S712 F718 F719	V40-H715 WeakPolarHBondContact CG2-CD2 3.34Å; V40-H715 WeakPolarHBondContact CG2-NE2 3.33Å; Y655-H715 PolarHBondContact O-NE2 3.17Å; G656-H715 PolarHBondContact O-CE1 3.33Å; G656-H715 PolarHBondContact O-ND1 2.99Å; S710-H715 WeakPolarHBondContact OG-CB 3.46Å; S710-H715 PolarHBondContact OG-ND1 3.42Å; S712-H715 PolarHBondContact O-N 2.79Å; S712-H715 PolarHBondContact OG-N 2.97Å; H715-F718 PolarHBondContact O-N 3.34Å; H715-F719 WeakPolarHBondContact O-CB 3.41Å; H715-F719 PolarHBondContact O-N 2.94Å
716	Q	88.3	Confident	89.7	Confident	87 Å²	87	39.2 Å²	39.2	41%	0.407	20%	0.198	S	C	.	.	H	α-helix	trans	-62.6	-43.5	173.9	-70.5	-179.3	-9.1	0	0	111.7	S712 E714 F718 F719 V720	S712-Q716 WeakPolarHBondContact O-CG 3.47Å; S712-Q716 PolarHBondContact O-N 2.87Å; E714-Q716 VanDerWaalsContact C-N 3.34Å; Q716-F718 VanDerWaalsContact C-N 3.33Å; Q716-F718 PolarHBondContact O-N 3.21Å; Q716-F719 PolarHBondContact O-N 2.91Å; Q716-V720 WeakPolarHBondContact O-CB 3.15Å; Q716-V720 VanDerWaalsContact O-CG2 3.3Å; Q716-V720 WeakPolarHBondContact O-CG2 3.15Å; Q716-V720 PolarHBondContact O-N 3.04Å
717	E	89	Confident	90.1	Very high	80 Å²	80	36 Å²	36	37%	0.374	19%	0.185	S	C	.	.	H	α-helix	trans	-60.6	-42	177.1	-164.3	-169.3	169.3	0	0	111.8	R494 P713 E714 V720 F721	R494-E717 IonicContact CZ-OE1 3.64Å; R494-E717 IonicContact CZ-OE2 2.94Å; R494-E717 IonicContact NE-OE1 3.77Å; R494-E717 PolarHBondContact NE-OE1 3.43Å; R494-E717 IonicContact NH2-OE1 3.1Å; R494-E717 PolarHBondContact NH2-OE1 3.02Å; R494-E717 IonicContact NH2-OE2 2.82Å; R494-E717 PolarHBondContact NH2-OE2 3.01Å; P713-E717 PolarHBondContact O-N 3Å; E714-E717 PolarHBondContact O-N 2.92Å; E717-V720 PolarHBondContact O-N 2.98Å; E717-F721 WeakPolarHBondContact O-CB 3.43Å; E717-F721 PolarHBondContact O-N 3.38Å
718	F	89.2	Confident	90.3	Very high	14 Å²	14	36.2 Å²	36.2	6%	0.061	19%	0.186	C	C	.	.	H	α-helix	trans	-65.5	-42.6	175.3	-179.4	-110.6	0	0	0	112.3	L652 V657 E714 H715 Q716 V720 F721 L722	L652-F718 HydrophobicContact CD2-CE1 4.34Å; V657-F718 HydrophobicContact CG2-CD1 3.99Å; V657-F718 HydrophobicContact CG2-CE1 4.48Å; E714-F718 PolarHBondContact O-N 3.29Å; E714-F718 VanDerWaalsContact O-N 3.1Å; H715-F718 PolarHBondContact O-N 3.34Å; Q716-F718 VanDerWaalsContact C-N 3.33Å; Q716-F718 PolarHBondContact O-N 3.21Å; F718-V720 VanDerWaalsContact C-N 3.34Å; F718-V720 PolarHBondContact O-N 2.87Å; F718-F721 HydrophobicContact CD2-CD1 4.14Å; F718-F721 HydrophobicContact CE2-CD1 4.13Å; F718-F721 HydrophobicContact CE2-CE1 4.45Å; F718-F721 WeakPolarHBondContact O-CB 3.08Å; F718-F721 PolarHBondContact O-N 3.4Å; F718-L722 HydrophobicContact CD1-CD1 4.13Å; F718-L722 HydrophobicContact CD1-CG 4.49Å; F718-L722 HydrophobicContact CE1-CD1 3.64Å; F718-L722 HydrophobicContact CE1-CD2 4.5Å; F718-L722 HydrophobicContact CE1-CG 4.11Å; F718-L722 HydrophobicContact CE2-CD2 4.44Å; F718-L722 HydrophobicContact CE2-CG 4.48Å; F718-L722 HydrophobicContact CZ-CD1 4.04Å; F718-L722 HydrophobicContact CZ-CD2 4.05Å; F718-L722 HydrophobicContact CZ-CG 4.09Å; F718-L722 WeakPolarHBondContact O-CG 3.45Å; F718-L722 PolarHBondContact O-N 2.98Å
719	F	89.2	Confident	90.7	Very high	11 Å²	11	35.1 Å²	35.1	5%	0.048	18%	0.182	C	C	.	.	H	α-helix	trans	-63.2	-41	177.4	-158.5	-109.8	0	0	0	112.1	A586 A589 V657 H715 Q716 L722 Q723	A586-F719 HydrophobicContact CB-CD2 3.97Å; A586-F719 HydrophobicContact CB-CE1 4.27Å; A586-F719 HydrophobicContact CB-CE2 3.7Å; A586-F719 HydrophobicContact CB-CG 4.39Å; A586-F719 HydrophobicContact CB-CZ 3.88Å; A589-F719 HydrophobicContact CB-CE1 4.3Å; A589-F719 HydrophobicContact CB-CZ 3.71Å; V657-F719 HydrophobicContact CG1-CB 4.38Å; V657-F719 HydrophobicContact CG1-CD2 3.65Å; V657-F719 HydrophobicContact CG1-CE2 4.32Å; V657-F719 HydrophobicContact CG1-CG 4.4Å; H715-F719 WeakPolarHBondContact O-CB 3.41Å; H715-F719 PolarHBondContact O-N 2.94Å; Q716-F719 PolarHBondContact O-N 2.91Å; F719-L722 WeakPolarHBondContact O-CB 3.34Å; F719-L722 PolarHBondContact O-N 3.37Å; F719-Q723 VanDerWaalsContact CD1-NE2 3.33Å; F719-Q723 VanDerWaalsContact CE1-NE2 3.26Å; F719-Q723 WeakPolarHBondContact O-CG 3.3Å; F719-Q723 PolarHBondContact O-N 3.04Å
720	V	92.3	Very high	91.1	Very high	39 Å²	39	33.6 Å²	33.6	24%	0.236	17%	0.173	C	C	.	.	H	α-helix	trans	-64.7	-40	173	167.8	0	0	0	0	111.2	Q716 E717 F718 L722 Q723 R724 L828	Q716-V720 WeakPolarHBondContact O-CB 3.15Å; Q716-V720 VanDerWaalsContact O-CG2 3.3Å; Q716-V720 WeakPolarHBondContact O-CG2 3.15Å; Q716-V720 PolarHBondContact O-N 3.04Å; E717-V720 PolarHBondContact O-N 2.98Å; F718-V720 VanDerWaalsContact C-N 3.34Å; F718-V720 PolarHBondContact O-N 2.87Å; V720-L722 VanDerWaalsContact C-N 3.33Å; V720-L722 PolarHBondContact O-N 3.1Å; V720-Q723 PolarHBondContact O-N 2.89Å; V720-R724 HydrophobicContact CG1-CG 4.35Å; V720-R724 WeakPolarHBondContact O-CB 3.24Å; V720-R724 VanDerWaalsContact O-CG 3.31Å; V720-R724 WeakPolarHBondContact O-CG 3.41Å; V720-R724 PolarHBondContact O-N 2.93Å; V720-L828 HydrophobicContact CG1-CD2 3.89Å
721	F	94.1	Very high	91.5	Very high	3 Å²	3	33.9 Å²	33.9	1%	0.013	17%	0.173	C	C	.	.	H	α-helix	trans	-57.6	-46.4	172.8	162	-97.8	0	0	0	111.4	M511 E717 F718 Q723 R724 L725	M511-F721 HydrophobicContact CE-CE1 3.84Å; M511-F721 HydrophobicContact CE-CE2 4Å; M511-F721 HydrophobicContact CE-CZ 3.45Å; M511-F721 VanDerWaalsContact CE-CZ 3.45Å; E717-F721 WeakPolarHBondContact O-CB 3.43Å; E717-F721 PolarHBondContact O-N 3.38Å; F718-F721 HydrophobicContact CD2-CD1 4.14Å; F718-F721 HydrophobicContact CE2-CD1 4.13Å; F718-F721 HydrophobicContact CE2-CE1 4.45Å; F718-F721 WeakPolarHBondContact O-CB 3.08Å; F718-F721 PolarHBondContact O-N 3.4Å; F721-Q723 VanDerWaalsContact C-N 3.33Å; F721-Q723 PolarHBondContact O-N 3.17Å; F721-R724 PolarHBondContact O-N 3.03Å; F721-L725 HydrophobicContact CE1-CD1 3.92Å; F721-L725 HydrophobicContact CE1-CG 4.42Å; F721-L725 HydrophobicContact CE2-CD2 4.15Å; F721-L725 HydrophobicContact CE2-CG 4.41Å; F721-L725 HydrophobicContact CZ-CD1 3.98Å; F721-L725 HydrophobicContact CZ-CD2 4Å; F721-L725 HydrophobicContact CZ-CG 4.15Å; F721-L725 PolarHBondContact O-N 3.46Å
722	L	94.5	Very high	92	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.3	-42.8	176.9	-70.2	177.9	0	0	0	112	F579 D582 A583 A586 L652 F718 F719 V720 L725	F579-L722 HydrophobicContact CB-CD2 4.11Å; F579-L722 HydrophobicContact CD1-CD2 4.05Å; F579-L722 HydrophobicContact CG-CD2 4.42Å; D582-L722 HydrophobicContact CB-CD1 3.99Å; D582-L722 HydrophobicContact CB-CD2 3.99Å; A583-L722 VanDerWaalsContact CB-O 3.29Å; A583-L722 WeakPolarHBondContact CB-O 3.4Å; A586-L722 HydrophobicContact CB-CB 3.74Å; A586-L722 HydrophobicContact CB-CD1 4.29Å; L652-L722 HydrophobicContact CD2-CD1 4.1Å; F718-L722 HydrophobicContact CD1-CD1 4.13Å; F718-L722 HydrophobicContact CD1-CG 4.49Å; F718-L722 HydrophobicContact CE1-CD1 3.64Å; F718-L722 HydrophobicContact CE1-CD2 4.5Å; F718-L722 HydrophobicContact CE1-CG 4.11Å; F718-L722 HydrophobicContact CE2-CD2 4.44Å; F718-L722 HydrophobicContact CE2-CG 4.48Å; F718-L722 HydrophobicContact CZ-CD1 4.04Å; F718-L722 HydrophobicContact CZ-CD2 4.05Å; F718-L722 HydrophobicContact CZ-CG 4.09Å; F718-L722 WeakPolarHBondContact O-CG 3.45Å; F718-L722 PolarHBondContact O-N 2.98Å; F719-L722 WeakPolarHBondContact O-CB 3.34Å; F719-L722 PolarHBondContact O-N 3.37Å; V720-L722 VanDerWaalsContact C-N 3.33Å; V720-L722 PolarHBondContact O-N 3.1Å; L722-L725 HydrophobicContact CD2-CD1 4.29Å; L722-L725 WeakPolarHBondContact O-CB 3.47Å; L722-L725 PolarHBondContact O-N 3.48Å
723	Q	94.7	Very high	92.4	Very high	8 Å²	8	25.7 Å²	25.7	4%	0.037	13%	0.127	C	C	.	.	H	α-helix	trans	-63.7	-43.1	175.9	-68.2	165.6	-7.7	0	0	111.9	A586 F719 V720 F721 L725 L726 S727 L828	A586-Q723 HydrophobicContact CB-CG 3.9Å; A586-Q723 PolarHBondContact O-NE2 2.93Å; F719-Q723 VanDerWaalsContact CD1-NE2 3.33Å; F719-Q723 VanDerWaalsContact CE1-NE2 3.26Å; F719-Q723 WeakPolarHBondContact O-CG 3.3Å; F719-Q723 PolarHBondContact O-N 3.04Å; V720-Q723 PolarHBondContact O-N 2.89Å; F721-Q723 VanDerWaalsContact C-N 3.33Å; F721-Q723 PolarHBondContact O-N 3.17Å; Q723-L725 PolarHBondContact O-N 3.31Å; Q723-L726 PolarHBondContact O-N 2.84Å; Q723-L726 VanDerWaalsContact O-N 3.11Å; Q723-S727 PolarHBondContact O-N 3.14Å; Q723-S727 PolarHBondContact O-OG 3.06Å; Q723-L828 HydrophobicContact CB-CB 4.44Å; Q723-L828 HydrophobicContact CB-CD2 4.43Å
724	R	94.9	Very high	92.8	Very high	89 Å²	89	21.9 Å²	21.9	34%	0.336	10%	0.102	S	C	.	.	H	α-helix	trans	-62.3	-25.7	179.2	-75.3	176.3	-180	166.9	3.7	113.8	Y493 V720 F721 L726 S727 P728 L828	Y493-R724 HydrophobicContact CD1-CB 4.31Å; Y493-R724 VanDerWaalsContact CD1-O 3.3Å; Y493-R724 WeakPolarHBondContact CD1-O 3.45Å; Y493-R724 WeakPolarHBondContact CE1-O 3.41Å; Y493-R724 WeakPolarHBondContact O-CD 3.32Å; Y493-R724 PolarHBondContact O-NH1 3.36Å; V720-R724 HydrophobicContact CG1-CG 4.35Å; V720-R724 WeakPolarHBondContact O-CB 3.24Å; V720-R724 VanDerWaalsContact O-CG 3.31Å; V720-R724 WeakPolarHBondContact O-CG 3.41Å; V720-R724 PolarHBondContact O-N 2.93Å; F721-R724 PolarHBondContact O-N 3.03Å; R724-L726 VanDerWaalsContact C-N 3.26Å; R724-L726 PolarHBondContact O-N 3.25Å; R724-S727 PolarHBondContact O-N 3.25Å; R724-P728 VanDerWaalsContact O-CD 3.28Å; R724-P728 WeakPolarHBondContact O-CD 3.25Å; R724-L828 HydrophobicContact CG-CD2 3.89Å
725	L	94.4	Very high	93.5	Very high	6 Å²	6	19 Å²	19	3%	0.031	9%	0.089	C	C	.	.	H	α-helix	trans	-61	-35.5	174.6	-70.1	172.3	0	0	0	112.3	Y493 F579 A583 F721 L722 Q723	Y493-L725 HydrophobicContact CD2-CD2 3.48Å; Y493-L725 VanDerWaalsContact CD2-CD2 3.48Å; Y493-L725 HydrophobicContact CE2-CD2 3.79Å; Y493-L725 HydrophobicContact CG-CD2 3.99Å; F579-L725 HydrophobicContact CB-CD1 3.59Å; F579-L725 HydrophobicContact CG-CD1 4.24Å; A583-L725 HydrophobicContact CB-CB 4.4Å; A583-L725 HydrophobicContact CB-CD1 4.45Å; F721-L725 HydrophobicContact CE1-CD1 3.92Å; F721-L725 HydrophobicContact CE1-CG 4.42Å; F721-L725 HydrophobicContact CE2-CD2 4.15Å; F721-L725 HydrophobicContact CE2-CG 4.41Å; F721-L725 HydrophobicContact CZ-CD1 3.98Å; F721-L725 HydrophobicContact CZ-CD2 4Å; F721-L725 HydrophobicContact CZ-CG 4.15Å; F721-L725 PolarHBondContact O-N 3.46Å; L722-L725 HydrophobicContact CD2-CD1 4.29Å; L722-L725 WeakPolarHBondContact O-CB 3.47Å; L722-L725 PolarHBondContact O-N 3.48Å; Q723-L725 PolarHBondContact O-N 3.31Å
726	L	94.6	Very high	94	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-92.4	-20.6	179.5	-74	178.8	0	0	0	113.4	F576 I580 A583 I584 C587 L624 L628 Q723 R724 P728 V729 L730	F576-L726 HydrophobicContact CE2-CD2 3.95Å; F576-L726 HydrophobicContact CZ-CD2 3.63Å; I580-L726 HydrophobicContact CD1-CD2 3.77Å; A583-L726 HydrophobicContact CB-CD1 4.01Å; A583-L726 HydrophobicContact CB-CG 4.04Å; I584-L726 HydrophobicContact CG1-CD1 3.91Å; C587-L726 HydrophobicContact CB-CD1 4.36Å; L624-L726 HydrophobicContact CD2-CD1 4.39Å; L628-L726 HydrophobicContact CD1-CD1 4.37Å; L628-L726 HydrophobicContact CD1-CD2 3.95Å; Q723-L726 PolarHBondContact O-N 2.84Å; Q723-L726 VanDerWaalsContact O-N 3.11Å; R724-L726 VanDerWaalsContact C-N 3.26Å; R724-L726 PolarHBondContact O-N 3.25Å; L726-P728 VanDerWaalsContact C-CD 3.5Å; L726-V729 WeakPolarHBondContact O-CB 3.2Å; L726-V729 PolarHBondContact O-N 3.36Å; L726-L730 HydrophobicContact CB-CD1 4.14Å; L726-L730 HydrophobicContact CB-CG 4.45Å; L726-L730 PolarHBondContact O-N 3.45Å
727	S	94.8	Very high	94.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-52.1	-42.2	-175.6	-62.7	0	0	0	0	115.3	Q723 R724 V729 L730 E731	Q723-S727 PolarHBondContact O-N 3.14Å; Q723-S727 PolarHBondContact O-OG 3.06Å; R724-S727 PolarHBondContact O-N 3.25Å; S727-V729 VanDerWaalsContact C-N 3.31Å; S727-V729 PolarHBondContact O-N 3.03Å; S727-L730 PolarHBondContact O-N 3.28Å; S727-E731 VanDerWaalsContact O-CB 3.29Å; S727-E731 WeakPolarHBondContact O-CB 3.46Å; S727-E731 PolarHBondContact O-N 3.46Å
728	P	94.8	Very high	94.7	Very high	4 Å²	4	13 Å²	13	3%	0.026	6%	0.063	C	C	.	.	H	α-helix	trans	-66.2	-33.2	178.4	-18.1	28.7	0	0	0	113.6	Y493 R724 L726 A732 Y771 E773 S774	Y493-P728 HydrophobicContact CE1-CG 3.84Å; R724-P728 VanDerWaalsContact O-CD 3.28Å; R724-P728 WeakPolarHBondContact O-CD 3.25Å; L726-P728 VanDerWaalsContact C-CD 3.5Å; P728-A732 PolarHBondContact O-N 3.38Å; P728-A732 VanDerWaalsContact O-N 3.12Å; P728-Y771 HydrophobicContact CB-CG 4.36Å; P728-Y771 HydrophobicContact CG-CD1 3.86Å; P728-Y771 HydrophobicContact CG-CG 3.99Å; P728-E773 HydrophobicContact CB-CG 3.77Å; P728-E773 HydrophobicContact CG-CG 3.91Å; P728-E773 VanDerWaalsContact CG-OE1 3.27Å; P728-E773 WeakPolarHBondContact CG-OE1 3.42Å; P728-S774 WeakPolarHBondContact O-CA 3.34Å; P728-S774 WeakPolarHBondContact O-CB 3.43Å
729	V	95.3	Very high	95	Very high	6 Å²	6	13.3 Å²	13.3	4%	0.036	6%	0.064	C	C	.	.	H	α-helix	trans	-69.2	-49	175.3	-178.8	0	0	0	0	109.1	F576 L628 E631 L726 S727 E731 A732 Y733 L779	F576-V729 HydrophobicContact CZ-CG2 4.5Å; L628-V729 HydrophobicContact CD2-CG1 3.87Å; E631-V729 HydrophobicContact CG-CG1 3.83Å; L726-V729 WeakPolarHBondContact O-CB 3.2Å; L726-V729 PolarHBondContact O-N 3.36Å; S727-V729 VanDerWaalsContact C-N 3.31Å; S727-V729 PolarHBondContact O-N 3.03Å; V729-E731 VanDerWaalsContact C-N 3.31Å; V729-E731 PolarHBondContact O-N 3.2Å; V729-A732 WeakPolarHBondContact O-CB 3.49Å; V729-A732 PolarHBondContact O-N 3.42Å; V729-Y733 HydrophobicContact CG1-CD2 4.01Å; V729-Y733 HydrophobicContact CG1-CE2 3.87Å; V729-Y733 WeakPolarHBondContact O-CD2 3.25Å; V729-Y733 PolarHBondContact O-N 3.36Å; V729-L779 HydrophobicContact CG1-CD2 4.31Å; V729-L779 HydrophobicContact CG2-CD2 4.06Å
730	L	96.2	Very high	95.2	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63	-36.1	178.9	-64.8	173.7	0	0	0	112.4	L624 L726 S727 Y733 S734 I823 F826	L624-L730 HydrophobicContact CD1-CD2 4.17Å; L726-L730 HydrophobicContact CB-CD1 4.14Å; L726-L730 HydrophobicContact CB-CG 4.45Å; L726-L730 PolarHBondContact O-N 3.45Å; S727-L730 PolarHBondContact O-N 3.28Å; L730-Y733 PolarHBondContact O-N 2.9Å; L730-S734 WeakPolarHBondContact O-CB 3.32Å; L730-S734 PolarHBondContact O-N 3.1Å; L730-S734 PolarHBondContact O-OG 3.22Å; L730-I823 HydrophobicContact CD2-CG2 4.48Å; L730-F826 HydrophobicContact CD1-CB 3.83Å; L730-F826 WeakPolarHBondContact CD1-O 3.43Å; L730-F826 HydrophobicContact CD2-CB 4.4Å
731	E	96	Very high	95.2	Very high	21 Å²	21	13.7 Å²	13.7	10%	0.098	6%	0.063	C	C	.	.	H	α-helix	trans	-66.3	-39.6	174.2	-174.7	174.5	-123.9	0	0	112.2	S727 V729 Y733 S734 G735 A770 Y771 S774	S727-E731 VanDerWaalsContact O-CB 3.29Å; S727-E731 WeakPolarHBondContact O-CB 3.46Å; S727-E731 PolarHBondContact O-N 3.46Å; V729-E731 VanDerWaalsContact C-N 3.31Å; V729-E731 PolarHBondContact O-N 3.2Å; E731-Y733 VanDerWaalsContact C-N 3.33Å; E731-S734 WeakPolarHBondContact CA-OG 3.44Å; E731-S734 PolarHBondContact O-OG 3.04Å; E731-S734 VanDerWaalsContact O-OG 3.1Å; E731-G735 PolarHBondContact O-N 3Å; E731-A770 WeakPolarHBondContact OE1-CB 3.42Å; E731-A770 PolarHBondContact OE1-N 3.31Å; E731-Y771 WeakPolarHBondContact OE2-CA 3.47Å; E731-Y771 WeakPolarHBondContact OE2-CB 3.33Å; E731-Y771 PolarHBondContact OE2-N 3.41Å; E731-Y771 VanDerWaalsContact OE2-O 3.08Å; E731-S774 PolarHBondContact OE2-OG 3.18Å; E731-S774 VanDerWaalsContact OE2-OG 3.06Å
732	A	96.3	Very high	95.1	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.1	-42.6	174.5	0	0	0	0	0	111.3	P728 V729 G735 A736 L760 S774 L779	P728-A732 PolarHBondContact O-N 3.38Å; P728-A732 VanDerWaalsContact O-N 3.12Å; V729-A732 WeakPolarHBondContact O-CB 3.49Å; V729-A732 PolarHBondContact O-N 3.42Å; A732-G735 PolarHBondContact O-N 3.18Å; A732-A736 WeakPolarHBondContact O-CB 3.42Å; A732-A736 PolarHBondContact O-N 3.42Å; A732-L760 HydrophobicContact CB-CD1 4.47Å; A732-S774 VanDerWaalsContact CB-O 3.26Å; A732-S774 WeakPolarHBondContact CB-O 3.22Å; A732-L779 HydrophobicContact CB-CB 4.05Å; A732-L779 HydrophobicContact CB-CD1 4.03Å
733	Y	96.8	Very high	94.9	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-70.7	-39.8	179.7	-84.2	-114.3	0	0	0	112.6	F627 E631 V729 L730 E731 A736 A737 T783 T786 F787	F627-Y733 HydrophobicContact CD1-CD1 4.42Å; F627-Y733 AromaticContact CE1-CD1 3.4Å; F627-Y733 HydrophobicContact CE1-CD1 3.4Å; F627-Y733 VanDerWaalsContact CE1-CD1 3.4Å; F627-Y733 AromaticContact CE1-CE1 3.92Å; F627-Y733 HydrophobicContact CE1-CE1 3.92Å; F627-Y733 HydrophobicContact CE1-CG 4.11Å; F627-Y733 HydrophobicContact CE2-CD1 4.42Å; F627-Y733 AromaticContact CZ-CD1 3.42Å; F627-Y733 HydrophobicContact CZ-CD1 3.42Å; F627-Y733 VanDerWaalsContact CZ-CD1 3.42Å; F627-Y733 HydrophobicContact CZ-CE1 4.03Å; F627-Y733 HydrophobicContact CZ-CG 4.35Å; E631-Y733 HydrophobicContact CG-CE2 4.29Å; V729-Y733 HydrophobicContact CG1-CD2 4.01Å; V729-Y733 HydrophobicContact CG1-CE2 3.87Å; V729-Y733 WeakPolarHBondContact O-CD2 3.25Å; V729-Y733 PolarHBondContact O-N 3.36Å; L730-Y733 PolarHBondContact O-N 2.9Å; E731-Y733 VanDerWaalsContact C-N 3.33Å; Y733-A736 PolarHBondContact O-N 3.42Å; Y733-A737 PolarHBondContact O-N 3.22Å; Y733-T783 HydrophobicContact CD1-CG2 3.96Å; Y733-T783 HydrophobicContact CD2-CG2 4.29Å; Y733-T783 VanDerWaalsContact CD2-OG1 3.3Å; Y733-T783 WeakPolarHBondContact CD2-OG1 3.4Å; Y733-T783 HydrophobicContact CE1-CG2 4.28Å; Y733-T783 VanDerWaalsContact CE2-OG1 3.28Å; Y733-T783 WeakPolarHBondContact CE2-OG1 3.47Å; Y733-T783 HydrophobicContact CG-CG2 4.01Å; Y733-T786 HydrophobicContact CE1-CG2 3.9Å; Y733-T786 PolarHBondContact OH-OG1 3.19Å; Y733-F787 HydrophobicContact CD1-CE1 4.24Å
734	S	96.2	Very high	94.4	Very high	7 Å²	7	22.6 Å²	22.6	5%	0.049	13%	0.126	C	C	.	.	H	α-helix	trans	-68.5	-38.8	174.1	67.5	0	0	0	0	111.2	L730 E731 A736 A737 I738	L730-S734 WeakPolarHBondContact O-CB 3.32Å; L730-S734 PolarHBondContact O-N 3.1Å; L730-S734 PolarHBondContact O-OG 3.22Å; E731-S734 WeakPolarHBondContact CA-OG 3.44Å; E731-S734 PolarHBondContact O-OG 3.04Å; E731-S734 VanDerWaalsContact O-OG 3.1Å; S734-A736 VanDerWaalsContact C-N 3.32Å; S734-A736 PolarHBondContact O-N 3.19Å; S734-A737 PolarHBondContact O-N 3.33Å; S734-I738 VanDerWaalsContact O-CG1 3.32Å; S734-I738 WeakPolarHBondContact O-CG1 3.45Å; S734-I738 PolarHBondContact O-N 3.1Å
735	G	96	Very high	94.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.6	-40.9	171.8	0	0	0	0	0	112.6	E731 A732 I738 F739 Y759	E731-G735 PolarHBondContact O-N 3Å; A732-G735 PolarHBondContact O-N 3.18Å; G735-I738 PolarHBondContact O-N 2.93Å; G735-F739 WeakPolarHBondContact O-CB 2.89Å; G735-F739 PolarHBondContact O-N 3.31Å; G735-Y759 WeakPolarHBondContact O-CE1 3.1Å
736	A	96.4	Very high	93.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-67.9	-42.2	173.1	0	0	0	0	0	112.6	A732 Y733 S734 I738 F739 V740 L756 T783 F787	A732-A736 WeakPolarHBondContact O-CB 3.42Å; A732-A736 PolarHBondContact O-N 3.42Å; Y733-A736 PolarHBondContact O-N 3.42Å; S734-A736 VanDerWaalsContact C-N 3.32Å; S734-A736 PolarHBondContact O-N 3.19Å; A736-I738 VanDerWaalsContact C-N 3.26Å; A736-I738 PolarHBondContact O-N 3.46Å; A736-F739 WeakPolarHBondContact O-CB 3.47Å; A736-F739 PolarHBondContact O-N 3.36Å; A736-V740 VanDerWaalsContact O-CG2 3.3Å; A736-V740 WeakPolarHBondContact O-CG2 2.94Å; A736-V740 PolarHBondContact O-N 3.43Å; A736-L756 HydrophobicContact CB-CD1 4.01Å; A736-L756 HydrophobicContact CB-CD2 3.95Å; A736-T783 HydrophobicContact CB-CG2 3.26Å; A736-F787 HydrophobicContact CB-CE2 3.84Å; A736-F787 HydrophobicContact CB-CZ 4.06Å
737	A	96	Very high	93.8	Very high	2 Å²	2	30.6 Å²	30.6	2%	0.017	17%	0.174	C	C	.	.	H	α-helix	trans	-58.3	-39.8	175.6	0	0	0	0	0	111.4	Y733 S734 H741 F787 L819 L820 I823	Y733-A737 PolarHBondContact O-N 3.22Å; S734-A737 PolarHBondContact O-N 3.33Å; A737-H741 PolarHBondContact O-CD2 3.19Å; A737-H741 VanDerWaalsContact O-CD2 3.28Å; A737-F787 HydrophobicContact CB-CE2 4.49Å; A737-F787 HydrophobicContact CB-CZ 4.1Å; A737-L819 HydrophobicContact CB-CD2 4.48Å; A737-L820 HydrophobicContact CB-CB 4.33Å; A737-L820 HydrophobicContact CB-CD1 4.07Å; A737-I823 HydrophobicContact CB-CD1 3.89Å
738	I	95.6	Very high	93.8	Very high	64 Å²	64	31.7 Å²	31.7	33%	0.328	18%	0.182	S	C	.	.	H	α-helix	trans	-63.8	-47	171.5	-65.5	162.9	0	0	0	110.7	S734 G735 A736 V740 H741 Y759 L820	S734-I738 VanDerWaalsContact O-CG1 3.32Å; S734-I738 WeakPolarHBondContact O-CG1 3.45Å; S734-I738 PolarHBondContact O-N 3.1Å; G735-I738 PolarHBondContact O-N 2.93Å; A736-I738 VanDerWaalsContact C-N 3.26Å; A736-I738 PolarHBondContact O-N 3.46Å; I738-V740 VanDerWaalsContact C-N 3.26Å; I738-V740 PolarHBondContact O-N 3.29Å; I738-H741 WeakPolarHBondContact O-CB 3.09Å; I738-H741 PolarHBondContact O-CD2 3.38Å; I738-H741 PolarHBondContact O-N 3.08Å; I738-H741 VanDerWaalsContact O-N 3.13Å; I738-Y759 WeakPolarHBondContact CG2-OH 3.08Å; I738-L820 HydrophobicContact CD1-CD1 4.38Å; I738-L820 HydrophobicContact CG1-CD1 3.9Å; I738-L820 HydrophobicContact CG1-CD2 3.87Å
739	F	95.8	Very high	93.6	Very high	19 Å²	19	33.8 Å²	33.8	8%	0.083	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-34.5	-178.6	-175.1	-104	0	0	0	112.5	G735 A736 H741 S742 Y752 Q755 L756 Y759	G735-F739 WeakPolarHBondContact O-CB 2.89Å; G735-F739 PolarHBondContact O-N 3.31Å; A736-F739 WeakPolarHBondContact O-CB 3.47Å; A736-F739 PolarHBondContact O-N 3.36Å; F739-H741 PolarHBondContact O-N 2.95Å; F739-H741 VanDerWaalsContact O-N 3.11Å; F739-S742 WeakPolarHBondContact O-CB 3.13Å; F739-S742 PolarHBondContact O-N 2.94Å; F739-S742 PolarHBondContact O-OG 3.5Å; F739-Y752 AromaticContact CD1-CE2 3.94Å; F739-Y752 HydrophobicContact CD1-CE2 3.94Å; F739-Y752 AromaticContact CD1-CZ 3.93Å; F739-Y752 HydrophobicContact CE1-CD2 4.06Å; F739-Y752 AromaticContact CE1-CE2 3.62Å; F739-Y752 HydrophobicContact CE1-CE2 3.62Å; F739-Y752 AromaticContact CE1-CZ 3.99Å; F739-Q755 HydrophobicContact CE1-CB 4.48Å; F739-Q755 HydrophobicContact CZ-CB 3.76Å; F739-L756 HydrophobicContact CB-CD1 3.74Å; F739-L756 HydrophobicContact CD1-CB 3.87Å; F739-L756 HydrophobicContact CD1-CD1 3.78Å; F739-L756 HydrophobicContact CD1-CG 4.32Å; F739-L756 HydrophobicContact CE1-CB 3.88Å; F739-L756 HydrophobicContact CG-CD1 3.79Å; F739-Y759 HydrophobicContact CB-CD1 4.06Å; F739-Y759 HydrophobicContact CB-CE1 4.14Å; F739-Y759 AromaticContact CD2-CD1 3.97Å; F739-Y759 HydrophobicContact CD2-CD1 3.97Å; F739-Y759 HydrophobicContact CD2-CD2 4.09Å; F739-Y759 AromaticContact CD2-CG 3.7Å; F739-Y759 HydrophobicContact CD2-CG 3.7Å; F739-Y759 HydrophobicContact CE2-CG 4.33Å; F739-Y759 HydrophobicContact CG-CD1 4.31Å; F739-Y759 HydrophobicContact CG-CG 4.47Å
740	V	93.9	Very high	93.4	Very high	2 Å²	2	38 Å²	38	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-55.2	-28.2	176.1	171.9	0	0	0	0	112.7	A736 I738 S742 L743 Y752 F787 V792 L806	A736-V740 VanDerWaalsContact O-CG2 3.3Å; A736-V740 WeakPolarHBondContact O-CG2 2.94Å; A736-V740 PolarHBondContact O-N 3.43Å; I738-V740 VanDerWaalsContact C-N 3.26Å; I738-V740 PolarHBondContact O-N 3.29Å; V740-S742 PolarHBondContact O-N 3.36Å; V740-L743 WeakPolarHBondContact O-CB 3.39Å; V740-L743 PolarHBondContact O-N 2.81Å; V740-L743 VanDerWaalsContact O-N 3.09Å; V740-Y752 VanDerWaalsContact CG2-OH 3.29Å; V740-Y752 WeakPolarHBondContact CG2-OH 3.2Å; V740-F787 HydrophobicContact CG2-CD2 3.76Å; V740-F787 HydrophobicContact CG2-CE2 3.68Å; V740-V792 HydrophobicContact CG1-CG1 4.16Å; V740-L806 HydrophobicContact CG1-CD2 3.46Å; V740-L806 VanDerWaalsContact CG1-CD2 3.46Å
741	H	92.3	Very high	93.3	Very high	57 Å²	57	42.6 Å²	42.6	26%	0.264	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.8	175	-71.8	-99.2	0	0	0	113.9	A737 I738 F739 L743 R816 N817	A737-H741 PolarHBondContact O-CD2 3.19Å; A737-H741 VanDerWaalsContact O-CD2 3.28Å; I738-H741 WeakPolarHBondContact O-CB 3.09Å; I738-H741 PolarHBondContact O-CD2 3.38Å; I738-H741 PolarHBondContact O-N 3.08Å; I738-H741 VanDerWaalsContact O-N 3.13Å; F739-H741 PolarHBondContact O-N 2.95Å; F739-H741 VanDerWaalsContact O-N 3.11Å; H741-L743 VanDerWaalsContact C-N 3.33Å; H741-R816 VanDerWaalsContact CE1-CB 3.49Å; H741-R816 WeakPolarHBondContact CE1-CB 3.48Å; H741-R816 PolarHBondContact ND1-NE 2.98Å; H741-R816 WeakPolarHBondContact NE2-CB 3.35Å; H741-N817 PolarHBondContact CE1-OD1 3.39Å
742	S	90.9	Very high	93.2	Very high	72 Å²	72	41.7 Å²	41.7	50%	0.503	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-8.1	176.6	69.7	0	0	0	0	113.6	F739 V740 S744	F739-S742 WeakPolarHBondContact O-CB 3.13Å; F739-S742 PolarHBondContact O-N 2.94Å; F739-S742 PolarHBondContact O-OG 3.5Å; V740-S742 PolarHBondContact O-N 3.36Å; S742-S744 PolarHBondContact O-N 3.42Å; S742-S744 VanDerWaalsContact O-N 3.13Å
743	L	90.8	Very high	93.1	Very high	12 Å²	12	42.3 Å²	42.3	6%	0.063	24%	0.24	C	C	.	.			trans	-81.9	91.8	-178.8	-171.7	64	0	0	0	110.8	V740 H741 Q745 M747 Y752 L793 L806	V740-L743 WeakPolarHBondContact O-CB 3.39Å; V740-L743 PolarHBondContact O-N 2.81Å; V740-L743 VanDerWaalsContact O-N 3.09Å; H741-L743 VanDerWaalsContact C-N 3.33Å; L743-Q745 VanDerWaalsContact CD1-O 3.31Å; L743-Q745 WeakPolarHBondContact CD1-O 3.25Å; L743-M747 HydrophobicContact CD1-CB 4.41Å; L743-Y752 HydrophobicContact CB-CE2 4.42Å; L743-Y752 HydrophobicContact CD1-CD2 3.98Å; L743-Y752 HydrophobicContact CD1-CE2 4.08Å; L743-Y752 HydrophobicContact CD2-CD2 4.43Å; L743-Y752 HydrophobicContact CD2-CE2 3.99Å; L743-Y752 HydrophobicContact CG-CE2 4.4Å; L743-L793 HydrophobicContact CD2-CD2 3.76Å; L743-L806 HydrophobicContact CD2-CD2 4.47Å; L743-L806 HydrophobicContact CD2-CG 4.21Å; L743-L806 WeakPolarHBondContact O-CD1 3.49Å
744	S	84.3	Confident	93	Very high	113 Å²	113	46.9 Å²	46.9	79%	0.79	26%	0.262	S	S	*	.			trans	-97.5	-21.2	179.3	-52.8	0	0	0	0	114.1	S742	S742-S744 PolarHBondContact O-N 3.42Å; S742-S744 VanDerWaalsContact O-N 3.13Å
745	Q	88.3	Confident	92.9	Very high	154 Å²	154	49.7 Å²	49.7	72%	0.72	27%	0.274	S	S	*	.	S	Bend	trans	-134.6	152	-177.4	-67.3	-175.2	-6.5	0	0	110.7	L743 M747	L743-Q745 VanDerWaalsContact CD1-O 3.31Å; L743-Q745 WeakPolarHBondContact CD1-O 3.25Å; Q745-M747 PolarHBondContact O-N 2.85Å
746	P	90.9	Very high	92.9	Very high	74 Å²	74	49.8 Å²	49.8	48%	0.481	28%	0.275	S	S	.	.			trans	-56.8	135.9	172.8	-22.6	33.3	0	0	0	111.2	V804 E805	P746-V804 WeakPolarHBondContact CA-O 3.36Å; P746-E805 HydrophobicContact CB-CB 4.22Å; P746-E805 HydrophobicContact CG-CB 4.13Å
747	M	93.3	Very high	92.9	Very high	36 Å²	36	50.4 Å²	50.4	18%	0.177	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.9	-177	-177.7	-176.9	-65.9	0	0	110.4	L743 Q745 E749 E751 Y752 L803 V804	L743-M747 HydrophobicContact CD1-CB 4.41Å; Q745-M747 PolarHBondContact O-N 2.85Å; M747-E749 PolarHBondContact O-N 3.05Å; M747-E751 HydrophobicContact CG-CB 3.94Å; M747-E751 HydrophobicContact CG-CG 4.03Å; M747-E751 HydrophobicContact SD-CB 4.08Å; M747-E751 HydrophobicContact SD-CG 3.78Å; M747-Y752 VanDerWaalsContact SD-CA 3.53Å; M747-Y752 HydrophobicContact SD-CD2 4.44Å; M747-Y752 PolarHBondContact SD-N 3.23Å; M747-Y752 VanDerWaalsContact SD-N 3.43Å; M747-L803 CarbonylContact O-C 3.51Å; M747-L803 WeakPolarHBondContact O-CA 3.13Å; M747-V804 PolarHBondContact N-O 2.94Å; M747-V804 PolarHBondContact O-N 3.05Å
748	A	92.8	Very high	92.8	Very high	22 Å²	22	57.3 Å²	57.3	18%	0.182	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	134	173.6	0	0	0	0	0	111.3	P750 E751 Y752 V801 S802 L803	A748-P750 VanDerWaalsContact C-CD 3.41Å; A748-P750 VanDerWaalsContact C-N 3.34Å; A748-E751 HydrophobicContact CB-CB 4.24Å; A748-E751 WeakPolarHBondContact O-CA 3.29Å; A748-E751 WeakPolarHBondContact O-CB 3.24Å; A748-E751 PolarHBondContact O-N 3.21Å; A748-Y752 PolarHBondContact O-N 3.12Å; A748-V801 HydrophobicContact CB-CG1 3.87Å; A748-S802 WeakPolarHBondContact CA-O 3.42Å; A748-L803 HydrophobicContact CB-CD2 4.33Å
749	E	91.9	Very high	92.9	Very high	49 Å²	49	57.6 Å²	57.6	23%	0.229	30%	0.3	C	S	.	.	H	α-helix	trans	-51.5	-43.7	-179.5	-177.4	178.7	156.9	0	0	113.7	M747 E751 Y752 T753 K788 S802 V804	M747-E749 PolarHBondContact O-N 3.05Å; E749-E751 VanDerWaalsContact C-N 3.3Å; E749-E751 PolarHBondContact O-N 3.48Å; E749-Y752 PolarHBondContact O-N 3.01Å; E749-T753 WeakPolarHBondContact O-CB 2.97Å; E749-T753 PolarHBondContact O-N 3.36Å; E749-T753 PolarHBondContact O-OG1 2.93Å; E749-K788 IonicContact OE1-NZ 3.18Å; E749-K788 PolarHBondContact OE1-NZ 2.96Å; E749-K788 VanDerWaalsContact OE1-NZ 3.1Å; E749-K788 IonicContact OE2-NZ 3.91Å; E749-K788 PolarHBondContact OE2-NZ 3.21Å; E749-S802 PolarHBondContact N-O 3.35Å; E749-S802 PolarHBondContact OE2-OG 3.03Å; E749-V804 HydrophobicContact CB-CG2 3.54Å; E749-V804 HydrophobicContact CG-CG2 3.98Å
750	P	91.4	Very high	92.9	Very high	94 Å²	94	56.9 Å²	56.9	61%	0.61	30%	0.297	S	S	*	.	H	α-helix	trans	-64.4	-35.8	177.5	-20.7	34.2	0	0	0	112.7	A748 Q754	A748-P750 VanDerWaalsContact C-CD 3.41Å; A748-P750 VanDerWaalsContact C-N 3.34Å; P750-Q754 WeakPolarHBondContact O-CB 3.28Å; P750-Q754 PolarHBondContact O-N 2.95Å
751	E	92.7	Very high	92.9	Very high	97 Å²	97	58 Å²	58	45%	0.453	30%	0.303	S	S	.	.	H	α-helix	trans	-69.6	-49	178.1	-172.5	-178	178.4	0	0	110.3	M747 A748 E749 T753 Q754 Q755	M747-E751 HydrophobicContact CG-CB 3.94Å; M747-E751 HydrophobicContact CG-CG 4.03Å; M747-E751 HydrophobicContact SD-CB 4.08Å; M747-E751 HydrophobicContact SD-CG 3.78Å; A748-E751 HydrophobicContact CB-CB 4.24Å; A748-E751 WeakPolarHBondContact O-CA 3.29Å; A748-E751 WeakPolarHBondContact O-CB 3.24Å; A748-E751 PolarHBondContact O-N 3.21Å; E749-E751 VanDerWaalsContact C-N 3.3Å; E749-E751 PolarHBondContact O-N 3.48Å; E751-T753 VanDerWaalsContact C-N 3.31Å; E751-T753 PolarHBondContact O-N 3.47Å; E751-Q754 PolarHBondContact O-N 3.2Å; E751-Q755 HydrophobicContact CG-CG 4.45Å; E751-Q755 WeakPolarHBondContact O-CG 3.42Å; E751-Q755 PolarHBondContact O-N 3.2Å; E751-Q755 PolarHBondContact OE1-NE2 3.39Å
752	Y	94.3	Very high	93	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.008	31%	0.307	C	S	.	.	H	α-helix	trans	-55.3	-47.4	175.6	-179.3	-95.1	0	0	0	111.6	F739 V740 L743 M747 A748 E749 Q754 Q755 L756 V784 L793	F739-Y752 AromaticContact CD1-CE2 3.94Å; F739-Y752 HydrophobicContact CD1-CE2 3.94Å; F739-Y752 AromaticContact CD1-CZ 3.93Å; F739-Y752 HydrophobicContact CE1-CD2 4.06Å; F739-Y752 AromaticContact CE1-CE2 3.62Å; F739-Y752 HydrophobicContact CE1-CE2 3.62Å; F739-Y752 AromaticContact CE1-CZ 3.99Å; V740-Y752 VanDerWaalsContact CG2-OH 3.29Å; V740-Y752 WeakPolarHBondContact CG2-OH 3.2Å; L743-Y752 HydrophobicContact CB-CE2 4.42Å; L743-Y752 HydrophobicContact CD1-CD2 3.98Å; L743-Y752 HydrophobicContact CD1-CE2 4.08Å; L743-Y752 HydrophobicContact CD2-CD2 4.43Å; L743-Y752 HydrophobicContact CD2-CE2 3.99Å; L743-Y752 HydrophobicContact CG-CE2 4.4Å; M747-Y752 VanDerWaalsContact SD-CA 3.53Å; M747-Y752 HydrophobicContact SD-CD2 4.44Å; M747-Y752 PolarHBondContact SD-N 3.23Å; M747-Y752 VanDerWaalsContact SD-N 3.43Å; A748-Y752 PolarHBondContact O-N 3.12Å; E749-Y752 PolarHBondContact O-N 3.01Å; Y752-Q754 VanDerWaalsContact C-N 3.31Å; Y752-Q754 PolarHBondContact O-N 3.32Å; Y752-Q755 PolarHBondContact O-N 2.71Å; Y752-L756 HydrophobicContact CE1-CD2 4.39Å; Y752-L756 WeakPolarHBondContact O-CB 3.49Å; Y752-L756 PolarHBondContact O-N 3.26Å; Y752-V784 HydrophobicContact CD1-CG2 4.06Å; Y752-V784 HydrophobicContact CE1-CG2 3.99Å; Y752-L793 HydrophobicContact CE1-CD1 3.91Å
753	T	94.3	Very high	93.2	Very high	12 Å²	12	56.8 Å²	56.8	7%	0.074	29%	0.291	C	S	.	.	H	α-helix	trans	-60	-40.8	177.4	-56.6	0	0	0	0	111.5	E749 E751 F757 V780 K781	E749-T753 WeakPolarHBondContact O-CB 2.97Å; E749-T753 PolarHBondContact O-N 3.36Å; E749-T753 PolarHBondContact O-OG1 2.93Å; E751-T753 VanDerWaalsContact C-N 3.31Å; E751-T753 PolarHBondContact O-N 3.47Å; T753-F757 WeakPolarHBondContact O-CB 3.47Å; T753-F757 PolarHBondContact O-N 3.45Å; T753-V780 HydrophobicContact CG2-CG1 3.85Å; T753-V780 WeakPolarHBondContact O-CG1 3.49Å; T753-K781 HydrophobicContact CG2-CG 4.12Å
754	Q	94.1	Very high	93.2	Very high	96 Å²	96	57.1 Å²	57.1	45%	0.449	29%	0.294	S	S	.	.	H	α-helix	trans	-70.7	-39.8	178.8	-173.4	173.9	35.6	0	0	112.1	P750 E751 Y752 F757 R758	P750-Q754 WeakPolarHBondContact O-CB 3.28Å; P750-Q754 PolarHBondContact O-N 2.95Å; E751-Q754 PolarHBondContact O-N 3.2Å; Y752-Q754 VanDerWaalsContact C-N 3.31Å; Y752-Q754 PolarHBondContact O-N 3.32Å; Q754-F757 PolarHBondContact O-N 2.98Å; Q754-R758 WeakPolarHBondContact O-CG 3.3Å; Q754-R758 PolarHBondContact O-N 3.01Å
755	Q	95.1	Very high	93.6	Very high	67 Å²	67	58 Å²	58	31%	0.313	29%	0.286	S	S	.	.	H	α-helix	trans	-66.1	-44.8	177	-67.8	-173.6	13.4	0	0	111.4	F739 E751 Y752 F757 R758 Y759	F739-Q755 HydrophobicContact CE1-CB 4.48Å; F739-Q755 HydrophobicContact CZ-CB 3.76Å; E751-Q755 HydrophobicContact CG-CG 4.45Å; E751-Q755 WeakPolarHBondContact O-CG 3.42Å; E751-Q755 PolarHBondContact O-N 3.2Å; E751-Q755 PolarHBondContact OE1-NE2 3.39Å; Y752-Q755 PolarHBondContact O-N 2.71Å; Q755-F757 VanDerWaalsContact C-N 3.34Å; Q755-F757 PolarHBondContact O-N 2.97Å; Q755-R758 PolarHBondContact O-N 3.13Å; Q755-Y759 WeakPolarHBondContact O-CB 3.49Å; Q755-Y759 PolarHBondContact O-N 2.88Å
756	L	96	Very high	93.7	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-59.1	-44.3	173.8	174.8	56.5	0	0	0	111.6	A736 F739 Y752 R758 Y759 L760 V780 V784	A736-L756 HydrophobicContact CB-CD1 4.01Å; A736-L756 HydrophobicContact CB-CD2 3.95Å; F739-L756 HydrophobicContact CB-CD1 3.74Å; F739-L756 HydrophobicContact CD1-CB 3.87Å; F739-L756 HydrophobicContact CD1-CD1 3.78Å; F739-L756 HydrophobicContact CD1-CG 4.32Å; F739-L756 HydrophobicContact CE1-CB 3.88Å; F739-L756 HydrophobicContact CG-CD1 3.79Å; Y752-L756 HydrophobicContact CE1-CD2 4.39Å; Y752-L756 WeakPolarHBondContact O-CB 3.49Å; Y752-L756 PolarHBondContact O-N 3.26Å; L756-R758 PolarHBondContact O-N 3.04Å; L756-Y759 HydrophobicContact CD1-CD1 4.33Å; L756-Y759 WeakPolarHBondContact O-CB 3.11Å; L756-Y759 PolarHBondContact O-N 2.81Å; L756-L760 HydrophobicContact CD1-CD1 4.35Å; L756-L760 HydrophobicContact CD1-CG 4.16Å; L756-L760 PolarHBondContact O-N 3.47Å; L756-V780 HydrophobicContact CB-CG1 4.25Å; L756-V780 HydrophobicContact CD2-CG1 3.93Å; L756-V780 HydrophobicContact CG-CG1 3.95Å; L756-V784 HydrophobicContact CD2-CG2 4.01Å
757	F	95.9	Very high	93.6	Very high	13 Å²	13	57.7 Å²	57.7	6%	0.057	29%	0.292	C	S	.	.	H	α-helix	trans	-59.9	-45.5	175.9	173.8	-108	0	0	0	112.3	Q367 L368 T753 Q754 Q755 Y759 L760 L761 A775 H777 V780	Q367-F757 WeakPolarHBondContact O-CE2 3.41Å; L368-F757 VanDerWaalsContact O-CE1 3.27Å; L368-F757 WeakPolarHBondContact O-CE1 3.49Å; L368-F757 WeakPolarHBondContact O-CZ 3.28Å; T753-F757 WeakPolarHBondContact O-CB 3.47Å; T753-F757 PolarHBondContact O-N 3.45Å; Q754-F757 PolarHBondContact O-N 2.98Å; Q755-F757 VanDerWaalsContact C-N 3.34Å; Q755-F757 PolarHBondContact O-N 2.97Å; F757-Y759 VanDerWaalsContact C-N 3.31Å; F757-Y759 PolarHBondContact O-N 3.34Å; F757-L760 PolarHBondContact O-N 3.05Å; F757-L761 HydrophobicContact CE1-CD2 4.21Å; F757-L761 HydrophobicContact CZ-CD2 4.12Å; F757-L761 VanDerWaalsContact O-CB 3.31Å; F757-L761 WeakPolarHBondContact O-CB 3.45Å; F757-L761 PolarHBondContact O-N 2.68Å; F757-A775 WeakPolarHBondContact CE2-O 3.48Å; F757-H777 HydrophobicContact CD2-CB 3.97Å; F757-H777 HydrophobicContact CE2-CB 3.93Å; F757-V780 HydrophobicContact CB-CG1 4.22Å; F757-V780 HydrophobicContact CB-CG2 4.13Å; F757-V780 HydrophobicContact CD2-CG2 4.14Å
758	R	95.1	Very high	93.5	Very high	147 Å²	147	60.3 Å²	60.3	56%	0.555	31%	0.31	S	S	*	.	H	α-helix	trans	-62.3	-38.8	175.7	-74.2	-179.9	-177.9	164.3	3.8	112.2	Q754 Q755 L756 T762	Q754-R758 WeakPolarHBondContact O-CG 3.3Å; Q754-R758 PolarHBondContact O-N 3.01Å; Q755-R758 PolarHBondContact O-N 3.13Å; L756-R758 PolarHBondContact O-N 3.04Å; R758-T762 WeakPolarHBondContact O-CB 3.3Å; R758-T762 PolarHBondContact O-N 3.35Å; R758-T762 PolarHBondContact O-OG1 3.35Å
759	Y	96.1	Very high	93.3	Very high	69 Å²	69	60 Å²	60	27%	0.271	31%	0.307	S	S	.	.	H	α-helix	trans	-60.4	-51.9	176.8	169.8	-100.5	0	0	0	111.7	G735 I738 F739 Q755 L756 F757 L761 T762 R763	G735-Y759 WeakPolarHBondContact O-CE1 3.1Å; I738-Y759 WeakPolarHBondContact CG2-OH 3.08Å; F739-Y759 HydrophobicContact CB-CD1 4.06Å; F739-Y759 HydrophobicContact CB-CE1 4.14Å; F739-Y759 AromaticContact CD2-CD1 3.97Å; F739-Y759 HydrophobicContact CD2-CD1 3.97Å; F739-Y759 HydrophobicContact CD2-CD2 4.09Å; F739-Y759 AromaticContact CD2-CG 3.7Å; F739-Y759 HydrophobicContact CD2-CG 3.7Å; F739-Y759 HydrophobicContact CE2-CG 4.33Å; F739-Y759 HydrophobicContact CG-CD1 4.31Å; F739-Y759 HydrophobicContact CG-CG 4.47Å; Q755-Y759 WeakPolarHBondContact O-CB 3.49Å; Q755-Y759 PolarHBondContact O-N 2.88Å; L756-Y759 HydrophobicContact CD1-CD1 4.33Å; L756-Y759 WeakPolarHBondContact O-CB 3.11Å; L756-Y759 PolarHBondContact O-N 2.81Å; F757-Y759 VanDerWaalsContact C-N 3.31Å; F757-Y759 PolarHBondContact O-N 3.34Å; Y759-L761 PolarHBondContact O-N 2.93Å; Y759-T762 PolarHBondContact O-N 3.42Å; Y759-R763 WeakPolarHBondContact O-CG 3.47Å; Y759-R763 PolarHBondContact O-N 3.48Å; Y759-R763 VanDerWaalsContact O-N 3.1Å; Y759-R763 PolarHBondContact OH-NH1 3.45Å
760	L	95.8	Very high	93.3	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-65.4	-39.2	178.8	-63.8	-176.4	0	0	0	112.5	A732 L756 F757 R763 T764 A775 V780	A732-L760 HydrophobicContact CB-CD1 4.47Å; L756-L760 HydrophobicContact CD1-CD1 4.35Å; L756-L760 HydrophobicContact CD1-CG 4.16Å; L756-L760 PolarHBondContact O-N 3.47Å; F757-L760 PolarHBondContact O-N 3.05Å; L760-R763 WeakPolarHBondContact O-CB 3.01Å; L760-R763 PolarHBondContact O-N 2.82Å; L760-T764 PolarHBondContact O-N 3.29Å; L760-T764 PolarHBondContact O-OG1 3.46Å; L760-A775 HydrophobicContact CB-CB 3.93Å; L760-V780 HydrophobicContact CD1-CG2 3.76Å
761	L	94.6	Very high	93.4	Very high	25 Å²	25	56.4 Å²	56.4	13%	0.131	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-44.5	176.8	-174.4	63.9	0	0	0	111.4	V562 F757 Y759 R763 T764 E765	V562-L761 HydrophobicContact CG1-CD1 3.96Å; V562-L761 HydrophobicContact CG2-CD1 4.39Å; F757-L761 HydrophobicContact CE1-CD2 4.21Å; F757-L761 HydrophobicContact CZ-CD2 4.12Å; F757-L761 VanDerWaalsContact O-CB 3.31Å; F757-L761 WeakPolarHBondContact O-CB 3.45Å; F757-L761 PolarHBondContact O-N 2.68Å; Y759-L761 PolarHBondContact O-N 2.93Å; L761-R763 VanDerWaalsContact C-N 3.29Å; L761-R763 PolarHBondContact O-N 2.96Å; L761-T764 WeakPolarHBondContact O-CA 3.26Å; L761-T764 WeakPolarHBondContact O-CB 3.18Å; L761-T764 PolarHBondContact O-N 2.98Å; L761-E765 HydrophobicContact CG-CG 4.45Å; L761-E765 WeakPolarHBondContact O-CG 3.35Å; L761-E765 PolarHBondContact O-N 2.82Å
762	T	94.9	Very high	93.2	Very high	56 Å²	56	52 Å²	52	34%	0.344	27%	0.27	S	S	.	.	H	α-helix	trans	-61.3	-38.1	177.1	-56.8	0	0	0	0	111.5	R758 Y759 T764 E765 K766	R758-T762 WeakPolarHBondContact O-CB 3.3Å; R758-T762 PolarHBondContact O-N 3.35Å; R758-T762 PolarHBondContact O-OG1 3.35Å; Y759-T762 PolarHBondContact O-N 3.42Å; T762-T764 VanDerWaalsContact C-N 3.31Å; T762-E765 PolarHBondContact O-N 2.81Å; T762-K766 HydrophobicContact CG2-CD 3.95Å; T762-K766 HydrophobicContact CG2-CG 4.39Å; T762-K766 WeakPolarHBondContact O-CB 3.3Å; T762-K766 VanDerWaalsContact O-CG 3.28Å; T762-K766 WeakPolarHBondContact O-CG 3.29Å; T762-K766 PolarHBondContact O-N 3.1Å
763	R	94	Very high	93.1	Very high	49 Å²	49	51.9 Å²	51.9	19%	0.185	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-39.9	174.2	-73.1	176.6	61.7	137.8	1.3	111.8	Y759 L760 L761 G767 V768 A769	Y759-R763 WeakPolarHBondContact O-CG 3.47Å; Y759-R763 PolarHBondContact O-N 3.48Å; Y759-R763 VanDerWaalsContact O-N 3.1Å; Y759-R763 PolarHBondContact OH-NH1 3.45Å; L760-R763 WeakPolarHBondContact O-CB 3.01Å; L760-R763 PolarHBondContact O-N 2.82Å; L761-R763 VanDerWaalsContact C-N 3.29Å; L761-R763 PolarHBondContact O-N 2.96Å; R763-G767 PolarHBondContact O-N 3.37Å; R763-V768 HydrophobicContact CB-CB 4.37Å; R763-V768 PolarHBondContact O-N 3.02Å; R763-A769 HydrophobicContact CB-CB 4.48Å; R763-A769 PolarHBondContact O-N 2.94Å
764	T	92.3	Very high	93.1	Very high	18 Å²	18	51.5 Å²	51.5	11%	0.11	27%	0.267	C	S	.	.	H	α-helix	trans	-67.5	-48.1	177	-60.3	0	0	0	0	111.6	V562 L760 L761 T762 K766 G767 G772 A775	V562-T764 HydrophobicContact CG2-CG2 3.93Å; L760-T764 PolarHBondContact O-N 3.29Å; L760-T764 PolarHBondContact O-OG1 3.46Å; L761-T764 WeakPolarHBondContact O-CA 3.26Å; L761-T764 WeakPolarHBondContact O-CB 3.18Å; L761-T764 PolarHBondContact O-N 2.98Å; T762-T764 VanDerWaalsContact C-N 3.31Å; T764-K766 VanDerWaalsContact C-N 3.27Å; T764-K766 PolarHBondContact O-N 3.41Å; T764-G767 PolarHBondContact O-N 3.29Å; T764-G772 VanDerWaalsContact CG2-CA 3.47Å; T764-A775 WeakPolarHBondContact OG1-CB 3.34Å
765	E	91.2	Very high	93.1	Very high	133 Å²	133	46.9 Å²	46.9	62%	0.621	25%	0.246	S	C	*	.	H	α-helix	trans	-63.3	-32.5	180	-70.6	174.8	165.3	0	0	112.6	L761 T762 G767	L761-E765 HydrophobicContact CG-CG 4.45Å; L761-E765 WeakPolarHBondContact O-CG 3.35Å; L761-E765 PolarHBondContact O-N 2.82Å; T762-E765 PolarHBondContact O-N 2.81Å; E765-G767 VanDerWaalsContact C-N 3.3Å
766	K	91.5	Very high	93	Very high	159 Å²	159	43.8 Å²	43.8	69%	0.691	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-1.1	175	-69.1	-178.8	179.4	-177.9	0	114.1	T762 T764 V768	T762-K766 HydrophobicContact CG2-CD 3.95Å; T762-K766 HydrophobicContact CG2-CG 4.39Å; T762-K766 WeakPolarHBondContact O-CB 3.3Å; T762-K766 VanDerWaalsContact O-CG 3.28Å; T762-K766 WeakPolarHBondContact O-CG 3.29Å; T762-K766 PolarHBondContact O-N 3.1Å; T764-K766 VanDerWaalsContact C-N 3.27Å; T764-K766 PolarHBondContact O-N 3.41Å; K766-V768 HydrophobicContact CB-CG2 4.04Å; K766-V768 PolarHBondContact O-N 3.4Å
767	G	87.9	Confident	92.8	Very high	62 Å²	62	45.1 Å²	45.1	64%	0.639	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.1	20.2	-177.6	0	0	0	0	0	114.6	R763 T764 E765	R763-G767 PolarHBondContact O-N 3.37Å; T764-G767 PolarHBondContact O-N 3.29Å; E765-G767 VanDerWaalsContact C-N 3.3Å
768	V	90.6	Very high	92.5	Very high	91 Å²	91	45.8 Å²	45.8	55%	0.552	24%	0.24	S	C	*	.			trans	-81.7	-32	175.8	179.6	0	0	0	0	111	R763 K766	R763-V768 HydrophobicContact CB-CB 4.37Å; R763-V768 PolarHBondContact O-N 3.02Å; K766-V768 HydrophobicContact CB-CG2 4.04Å; K766-V768 PolarHBondContact O-N 3.4Å
769	A	90.5	Very high	92.4	Very high	15 Å²	15	39 Å²	39	12%	0.124	21%	0.214	C	C	.	.			trans	-75	131	174.4	0	0	0	0	0	110.2	R763 Y771	R763-A769 HydrophobicContact CB-CB 4.48Å; R763-A769 PolarHBondContact O-N 2.94Å; A769-Y771 VanDerWaalsContact C-N 3.32Å
770	A	90.9	Very high	92.4	Very high	47 Å²	47	35.8 Å²	35.8	39%	0.388	20%	0.202	S	C	.	.	S	Bend	trans	-67.8	-36.8	173.3	0	0	0	0	0	110	R496 E731	R496-A770 PolarHBondContact NH1-O 3.1Å; R496-A770 PolarHBondContact NH2-O 3.15Å; E731-A770 WeakPolarHBondContact OE1-CB 3.42Å; E731-A770 PolarHBondContact OE1-N 3.31Å
771	Y	92.8	Very high	92.2	Very high	21 Å²	21	40 Å²	40	8%	0.082	22%	0.22	C	C	.	.			trans	-117.8	108.6	-177.9	-56.2	-91.3	0	0	0	110.1	P728 E731 A769 E773 S774	P728-Y771 HydrophobicContact CB-CG 4.36Å; P728-Y771 HydrophobicContact CG-CD1 3.86Å; P728-Y771 HydrophobicContact CG-CG 3.99Å; E731-Y771 WeakPolarHBondContact OE2-CA 3.47Å; E731-Y771 WeakPolarHBondContact OE2-CB 3.33Å; E731-Y771 PolarHBondContact OE2-N 3.41Å; E731-Y771 VanDerWaalsContact OE2-O 3.08Å; A769-Y771 VanDerWaalsContact C-N 3.32Å; Y771-E773 PolarHBondContact O-N 3.43Å; Y771-S774 VanDerWaalsContact O-CB 3.29Å; Y771-S774 WeakPolarHBondContact O-CB 3.48Å; Y771-S774 PolarHBondContact O-N 3.24Å; Y771-S774 PolarHBondContact O-OG 2.94Å
772	G	90	Very high	92.1	Very high	4 Å²	4	39.4 Å²	39.4	4%	0.041	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-67.7	-22.7	-174.7	0	0	0	0	0	113.2	F566 T764 S774	F566-G772 WeakPolarHBondContact CE1-O 3.49Å; T764-G772 VanDerWaalsContact CG2-CA 3.47Å; G772-S774 VanDerWaalsContact C-N 3.25Å; G772-S774 PolarHBondContact O-N 3.31Å
773	E	92	Very high	92.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-76.6	-4.4	175	69.5	-79.4	-168.4	0	0	114.2	N569 P728 Y771 A775 T776	N569-E773 HydrophobicContact CB-CB 3.75Å; N569-E773 HydrophobicContact CB-CG 4.19Å; P728-E773 HydrophobicContact CB-CG 3.77Å; P728-E773 HydrophobicContact CG-CG 3.91Å; P728-E773 VanDerWaalsContact CG-OE1 3.27Å; P728-E773 WeakPolarHBondContact CG-OE1 3.42Å; Y771-E773 PolarHBondContact O-N 3.43Å; E773-A775 VanDerWaalsContact C-N 3.25Å; E773-A775 PolarHBondContact O-N 3.28Å; E773-T776 WeakPolarHBondContact O-CG2 3.34Å
774	S	94.3	Very high	92.2	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.021	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-69.1	-22.8	171.5	67.8	0	0	0	0	112.7	P728 E731 A732 Y771 G772 T776	P728-S774 WeakPolarHBondContact O-CA 3.34Å; P728-S774 WeakPolarHBondContact O-CB 3.43Å; E731-S774 PolarHBondContact OE2-OG 3.18Å; E731-S774 VanDerWaalsContact OE2-OG 3.06Å; A732-S774 VanDerWaalsContact CB-O 3.26Å; A732-S774 WeakPolarHBondContact CB-O 3.22Å; Y771-S774 VanDerWaalsContact O-CB 3.29Å; Y771-S774 WeakPolarHBondContact O-CB 3.48Å; Y771-S774 PolarHBondContact O-N 3.24Å; Y771-S774 PolarHBondContact O-OG 2.94Å; G772-S774 VanDerWaalsContact C-N 3.25Å; G772-S774 PolarHBondContact O-N 3.31Å; S774-T776 VanDerWaalsContact C-N 3.31Å; S774-T776 PolarHBondContact O-N 3.28Å
775	A	94.2	Very high	92.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-87.6	21.2	-176.5	0	0	0	0	0	114.8	F566 F757 L760 T764 E773	F566-A775 HydrophobicContact CZ-CB 4.47Å; F566-A775 WeakPolarHBondContact CZ-O 3.48Å; F757-A775 WeakPolarHBondContact CE2-O 3.48Å; L760-A775 HydrophobicContact CB-CB 3.93Å; T764-A775 WeakPolarHBondContact OG1-CB 3.34Å; E773-A775 VanDerWaalsContact C-N 3.25Å; E773-A775 PolarHBondContact O-N 3.28Å
776	T	92.5	Very high	92.4	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.006	18%	0.176	C	C	.	.			trans	-72.2	141.7	179.1	64.2	0	0	0	0	111.9	F566 E773 S774 Y778 L779 V780	F566-T776 HydrophobicContact CD1-CG2 3.71Å; F566-T776 HydrophobicContact CD2-CG2 4.26Å; F566-T776 HydrophobicContact CE1-CG2 3.66Å; F566-T776 HydrophobicContact CE2-CG2 4.22Å; F566-T776 HydrophobicContact CG-CG2 4.02Å; F566-T776 HydrophobicContact CZ-CG2 3.94Å; E773-T776 WeakPolarHBondContact O-CG2 3.34Å; S774-T776 VanDerWaalsContact C-N 3.31Å; S774-T776 PolarHBondContact O-N 3.28Å; T776-Y778 PolarHBondContact O-N 3.16Å; T776-Y778 VanDerWaalsContact O-N 3.11Å; T776-L779 PolarHBondContact O-N 3.36Å; T776-L779 VanDerWaalsContact O-N 3.15Å; T776-L779 WeakPolarHBondContact OG1-CD1 3.39Å; T776-L779 VanDerWaalsContact OG1-CG 3.27Å; T776-L779 WeakPolarHBondContact OG1-CG 3.42Å; T776-L779 PolarHBondContact OG1-N 3.09Å; T776-V780 PolarHBondContact O-N 3.14Å
777	H	91.1	Very high	92.6	Very high	30 Å²	30	24.8 Å²	24.8	14%	0.139	14%	0.144	C	C	.	.	H	α-helix	trans	-62	-20.6	176	-171.9	65	0	0	0	113.6	Q367 F757 K781	Q367-H777 WeakPolarHBondContact O-CB 3.24Å; Q367-H777 PolarHBondContact O-N 3.01Å; Q367-H777 VanDerWaalsContact O-N 3.1Å; F757-H777 HydrophobicContact CD2-CB 3.97Å; F757-H777 HydrophobicContact CE2-CB 3.93Å; H777-K781 WeakPolarHBondContact NE2-CE 3.41Å; H777-K781 PolarHBondContact NE2-NZ 3.18Å; H777-K781 PolarHBondContact O-N 3.42Å
778	Y	90.3	Very high	92.9	Very high	28 Å²	28	24.2 Å²	24.2	11%	0.11	12%	0.124	C	C	.	.	H	α-helix	trans	-66.5	-53.4	171.9	171.6	-96.7	0	0	0	111.4	K322 T776 V780 K781 N782	K322-Y778 HydrophobicContact CD-CE1 4.47Å; T776-Y778 PolarHBondContact O-N 3.16Å; T776-Y778 VanDerWaalsContact O-N 3.11Å; Y778-V780 VanDerWaalsContact C-N 3.31Å; Y778-V780 PolarHBondContact O-N 3.3Å; Y778-K781 PolarHBondContact O-N 3.11Å; Y778-K781 VanDerWaalsContact O-N 3.17Å; Y778-N782 VanDerWaalsContact CE1-ND2 3.29Å; Y778-N782 WeakPolarHBondContact CE1-ND2 3.3Å; Y778-N782 PolarHBondContact O-N 3.05Å; Y778-N782 VanDerWaalsContact O-N 3.12Å; Y778-N782 PolarHBondContact OH-ND2 3.43Å
779	L	93.5	Very high	92.9	Very high	5 Å²	5	23.3 Å²	23.3	3%	0.026	11%	0.113	C	C	.	.	H	α-helix	trans	-58.8	-44.5	178.7	-70.6	173.1	0	0	0	110.8	E631 V729 A732 T776 K781 N782 T783	E631-L779 WeakPolarHBondContact OE1-CD2 3.27Å; E631-L779 WeakPolarHBondContact OE2-CD2 3.47Å; V729-L779 HydrophobicContact CG1-CD2 4.31Å; V729-L779 HydrophobicContact CG2-CD2 4.06Å; A732-L779 HydrophobicContact CB-CB 4.05Å; A732-L779 HydrophobicContact CB-CD1 4.03Å; T776-L779 PolarHBondContact O-N 3.36Å; T776-L779 VanDerWaalsContact O-N 3.15Å; T776-L779 WeakPolarHBondContact OG1-CD1 3.39Å; T776-L779 VanDerWaalsContact OG1-CG 3.27Å; T776-L779 WeakPolarHBondContact OG1-CG 3.42Å; T776-L779 PolarHBondContact OG1-N 3.09Å; L779-K781 VanDerWaalsContact C-N 3.31Å; L779-K781 PolarHBondContact O-N 2.98Å; L779-N782 PolarHBondContact O-N 2.92Å; L779-N782 VanDerWaalsContact O-N 3.09Å; L779-T783 PolarHBondContact O-N 3.25Å; L779-T783 PolarHBondContact O-OG1 3.36Å
780	V	94.8	Very high	93	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-53.5	-46.9	176.7	173.4	0	0	0	0	112.2	T753 L756 F757 L760 T776 Y778 N782 T783 V784	T753-V780 HydrophobicContact CG2-CG1 3.85Å; T753-V780 WeakPolarHBondContact O-CG1 3.49Å; L756-V780 HydrophobicContact CB-CG1 4.25Å; L756-V780 HydrophobicContact CD2-CG1 3.93Å; L756-V780 HydrophobicContact CG-CG1 3.95Å; F757-V780 HydrophobicContact CB-CG1 4.22Å; F757-V780 HydrophobicContact CB-CG2 4.13Å; F757-V780 HydrophobicContact CD2-CG2 4.14Å; L760-V780 HydrophobicContact CD1-CG2 3.76Å; T776-V780 PolarHBondContact O-N 3.14Å; Y778-V780 VanDerWaalsContact C-N 3.31Å; Y778-V780 PolarHBondContact O-N 3.3Å; V780-N782 PolarHBondContact O-N 3.47Å; V780-T783 PolarHBondContact O-N 2.99Å; V780-V784 VanDerWaalsContact O-CG2 3.31Å; V780-V784 WeakPolarHBondContact O-CG2 3.47Å; V780-V784 PolarHBondContact O-N 3.27Å
781	K	92.6	Very high	93	Very high	93 Å²	93	20.8 Å²	20.8	40%	0.404	9%	0.094	S	C	.	.	H	α-helix	trans	-64.2	-41	179.1	-81	178.5	164	159	0	112.4	T753 H777 Y778 L779 R785	T753-K781 HydrophobicContact CG2-CG 4.12Å; H777-K781 WeakPolarHBondContact NE2-CE 3.41Å; H777-K781 PolarHBondContact NE2-NZ 3.18Å; H777-K781 PolarHBondContact O-N 3.42Å; Y778-K781 PolarHBondContact O-N 3.11Å; Y778-K781 VanDerWaalsContact O-N 3.17Å; L779-K781 VanDerWaalsContact C-N 3.31Å; L779-K781 PolarHBondContact O-N 2.98Å; K781-R785 WeakPolarHBondContact O-CB 3.28Å; K781-R785 PolarHBondContact O-N 2.97Å
782	N	93.3	Very high	93	Very high	13 Å²	13	19.8 Å²	19.8	7%	0.07	9%	0.09	C	C	.	.	H	α-helix	trans	-69.1	-36.7	177.8	-77.4	-0.7	0	0	0	112.2	N630 E631 Y778 L779 V780 R785 T786	N630-N782 PolarHBondContact O-ND2 3.26Å; E631-N782 WeakPolarHBondContact OE1-CB 3.37Å; E631-N782 PolarHBondContact OE1-ND2 2.92Å; Y778-N782 VanDerWaalsContact CE1-ND2 3.29Å; Y778-N782 WeakPolarHBondContact CE1-ND2 3.3Å; Y778-N782 PolarHBondContact O-N 3.05Å; Y778-N782 VanDerWaalsContact O-N 3.12Å; Y778-N782 PolarHBondContact OH-ND2 3.43Å; L779-N782 PolarHBondContact O-N 2.92Å; L779-N782 VanDerWaalsContact O-N 3.09Å; V780-N782 PolarHBondContact O-N 3.47Å; N782-R785 PolarHBondContact O-N 2.97Å; N782-T786 WeakPolarHBondContact O-CB 3.2Å; N782-T786 PolarHBondContact O-N 3.37Å; N782-T786 PolarHBondContact O-OG1 3.24Å
783	T	95	Very high	93.1	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.006	9%	0.089	C	C	.	.	H	α-helix	trans	-65.4	-46.9	175	-51.5	0	0	0	0	111.4	Y733 A736 L779 V780 R785 T786 F787	Y733-T783 HydrophobicContact CD1-CG2 3.96Å; Y733-T783 HydrophobicContact CD2-CG2 4.29Å; Y733-T783 VanDerWaalsContact CD2-OG1 3.3Å; Y733-T783 WeakPolarHBondContact CD2-OG1 3.4Å; Y733-T783 HydrophobicContact CE1-CG2 4.28Å; Y733-T783 VanDerWaalsContact CE2-OG1 3.28Å; Y733-T783 WeakPolarHBondContact CE2-OG1 3.47Å; Y733-T783 HydrophobicContact CG-CG2 4.01Å; A736-T783 HydrophobicContact CB-CG2 3.26Å; L779-T783 PolarHBondContact O-N 3.25Å; L779-T783 PolarHBondContact O-OG1 3.36Å; V780-T783 PolarHBondContact O-N 2.99Å; T783-R785 VanDerWaalsContact C-N 3.29Å; T783-R785 PolarHBondContact O-N 3.35Å; T783-T786 PolarHBondContact O-N 3.41Å; T783-F787 HydrophobicContact CG2-CD1 4.2Å; T783-F787 HydrophobicContact CG2-CD2 4.48Å; T783-F787 HydrophobicContact CG2-CE1 3.91Å; T783-F787 HydrophobicContact CG2-CE2 4.21Å; T783-F787 HydrophobicContact CG2-CG 4.48Å; T783-F787 HydrophobicContact CG2-CZ 3.92Å; T783-F787 WeakPolarHBondContact O-CB 3.36Å; T783-F787 WeakPolarHBondContact O-CG 3.44Å; T783-F787 PolarHBondContact O-N 3.35Å
784	V	94.9	Very high	93.1	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.018	12%	0.115	C	C	.	.	H	α-helix	trans	-57.2	-46.1	174.6	174.7	0	0	0	0	110.3	Y752 L756 V780 F787 K788 L793	Y752-V784 HydrophobicContact CD1-CG2 4.06Å; Y752-V784 HydrophobicContact CE1-CG2 3.99Å; L756-V784 HydrophobicContact CD2-CG2 4.01Å; V780-V784 VanDerWaalsContact O-CG2 3.31Å; V780-V784 WeakPolarHBondContact O-CG2 3.47Å; V780-V784 PolarHBondContact O-N 3.27Å; V784-F787 PolarHBondContact O-N 3.33Å; V784-K788 WeakPolarHBondContact O-CG 3.22Å; V784-K788 PolarHBondContact O-N 3.27Å; V784-L793 HydrophobicContact CG1-CD1 4.47Å
785	R	93.6	Very high	92.9	Very high	102 Å²	102	29.4 Å²	29.4	39%	0.385	13%	0.132	S	C	.	.	H	α-helix	trans	-60	-46.9	176.7	-178.4	178.8	177.4	173.3	-0.9	112.3	N630 K781 N782 T783 F787 K788 E789	N630-R785 PolarHBondContact OD1-NE 2.86Å; K781-R785 WeakPolarHBondContact O-CB 3.28Å; K781-R785 PolarHBondContact O-N 2.97Å; N782-R785 PolarHBondContact O-N 2.97Å; T783-R785 VanDerWaalsContact C-N 3.29Å; T783-R785 PolarHBondContact O-N 3.35Å; R785-F787 VanDerWaalsContact C-N 3.33Å; R785-F787 PolarHBondContact O-N 3.16Å; R785-K788 WeakPolarHBondContact O-CB 3.25Å; R785-K788 PolarHBondContact O-N 3.48Å; R785-E789 IonicContact CZ-OE1 2.86Å; R785-E789 IonicContact NE-OE1 3.9Å; R785-E789 PolarHBondContact NE-OE1 2.82Å; R785-E789 IonicContact NH2-OE1 2.75Å; R785-E789 PolarHBondContact NH2-OE1 3.5Å; R785-E789 WeakPolarHBondContact O-CG 3.39Å; R785-E789 PolarHBondContact O-N 3.39Å
786	T	94.3	Very high	92.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-39.8	-179.7	-53.9	0	0	0	0	111	L423 F627 N630 Y733 N782 T783 K788 E789 L790	L423-T786 HydrophobicContact CD2-CG2 3.77Å; F627-T786 WeakPolarHBondContact O-CG2 3.34Å; N630-T786 PolarHBondContact ND2-OG1 2.75Å; N630-T786 VanDerWaalsContact ND2-OG1 3.12Å; Y733-T786 HydrophobicContact CE1-CG2 3.9Å; Y733-T786 PolarHBondContact OH-OG1 3.19Å; N782-T786 WeakPolarHBondContact O-CB 3.2Å; N782-T786 PolarHBondContact O-N 3.37Å; N782-T786 PolarHBondContact O-OG1 3.24Å; T783-T786 PolarHBondContact O-N 3.41Å; T786-K788 VanDerWaalsContact C-N 3.32Å; T786-K788 PolarHBondContact O-N 2.98Å; T786-E789 PolarHBondContact O-N 3.48Å; T786-L790 VanDerWaalsContact O-CB 3.25Å; T786-L790 WeakPolarHBondContact O-CB 3.41Å; T786-L790 PolarHBondContact O-N 2.91Å
787	F	95.4	Very high	92.1	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.009	19%	0.189	C	C	.	.	H	α-helix	trans	-68.4	-30.2	176.8	-78.3	15.1	0	0	0	112.5	Y733 A736 A737 V740 T783 V784 R785 G791 V792 L793 L819	Y733-F787 HydrophobicContact CD1-CE1 4.24Å; A736-F787 HydrophobicContact CB-CE2 3.84Å; A736-F787 HydrophobicContact CB-CZ 4.06Å; A737-F787 HydrophobicContact CB-CE2 4.49Å; A737-F787 HydrophobicContact CB-CZ 4.1Å; V740-F787 HydrophobicContact CG2-CD2 3.76Å; V740-F787 HydrophobicContact CG2-CE2 3.68Å; T783-F787 HydrophobicContact CG2-CD1 4.2Å; T783-F787 HydrophobicContact CG2-CD2 4.48Å; T783-F787 HydrophobicContact CG2-CE1 3.91Å; T783-F787 HydrophobicContact CG2-CE2 4.21Å; T783-F787 HydrophobicContact CG2-CG 4.48Å; T783-F787 HydrophobicContact CG2-CZ 3.92Å; T783-F787 WeakPolarHBondContact O-CB 3.36Å; T783-F787 WeakPolarHBondContact O-CG 3.44Å; T783-F787 PolarHBondContact O-N 3.35Å; V784-F787 PolarHBondContact O-N 3.33Å; R785-F787 VanDerWaalsContact C-N 3.33Å; R785-F787 PolarHBondContact O-N 3.16Å; F787-G791 PolarHBondContact O-N 3.12Å; F787-V792 HydrophobicContact CB-CB 4.05Å; F787-V792 HydrophobicContact CD2-CG1 4.24Å; F787-V792 HydrophobicContact CG-CB 4.33Å; F787-V792 HydrophobicContact CG-CG1 4.48Å; F787-V792 WeakPolarHBondContact O-CA 3.07Å; F787-V792 WeakPolarHBondContact O-CB 3.35Å; F787-V792 PolarHBondContact O-N 3.46Å; F787-L793 HydrophobicContact CB-CD1 3.75Å; F787-L793 HydrophobicContact CB-CG 3.98Å; F787-L793 HydrophobicContact CD2-CD1 4.44Å; F787-L793 PolarHBondContact O-N 3.45Å; F787-L793 VanDerWaalsContact O-N 3.09Å; F787-L819 HydrophobicContact CE1-CD2 4.46Å; F787-L819 HydrophobicContact CZ-CD2 4.25Å
788	K	93.3	Very high	91.7	Very high	49 Å²	49	47.4 Å²	47.4	21%	0.213	20%	0.202	C	C	.	.	H	α-helix	trans	-67	-47.4	168.2	-69.6	-164.7	-63.7	179.1	0	111.8	E749 V784 R785 T786 L790 G791 L793 E795	E749-K788 IonicContact OE1-NZ 3.18Å; E749-K788 PolarHBondContact OE1-NZ 2.96Å; E749-K788 VanDerWaalsContact OE1-NZ 3.1Å; E749-K788 IonicContact OE2-NZ 3.91Å; E749-K788 PolarHBondContact OE2-NZ 3.21Å; V784-K788 WeakPolarHBondContact O-CG 3.22Å; V784-K788 PolarHBondContact O-N 3.27Å; R785-K788 WeakPolarHBondContact O-CB 3.25Å; R785-K788 PolarHBondContact O-N 3.48Å; T786-K788 VanDerWaalsContact C-N 3.32Å; T786-K788 PolarHBondContact O-N 2.98Å; K788-L790 VanDerWaalsContact C-N 3.31Å; K788-L790 PolarHBondContact O-N 3.01Å; K788-G791 PolarHBondContact O-N 2.81Å; K788-G791 VanDerWaalsContact O-N 3.13Å; K788-L793 WeakPolarHBondContact CA-O 3.44Å; K788-L793 HydrophobicContact CG-CB 3.93Å; K788-E795 HydrophobicContact CD-CB 4.42Å; K788-E795 IonicContact NZ-OE2 2.66Å; K788-E795 PolarHBondContact NZ-OE2 3.37Å
789	E	92.3	Very high	91	Very high	72 Å²	72	53.4 Å²	53.4	34%	0.336	24%	0.236	S	C	.	.	H	α-helix	trans	-67.3	-29.4	-179.5	-70.7	171.9	-176	0	0	113.2	L423 E424 N630 R785 T786 G791	L423-E789 HydrophobicContact CB-CB 4.3Å; L423-E789 HydrophobicContact CD2-CB 4.07Å; E424-E789 PolarHBondContact N-O 3.3Å; N630-E789 PolarHBondContact ND2-OE2 3.43Å; R785-E789 IonicContact CZ-OE1 2.86Å; R785-E789 IonicContact NE-OE1 3.9Å; R785-E789 PolarHBondContact NE-OE1 2.82Å; R785-E789 IonicContact NH2-OE1 2.75Å; R785-E789 PolarHBondContact NH2-OE1 3.5Å; R785-E789 WeakPolarHBondContact O-CG 3.39Å; R785-E789 PolarHBondContact O-N 3.39Å; T786-E789 PolarHBondContact O-N 3.48Å; E789-G791 VanDerWaalsContact C-N 3.28Å
790	L	91.7	Very high	90	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-11.2	174.7	-171.8	61.7	0	0	0	112.8	L423 L427 V428 I431 F627 T786 K788 V792 L819	L423-L790 HydrophobicContact CD2-CB 4.09Å; L423-L790 HydrophobicContact CD2-CD1 4.45Å; L423-L790 HydrophobicContact CG-CD1 4.19Å; L427-L790 HydrophobicContact CB-CD1 3.77Å; L427-L790 HydrophobicContact CD1-CD1 4.25Å; V428-L790 HydrophobicContact CG2-CD1 4.06Å; I431-L790 HydrophobicContact CD1-CD1 4.01Å; I431-L790 HydrophobicContact CD1-CD2 3.99Å; F627-L790 HydrophobicContact CE2-CD2 4.18Å; T786-L790 VanDerWaalsContact O-CB 3.25Å; T786-L790 WeakPolarHBondContact O-CB 3.41Å; T786-L790 PolarHBondContact O-N 2.91Å; K788-L790 VanDerWaalsContact C-N 3.31Å; K788-L790 PolarHBondContact O-N 3.01Å; L790-V792 HydrophobicContact CB-CG2 4.24Å; L790-V792 HydrophobicContact CD2-CG2 3.84Å; L790-V792 HydrophobicContact CG-CG2 4.08Å; L790-L819 HydrophobicContact CD2-CD1 3.79Å
791	G	90.7	Very high	89.4	Confident	10 Å²	10	65.5 Å²	65.5	10%	0.103	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	16.7	-176.2	0	0	0	0	0	114.3	F787 K788 E789 S807 F810	F787-G791 PolarHBondContact O-N 3.12Å; K788-G791 PolarHBondContact O-N 2.81Å; K788-G791 VanDerWaalsContact O-N 3.13Å; E789-G791 VanDerWaalsContact C-N 3.28Å; G791-S807 WeakPolarHBondContact O-CB 3.44Å; G791-S807 PolarHBondContact O-OG 3.45Å; G791-F810 WeakPolarHBondContact O-CD2 3.49Å
792	V	92.4	Very high	89.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	29%	0.285	C	S	.	.	S	Bend	trans	-72.9	-42.9	171.9	-179.6	0	0	0	0	110.6	V740 F787 L790 S807 F810 L819	V740-V792 HydrophobicContact CG1-CG1 4.16Å; F787-V792 HydrophobicContact CB-CB 4.05Å; F787-V792 HydrophobicContact CD2-CG1 4.24Å; F787-V792 HydrophobicContact CG-CB 4.33Å; F787-V792 HydrophobicContact CG-CG1 4.48Å; F787-V792 WeakPolarHBondContact O-CA 3.07Å; F787-V792 WeakPolarHBondContact O-CB 3.35Å; F787-V792 PolarHBondContact O-N 3.46Å; L790-V792 HydrophobicContact CB-CG2 4.24Å; L790-V792 HydrophobicContact CD2-CG2 3.84Å; L790-V792 HydrophobicContact CG-CG2 4.08Å; V792-S807 PolarHBondContact O-N 3.08Å; V792-F810 HydrophobicContact CB-CD2 4.21Å; V792-F810 HydrophobicContact CB-CE2 4.46Å; V792-F810 HydrophobicContact CB-CG 4.3Å; V792-F810 HydrophobicContact CG1-CB 4.32Å; V792-F810 HydrophobicContact CG1-CD1 4.43Å; V792-F810 HydrophobicContact CG1-CG 4.2Å; V792-F810 HydrophobicContact CG2-CD1 4.18Å; V792-F810 HydrophobicContact CG2-CD2 3.97Å; V792-F810 HydrophobicContact CG2-CE1 4.01Å; V792-F810 HydrophobicContact CG2-CE2 3.76Å; V792-F810 HydrophobicContact CG2-CG 4.15Å; V792-F810 HydrophobicContact CG2-CZ 3.78Å; V792-L819 HydrophobicContact CG1-CD2 4.23Å; V792-L819 HydrophobicContact CG2-CD2 3.71Å
793	L	93.3	Very high	89	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.021	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	124.9	-178.7	-64.7	176.5	0	0	0	109.5	L743 Y752 V784 F787 K788 V804 E805	L743-L793 HydrophobicContact CD2-CD2 3.76Å; Y752-L793 HydrophobicContact CE1-CD1 3.91Å; V784-L793 HydrophobicContact CG1-CD1 4.47Å; F787-L793 HydrophobicContact CB-CD1 3.75Å; F787-L793 HydrophobicContact CB-CG 3.98Å; F787-L793 HydrophobicContact CD2-CD1 4.44Å; F787-L793 PolarHBondContact O-N 3.45Å; F787-L793 VanDerWaalsContact O-N 3.09Å; K788-L793 WeakPolarHBondContact CA-O 3.44Å; K788-L793 HydrophobicContact CG-CB 3.93Å; L793-V804 HydrophobicContact CB-CG1 3.64Å; L793-V804 HydrophobicContact CD1-CG1 4.04Å; L793-V804 HydrophobicContact CD2-CG1 3.84Å; L793-V804 HydrophobicContact CG-CG1 4.03Å; L793-E805 CarbonylContact C-O 3.51Å; L793-E805 WeakPolarHBondContact CA-O 3.48Å
794	K	91.9	Very high	88.9	Confident	128 Å²	128	63.1 Å²	63.1	56%	0.557	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.5	175.8	-168.6	175.8	-177.4	177.7	0	110	V804 E805	K794-V804 WeakPolarHBondContact O-CA 3.44Å; K794-E805 HydrophobicContact CB-CG 4.2Å; K794-E805 PolarHBondContact N-O 3.13Å; K794-E805 PolarHBondContact O-N 2.94Å
795	E	89.7	Confident	88.9	Confident	77 Å²	77	64.8 Å²	64.8	36%	0.36	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	126.1	174.8	-177.4	172.6	154.8	0	0	110.1	K788 R797 S802 L803	K788-E795 HydrophobicContact CD-CB 4.42Å; K788-E795 IonicContact NZ-OE2 2.66Å; K788-E795 PolarHBondContact NZ-OE2 3.37Å; E795-R797 IonicContact OE1-NE 2.98Å; E795-R797 PolarHBondContact OE1-NE 3.25Å; E795-R797 IonicContact OE1-NH2 3.21Å; E795-S802 VanDerWaalsContact CD-OG 3.24Å; E795-S802 VanDerWaalsContact CG-OG 3.24Å; E795-S802 WeakPolarHBondContact CG-OG 3.34Å; E795-S802 PolarHBondContact OE1-OG 2.78Å; E795-L803 WeakPolarHBondContact CA-O 3.43Å
796	R	86.9	Confident	88.9	Confident	119 Å²	119	61.1 Å²	61.1	45%	0.449	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.7	170.9	-171.5	-170.4	-64.6	-161.1	2.3	109	E798 L803 E805	R796-E798 WeakPolarHBondContact CD-OE1 3.47Å; R796-E798 HydrophobicContact CG-CG 4.28Å; R796-E798 IonicContact NH1-OE1 3.16Å; R796-E798 PolarHBondContact NH1-OE1 2.84Å; R796-L803 PolarHBondContact N-O 2.82Å; R796-L803 PolarHBondContact O-N 3.42Å; R796-E805 IonicContact CZ-OE1 3.77Å; R796-E805 IonicContact NE-OE1 3.23Å; R796-E805 PolarHBondContact NE-OE1 2.96Å; R796-E805 IonicContact NH2-OE1 2.67Å; R796-E805 PolarHBondContact NH2-OE1 3.28Å; R796-E805 IonicContact NH2-OE2 3.68Å; R796-E805 PolarHBondContact NH2-OE2 2.92Å
797	R	83.5	Confident	88.7	Confident	202 Å²	202	61.7 Å²	61.7	76%	0.762	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	116.8	176.4	-69.5	-175.5	179.5	178.5	1.2	110.3	E795 V801	E795-R797 IonicContact OE1-NE 2.98Å; E795-R797 PolarHBondContact OE1-NE 3.25Å; E795-R797 IonicContact OE1-NH2 3.21Å; R797-V801 WeakPolarHBondContact CA-O 3.39Å
798	E	81.6	Confident	88.4	Confident	87 Å²	87	66.5 Å²	66.5	41%	0.407	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	129.1	173.7	-68.6	-176.8	-175.2	0	0	108.6	R796 H800 V801 L803	R796-E798 WeakPolarHBondContact CD-OE1 3.47Å; R796-E798 HydrophobicContact CG-CG 4.28Å; R796-E798 IonicContact NH1-OE1 3.16Å; R796-E798 PolarHBondContact NH1-OE1 2.84Å; E798-H800 VanDerWaalsContact C-N 3.29Å; E798-H800 PolarHBondContact O-N 3.24Å; E798-H800 VanDerWaalsContact O-N 3.15Å; E798-V801 PolarHBondContact N-O 3.37Å; E798-V801 WeakPolarHBondContact O-CA 3.25Å; E798-V801 PolarHBondContact O-N 3.16Å; E798-L803 HydrophobicContact CB-CD1 4Å; E798-L803 HydrophobicContact CG-CD1 4.09Å; E798-L803 WeakPolarHBondContact OE2-CD1 3.33Å
799	N	75.5	Confident	88.1	Confident	155 Å²	155	66.4 Å²	66.4	83%	0.829	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	42.8	176.7	-59.7	-29.4	0	0	0	114.8	V801	N799-V801 PolarHBondContact O-N 2.78Å
800	H	73.4	Confident	88.1	Confident	193 Å²	193	63 Å²	63	89%	0.894	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	10.6	-175.6	-53.6	-83.5	0	0	0	115.9	E798	E798-H800 VanDerWaalsContact C-N 3.29Å; E798-H800 PolarHBondContact O-N 3.24Å; E798-H800 VanDerWaalsContact O-N 3.15Å
801	V	81.5	Confident	88	Confident	66 Å²	66	68.5 Å²	68.5	40%	0.4	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.7	172.9	-176.3	0	0	0	0	109.3	A748 R797 E798 N799 L803	A748-V801 HydrophobicContact CB-CG1 3.87Å; R797-V801 WeakPolarHBondContact CA-O 3.39Å; E798-V801 PolarHBondContact N-O 3.37Å; E798-V801 WeakPolarHBondContact O-CA 3.25Å; E798-V801 PolarHBondContact O-N 3.16Å; N799-V801 PolarHBondContact O-N 2.78Å; V801-L803 HydrophobicContact CG1-CD2 4.23Å; V801-L803 PolarHBondContact O-N 3.35Å
802	S	87.2	Confident	88	Confident	24 Å²	24	70.8 Å²	70.8	17%	0.168	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	109.3	169.8	175.9	0	0	0	0	108.4	A748 E749 E795	A748-S802 WeakPolarHBondContact CA-O 3.42Å; E749-S802 PolarHBondContact N-O 3.35Å; E749-S802 PolarHBondContact OE2-OG 3.03Å; E795-S802 VanDerWaalsContact CD-OG 3.24Å; E795-S802 VanDerWaalsContact CG-OG 3.24Å; E795-S802 WeakPolarHBondContact CG-OG 3.34Å; E795-S802 PolarHBondContact OE1-OG 2.78Å
803	L	91.8	Very high	87.9	Confident	32 Å²	32	76.5 Å²	76.5	17%	0.168	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	143.8	170.5	-61.1	179.5	0	0	0	109.4	M747 A748 E795 R796 E798 V801	M747-L803 CarbonylContact O-C 3.51Å; M747-L803 WeakPolarHBondContact O-CA 3.13Å; A748-L803 HydrophobicContact CB-CD2 4.33Å; E795-L803 WeakPolarHBondContact CA-O 3.43Å; R796-L803 PolarHBondContact N-O 2.82Å; R796-L803 PolarHBondContact O-N 3.42Å; E798-L803 HydrophobicContact CB-CD1 4Å; E798-L803 HydrophobicContact CG-CD1 4.09Å; E798-L803 WeakPolarHBondContact OE2-CD1 3.33Å; V801-L803 HydrophobicContact CG1-CD2 4.23Å; V801-L803 PolarHBondContact O-N 3.35Å
804	V	92.8	Very high	87.8	Confident	0 Å²	0	79 Å²	79	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.8	179.6	-170.8	0	0	0	0	108.5	P746 M747 E749 L793 K794	P746-V804 WeakPolarHBondContact CA-O 3.36Å; M747-V804 PolarHBondContact N-O 2.94Å; M747-V804 PolarHBondContact O-N 3.05Å; E749-V804 HydrophobicContact CB-CG2 3.54Å; E749-V804 HydrophobicContact CG-CG2 3.98Å; L793-V804 HydrophobicContact CB-CG1 3.64Å; L793-V804 HydrophobicContact CD1-CG1 4.04Å; L793-V804 HydrophobicContact CD2-CG1 3.84Å; L793-V804 HydrophobicContact CG-CG1 4.03Å; K794-V804 WeakPolarHBondContact O-CA 3.44Å
805	E	93.8	Very high	87.8	Confident	38 Å²	38	74.3 Å²	74.3	18%	0.178	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	163.8	175.8	64	-173.9	170.1	0	0	110.7	P746 L793 K794 R796	P746-E805 HydrophobicContact CB-CB 4.22Å; P746-E805 HydrophobicContact CG-CB 4.13Å; L793-E805 CarbonylContact C-O 3.51Å; L793-E805 WeakPolarHBondContact CA-O 3.48Å; K794-E805 HydrophobicContact CB-CG 4.2Å; K794-E805 PolarHBondContact N-O 3.13Å; K794-E805 PolarHBondContact O-N 2.94Å; R796-E805 IonicContact CZ-OE1 3.77Å; R796-E805 IonicContact NE-OE1 3.23Å; R796-E805 PolarHBondContact NE-OE1 2.96Å; R796-E805 IonicContact NH2-OE1 2.67Å; R796-E805 PolarHBondContact NH2-OE1 3.28Å; R796-E805 IonicContact NH2-OE2 3.68Å; R796-E805 PolarHBondContact NH2-OE2 2.92Å
806	L	93	Very high	87.9	Confident	25 Å²	25	72 Å²	72	13%	0.131	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	139.1	172	-75.7	175.2	0	0	0	110.3	V740 L743 L811	V740-L806 HydrophobicContact CG1-CD2 3.46Å; V740-L806 VanDerWaalsContact CG1-CD2 3.46Å; L743-L806 HydrophobicContact CD2-CD2 4.47Å; L743-L806 HydrophobicContact CD2-CG 4.21Å; L743-L806 WeakPolarHBondContact O-CD1 3.49Å; L806-L811 HydrophobicContact CB-CD1 4.15Å; L806-L811 HydrophobicContact CD1-CD1 4.39Å
807	S	91.4	Very high	88.2	Confident	12 Å²	12	69.1 Å²	69.1	8%	0.084	36%	0.363	C	S	.	.			trans	-70.4	159.5	168.9	71	0	0	0	0	111.5	G791 V792 T809 F810 L811	G791-S807 WeakPolarHBondContact O-CB 3.44Å; G791-S807 PolarHBondContact O-OG 3.45Å; V792-S807 PolarHBondContact O-N 3.08Å; S807-T809 PolarHBondContact O-N 3.08Å; S807-F810 CarbonylContact O-C 3.52Å; S807-F810 PolarHBondContact O-N 3.01Å; S807-F810 VanDerWaalsContact O-N 3.13Å; S807-F810 PolarHBondContact OG-N 2.84Å; S807-L811 PolarHBondContact O-N 3.43Å
808	S	88.8	Confident	88.6	Confident	103 Å²	103	63.5 Å²	63.5	72%	0.72	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-55.9	-37.3	174.2	47.6	0	0	0	0	112.1	F810 L811 P812	S808-F810 VanDerWaalsContact C-N 3.34Å; S808-F810 PolarHBondContact O-N 3.3Å; S808-L811 PolarHBondContact O-N 3.16Å; S808-P812 WeakPolarHBondContact O-CD 3.35Å
809	T	88.1	Confident	89.2	Confident	47 Å²	47	59.4 Å²	59.4	29%	0.288	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-64.1	-36.1	178.9	-50.1	0	0	0	0	112.4	I432 S807 N815	I432-T809 HydrophobicContact CD1-CG2 3.3Å; S807-T809 PolarHBondContact O-N 3.08Å; T809-N815 WeakPolarHBondContact O-CB 3.46Å; T809-N815 PolarHBondContact O-ND2 2.96Å
810	F	90.3	Very high	90.1	Very high	1 Å²	1	53.3 Å²	53.3	0%	0.004	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-106	7.2	-178.2	-72.3	-87	0	0	0	113.9	I432 G791 V792 S807 S808 N815 R816 L819	I432-F810 HydrophobicContact CD1-CE1 4.16Å; I432-F810 HydrophobicContact CD1-CE2 4.11Å; I432-F810 HydrophobicContact CD1-CZ 3.79Å; I432-F810 HydrophobicContact CG1-CZ 4.33Å; G791-F810 WeakPolarHBondContact O-CD2 3.49Å; V792-F810 HydrophobicContact CB-CD2 4.21Å; V792-F810 HydrophobicContact CB-CE2 4.46Å; V792-F810 HydrophobicContact CB-CG 4.3Å; V792-F810 HydrophobicContact CG1-CB 4.32Å; V792-F810 HydrophobicContact CG1-CD1 4.43Å; V792-F810 HydrophobicContact CG1-CG 4.2Å; V792-F810 HydrophobicContact CG2-CD1 4.18Å; V792-F810 HydrophobicContact CG2-CD2 3.97Å; V792-F810 HydrophobicContact CG2-CE1 4.01Å; V792-F810 HydrophobicContact CG2-CE2 3.76Å; V792-F810 HydrophobicContact CG2-CG 4.15Å; V792-F810 HydrophobicContact CG2-CZ 3.78Å; S807-F810 CarbonylContact O-C 3.52Å; S807-F810 PolarHBondContact O-N 3.01Å; S807-F810 VanDerWaalsContact O-N 3.13Å; S807-F810 PolarHBondContact OG-N 2.84Å; S808-F810 VanDerWaalsContact C-N 3.34Å; S808-F810 PolarHBondContact O-N 3.3Å; F810-N815 HydrophobicContact CD1-CB 4.26Å; F810-R816 HydrophobicContact CB-CG 4.45Å; F810-R816 WeakPolarHBondContact O-CG 2.89Å; F810-R816 PolarHBondContact O-NH1 3.1Å; F810-L819 HydrophobicContact CE1-CB 4.05Å; F810-L819 HydrophobicContact CE1-CD2 4.26Å
811	L	89.6	Confident	91	Very high	115 Å²	115	50.4 Å²	50.4	60%	0.602	28%	0.279	S	S	*	.	S	Bend	trans	-64.7	-37.5	170.1	-159.3	75.3	0	0	0	112.7	L806 S807 S808 Q813 R816	L806-L811 HydrophobicContact CB-CD1 4.15Å; L806-L811 HydrophobicContact CD1-CD1 4.39Å; S807-L811 PolarHBondContact O-N 3.43Å; S808-L811 PolarHBondContact O-N 3.16Å; L811-Q813 PolarHBondContact O-N 3.49Å; L811-R816 VanDerWaalsContact C-NH1 3.3Å; L811-R816 PolarHBondContact O-NH1 3.08Å
812	P	91	Very high	91.5	Very high	59 Å²	59	48.4 Å²	48.4	38%	0.383	26%	0.264	S	S	.	.	S	Bend	trans	-65.7	132.4	170.5	-21	34.1	0	0	0	111.7	S808 A814 N815 R816	S808-P812 WeakPolarHBondContact O-CD 3.35Å; P812-A814 PolarHBondContact O-N 2.83Å; P812-N815 PolarHBondContact O-N 2.98Å; P812-R816 PolarHBondContact O-N 3.23Å
813	Q	90.8	Very high	91.9	Very high	119 Å²	119	47.3 Å²	47.3	56%	0.556	26%	0.256	S	S	*	.	H	α-helix	trans	-60.1	-33.2	177.2	-175.5	175	-6.5	0	0	112.4	L811 N815 R816 N817	L811-Q813 PolarHBondContact O-N 3.49Å; Q813-N815 VanDerWaalsContact C-N 3.35Å; Q813-N815 PolarHBondContact O-N 2.74Å; Q813-R816 PolarHBondContact O-N 2.94Å; Q813-N817 PolarHBondContact O-N 2.87Å
814	A	90.8	Very high	91.9	Very high	57 Å²	57	48.3 Å²	48.3	47%	0.471	26%	0.262	S	S	.	.	H	α-helix	trans	-57.2	-45.1	176.8	0	0	0	0	0	112.3	P812 R816 N817 K818	P812-A814 PolarHBondContact O-N 2.83Å; A814-R816 VanDerWaalsContact C-N 3.35Å; A814-R816 PolarHBondContact O-N 3.31Å; A814-N817 WeakPolarHBondContact O-CB 3.24Å; A814-N817 PolarHBondContact O-N 3.12Å; A814-K818 WeakPolarHBondContact O-CG 3.38Å; A814-K818 PolarHBondContact O-N 3.2Å
815	N	91.8	Very high	91.8	Very high	29 Å²	29	49.2 Å²	49.2	16%	0.155	27%	0.271	C	S	.	.	H	α-helix	trans	-70.4	-32.1	-178.7	-68.3	-4.6	0	0	0	112.1	I432 T809 F810 P812 Q813 K818 L819	I432-N815 HydrophobicContact CD1-CB 4.28Å; T809-N815 WeakPolarHBondContact O-CB 3.46Å; T809-N815 PolarHBondContact O-ND2 2.96Å; F810-N815 HydrophobicContact CD1-CB 4.26Å; P812-N815 PolarHBondContact O-N 2.98Å; Q813-N815 VanDerWaalsContact C-N 3.35Å; Q813-N815 PolarHBondContact O-N 2.74Å; N815-K818 PolarHBondContact O-N 3Å; N815-L819 PolarHBondContact O-N 3.25Å
816	R	92.8	Very high	91.8	Very high	30 Å²	30	47.5 Å²	47.5	11%	0.113	26%	0.263	C	S	.	.	H	α-helix	trans	-67.4	-40.7	171	-62.6	-165.7	-65.6	-81.6	6.3	112.4	H741 F810 L811 P812 Q813 A814 K818 L819 L820	H741-R816 VanDerWaalsContact CE1-CB 3.49Å; H741-R816 WeakPolarHBondContact CE1-CB 3.48Å; H741-R816 PolarHBondContact ND1-NE 2.98Å; H741-R816 WeakPolarHBondContact NE2-CB 3.35Å; F810-R816 HydrophobicContact CB-CG 4.45Å; F810-R816 WeakPolarHBondContact O-CG 2.89Å; F810-R816 PolarHBondContact O-NH1 3.1Å; L811-R816 VanDerWaalsContact C-NH1 3.3Å; L811-R816 PolarHBondContact O-NH1 3.08Å; P812-R816 PolarHBondContact O-N 3.23Å; Q813-R816 PolarHBondContact O-N 2.94Å; A814-R816 VanDerWaalsContact C-N 3.35Å; A814-R816 PolarHBondContact O-N 3.31Å; R816-K818 VanDerWaalsContact C-N 3.34Å; R816-L819 WeakPolarHBondContact O-CB 3.5Å; R816-L819 PolarHBondContact O-N 3.24Å; R816-L820 PolarHBondContact O-N 3Å
817	N	93	Very high	91.6	Very high	58 Å²	58	46.7 Å²	46.7	31%	0.31	26%	0.259	S	S	.	.	H	α-helix	trans	-63.2	-42.2	173.9	-70	-10.4	0	0	0	110.9	H741 Q813 A814 L819 L820 H821	H741-N817 PolarHBondContact CE1-OD1 3.39Å; Q813-N817 PolarHBondContact O-N 2.87Å; A814-N817 WeakPolarHBondContact O-CB 3.24Å; A814-N817 PolarHBondContact O-N 3.12Å; N817-L819 VanDerWaalsContact C-N 3.35Å; N817-L819 PolarHBondContact O-N 2.91Å; N817-L820 WeakPolarHBondContact O-CB 3.35Å; N817-L820 PolarHBondContact O-N 3.16Å; N817-L820 VanDerWaalsContact O-N 3.13Å; N817-H821 PolarHBondContact O-CD2 3.49Å; N817-H821 PolarHBondContact O-N 2.94Å
818	K	92.7	Very high	91	Very high	83 Å²	83	47.9 Å²	47.9	36%	0.361	26%	0.264	S	S	.	.	H	α-helix	trans	-58.5	-43.5	175.1	-73.5	-178.9	176.9	-176.1	0	112.2	I431 I432 A814 N815 R816 L820 H821 Y822	I431-K818 WeakPolarHBondContact O-CB 3.49Å; I432-K818 WeakPolarHBondContact O-CD 3.46Å; I432-K818 PolarHBondContact O-NZ 3.02Å; A814-K818 WeakPolarHBondContact O-CG 3.38Å; A814-K818 PolarHBondContact O-N 3.2Å; N815-K818 PolarHBondContact O-N 3Å; R816-K818 VanDerWaalsContact C-N 3.34Å; K818-L820 PolarHBondContact O-N 2.78Å; K818-H821 PolarHBondContact O-N 3.33Å; K818-Y822 WeakPolarHBondContact O-CB 3.47Å; K818-Y822 PolarHBondContact O-N 3.07Å
819	L	93.6	Very high	89.7	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-59.3	-45.9	172.4	176	64.9	0	0	0	112.2	I431 A737 F787 L790 V792 F810 N815 R816 N817 Y822 I823	I431-L819 HydrophobicContact CD1-CD1 4.23Å; I431-L819 HydrophobicContact CG2-CB 4.25Å; I431-L819 HydrophobicContact CG2-CD1 4.35Å; A737-L819 HydrophobicContact CB-CD2 4.48Å; F787-L819 HydrophobicContact CE1-CD2 4.46Å; F787-L819 HydrophobicContact CZ-CD2 4.25Å; L790-L819 HydrophobicContact CD2-CD1 3.79Å; V792-L819 HydrophobicContact CG1-CD2 4.23Å; V792-L819 HydrophobicContact CG2-CD2 3.71Å; F810-L819 HydrophobicContact CE1-CB 4.05Å; F810-L819 HydrophobicContact CE1-CD2 4.26Å; N815-L819 PolarHBondContact O-N 3.25Å; R816-L819 WeakPolarHBondContact O-CB 3.5Å; R816-L819 PolarHBondContact O-N 3.24Å; N817-L819 VanDerWaalsContact C-N 3.35Å; N817-L819 PolarHBondContact O-N 2.91Å; L819-Y822 WeakPolarHBondContact O-CB 3.32Å; L819-Y822 PolarHBondContact O-N 2.94Å; L819-I823 HydrophobicContact CD1-CD1 4.17Å; L819-I823 HydrophobicContact CG-CD1 4.18Å; L819-I823 WeakPolarHBondContact O-CG1 3.49Å; L819-I823 PolarHBondContact O-N 3.04Å; L819-I823 VanDerWaalsContact O-N 3.14Å
820	L	94.7	Very high	89.8	Confident	27 Å²	27	51.7 Å²	51.7	14%	0.141	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-45.2	177.6	178.5	59.9	0	0	0	111.3	A737 I738 R816 N817 K818 Y822 I823 L824	A737-L820 HydrophobicContact CB-CB 4.33Å; A737-L820 HydrophobicContact CB-CD1 4.07Å; I738-L820 HydrophobicContact CD1-CD1 4.38Å; I738-L820 HydrophobicContact CG1-CD1 3.9Å; I738-L820 HydrophobicContact CG1-CD2 3.87Å; R816-L820 PolarHBondContact O-N 3Å; N817-L820 WeakPolarHBondContact O-CB 3.35Å; N817-L820 PolarHBondContact O-N 3.16Å; N817-L820 VanDerWaalsContact O-N 3.13Å; K818-L820 PolarHBondContact O-N 2.78Å; L820-Y822 PolarHBondContact O-N 3.14Å; L820-I823 PolarHBondContact O-N 2.92Å; L820-L824 HydrophobicContact CD1-CD1 3.91Å; L820-L824 HydrophobicContact CD1-CG 3.99Å; L820-L824 HydrophobicContact CD2-CD1 4.47Å; L820-L824 HydrophobicContact CG-CD1 3.83Å; L820-L824 HydrophobicContact CG-CG 4.3Å; L820-L824 WeakPolarHBondContact O-CB 3.31Å; L820-L824 VanDerWaalsContact O-CG 3.31Å; L820-L824 WeakPolarHBondContact O-CG 3.49Å; L820-L824 PolarHBondContact O-N 3.21Å
821	H	92.2	Very high	89.7	Confident	131 Å²	131	54.3 Å²	54.3	61%	0.606	29%	0.288	S	S	*	.	H	α-helix	trans	-62	-41.8	176.7	-77.3	-65.5	0	0	0	112.3	N817 K818 I823 L824 G825	N817-H821 PolarHBondContact O-CD2 3.49Å; N817-H821 PolarHBondContact O-N 2.94Å; K818-H821 PolarHBondContact O-N 3.33Å; H821-I823 VanDerWaalsContact C-N 3.33Å; H821-I823 PolarHBondContact O-N 3.37Å; H821-L824 PolarHBondContact O-N 3.05Å; H821-G825 PolarHBondContact O-N 3.04Å
822	Y	92.3	Very high	89.7	Confident	24 Å²	24	50.9 Å²	50.9	9%	0.094	27%	0.271	C	S	.	.	H	α-helix	trans	-55.1	-48.5	174.2	176.9	-96.1	0	0	0	111.3	T430 I431 G623 F627 K818 L819 L820 G825 F826	T430-Y822 HydrophobicContact CG2-CE2 4.48Å; I431-Y822 HydrophobicContact CD1-CD1 4.17Å; I431-Y822 HydrophobicContact CD1-CE1 4.3Å; I431-Y822 HydrophobicContact CD1-CG 4.43Å; I431-Y822 HydrophobicContact CG1-CD1 4.03Å; I431-Y822 HydrophobicContact CG1-CD2 3.86Å; I431-Y822 HydrophobicContact CG1-CE1 4.32Å; I431-Y822 HydrophobicContact CG1-CE2 4.16Å; I431-Y822 HydrophobicContact CG1-CG 3.8Å; G623-Y822 PolarHBondContact O-OH 3.44Å; F627-Y822 HydrophobicContact CD2-CE1 4.24Å; F627-Y822 HydrophobicContact CG-CE1 4.28Å; K818-Y822 WeakPolarHBondContact O-CB 3.47Å; K818-Y822 PolarHBondContact O-N 3.07Å; L819-Y822 WeakPolarHBondContact O-CB 3.32Å; L819-Y822 PolarHBondContact O-N 2.94Å; L820-Y822 PolarHBondContact O-N 3.14Å; Y822-G825 PolarHBondContact O-N 2.96Å; Y822-F826 HydrophobicContact CD1-CE2 4.23Å; Y822-F826 HydrophobicContact CD2-CE2 4.23Å; Y822-F826 AromaticContact CE1-CE2 3.87Å; Y822-F826 HydrophobicContact CE1-CE2 3.87Å; Y822-F826 AromaticContact CE2-CE2 3.87Å; Y822-F826 HydrophobicContact CE2-CE2 3.87Å; Y822-F826 HydrophobicContact CE2-CZ 4.21Å; Y822-F826 HydrophobicContact CG-CE2 4.4Å; Y822-F826 AromaticContact CZ-CE2 3.68Å; Y822-F826 WeakPolarHBondContact O-CD2 3.4Å; Y822-F826 VanDerWaalsContact O-CE2 3.29Å; Y822-F826 WeakPolarHBondContact O-CE2 3.49Å
823	I	94.4	Very high	89.7	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-68	-43.4	179.9	-59.5	163.5	0	0	0	111.4	F627 L730 A737 L819 L820 H821 G825 F826 T827	F627-I823 HydrophobicContact CE1-CG1 4.09Å; F627-I823 HydrophobicContact CE2-CG1 4.49Å; F627-I823 HydrophobicContact CZ-CD1 3.81Å; F627-I823 HydrophobicContact CZ-CG1 3.67Å; L730-I823 HydrophobicContact CD2-CG2 4.48Å; A737-I823 HydrophobicContact CB-CD1 3.89Å; L819-I823 HydrophobicContact CD1-CD1 4.17Å; L819-I823 HydrophobicContact CG-CD1 4.18Å; L819-I823 WeakPolarHBondContact O-CG1 3.49Å; L819-I823 PolarHBondContact O-N 3.04Å; L819-I823 VanDerWaalsContact O-N 3.14Å; L820-I823 PolarHBondContact O-N 2.92Å; H821-I823 VanDerWaalsContact C-N 3.33Å; H821-I823 PolarHBondContact O-N 3.37Å; I823-G825 VanDerWaalsContact C-N 3.26Å; I823-G825 PolarHBondContact O-N 3.23Å; I823-F826 PolarHBondContact O-N 3.39Å; I823-T827 PolarHBondContact O-OG1 2.91Å; I823-T827 VanDerWaalsContact O-OG1 3.09Å
824	L	93	Very high	89.6	Confident	53 Å²	53	46.2 Å²	46.2	28%	0.277	25%	0.246	S	C	.	.	H	α-helix	trans	-66	-28.9	-179.3	-71.9	177.9	0	0	0	112.5	R594 L820 H821 F826 T827	R594-L824 PolarHBondContact NH1-O 3.43Å; L820-L824 HydrophobicContact CD1-CD1 3.91Å; L820-L824 HydrophobicContact CD1-CG 3.99Å; L820-L824 HydrophobicContact CD2-CD1 4.47Å; L820-L824 HydrophobicContact CG-CD1 3.83Å; L820-L824 HydrophobicContact CG-CG 4.3Å; L820-L824 WeakPolarHBondContact O-CB 3.31Å; L820-L824 VanDerWaalsContact O-CG 3.31Å; L820-L824 WeakPolarHBondContact O-CG 3.49Å; L820-L824 PolarHBondContact O-N 3.21Å; H821-L824 PolarHBondContact O-N 3.05Å; L824-F826 PolarHBondContact O-N 3.47Å; L824-T827 PolarHBondContact O-N 2.89Å
825	G	90.9	Very high	89.5	Confident	20 Å²	20	45.5 Å²	45.5	21%	0.206	23%	0.231	C	C	.	.	H	α-helix	trans	-51.9	-39.3	174.7	0	0	0	0	0	112.7	A591 R594 H821 Y822 I823	A591-G825 WeakPolarHBondContact CA-O 3.47Å; R594-G825 PolarHBondContact NH1-O 3.29Å; H821-G825 PolarHBondContact O-N 3.04Å; Y822-G825 PolarHBondContact O-N 2.96Å; I823-G825 VanDerWaalsContact C-N 3.26Å; I823-G825 PolarHBondContact O-N 3.23Å
826	F	93	Very high	89.4	Confident	1 Å²	1	46.6 Å²	46.6	0%	0.004	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-11.1	179.8	-57.8	-75.7	0	0	0	114.6	C587 A591 K620 L624 L730 Y822 I823 L824	C587-F826 HydrophobicContact CB-CB 4.34Å; A591-F826 HydrophobicContact CB-CD1 3.71Å; A591-F826 HydrophobicContact CB-CE1 3.82Å; A591-F826 HydrophobicContact CB-CG 4.36Å; K620-F826 HydrophobicContact CD-CE1 4.41Å; K620-F826 HydrophobicContact CD-CZ 4.23Å; K620-F826 HydrophobicContact CG-CE1 3.86Å; K620-F826 HydrophobicContact CG-CZ 4.13Å; L624-F826 HydrophobicContact CB-CD1 4.45Å; L624-F826 HydrophobicContact CB-CE1 4.02Å; L624-F826 HydrophobicContact CB-CZ 4.16Å; L624-F826 HydrophobicContact CD1-CD1 4.41Å; L624-F826 HydrophobicContact CD1-CD2 4.14Å; L624-F826 HydrophobicContact CD1-CE2 4.41Å; L624-F826 HydrophobicContact CD1-CG 4.14Å; L624-F826 HydrophobicContact CD2-CB 4.45Å; L624-F826 HydrophobicContact CD2-CD1 3.73Å; L624-F826 HydrophobicContact CD2-CE1 4.13Å; L624-F826 HydrophobicContact CD2-CG 4.11Å; L624-F826 HydrophobicContact CG-CD1 4.42Å; L624-F826 HydrophobicContact CG-CE1 4.49Å; L730-F826 HydrophobicContact CD1-CB 3.83Å; L730-F826 WeakPolarHBondContact CD1-O 3.43Å; L730-F826 HydrophobicContact CD2-CB 4.4Å; Y822-F826 HydrophobicContact CD1-CE2 4.23Å; Y822-F826 HydrophobicContact CD2-CE2 4.23Å; Y822-F826 AromaticContact CE1-CE2 3.87Å; Y822-F826 HydrophobicContact CE1-CE2 3.87Å; Y822-F826 AromaticContact CE2-CE2 3.87Å; Y822-F826 HydrophobicContact CE2-CE2 3.87Å; Y822-F826 HydrophobicContact CE2-CZ 4.21Å; Y822-F826 HydrophobicContact CG-CE2 4.4Å; Y822-F826 AromaticContact CZ-CE2 3.68Å; Y822-F826 WeakPolarHBondContact O-CD2 3.4Å; Y822-F826 VanDerWaalsContact O-CE2 3.29Å; Y822-F826 WeakPolarHBondContact O-CE2 3.49Å; I823-F826 PolarHBondContact O-N 3.39Å; L824-F826 PolarHBondContact O-N 3.47Å
827	T	88.6	Confident	89.1	Confident	9 Å²	9	47.9 Å²	47.9	6%	0.055	25%	0.246	C	C	.	.			trans	-85.5	126.5	-171.3	-56.1	0	0	0	0	111.3	R594 I823 L824 L829	R594-T827 PolarHBondContact NH1-O 3.44Å; R594-T827 PolarHBondContact NH2-O 2.77Å; I823-T827 PolarHBondContact O-OG1 2.91Å; I823-T827 VanDerWaalsContact O-OG1 3.09Å; L824-T827 PolarHBondContact O-N 2.89Å; T827-L829 HydrophobicContact CG2-CD2 4.45Å; T827-L829 PolarHBondContact O-N 3.07Å
828	L	79.9	Confident	88.8	Confident	36 Å²	36	47.1 Å²	47.1	19%	0.188	24%	0.24	C	C	.	.			trans	-71.6	110.1	165.9	-172.1	69.6	0	0	0	108.6	L590 V720 Q723 R724	L590-L828 HydrophobicContact CD2-CB 4.31Å; L590-L828 HydrophobicContact CD2-CD1 4.21Å; V720-L828 HydrophobicContact CG1-CD2 3.89Å; Q723-L828 HydrophobicContact CB-CB 4.44Å; Q723-L828 HydrophobicContact CB-CD2 4.43Å; R724-L828 HydrophobicContact CG-CD2 3.89Å
829	L	60	Low	88.4	Confident	178 Å²	178	43.8 Å²	43.8	93%	0.932	23%	0.229	S	C	*	.			trans	-80	0	-177.2	-71.2	173.3	0	0	0	111.5	T827	T827-L829 HydrophobicContact CG2-CD2 4.45Å; T827-L829 PolarHBondContact O-N 3.07Å

Retrieved 829 of 829 residues in 208.4 ms (Link to these results)

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