A0A096N2A1_PAPAN Loading...

Polyamine-transporting ATPase 13A2

ATPase which acts as a lysosomal polyamine exporter with high affinity for spermine. Also stimulates cellular uptake of polyamines and protects against polyamine toxicity. Plays a role in intracellular cation homeostasis and the maintenance of neuronal integrity. Contributes to cellular zinc homeostasis. Confers cellular protection against Mn(2+) and Zn(2+) toxicity and mitochondrial stress. Required for proper lysosomal and mitochondrial maintenance. Regulates the autophagy-lysosome pathway through the control of SYT11 expression at both transcriptional and post-translational levels. Facilitates recruitment of deacetylase HDAC6 to lysosomes to deacetylate CTTN, leading to actin polymerization, promotion of autophagosome-lysosome fusion and completion of autophagy. Promotes secretion of exosomes as well as secretion of SCNA via exosomes. Plays a role in lipid homeostasis.

AlphaFold DB , UniProt , Accession A0A096N2A1, Species PAPAN (Papio anubis, Olive baboon), Gene ATP13A2, Length 1,179 aa.

						>A0A096N2A1_PAPAN|A0A096N2A1|ATP13A2
MSADSSPLVGSTPTGYGTLTIGTSIDPLSSSVSSVRLSGYCGSPWRVIGYHVVVWMMAGIPLLLFRWKPLWGVRLRLRPCNLARAETLVIEIRDKEDSSWQLFTVQVQTEAIGEGSLEPPPQAQVEDGRSQAAVGAVPEGAWKDTAQLHKSEEAVSGRKRVLRYYLFQGQRYIWIETQQAFYQVSLLDHGRSCDDIHRSRHGLSLQDQTVRKAIYGPNVISVPVKSYPQLLVDEALNPYYGFQAFSIALWLADHYYWYALCIFLISAISICLSLYKTRKQSQTLRDMVKLSMRVCVCRPGGEEEWVDSSELVPGDCLVLPQEGGLMPCDAALVAGECMVNESSLTGESVPVLKTALPEGLGPYCAETHRRHTLFCGTLVLQARAYVGPHVLAVVTRTGFCTAKGGLVSSILHPRPINFKFYKHSMKFVAALSVLALLGTIYSIFILYRNRLPLNEIVIRALDLVTVVVPPALPAAMTVCTLYAQSRLRRQGIFCIHPLRINLGGKLQLVCFDKTGTLTEDGLDVMGVVPLKGQAFLPLVPEPRRLPVGPLLRALATCHALSRLQDTPVGDPMDLKMVESTGWVLEEEPAADSAFGTQVLAVMRPPLWEPQLQGMEEPPVPVSVLCRFPFSSALQRMSVVVAWPGASQPEAYVKGSPELVAGLCNPETVPTDFAQMLQSYTAAGYRVVALASKSLPTVSSLEAAQQLTRDTVERELSLLGLLVMRNLLKPQTTPVIQALRRTRIRAVMVTGDNLQTAVTVARGCGMVAPQEHLIIVHATHPERGQPASLEFLPMESPTVVNGIKDPDQAASYTVEPDPRSRHLALSGPTFGIIMKHFPKLLPKVLVQGTVFARMAPEQKTELVCELQKLQYCVGMCGDGANDCGALKAADVGISLSQAEASVVSPFTSSMASIECVPMVIREGRCSLDTSFSVFKYMALYSLTQFISVLILYTINTNLGDLQFLAIDLVITTTVAVLMSRTGPALALGRVRPPGALLSVPVLSSLLLQVALVTGVQLGGYFLTLAQPWFVPLNRTVPAPDNLPNYENTVVFSLSSFQYLILAAAVSKGAPFRRPLYTNVPFLVALALLSSILVGLVLVPGLLQGPLALRNITDTCFKLLLLGLVTFNFVGAFMLESVLDQCLPACLRRLRPKRTSKKRFKQLERELAEQPWPLLPAGPLR
					

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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	31.2	Very low	27.4	Very low	252 Å²	252	120.8 Å²	120.8	100%	1.241	77%	0.77	S	S	*	*				0	104.8	0	-86	175	155.2	0	0	109.3
2	S	22.5	Very low	27.5	Very low	119 Å²	119	121.9 Å²	121.9	83%	0.832	78%	0.775	S	S	*	*			trans	-161.1	102	150.4	61.7	0	0	0	0	105.5	D4	S2-D4 PolarHBondContact O-N 2.83Å
3	A	27.5	Very low	27.5	Very low	93 Å²	93	119.2 Å²	119.2	77%	0.769	76%	0.758	S	S	*	*			trans	-63.9	124.3	168	0	0	0	0	0	108.3
4	D	27.3	Very low	27.8	Very low	159 Å²	159	121.7 Å²	121.7	85%	0.85	77%	0.772	S	S	*	*			trans	167.4	87.8	147.6	-90.1	-15.2	0	0	0	109.3	S2	S2-D4 PolarHBondContact O-N 2.83Å
5	S	24.4	Very low	28.2	Very low	117 Å²	117	116.7 Å²	116.7	82%	0.818	75%	0.752	S	S	*	*			trans	-152.3	63.6	161.4	65.9	0	0	0	0	109.6
6	S	22.4	Very low	28.8	Very low	91 Å²	91	122.7 Å²	122.7	64%	0.636	76%	0.757	S	S	*	*			trans	-83.6	117.6	155.5	56.7	0	0	0	0	107.5	L8	S6-L8 PolarHBondContact O-N 3Å
7	P	26.3	Very low	30	Very low	104 Å²	104	116.8 Å²	116.8	68%	0.675	73%	0.726	S	S	*	*			trans	-84.2	14.6	-179.4	30.3	-27.9	0	0	0	113.1
8	L	31.8	Very low	30.9	Very low	101 Å²	101	112.9 Å²	112.9	53%	0.529	70%	0.702	S	S	.	*			trans	-136.3	70.4	-167.7	-74.2	165.1	0	0	0	112	S6	S6-L8 PolarHBondContact O-N 3Å
9	V	28.4	Very low	32	Very low	126 Å²	126	110.3 Å²	110.3	76%	0.764	68%	0.682	S	S	*	*			trans	-138.8	90.7	156.1	-171.1	0	0	0	0	108.3
10	G	32.5	Very low	32.7	Very low	58 Å²	58	107.8 Å²	107.8	60%	0.598	67%	0.666	S	S	*	*			trans	-66.8	131	162.2	0	0	0	0	0	108.7	T12	G10-T12 PolarHBondContact O-N 3.31Å
11	S	27	Very low	33.7	Very low	109 Å²	109	106 Å²	106	76%	0.762	65%	0.652	S	S	*	*			trans	-59	118.1	172.4	56.5	0	0	0	0	109.5	P13	S11-P13 VanDerWaalsContact O-CD 3.24Å; S11-P13 WeakPolarHBondContact O-CD 3.36Å
12	T	28.2	Very low	34.1	Very low	134 Å²	134	96.8 Å²	96.8	82%	0.822	62%	0.622	S	S	*	*			trans	-71	114.2	168.8	36.7	0	0	0	0	109	G10	G10-T12 PolarHBondContact O-N 3.31Å
13	P	28.5	Very low	34.9	Very low	86 Å²	86	93.3 Å²	93.3	56%	0.558	60%	0.596	S	S	*	*			trans	-75	135.7	158.4	3.7	15.9	0	0	0	107.1	S11 G15	S11-P13 VanDerWaalsContact O-CD 3.24Å; S11-P13 WeakPolarHBondContact O-CD 3.36Å; P13-G15 VanDerWaalsContact C-N 3.26Å; P13-G15 PolarHBondContact O-N 3.04Å
14	T	31.6	Very low	35	Very low	155 Å²	155	93.6 Å²	93.6	95%	0.951	59%	0.592	S	S	*	*	S	Bend	trans	-60.4	86.2	167.3	38.6	0	0	0	0	109.7
15	G	33	Very low	35.2	Very low	46 Å²	46	90.9 Å²	90.9	47%	0.474	58%	0.576	S	S	.	*	S	Bend	trans	-176.7	103.2	179.5	0	0	0	0	0	111.9	P13	P13-G15 VanDerWaalsContact C-N 3.26Å; P13-G15 PolarHBondContact O-N 3.04Å
16	Y	38.8	Very low	35.6	Very low	213 Å²	213	89.3 Å²	89.3	84%	0.835	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	4.6	110.9	170.5	-71.8	-87.7	0	0	0	117.8	T18	Y16-T18 VanDerWaalsContact C-N 3.32Å; Y16-T18 PolarHBondContact O-N 3.03Å; Y16-T18 VanDerWaalsContact O-N 3.09Å; Y16-T18 PolarHBondContact O-OG1 2.83Å
17	G	48	Very low	36	Very low	22 Å²	22	88 Å²	88	23%	0.227	55%	0.548	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	18.7	148.5	0	0	0	0	0	117.9	G39	G17-G39 PolarHBondContact O-N 3.27Å
18	T	47.4	Very low	36.3	Very low	48 Å²	48	86.6 Å²	86.6	29%	0.294	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	109.8	-174.4	-42.2	0	0	0	0	111.5	Y16 R36 L37	Y16-T18 VanDerWaalsContact C-N 3.32Å; Y16-T18 PolarHBondContact O-N 3.03Å; Y16-T18 VanDerWaalsContact O-N 3.09Å; Y16-T18 PolarHBondContact O-OG1 2.83Å; T18-R36 VanDerWaalsContact CG2-CD 3.41Å; T18-R36 HydrophobicContact CG2-CG 3.2Å; T18-L37 CarbonylContact C-O 3.05Å; T18-L37 WeakPolarHBondContact CA-O 3.24Å
19	L	50.7	Low	36.6	Very low	62 Å²	62	82.8 Å²	82.8	33%	0.325	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.5	176.3	-160.1	141.8	0	0	0	109.4	I21 L37 L82 A180	L19-I21 HydrophobicContact CD2-CD1 4.12Å; L19-I21 HydrophobicContact CD2-CG1 3.37Å; L19-L37 PolarHBondContact N-O 2.87Å; L19-L37 PolarHBondContact O-N 3.15Å; L19-L82 HydrophobicContact CB-CD1 3.8Å; L19-L82 HydrophobicContact CD1-CD1 4.31Å; L19-A180 HydrophobicContact CD1-CB 3.96Å
20	T	45.8	Very low	37	Very low	60 Å²	60	78.2 Å²	78.2	37%	0.368	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	107.7	177.4	-45.4	0	0	0	0	108	V35	T20-V35 CarbonylContact C-O 3.52Å; T20-V35 WeakPolarHBondContact CA-O 3.3Å
21	I	53.4	Low	37.2	Very low	70 Å²	70	76.5 Å²	76.5	36%	0.359	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	114.4	176.7	-54.9	176	0	0	0	107.2	L19 T23 V35	L19-I21 HydrophobicContact CD2-CD1 4.12Å; L19-I21 HydrophobicContact CD2-CG1 3.37Å; I21-T23 PolarHBondContact O-N 2.71Å; I21-V35 PolarHBondContact N-O 2.81Å; I21-V35 PolarHBondContact O-N 2.94Å
22	G	40	Very low	38	Very low	59 Å²	59	72.5 Å²	72.5	61%	0.608	44%	0.44	S	S	*	.			trans	-72.3	108.6	161.5	0	0	0	0	0	107.9	S24	G22-S24 PolarHBondContact O-N 3.12Å
23	T	39.4	Very low	38.7	Very low	47 Å²	47	68.4 Å²	68.4	29%	0.288	42%	0.417	S	S	.	.			trans	-74.7	91.8	179.5	51.8	0	0	0	0	109.1	I21 V32 V35	I21-T23 PolarHBondContact O-N 2.71Å; T23-V32 PolarHBondContact OG1-O 3.04Å; T23-V35 HydrophobicContact CG2-CG2 3.92Å
24	S	30	Very low	40.1	Very low	99 Å²	99	65 Å²	65	69%	0.692	40%	0.395	S	S	*	.			trans	-102.5	-3.9	173	61.4	0	0	0	0	114.1	G22	G22-S24 PolarHBondContact O-N 3.12Å
25	I	31.8	Very low	41.9	Very low	101 Å²	101	59 Å²	59	52%	0.518	36%	0.358	S	S	.	.	S	Bend	trans	-113.4	-11.8	-164.1	-54.5	178.8	0	0	0	114	P27	I25-P27 WeakPolarHBondContact O-CD 3.47Å
26	D	33.7	Very low	44	Very low	85 Å²	85	61.4 Å²	61.4	46%	0.455	35%	0.353	S	S	.	.			trans	-107.5	105.5	175.9	-156.6	-8.5	0	0	0	110.1	L28 S29	D26-L28 PolarHBondContact O-N 3.49Å; D26-L28 VanDerWaalsContact O-N 3.1Å; D26-S29 PolarHBondContact O-N 3.44Å; D26-S29 PolarHBondContact O-OG 3.26Å
27	P	29.6	Very low	46.1	Very low	63 Å²	63	51.6 Å²	51.6	41%	0.409	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-59.5	-22.5	178.8	21.5	-29.7	0	0	0	111.9	I25 S29 S30	I25-P27 WeakPolarHBondContact O-CD 3.47Å; P27-S29 VanDerWaalsContact C-N 3.33Å; P27-S30 PolarHBondContact O-OG 3.26Å
28	L	33	Very low	47.8	Very low	74 Å²	74	51.1 Å²	51.1	39%	0.387	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-78.3	-8	172.7	-69	165.4	0	0	0	114	D26 R414	D26-L28 PolarHBondContact O-N 3.49Å; D26-L28 VanDerWaalsContact O-N 3.1Å; L28-R414 PolarHBondContact O-NH2 2.68Å
29	S	39	Very low	49.6	Very low	21 Å²	21	49 Å²	49	15%	0.147	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-109.6	10.2	179.9	91.3	0	0	0	0	114.3	D26 P27 S31 V32	D26-S29 PolarHBondContact O-N 3.44Å; D26-S29 PolarHBondContact O-OG 3.26Å; P27-S29 VanDerWaalsContact C-N 3.33Å; S29-S31 PolarHBondContact O-N 3.34Å; S29-V32 PolarHBondContact O-N 2.85Å
30	S	34.9	Very low	51.2	Low	30 Å²	30	46.9 Å²	46.9	21%	0.21	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-10.1	-172.3	60.1	0	0	0	0	116.3	P27 K95	P27-S30 PolarHBondContact O-OG 3.26Å; S30-K95 PolarHBondContact O-NZ 2.9Å
31	S	38	Very low	53.2	Low	22 Å²	22	45.6 Å²	45.6	15%	0.154	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-19.1	172.7	71	0	0	0	0	114.7	S29 S33 K95	S29-S31 PolarHBondContact O-N 3.34Å; S31-S33 PolarHBondContact O-N 3.35Å; S31-K95 WeakPolarHBondContact O-CB 3.44Å; S31-K95 VanDerWaalsContact O-CG 3.27Å; S31-K95 WeakPolarHBondContact O-CG 3.15Å; S31-K95 PolarHBondContact O-N 3.3Å; S31-K95 VanDerWaalsContact O-N 3.13Å
32	V	43.9	Very low	54.4	Low	26 Å²	26	43.9 Å²	43.9	16%	0.158	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	122.1	177.4	-179.6	0	0	0	0	108.7	T23 S29 V35 I92	T23-V32 PolarHBondContact OG1-O 3.04Å; S29-V32 PolarHBondContact O-N 2.85Å; V32-V35 HydrophobicContact CG1-CG2 3.8Å; V32-I92 HydrophobicContact CG1-CG2 3.83Å; V32-I92 HydrophobicContact CG2-CG2 4.07Å
33	S	42.9	Very low	56.3	Low	47 Å²	47	41.4 Å²	41.4	33%	0.329	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-28.9	179.9	61.7	0	0	0	0	112.7	S31 R93	S31-S33 PolarHBondContact O-N 3.35Å; S33-R93 PolarHBondContact N-O 2.79Å; S33-R93 WeakPolarHBondContact OG-CB 3.39Å; S33-R93 WeakPolarHBondContact OG-CD 3.41Å; S33-R93 WeakPolarHBondContact OG-CG 3.46Å; S33-R93 PolarHBondContact OG-O 2.82Å
34	S	57.6	Low	58.3	Low	16 Å²	16	43.4 Å²	43.4	11%	0.112	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.3	132.5	-172.6	52.6	0	0	0	0	110.3	R93 W100	S34-R93 PolarHBondContact O-N 2.88Å; S34-R93 VanDerWaalsContact O-N 3.1Å; S34-R93 WeakPolarHBondContact OG-CB 3.47Å; S34-W100 VanDerWaalsContact OG-CH2 3.27Å; S34-W100 WeakPolarHBondContact OG-CH2 3.31Å
35	V	68.3	Low	60.7	Low	28 Å²	28	48.1 Å²	48.1	17%	0.17	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130.1	164.6	-177.7	0	0	0	0	107.9	T20 I21 T23 V32 I90 E91 I92	T20-V35 CarbonylContact C-O 3.52Å; T20-V35 WeakPolarHBondContact CA-O 3.3Å; I21-V35 PolarHBondContact N-O 2.81Å; I21-V35 PolarHBondContact O-N 2.94Å; T23-V35 HydrophobicContact CG2-CG2 3.92Å; V32-V35 HydrophobicContact CG1-CG2 3.8Å; V35-I90 HydrophobicContact CG1-CG2 3.88Å; V35-E91 CarbonylContact C-O 3.53Å; V35-E91 WeakPolarHBondContact CA-O 3.33Å; V35-I92 HydrophobicContact CG1-CG1 4.41Å; V35-I92 HydrophobicContact CG2-CG1 4.32Å
36	R	77.9	Confident	63.1	Low	97 Å²	97	47.9 Å²	47.9	37%	0.366	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123.3	177.6	-177	179.7	-102.2	-175.4	-7.4	109.3	T18 E91 W100	T18-R36 VanDerWaalsContact CG2-CD 3.41Å; T18-R36 HydrophobicContact CG2-CG 3.2Å; R36-E91 HydrophobicContact CB-CB 4.16Å; R36-E91 VanDerWaalsContact CD-OE2 3.23Å; R36-E91 WeakPolarHBondContact CD-OE2 3.19Å; R36-E91 PolarHBondContact N-O 3.12Å; R36-E91 PolarHBondContact O-N 3.44Å; R36-W100 HydrophobicContact CB-CH2 4.36Å; R36-W100 HydrophobicContact CB-CZ3 4.05Å
37	L	81.9	Confident	65.4	Low	7 Å²	7	45.4 Å²	45.4	4%	0.037	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.3	178.9	-170.6	72.6	0	0	0	109.7	T18 L19 L82 L88 I90 F181	T18-L37 CarbonylContact C-O 3.05Å; T18-L37 WeakPolarHBondContact CA-O 3.24Å; L19-L37 PolarHBondContact N-O 2.87Å; L19-L37 PolarHBondContact O-N 3.15Å; L37-L82 HydrophobicContact CD2-CD1 4.15Å; L37-L82 HydrophobicContact CD2-CD2 3.83Å; L37-L82 HydrophobicContact CG-CD2 3.89Å; L37-L88 HydrophobicContact CD1-CB 4.09Å; L37-L88 HydrophobicContact CD1-CD1 4.33Å; L37-L88 HydrophobicContact CG-CD2 4.44Å; L37-I90 HydrophobicContact CD1-CD1 4.48Å; L37-I90 HydrophobicContact CD1-CG1 3.56Å; L37-F181 HydrophobicContact CD2-CD2 4.18Å
38	S	84.1	Confident	68	Low	12 Å²	12	46.9 Å²	46.9	8%	0.084	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129	-179.1	-58.1	0	0	0	0	111.3	L88 V89	S38-L88 WeakPolarHBondContact O-CA 3.28Å; S38-V89 PolarHBondContact N-O 3.37Å; S38-V89 PolarHBondContact O-N 2.96Å
39	G	85.1	Confident	70.3	Confident	2 Å²	2	45 Å²	45	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	140.1	179.7	0	0	0	0	0	114.5	G17 P79 C80	G17-G39 PolarHBondContact O-N 3.27Å; G39-P79 WeakPolarHBondContact O-CA 3.39Å; G39-C80 PolarHBondContact O-N 3.21Å
40	Y	85.8	Confident	72.4	Confident	19 Å²	19	45.6 Å²	45.6	8%	0.075	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143.9	176.3	-66.1	-93.8	0	0	0	112.2	V73 L77 R78 P79 E86 T87 V89	Y40-V73 HydrophobicContact CD1-CG1 3.95Å; Y40-V73 HydrophobicContact CD2-CG1 4.01Å; Y40-V73 HydrophobicContact CE1-CG1 4.15Å; Y40-V73 HydrophobicContact CE2-CG1 4.2Å; Y40-V73 HydrophobicContact CG-CG1 3.88Å; Y40-L77 HydrophobicContact CD1-CB 4.22Å; Y40-L77 HydrophobicContact CG-CB 4.43Å; Y40-R78 CarbonylContact C-O 3.57Å; Y40-R78 VanDerWaalsContact CA-O 3.27Å; Y40-R78 WeakPolarHBondContact CA-O 2.98Å; Y40-P79 HydrophobicContact CD1-CG 4.46Å; Y40-P79 HydrophobicContact CE1-CB 4.36Å; Y40-P79 HydrophobicContact CE1-CG 4.02Å; Y40-E86 PolarHBondContact O-N 3.06Å; Y40-T87 PolarHBondContact N-O 3.05Å; Y40-T87 PolarHBondContact O-N 3.15Å; Y40-V89 HydrophobicContact CD2-CB 4.34Å; Y40-V89 HydrophobicContact CD2-CG2 3.63Å; Y40-V89 HydrophobicContact CE2-CB 3.83Å; Y40-V89 HydrophobicContact CE2-CG2 3.32Å
41	C	86.2	Confident	74.7	Confident	32 Å²	32	49 Å²	49	22%	0.216	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	154.4	174.9	62.3	0	0	0	0	112.3	L77 R78 C80	C41-L77 WeakPolarHBondContact O-CA 3.43Å; C41-L77 WeakPolarHBondContact O-CB 3.37Å; C41-R78 PolarHBondContact N-O 3.46Å; C41-R78 PolarHBondContact O-N 3.46Å; C41-C80 HydrophobicContact CB-CB 4.14Å; C41-C80 PolarHBondContact N-SG 2.96Å; C41-C80 VanDerWaalsContact N-SG 3.45Å; C41-C80 VanDerWaalsContact SG-CB 3.59Å
42	G	78.8	Confident	76.9	Confident	34 Å²	34	51.8 Å²	51.8	35%	0.351	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	137.8	173.9	0	0	0	0	0	113	E86	G42-E86 PolarHBondContact N-OE2 2.73Å
43	S	80.5	Confident	78.8	Confident	8 Å²	8	54.2 Å²	54.2	6%	0.056	29%	0.29	C	S	.	.			trans	-127	114.7	166.9	176.4	0	0	0	0	108.6	W45 R46 V47 R78	S43-W45 VanDerWaalsContact C-N 3.3Å; S43-W45 PolarHBondContact O-N 3.31Å; S43-R46 PolarHBondContact O-N 3.35Å; S43-V47 WeakPolarHBondContact O-CG2 3.49Å; S43-V47 PolarHBondContact O-N 2.82Å; S43-R78 PolarHBondContact OG-NE 3.28Å
44	P	80.8	Confident	80.7	Confident	88 Å²	88	52.7 Å²	52.7	57%	0.571	28%	0.279	S	S	*	.	H	α-helix	trans	-58.1	-42.3	-171.7	18.2	-29.5	0	0	0	112.1	R46 V47 I48	P44-R46 VanDerWaalsContact C-N 3.34Å; P44-R46 PolarHBondContact O-N 3.2Å; P44-V47 PolarHBondContact O-N 3.32Å; P44-I48 VanDerWaalsContact O-CG1 3.27Å; P44-I48 WeakPolarHBondContact O-CG1 3.47Å; P44-I48 PolarHBondContact O-N 3.04Å
45	W	81.2	Confident	82.1	Confident	199 Å²	199	61.9 Å²	61.9	75%	0.754	31%	0.311	S	S	*	.	H	α-helix	trans	-61.1	-37.3	175.8	-64.6	111.5	0	0	0	114.1	S43 G49	S43-W45 VanDerWaalsContact C-N 3.3Å; S43-W45 PolarHBondContact O-N 3.31Å; W45-G49 PolarHBondContact O-N 3.37Å
46	R	81.9	Confident	82.9	Confident	96 Å²	96	67.2 Å²	67.2	36%	0.362	34%	0.336	S	S	.	.	H	α-helix	trans	-73.4	-36.4	176.9	-73.8	-167.5	179	-168.7	-3.5	112.1	S43 P44 Y50 R74 L75 R76 L77	S43-R46 PolarHBondContact O-N 3.35Å; P44-R46 VanDerWaalsContact C-N 3.34Å; P44-R46 PolarHBondContact O-N 3.2Å; R46-Y50 WeakPolarHBondContact O-CB 3.34Å; R46-Y50 PolarHBondContact O-N 2.93Å; R46-R74 PolarHBondContact NH1-O 2.68Å; R46-L75 WeakPolarHBondContact CB-O 3.37Å; R46-R76 WeakPolarHBondContact CB-O 3.38Å; R46-L77 PolarHBondContact NH1-O 2.78Å
47	V	82.3	Confident	83.1	Confident	32 Å²	32	67.9 Å²	67.9	19%	0.194	35%	0.345	C	S	.	.	H	α-helix	trans	-65.1	-44.3	174.6	176.8	0	0	0	0	110.4	S43 P44 Y50 H51 R76	S43-V47 WeakPolarHBondContact O-CG2 3.49Å; S43-V47 PolarHBondContact O-N 2.82Å; P44-V47 PolarHBondContact O-N 3.32Å; V47-Y50 WeakPolarHBondContact O-CB 3.43Å; V47-Y50 PolarHBondContact O-N 3.29Å; V47-H51 PolarHBondContact O-CD2 2.93Å; V47-H51 PolarHBondContact O-N 2.92Å; V47-R76 HydrophobicContact CB-CG 4.47Å; V47-R76 HydrophobicContact CG2-CG 3.65Å
48	I	83.8	Confident	83.2	Confident	95 Å²	95	72 Å²	72	49%	0.487	38%	0.38	S	S	.	.	H	α-helix	trans	-62.1	-51	175.6	-66.5	163.9	0	0	0	110.1	P44 Y50 H51 V52	P44-I48 VanDerWaalsContact O-CG1 3.27Å; P44-I48 WeakPolarHBondContact O-CG1 3.47Å; P44-I48 PolarHBondContact O-N 3.04Å; I48-Y50 VanDerWaalsContact C-N 3.26Å; I48-Y50 PolarHBondContact O-N 2.88Å; I48-H51 PolarHBondContact O-N 2.91Å; I48-H51 VanDerWaalsContact O-N 3.09Å; I48-V52 HydrophobicContact CG2-CG2 4.39Å; I48-V52 WeakPolarHBondContact O-CG2 3.28Å; I48-V52 PolarHBondContact O-N 3.45Å
49	G	82.4	Confident	82.8	Confident	34 Å²	34	72.4 Å²	72.4	35%	0.351	39%	0.385	S	S	.	.	H	α-helix	trans	-57.5	-38.6	176.2	0	0	0	0	0	112.9	W45 V52 V53	W45-G49 PolarHBondContact O-N 3.37Å; G49-V52 PolarHBondContact O-N 3.44Å; G49-V53 WeakPolarHBondContact O-CB 3.28Å; G49-V53 VanDerWaalsContact O-CG2 3.28Å; G49-V53 WeakPolarHBondContact O-CG2 3.45Å; G49-V53 PolarHBondContact O-N 2.84Å
50	Y	82	Confident	82.4	Confident	33 Å²	33	77.1 Å²	77.1	13%	0.129	41%	0.409	C	S	.	.	H	α-helix	trans	-59.2	-49.3	173.1	168.6	-86.7	0	0	0	111.9	R46 V47 I48 V52 V53 V54 L62 F65 R76	R46-Y50 WeakPolarHBondContact O-CB 3.34Å; R46-Y50 PolarHBondContact O-N 2.93Å; V47-Y50 WeakPolarHBondContact O-CB 3.43Å; V47-Y50 PolarHBondContact O-N 3.29Å; I48-Y50 VanDerWaalsContact C-N 3.26Å; I48-Y50 PolarHBondContact O-N 2.88Å; Y50-V52 VanDerWaalsContact C-N 3.35Å; Y50-V52 PolarHBondContact O-N 2.8Å; Y50-V53 PolarHBondContact O-N 2.77Å; Y50-V54 HydrophobicContact CD1-CG2 4.27Å; Y50-V54 HydrophobicContact CD2-CG2 4.49Å; Y50-V54 HydrophobicContact CE1-CG2 3.92Å; Y50-V54 HydrophobicContact CE2-CG2 4.22Å; Y50-V54 WeakPolarHBondContact O-CB 3.09Å; Y50-V54 WeakPolarHBondContact O-CG2 3.47Å; Y50-V54 PolarHBondContact O-N 3.37Å; Y50-L62 VanDerWaalsContact OH-CD2 3.23Å; Y50-L62 WeakPolarHBondContact OH-CD2 3.49Å; Y50-F65 HydrophobicContact CD2-CD2 4.33Å; Y50-F65 AromaticContact CD2-CE2 3.86Å; Y50-F65 HydrophobicContact CD2-CE2 3.86Å; Y50-F65 AromaticContact CE2-CD2 3.36Å; Y50-F65 HydrophobicContact CE2-CD2 3.36Å; Y50-F65 AromaticContact CE2-CE2 3.3Å; Y50-F65 HydrophobicContact CE2-CE2 3.3Å; Y50-F65 HydrophobicContact CE2-CG 4.46Å; Y50-F65 HydrophobicContact CE2-CZ 4.38Å; Y50-F65 AromaticContact CZ-CD2 3.97Å; Y50-R76 HydrophobicContact CD2-CB 4.44Å
51	H	83.4	Confident	82.1	Confident	102 Å²	102	76.8 Å²	76.8	47%	0.472	41%	0.409	S	S	.	.	H	α-helix	trans	-66.2	-37.2	179.3	-75	-66.8	0	0	0	112.3	V47 I48 V54 W55	V47-H51 PolarHBondContact O-CD2 2.93Å; V47-H51 PolarHBondContact O-N 2.92Å; I48-H51 PolarHBondContact O-N 2.91Å; I48-H51 VanDerWaalsContact O-N 3.09Å; H51-V54 PolarHBondContact O-N 3.07Å; H51-W55 VanDerWaalsContact O-CB 3.27Å; H51-W55 WeakPolarHBondContact O-CB 3.34Å; H51-W55 PolarHBondContact O-N 2.84Å
52	V	83.9	Confident	81.6	Confident	81 Å²	81	79.5 Å²	79.5	49%	0.491	42%	0.421	S	S	.	.	H	α-helix	trans	-62.5	-48	174.1	172.5	0	0	0	0	110.9	I48 G49 Y50 V54 W55 M56	I48-V52 HydrophobicContact CG2-CG2 4.39Å; I48-V52 WeakPolarHBondContact O-CG2 3.28Å; I48-V52 PolarHBondContact O-N 3.45Å; G49-V52 PolarHBondContact O-N 3.44Å; Y50-V52 VanDerWaalsContact C-N 3.35Å; Y50-V52 PolarHBondContact O-N 2.8Å; V52-V54 PolarHBondContact O-N 3.36Å; V52-W55 PolarHBondContact O-N 3.5Å; V52-M56 HydrophobicContact CG1-CG 4.21Å; V52-M56 WeakPolarHBondContact O-CB 3.29Å; V52-M56 VanDerWaalsContact O-CG 3.22Å; V52-M56 WeakPolarHBondContact O-CG 3.42Å; V52-M56 PolarHBondContact O-N 3.04Å
53	V	83.1	Confident	81.3	Confident	77 Å²	77	80.8 Å²	80.8	47%	0.467	42%	0.419	S	S	.	.	H	α-helix	trans	-63	-42.6	177.9	169	0	0	0	0	111.4	G49 Y50 W55 M57 P61	G49-V53 WeakPolarHBondContact O-CB 3.28Å; G49-V53 VanDerWaalsContact O-CG2 3.28Å; G49-V53 WeakPolarHBondContact O-CG2 3.45Å; G49-V53 PolarHBondContact O-N 2.84Å; Y50-V53 PolarHBondContact O-N 2.77Å; V53-W55 VanDerWaalsContact C-N 3.33Å; V53-W55 PolarHBondContact O-N 2.69Å; V53-M57 WeakPolarHBondContact O-CB 3.37Å; V53-M57 WeakPolarHBondContact O-CG 3.45Å; V53-M57 PolarHBondContact O-N 3.41Å; V53-P61 HydrophobicContact CG1-CG 4.13Å
54	V	83.7	Confident	80.9	Confident	15 Å²	15	84.9 Å²	84.9	9%	0.091	44%	0.44	C	S	.	.	H	α-helix	trans	-60.8	-44.2	176.1	165.7	0	0	0	0	110.7	Y50 H51 V52 M57 A58 G59 P61 L62 F65	Y50-V54 HydrophobicContact CD1-CG2 4.27Å; Y50-V54 HydrophobicContact CD2-CG2 4.49Å; Y50-V54 HydrophobicContact CE1-CG2 3.92Å; Y50-V54 HydrophobicContact CE2-CG2 4.22Å; Y50-V54 WeakPolarHBondContact O-CB 3.09Å; Y50-V54 WeakPolarHBondContact O-CG2 3.47Å; Y50-V54 PolarHBondContact O-N 3.37Å; H51-V54 PolarHBondContact O-N 3.07Å; V52-V54 PolarHBondContact O-N 3.36Å; V54-M57 CarbonylContact O-C 3.58Å; V54-A58 PolarHBondContact O-N 3.07Å; V54-G59 PolarHBondContact O-N 3.32Å; V54-P61 HydrophobicContact CG2-CB 4.16Å; V54-L62 HydrophobicContact CG1-CD1 3.38Å; V54-L62 HydrophobicContact CG1-CG 3.71Å; V54-L62 HydrophobicContact CG2-CG 4.13Å; V54-F65 HydrophobicContact CG2-CE2 4.38Å
55	W	86.5	Confident	80.7	Confident	209 Å²	209	81.9 Å²	81.9	79%	0.792	42%	0.418	S	S	*	.	H	α-helix	trans	-69.4	-46.4	-179.7	-168.4	81.7	0	0	0	112.2	H51 V52 V53 M57 A58	H51-W55 VanDerWaalsContact O-CB 3.27Å; H51-W55 WeakPolarHBondContact O-CB 3.34Å; H51-W55 PolarHBondContact O-N 2.84Å; V52-W55 PolarHBondContact O-N 3.5Å; V53-W55 VanDerWaalsContact C-N 3.33Å; V53-W55 PolarHBondContact O-N 2.69Å; W55-M57 PolarHBondContact O-N 2.62Å; W55-A58 PolarHBondContact O-N 2.92Å
56	M	85.1	Confident	80.3	Confident	139 Å²	139	76.7 Å²	76.7	69%	0.685	40%	0.399	S	S	*	.	H	α-helix	trans	-58.3	-34	176.3	-75.1	-68.9	-71	0	0	112.8	V52	V52-M56 HydrophobicContact CG1-CG 4.21Å; V52-M56 WeakPolarHBondContact O-CB 3.29Å; V52-M56 VanDerWaalsContact O-CG 3.22Å; V52-M56 WeakPolarHBondContact O-CG 3.42Å; V52-M56 PolarHBondContact O-N 3.04Å
57	M	83.6	Confident	79.8	Confident	112 Å²	112	77.8 Å²	77.8	55%	0.552	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	21.6	179	-66.1	-74.8	-164.5	0	0	112.8	V53 V54 W55 G59 I60 P61	V53-M57 WeakPolarHBondContact O-CB 3.37Å; V53-M57 WeakPolarHBondContact O-CG 3.45Å; V53-M57 PolarHBondContact O-N 3.41Å; V54-M57 CarbonylContact O-C 3.58Å; W55-M57 PolarHBondContact O-N 2.62Å; M57-G59 PolarHBondContact O-N 3.34Å; M57-I60 WeakPolarHBondContact O-CB 3.36Å; M57-I60 VanDerWaalsContact O-CG1 3.29Å; M57-I60 WeakPolarHBondContact O-CG1 3.41Å; M57-I60 PolarHBondContact O-N 3.18Å; M57-P61 VanDerWaalsContact CB-CD 3.47Å; M57-P61 HydrophobicContact CB-CG 3.66Å; M57-P61 HydrophobicContact CG-CG 4.11Å
58	A	82.5	Confident	79.5	Confident	94 Å²	94	82.5 Å²	82.5	78%	0.777	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	34.2	177	0	0	0	0	0	114.5	V54 W55 I60	V54-A58 PolarHBondContact O-N 3.07Å; W55-A58 PolarHBondContact O-N 2.92Å; A58-I60 PolarHBondContact O-N 3.33Å
59	G	76.9	Confident	78.9	Confident	19 Å²	19	80.6 Å²	80.6	20%	0.196	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	-3.2	178.5	0	0	0	0	0	116	V54 M57 P61 L62	V54-G59 PolarHBondContact O-N 3.32Å; M57-G59 PolarHBondContact O-N 3.34Å; G59-P61 VanDerWaalsContact C-CD 3.4Å; G59-P61 VanDerWaalsContact C-N 3.31Å; G59-L62 VanDerWaalsContact O-CB 3.3Å; G59-L62 WeakPolarHBondContact O-CB 3.23Å; G59-L62 PolarHBondContact O-N 3.49Å
60	I	76.4	Confident	78.5	Confident	102 Å²	102	80.2 Å²	80.2	52%	0.523	40%	0.404	S	S	.	.	H	α-helix	trans	-53.5	-40.2	177.8	-63.8	168.4	0	0	0	113	M57 A58 L62 L63 L64	M57-I60 WeakPolarHBondContact O-CB 3.36Å; M57-I60 VanDerWaalsContact O-CG1 3.29Å; M57-I60 WeakPolarHBondContact O-CG1 3.41Å; M57-I60 PolarHBondContact O-N 3.18Å; A58-I60 PolarHBondContact O-N 3.33Å; I60-L62 VanDerWaalsContact C-N 3.27Å; I60-L62 PolarHBondContact O-N 2.66Å; I60-L63 WeakPolarHBondContact O-CB 3.46Å; I60-L63 PolarHBondContact O-N 2.51Å; I60-L64 PolarHBondContact O-N 2.84Å
61	P	78.5	Confident	78.3	Confident	12 Å²	12	86.4 Å²	86.4	8%	0.078	43%	0.428	C	S	.	.	H	α-helix	trans	-63.2	-30.9	177.9	-23	34.8	0	0	0	113.1	V53 V54 M57 G59 L63 L64 F65	V53-P61 HydrophobicContact CG1-CG 4.13Å; V54-P61 HydrophobicContact CG2-CB 4.16Å; M57-P61 VanDerWaalsContact CB-CD 3.47Å; M57-P61 HydrophobicContact CB-CG 3.66Å; M57-P61 HydrophobicContact CG-CG 4.11Å; G59-P61 VanDerWaalsContact C-CD 3.4Å; G59-P61 VanDerWaalsContact C-N 3.31Å; P61-L63 VanDerWaalsContact C-N 3.28Å; P61-L63 PolarHBondContact O-N 2.93Å; P61-L64 PolarHBondContact O-N 2.86Å; P61-F65 HydrophobicContact CB-CD2 4.19Å; P61-F65 HydrophobicContact CB-CE1 4.46Å; P61-F65 HydrophobicContact CB-CE2 3.42Å; P61-F65 VanDerWaalsContact CB-CE2 3.42Å; P61-F65 HydrophobicContact CB-CZ 3.58Å; P61-F65 WeakPolarHBondContact O-CB 3.01Å; P61-F65 WeakPolarHBondContact O-CD2 3.35Å; P61-F65 WeakPolarHBondContact O-CE2 3.33Å; P61-F65 WeakPolarHBondContact O-CG 3.37Å; P61-F65 PolarHBondContact O-N 2.88Å
62	L	76.3	Confident	77.9	Confident	88 Å²	88	82 Å²	82	46%	0.461	41%	0.41	S	S	.	.	H	α-helix	trans	-60.2	-38.9	176.3	-75.8	155.8	0	0	0	111.7	Y50 V54 G59 I60 F65 R66	Y50-L62 VanDerWaalsContact OH-CD2 3.23Å; Y50-L62 WeakPolarHBondContact OH-CD2 3.49Å; V54-L62 HydrophobicContact CG1-CD1 3.38Å; V54-L62 HydrophobicContact CG1-CG 3.71Å; V54-L62 HydrophobicContact CG2-CG 4.13Å; G59-L62 VanDerWaalsContact O-CB 3.3Å; G59-L62 WeakPolarHBondContact O-CB 3.23Å; G59-L62 PolarHBondContact O-N 3.49Å; I60-L62 VanDerWaalsContact C-N 3.27Å; I60-L62 PolarHBondContact O-N 2.66Å; L62-F65 PolarHBondContact O-N 2.82Å; L62-R66 WeakPolarHBondContact O-CB 3.41Å; L62-R66 PolarHBondContact O-N 2.87Å
63	L	72.1	Confident	77.6	Confident	61 Å²	61	79 Å²	79	32%	0.319	39%	0.391	S	S	.	.	H	α-helix	trans	-64.4	-48.4	175.4	-76.9	153.6	0	0	0	111.2	I60 P61 F65 R66 W67 L236	I60-L63 WeakPolarHBondContact O-CB 3.46Å; I60-L63 PolarHBondContact O-N 2.51Å; P61-L63 VanDerWaalsContact C-N 3.28Å; P61-L63 PolarHBondContact O-N 2.93Å; L63-F65 VanDerWaalsContact C-N 3.32Å; L63-F65 PolarHBondContact O-N 2.95Å; L63-R66 WeakPolarHBondContact O-CB 3.35Å; L63-R66 PolarHBondContact O-N 3.27Å; L63-R66 VanDerWaalsContact O-N 3.15Å; L63-W67 PolarHBondContact O-N 2.87Å; L63-W67 VanDerWaalsContact O-N 3.08Å; L63-L236 HydrophobicContact CD2-CB 4.32Å; L63-L236 HydrophobicContact CD2-CD1 3.59Å; L63-L236 HydrophobicContact CD2-CD2 3.63Å; L63-L236 HydrophobicContact CD2-CG 4.04Å
64	L	72.9	Confident	77.4	Confident	95 Å²	95	82 Å²	82	50%	0.497	39%	0.394	S	S	.	.	H	α-helix	trans	-60.5	-41.9	177.4	-75.2	169.1	0	0	0	111.8	I60 P61 R66 W67 K68	I60-L64 PolarHBondContact O-N 2.84Å; P61-L64 PolarHBondContact O-N 2.86Å; L64-R66 VanDerWaalsContact C-N 3.32Å; L64-R66 PolarHBondContact O-N 2.79Å; L64-W67 PolarHBondContact O-N 3.47Å; L64-K68 WeakPolarHBondContact O-CB 3.46Å; L64-K68 PolarHBondContact O-N 2.93Å
65	F	76.3	Confident	77.1	Confident	25 Å²	25	85.6 Å²	85.6	11%	0.11	41%	0.413	C	S	.	.	H	α-helix	trans	-69.8	-29.7	177.4	-55.6	-31.1	0	0	0	112.2	Y50 V54 P61 L62 L63 K68 P69 W71 L75	Y50-F65 HydrophobicContact CD2-CD2 4.33Å; Y50-F65 AromaticContact CD2-CE2 3.86Å; Y50-F65 HydrophobicContact CD2-CE2 3.86Å; Y50-F65 AromaticContact CE2-CD2 3.36Å; Y50-F65 HydrophobicContact CE2-CD2 3.36Å; Y50-F65 AromaticContact CE2-CE2 3.3Å; Y50-F65 HydrophobicContact CE2-CE2 3.3Å; Y50-F65 HydrophobicContact CE2-CG 4.46Å; Y50-F65 HydrophobicContact CE2-CZ 4.38Å; Y50-F65 AromaticContact CZ-CD2 3.97Å; V54-F65 HydrophobicContact CG2-CE2 4.38Å; P61-F65 HydrophobicContact CB-CD2 4.19Å; P61-F65 HydrophobicContact CB-CE1 4.46Å; P61-F65 HydrophobicContact CB-CE2 3.42Å; P61-F65 VanDerWaalsContact CB-CE2 3.42Å; P61-F65 HydrophobicContact CB-CZ 3.58Å; P61-F65 WeakPolarHBondContact O-CB 3.01Å; P61-F65 WeakPolarHBondContact O-CD2 3.35Å; P61-F65 WeakPolarHBondContact O-CE2 3.33Å; P61-F65 WeakPolarHBondContact O-CG 3.37Å; P61-F65 PolarHBondContact O-N 2.88Å; L62-F65 PolarHBondContact O-N 2.82Å; L63-F65 VanDerWaalsContact C-N 3.32Å; L63-F65 PolarHBondContact O-N 2.95Å; F65-K68 CarbonylContact O-C 3.56Å; F65-K68 PolarHBondContact O-N 2.92Å; F65-P69 WeakPolarHBondContact O-CA 3.45Å; F65-W71 HydrophobicContact CD1-CB 3.84Å; F65-W71 HydrophobicContact CE1-CB 4.1Å; F65-L75 HydrophobicContact CD1-CD1 4.39Å; F65-L75 HydrophobicContact CE1-CD1 3.33Å; F65-L75 HydrophobicContact CE2-CD1 4.41Å; F65-L75 HydrophobicContact CZ-CD1 3.34Å
66	R	73.4	Confident	76.7	Confident	89 Å²	89	81.1 Å²	81.1	34%	0.336	40%	0.396	S	S	.	.	H	α-helix	trans	-67	-40.1	171.9	-164	179.3	-172.9	-177	3.4	112	L62 L63 L64 V232 D233 L236	L62-R66 WeakPolarHBondContact O-CB 3.41Å; L62-R66 PolarHBondContact O-N 2.87Å; L63-R66 WeakPolarHBondContact O-CB 3.35Å; L63-R66 PolarHBondContact O-N 3.27Å; L63-R66 VanDerWaalsContact O-N 3.15Å; L64-R66 VanDerWaalsContact C-N 3.32Å; L64-R66 PolarHBondContact O-N 2.79Å; R66-V232 PolarHBondContact NH1-O 2.83Å; R66-V232 PolarHBondContact NH2-O 3.43Å; R66-D233 IonicContact CZ-OD1 2.65Å; R66-D233 IonicContact NH2-OD1 3.66Å; R66-D233 PolarHBondContact NH2-OD1 3.19Å; R66-L236 VanDerWaalsContact NH1-CB 3.34Å
67	W	71.1	Confident	76.7	Confident	119 Å²	119	75.2 Å²	75.2	45%	0.451	37%	0.367	S	S	.	.	H	α-helix	trans	-76.7	-25.9	175.9	-62.4	-22.2	0	0	0	113.3	L63 L64 L236 P238	L63-W67 PolarHBondContact O-N 2.87Å; L63-W67 VanDerWaalsContact O-N 3.08Å; L64-W67 PolarHBondContact O-N 3.47Å; W67-L236 PolarHBondContact NE1-O 2.89Å; W67-P238 HydrophobicContact CD2-CG 4.35Å; W67-P238 HydrophobicContact CH2-CB 4.43Å; W67-P238 HydrophobicContact CH2-CG 4.38Å; W67-P238 HydrophobicContact CZ2-CB 4.2Å; W67-P238 HydrophobicContact CZ2-CG 3.84Å
68	K	75.9	Confident	76.7	Confident	132 Å²	132	75.5 Å²	75.5	57%	0.574	36%	0.362	S	S	*	.	S	Bend	trans	-132.6	75.7	177.8	-66	-66.3	-175.8	-178.5	0	110.1	L64 F65 L70 W71	L64-K68 WeakPolarHBondContact O-CB 3.46Å; L64-K68 PolarHBondContact O-N 2.93Å; F65-K68 CarbonylContact O-C 3.56Å; F65-K68 PolarHBondContact O-N 2.92Å; K68-L70 PolarHBondContact O-N 3Å; K68-W71 HydrophobicContact CB-CB 4.43Å; K68-W71 HydrophobicContact CB-CG 4.08Å; K68-W71 WeakPolarHBondContact O-CB 3.16Å; K68-W71 PolarHBondContact O-N 2.74Å
69	P	70.4	Confident	76.7	Confident	54 Å²	54	75 Å²	75	35%	0.351	35%	0.35	S	S	.	.	H	α-helix	trans	-57.2	-30	-174	19.7	-32	0	0	0	113.8	F65 W71 G72 V73 T104	F65-P69 WeakPolarHBondContact O-CA 3.45Å; P69-W71 VanDerWaalsContact C-N 3.28Å; P69-W71 PolarHBondContact O-N 3.26Å; P69-G72 PolarHBondContact O-N 3.44Å; P69-V73 WeakPolarHBondContact O-CG2 3.21Å; P69-V73 PolarHBondContact O-N 3.08Å; P69-T104 HydrophobicContact CB-CG2 4.26Å
70	L	73.8	Confident	76.9	Confident	26 Å²	26	74.9 Å²	74.9	14%	0.136	35%	0.347	C	S	.	.	H	α-helix	trans	-59.9	-35.8	176.1	-167.7	72.8	0	0	0	113.3	K68 V73 R74 V89 L102	K68-L70 PolarHBondContact O-N 3Å; L70-V73 PolarHBondContact O-N 2.93Å; L70-R74 HydrophobicContact CG-CG 4.39Å; L70-R74 WeakPolarHBondContact O-CB 3.32Å; L70-R74 WeakPolarHBondContact O-CG 3.36Å; L70-R74 PolarHBondContact O-N 3.37Å; L70-V89 HydrophobicContact CD1-CG1 3.83Å; L70-V89 HydrophobicContact CD1-CG2 4.32Å; L70-L102 HydrophobicContact CB-CD2 4.34Å; L70-L102 HydrophobicContact CD1-CD2 3.62Å; L70-L102 HydrophobicContact CD2-CD2 3.72Å; L70-L102 HydrophobicContact CG-CD2 4.08Å
71	W	78.4	Confident	77.2	Confident	164 Å²	164	74.3 Å²	74.3	62%	0.621	34%	0.344	S	S	*	.	H	α-helix	trans	-68	-43.6	-179.5	-71.5	48.6	0	0	0	109.4	F65 K68 P69 V73 R74 L75	F65-W71 HydrophobicContact CD1-CB 3.84Å; F65-W71 HydrophobicContact CE1-CB 4.1Å; K68-W71 HydrophobicContact CB-CB 4.43Å; K68-W71 HydrophobicContact CB-CG 4.08Å; K68-W71 WeakPolarHBondContact O-CB 3.16Å; K68-W71 PolarHBondContact O-N 2.74Å; P69-W71 VanDerWaalsContact C-N 3.28Å; P69-W71 PolarHBondContact O-N 3.26Å; W71-V73 PolarHBondContact O-N 3.45Å; W71-R74 PolarHBondContact O-N 2.82Å; W71-L75 VanDerWaalsContact O-CB 3.31Å; W71-L75 WeakPolarHBondContact O-CB 3.46Å; W71-L75 WeakPolarHBondContact O-CD1 3.4Å; W71-L75 WeakPolarHBondContact O-CG 3.39Å; W71-L75 PolarHBondContact O-N 3.3Å
72	G	74.7	Confident	77.4	Confident	10 Å²	10	74 Å²	74	10%	0.103	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-44.3	172.9	0	0	0	0	0	112.5	P69 L75 R76	P69-G72 PolarHBondContact O-N 3.44Å; G72-L75 PolarHBondContact O-N 3.49Å; G72-R76 WeakPolarHBondContact O-CB 3.29Å; G72-R76 PolarHBondContact O-N 3.28Å
73	V	77.6	Confident	77.5	Confident	16 Å²	16	70.9 Å²	70.9	10%	0.097	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-48	176.4	166.8	0	0	0	0	111.8	Y40 P69 L70 W71 L75 R76 L77 V89 T104	Y40-V73 HydrophobicContact CD1-CG1 3.95Å; Y40-V73 HydrophobicContact CD2-CG1 4.01Å; Y40-V73 HydrophobicContact CE1-CG1 4.15Å; Y40-V73 HydrophobicContact CE2-CG1 4.2Å; Y40-V73 HydrophobicContact CG-CG1 3.88Å; P69-V73 WeakPolarHBondContact O-CG2 3.21Å; P69-V73 PolarHBondContact O-N 3.08Å; L70-V73 PolarHBondContact O-N 2.93Å; W71-V73 PolarHBondContact O-N 3.45Å; V73-L75 VanDerWaalsContact C-N 3.32Å; V73-L75 PolarHBondContact O-N 3.35Å; V73-R76 PolarHBondContact O-N 3.48Å; V73-L77 HydrophobicContact CG1-CD1 4.18Å; V73-L77 WeakPolarHBondContact O-CA 3.35Å; V73-L77 VanDerWaalsContact O-CB 3.3Å; V73-L77 WeakPolarHBondContact O-CB 3.35Å; V73-L77 PolarHBondContact O-N 2.93Å; V73-V89 HydrophobicContact CG1-CG2 3.89Å; V73-T104 HydrophobicContact CG2-CG2 3.81Å
74	R	79.3	Confident	77.9	Confident	140 Å²	140	76.9 Å²	76.9	53%	0.528	35%	0.347	S	S	.	.	H	α-helix	trans	-66.4	-33.1	-179.2	-74.1	179.4	179.8	-173.9	-0.3	113	R46 L70 W71	R46-R74 PolarHBondContact NH1-O 2.68Å; L70-R74 HydrophobicContact CG-CG 4.39Å; L70-R74 WeakPolarHBondContact O-CB 3.32Å; L70-R74 WeakPolarHBondContact O-CG 3.36Å; L70-R74 PolarHBondContact O-N 3.37Å; W71-R74 PolarHBondContact O-N 2.82Å
75	L	77.7	Confident	78.4	Confident	92 Å²	92	72.4 Å²	72.4	48%	0.482	32%	0.324	S	S	.	.	H	α-helix	trans	-74.5	-41.6	176.8	-81.1	157.2	0	0	0	111.8	R46 F65 W71 G72 V73	R46-L75 WeakPolarHBondContact CB-O 3.37Å; F65-L75 HydrophobicContact CD1-CD1 4.39Å; F65-L75 HydrophobicContact CE1-CD1 3.33Å; F65-L75 HydrophobicContact CE2-CD1 4.41Å; F65-L75 HydrophobicContact CZ-CD1 3.34Å; W71-L75 VanDerWaalsContact O-CB 3.31Å; W71-L75 WeakPolarHBondContact O-CB 3.46Å; W71-L75 WeakPolarHBondContact O-CD1 3.4Å; W71-L75 WeakPolarHBondContact O-CG 3.39Å; W71-L75 PolarHBondContact O-N 3.3Å; G72-L75 PolarHBondContact O-N 3.49Å; V73-L75 VanDerWaalsContact C-N 3.32Å; V73-L75 PolarHBondContact O-N 3.35Å
76	R	78.2	Confident	78.9	Confident	114 Å²	114	75.4 Å²	75.4	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-84.9	-34.4	-175.2	-169.7	179.1	-179.8	-171.1	0.2	113.7	R46 V47 Y50 G72 V73	R46-R76 WeakPolarHBondContact CB-O 3.38Å; V47-R76 HydrophobicContact CB-CG 4.47Å; V47-R76 HydrophobicContact CG2-CG 3.65Å; Y50-R76 HydrophobicContact CD2-CB 4.44Å; G72-R76 WeakPolarHBondContact O-CB 3.29Å; G72-R76 PolarHBondContact O-N 3.28Å; V73-R76 PolarHBondContact O-N 3.48Å
77	L	83.8	Confident	79.5	Confident	15 Å²	15	72 Å²	72	8%	0.079	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	158.2	-168.2	-53.2	178.4	0	0	0	111.8	Y40 C41 R46 V73 T87	Y40-L77 HydrophobicContact CD1-CB 4.22Å; Y40-L77 HydrophobicContact CG-CB 4.43Å; C41-L77 WeakPolarHBondContact O-CA 3.43Å; C41-L77 WeakPolarHBondContact O-CB 3.37Å; R46-L77 PolarHBondContact NH1-O 2.78Å; V73-L77 HydrophobicContact CG1-CD1 4.18Å; V73-L77 WeakPolarHBondContact O-CA 3.35Å; V73-L77 VanDerWaalsContact O-CB 3.3Å; V73-L77 WeakPolarHBondContact O-CB 3.35Å; V73-L77 PolarHBondContact O-N 2.93Å; L77-T87 HydrophobicContact CD1-CG2 4Å
78	R	83.8	Confident	80.3	Confident	119 Å²	119	66.3 Å²	66.3	45%	0.449	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	140.6	173.1	-72.7	-177.9	-175.2	-160.7	-0.2	109.8	Y40 C41 S43 C80	Y40-R78 CarbonylContact C-O 3.57Å; Y40-R78 VanDerWaalsContact CA-O 3.27Å; Y40-R78 WeakPolarHBondContact CA-O 2.98Å; C41-R78 PolarHBondContact N-O 3.46Å; C41-R78 PolarHBondContact O-N 3.46Å; S43-R78 PolarHBondContact OG-NE 3.28Å; R78-C80 PolarHBondContact O-N 2.95Å
79	P	82.5	Confident	80.7	Confident	82 Å²	82	60 Å²	60	53%	0.532	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	136.5	170.8	-18.1	29.8	0	0	0	110.1	G39 Y40	G39-P79 WeakPolarHBondContact O-CA 3.39Å; Y40-P79 HydrophobicContact CD1-CG 4.46Å; Y40-P79 HydrophobicContact CE1-CB 4.36Å; Y40-P79 HydrophobicContact CE1-CG 4.02Å
80	C	82.7	Confident	81.3	Confident	18 Å²	18	57.7 Å²	57.7	12%	0.122	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	171.8	178.1	68.8	0	0	0	0	111.4	G39 C41 R78 A85	G39-C80 PolarHBondContact O-N 3.21Å; C41-C80 HydrophobicContact CB-CB 4.14Å; C41-C80 PolarHBondContact N-SG 2.96Å; C41-C80 VanDerWaalsContact N-SG 3.45Å; C41-C80 VanDerWaalsContact SG-CB 3.59Å; R78-C80 PolarHBondContact O-N 2.95Å; C80-A85 VanDerWaalsContact SG-CA 3.54Å
81	N	82	Confident	81.6	Confident	89 Å²	89	57.5 Å²	57.5	48%	0.476	26%	0.262	S	S	.	.			trans	-64.3	144.8	171.9	-166.7	-6.5	0	0	0	109.9	A83 R84 A85	N81-A83 PolarHBondContact O-N 2.92Å; N81-A83 VanDerWaalsContact O-N 3.15Å; N81-R84 CarbonylContact O-C 3.57Å; N81-R84 PolarHBondContact O-N 3.4Å; N81-A85 PolarHBondContact O-N 3.27Å; N81-A85 VanDerWaalsContact O-N 3.14Å
82	L	81.8	Confident	81.3	Confident	6 Å²	6	50.9 Å²	50.9	3%	0.031	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-53.8	-35.2	177.7	-65.7	172.3	0	0	0	111.6	L19 L37 R84 A85 L88 R163 W174 F181	L19-L82 HydrophobicContact CB-CD1 3.8Å; L19-L82 HydrophobicContact CD1-CD1 4.31Å; L37-L82 HydrophobicContact CD2-CD1 4.15Å; L37-L82 HydrophobicContact CD2-CD2 3.83Å; L37-L82 HydrophobicContact CG-CD2 3.89Å; L82-R84 PolarHBondContact O-N 3.17Å; L82-R84 VanDerWaalsContact O-N 3.12Å; L82-A85 WeakPolarHBondContact O-CB 3.39Å; L82-A85 PolarHBondContact O-N 3.05Å; L82-A85 VanDerWaalsContact O-N 3.16Å; L82-L88 HydrophobicContact CD2-CD2 3.55Å; L82-R163 PolarHBondContact O-NH2 3.14Å; L82-W174 HydrophobicContact CB-CH2 3.98Å; L82-W174 HydrophobicContact CB-CZ3 3.66Å; L82-F181 HydrophobicContact CB-CE2 4.42Å
83	A	78.3	Confident	80.8	Confident	22 Å²	22	55.3 Å²	55.3	18%	0.182	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-58.2	-23.1	174.4	0	0	0	0	0	114.1	N81 R163 W174	N81-A83 PolarHBondContact O-N 2.92Å; N81-A83 VanDerWaalsContact O-N 3.15Å; A83-R163 VanDerWaalsContact C-NH1 3.32Å; A83-R163 PolarHBondContact O-NH1 2.72Å; A83-R163 PolarHBondContact O-NH2 3.38Å; A83-W174 VanDerWaalsContact CA-CZ2 3.45Å; A83-W174 HydrophobicContact CB-CH2 3.78Å; A83-W174 HydrophobicContact CB-CZ2 3.43Å; A83-W174 VanDerWaalsContact CB-CZ2 3.43Å; A83-W174 VanDerWaalsContact N-CH2 3.34Å
84	R	80.6	Confident	79.9	Confident	187 Å²	187	57 Å²	57	71%	0.706	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-120.6	11.5	179.2	-58.8	179.6	76.7	-179.2	6.1	112.6	N81 L82	N81-R84 CarbonylContact O-C 3.57Å; N81-R84 PolarHBondContact O-N 3.4Å; L82-R84 PolarHBondContact O-N 3.17Å; L82-R84 VanDerWaalsContact O-N 3.12Å
85	A	84.4	Confident	78.5	Confident	2 Å²	2	55.8 Å²	55.8	2%	0.017	26%	0.259	C	S	.	.			trans	-73.6	131.1	-178.7	0	0	0	0	0	111.3	C80 N81 L82 L88 V107 R163	C80-A85 VanDerWaalsContact SG-CA 3.54Å; N81-A85 PolarHBondContact O-N 3.27Å; N81-A85 VanDerWaalsContact O-N 3.14Å; L82-A85 WeakPolarHBondContact O-CB 3.39Å; L82-A85 PolarHBondContact O-N 3.05Å; L82-A85 VanDerWaalsContact O-N 3.16Å; A85-L88 HydrophobicContact CB-CD2 3.64Å; A85-V107 WeakPolarHBondContact O-CG2 3.22Å; A85-R163 PolarHBondContact O-NH2 3.39Å
86	E	86.6	Confident	76.9	Confident	88 Å²	88	57.1 Å²	57.1	41%	0.411	26%	0.262	S	S	.	.	S	Bend	trans	-95.7	-31.3	169.8	-65.7	170.5	171	0	0	110.2	Y40 G42 V107	Y40-E86 PolarHBondContact O-N 3.06Å; G42-E86 PolarHBondContact N-OE2 2.73Å; E86-V107 PolarHBondContact O-N 3.49Å
87	T	86.6	Confident	75.5	Confident	17 Å²	17	53 Å²	53	10%	0.104	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135.8	176.1	-57.2	0	0	0	0	109.2	Y40 L77	Y40-T87 PolarHBondContact N-O 3.05Å; Y40-T87 PolarHBondContact O-N 3.15Å; L77-T87 HydrophobicContact CD1-CG2 4Å
88	L	86.8	Confident	73.8	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	140.2	175.7	-60.5	169.3	0	0	0	109.7	L37 S38 L82 A85 T104 V105 V107 Y165 F181	L37-L88 HydrophobicContact CD1-CB 4.09Å; L37-L88 HydrophobicContact CD1-CD1 4.33Å; L37-L88 HydrophobicContact CG-CD2 4.44Å; S38-L88 WeakPolarHBondContact O-CA 3.28Å; L82-L88 HydrophobicContact CD2-CD2 3.55Å; A85-L88 HydrophobicContact CB-CD2 3.64Å; L88-T104 WeakPolarHBondContact O-CA 3.29Å; L88-V105 HydrophobicContact CB-CG2 3.74Å; L88-V105 HydrophobicContact CD1-CG2 4.37Å; L88-V105 PolarHBondContact N-O 3.28Å; L88-V105 PolarHBondContact O-N 2.8Å; L88-V107 HydrophobicContact CD1-CG2 3.7Å; L88-V107 HydrophobicContact CD2-CG2 4.43Å; L88-V107 HydrophobicContact CG-CG2 3.67Å; L88-Y165 HydrophobicContact CD1-CD1 3.31Å; L88-Y165 HydrophobicContact CD1-CE1 3.46Å; L88-Y165 VanDerWaalsContact CD1-CE1 3.46Å; L88-Y165 HydrophobicContact CD1-CG 3.92Å; L88-F181 HydrophobicContact CD1-CD2 4.13Å; L88-F181 HydrophobicContact CD1-CE2 3.82Å; L88-F181 HydrophobicContact CD1-CZ 4.16Å; L88-F181 HydrophobicContact CD2-CE2 4.21Å
89	V	85.2	Confident	72.4	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	121.6	168.8	179.1	0	0	0	0	108.1	S38 Y40 L70 V73 E91 L102 F103 T104	S38-V89 PolarHBondContact N-O 3.37Å; S38-V89 PolarHBondContact O-N 2.96Å; Y40-V89 HydrophobicContact CD2-CB 4.34Å; Y40-V89 HydrophobicContact CD2-CG2 3.63Å; Y40-V89 HydrophobicContact CE2-CB 3.83Å; Y40-V89 HydrophobicContact CE2-CG2 3.32Å; L70-V89 HydrophobicContact CD1-CG1 3.83Å; L70-V89 HydrophobicContact CD1-CG2 4.32Å; V73-V89 HydrophobicContact CG1-CG2 3.89Å; V89-E91 HydrophobicContact CG1-CG 4.16Å; V89-L102 HydrophobicContact CG1-CD2 4.12Å; V89-F103 CarbonylContact C-O 3.06Å; V89-F103 WeakPolarHBondContact CA-O 3.5Å; V89-T104 HydrophobicContact CG2-CG2 4.35Å
90	I	83.9	Confident	71.6	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116.2	177.8	-57.7	166.5	0	0	0	107.4	V35 L37 I92 L102 F103 V105 Y165 F167	V35-I90 HydrophobicContact CG1-CG2 3.88Å; L37-I90 HydrophobicContact CD1-CD1 4.48Å; L37-I90 HydrophobicContact CD1-CG1 3.56Å; I90-I92 HydrophobicContact CG2-CD1 4.35Å; I90-I92 HydrophobicContact CG2-CG1 4.09Å; I90-L102 CarbonylContact O-C 3.55Å; I90-L102 WeakPolarHBondContact O-CA 3.44Å; I90-F103 HydrophobicContact CB-CB 4.32Å; I90-F103 PolarHBondContact N-O 2.77Å; I90-F103 PolarHBondContact O-N 2.86Å; I90-V105 HydrophobicContact CD1-CG1 4.13Å; I90-V105 HydrophobicContact CD1-CG2 3.9Å; I90-V105 HydrophobicContact CG1-CG2 4.45Å; I90-Y165 HydrophobicContact CD1-CE2 4.09Å; I90-F167 HydrophobicContact CD1-CB 4.11Å; I90-F167 HydrophobicContact CD1-CD1 4.09Å; I90-F167 HydrophobicContact CD1-CD2 3.4Å; I90-F167 HydrophobicContact CD1-CE1 4.38Å; I90-F167 HydrophobicContact CD1-CE2 3.74Å; I90-F167 HydrophobicContact CD1-CG 3.59Å; I90-F167 HydrophobicContact CD1-CZ 4.22Å; I90-F167 HydrophobicContact CG2-CE1 4.49Å; I90-F167 HydrophobicContact CG2-CZ 4.24Å
91	E	79.2	Confident	70.9	Confident	22 Å²	22	56.7 Å²	56.7	10%	0.103	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	120.4	174.3	-41.8	-178	146.3	0	0	109.4	V35 R36 V89 W100 Q101 L102	V35-E91 CarbonylContact C-O 3.53Å; V35-E91 WeakPolarHBondContact CA-O 3.33Å; R36-E91 HydrophobicContact CB-CB 4.16Å; R36-E91 VanDerWaalsContact CD-OE2 3.23Å; R36-E91 WeakPolarHBondContact CD-OE2 3.19Å; R36-E91 PolarHBondContact N-O 3.12Å; R36-E91 PolarHBondContact O-N 3.44Å; V89-E91 HydrophobicContact CG1-CG 4.16Å; E91-W100 HydrophobicContact CB-CD2 4.29Å; E91-W100 HydrophobicContact CB-CE3 3.48Å; E91-W100 VanDerWaalsContact CB-CE3 3.48Å; E91-W100 HydrophobicContact CB-CZ3 3.97Å; E91-Q101 CarbonylContact C-O 3.57Å; E91-Q101 VanDerWaalsContact CA-O 3.27Å; E91-Q101 WeakPolarHBondContact CA-O 3.44Å; E91-L102 HydrophobicContact CB-CG 4.49Å; E91-L102 HydrophobicContact CG-CD2 3.88Å; E91-L102 HydrophobicContact CG-CG 4.11Å; E91-L102 WeakPolarHBondContact OE1-CD2 3.31Å
92	I	72.9	Confident	70.6	Confident	26 Å²	26	55.4 Å²	55.4	13%	0.133	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.2	178.8	-63.1	170.2	0	0	0	108.3	V32 V35 I90 Q101 F103 F167	V32-I92 HydrophobicContact CG1-CG2 3.83Å; V32-I92 HydrophobicContact CG2-CG2 4.07Å; V35-I92 HydrophobicContact CG1-CG1 4.41Å; V35-I92 HydrophobicContact CG2-CG1 4.32Å; I90-I92 HydrophobicContact CG2-CD1 4.35Å; I90-I92 HydrophobicContact CG2-CG1 4.09Å; I92-Q101 PolarHBondContact N-O 3.48Å; I92-Q101 PolarHBondContact O-N 2.9Å; I92-F103 HydrophobicContact CD1-CD2 4.13Å; I92-F103 HydrophobicContact CD1-CE2 3.86Å; I92-F167 HydrophobicContact CD1-CE1 4.21Å; I92-F167 HydrophobicContact CD1-CZ 3.91Å
93	R	64.2	Low	70.6	Confident	103 Å²	103	58.6 Å²	58.6	39%	0.389	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	122.5	174.1	-169.5	176.7	-177.5	-179.2	0.7	110.7	S33 S34 W100	S33-R93 PolarHBondContact N-O 2.79Å; S33-R93 WeakPolarHBondContact OG-CB 3.39Å; S33-R93 WeakPolarHBondContact OG-CD 3.41Å; S33-R93 WeakPolarHBondContact OG-CG 3.46Å; S33-R93 PolarHBondContact OG-O 2.82Å; S34-R93 PolarHBondContact O-N 2.88Å; S34-R93 VanDerWaalsContact O-N 3.1Å; S34-R93 WeakPolarHBondContact OG-CB 3.47Å; R93-W100 HydrophobicContact CB-CD2 3.9Å; R93-W100 HydrophobicContact CB-CE3 3.63Å; R93-W100 HydrophobicContact CB-CH2 3.77Å; R93-W100 HydrophobicContact CB-CZ2 4.02Å; R93-W100 HydrophobicContact CB-CZ3 3.57Å; R93-W100 HydrophobicContact CG-CD2 4.36Å; R93-W100 HydrophobicContact CG-CZ2 4.32Å
94	D	57.3	Low	70.8	Confident	50 Å²	50	60.5 Å²	60.5	27%	0.267	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	140.7	172.3	-146.3	-17.2	0	0	0	109.9	E96 D97	D94-E96 PolarHBondContact O-N 2.9Å; D94-D97 PolarHBondContact O-N 2.78Å
95	K	49.8	Very low	71.1	Confident	115 Å²	115	52.5 Å²	52.5	50%	0.5	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.1	-176.8	-80.8	172.5	-174.7	166.9	0	113.1	S30 S31	S30-K95 PolarHBondContact O-NZ 2.9Å; S31-K95 WeakPolarHBondContact O-CB 3.44Å; S31-K95 VanDerWaalsContact O-CG 3.27Å; S31-K95 WeakPolarHBondContact O-CG 3.15Å; S31-K95 PolarHBondContact O-N 3.3Å; S31-K95 VanDerWaalsContact O-N 3.13Å
96	E	45.1	Very low	71.3	Confident	120 Å²	120	59.4 Å²	59.4	56%	0.561	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-23	-174.8	-64.2	-164.1	160.9	0	0	115	D94	D94-E96 PolarHBondContact O-N 2.9Å
97	D	48.5	Very low	71.3	Confident	29 Å²	29	56.2 Å²	56.2	16%	0.155	28%	0.283	C	S	.	.			trans	-120	134.3	-179.4	-143.4	-12.5	0	0	0	110.6	D94 S99 N417 K422	D94-D97 PolarHBondContact O-N 2.78Å; D97-S99 VanDerWaalsContact CG-OG 3.29Å; D97-S99 PolarHBondContact O-N 3.13Å; D97-S99 PolarHBondContact OD2-OG 2.98Å; D97-N417 VanDerWaalsContact CG-ND2 3.29Å; D97-N417 PolarHBondContact OD2-ND2 2.84Å; D97-K422 IonicContact OD1-NZ 3.98Å; D97-K422 IonicContact OD2-NZ 3.28Å
98	S	48.7	Very low	71.4	Confident	101 Å²	101	59.7 Å²	59.7	71%	0.706	30%	0.298	S	S	*	.	S	Bend	trans	-71.1	2	174.9	55.4	0	0	0	0	112.9
99	S	54.4	Low	71.3	Confident	60 Å²	60	64.3 Å²	64.3	42%	0.42	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-94.6	124.4	-179.3	58.8	0	0	0	0	111.8	D97	D97-S99 VanDerWaalsContact CG-OG 3.29Å; D97-S99 PolarHBondContact O-N 3.13Å; D97-S99 PolarHBondContact OD2-OG 2.98Å
100	W	63.8	Low	71.1	Confident	78 Å²	78	67.7 Å²	67.7	30%	0.295	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	135.6	169.7	-67.2	86.1	0	0	0	110.7	S34 R36 E91 R93 L102	S34-W100 VanDerWaalsContact OG-CH2 3.27Å; S34-W100 WeakPolarHBondContact OG-CH2 3.31Å; R36-W100 HydrophobicContact CB-CH2 4.36Å; R36-W100 HydrophobicContact CB-CZ3 4.05Å; E91-W100 HydrophobicContact CB-CD2 4.29Å; E91-W100 HydrophobicContact CB-CE3 3.48Å; E91-W100 VanDerWaalsContact CB-CE3 3.48Å; E91-W100 HydrophobicContact CB-CZ3 3.97Å; R93-W100 HydrophobicContact CB-CD2 3.9Å; R93-W100 HydrophobicContact CB-CE3 3.63Å; R93-W100 HydrophobicContact CB-CH2 3.77Å; R93-W100 HydrophobicContact CB-CZ2 4.02Å; R93-W100 HydrophobicContact CB-CZ3 3.57Å; R93-W100 HydrophobicContact CG-CD2 4.36Å; R93-W100 HydrophobicContact CG-CZ2 4.32Å; W100-L102 HydrophobicContact CB-CD1 4.28Å
101	Q	68.9	Low	70.7	Confident	72 Å²	72	70.7 Å²	70.7	34%	0.336	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	138.4	163.2	-58.4	-158.1	-46.5	0	0	108.9	E91 I92 F103	E91-Q101 CarbonylContact C-O 3.57Å; E91-Q101 VanDerWaalsContact CA-O 3.27Å; E91-Q101 WeakPolarHBondContact CA-O 3.44Å; I92-Q101 PolarHBondContact N-O 3.48Å; I92-Q101 PolarHBondContact O-N 2.9Å; Q101-F103 HydrophobicContact CB-CE2 3.95Å; Q101-F103 HydrophobicContact CB-CZ 4.49Å
102	L	75.6	Confident	70.3	Confident	62 Å²	62	70.7 Å²	70.7	33%	0.325	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.8	-176.5	-65.8	99.3	0	0	0	111	L70 V89 I90 E91 W100	L70-L102 HydrophobicContact CB-CD2 4.34Å; L70-L102 HydrophobicContact CD1-CD2 3.62Å; L70-L102 HydrophobicContact CD2-CD2 3.72Å; L70-L102 HydrophobicContact CG-CD2 4.08Å; V89-L102 HydrophobicContact CG1-CD2 4.12Å; I90-L102 CarbonylContact O-C 3.55Å; I90-L102 WeakPolarHBondContact O-CA 3.44Å; E91-L102 HydrophobicContact CB-CG 4.49Å; E91-L102 HydrophobicContact CG-CD2 3.88Å; E91-L102 HydrophobicContact CG-CG 4.11Å; E91-L102 WeakPolarHBondContact OE1-CD2 3.31Å; W100-L102 HydrophobicContact CB-CD1 4.28Å
103	F	81.9	Confident	69.5	Low	72 Å²	72	72 Å²	72	32%	0.316	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	146.5	175.8	-57.1	-91	0	0	0	109.5	V89 I90 I92 Q101 F167	V89-F103 CarbonylContact C-O 3.06Å; V89-F103 WeakPolarHBondContact CA-O 3.5Å; I90-F103 HydrophobicContact CB-CB 4.32Å; I90-F103 PolarHBondContact N-O 2.77Å; I90-F103 PolarHBondContact O-N 2.86Å; I92-F103 HydrophobicContact CD1-CD2 4.13Å; I92-F103 HydrophobicContact CD1-CE2 3.86Å; Q101-F103 HydrophobicContact CB-CE2 3.95Å; Q101-F103 HydrophobicContact CB-CZ 4.49Å; F103-F167 HydrophobicContact CB-CE2 3.73Å; F103-F167 HydrophobicContact CB-CZ 4.47Å; F103-F167 HydrophobicContact CD1-CE2 4.17Å; F103-F167 HydrophobicContact CD2-CE2 4.1Å; F103-F167 HydrophobicContact CD2-CZ 4.04Å; F103-F167 HydrophobicContact CE2-CZ 4.49Å; F103-F167 AromaticContact CG-CE2 3.73Å; F103-F167 HydrophobicContact CG-CE2 3.73Å; F103-F167 HydrophobicContact CG-CZ 4.14Å
104	T	82.8	Confident	68.7	Low	63 Å²	63	72.4 Å²	72.4	39%	0.387	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	125.7	176.9	55.1	0	0	0	0	108.6	P69 V73 L88 V89	P69-T104 HydrophobicContact CB-CG2 4.26Å; V73-T104 HydrophobicContact CG2-CG2 3.81Å; L88-T104 WeakPolarHBondContact O-CA 3.29Å; V89-T104 HydrophobicContact CG2-CG2 4.35Å
105	V	86	Confident	68.1	Low	19 Å²	19	73.1 Å²	73.1	12%	0.115	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	147	177.9	-61.9	0	0	0	0	110.2	L88 I90 Y165 F167	L88-V105 HydrophobicContact CB-CG2 3.74Å; L88-V105 HydrophobicContact CD1-CG2 4.37Å; L88-V105 PolarHBondContact N-O 3.28Å; L88-V105 PolarHBondContact O-N 2.8Å; I90-V105 HydrophobicContact CD1-CG1 4.13Å; I90-V105 HydrophobicContact CD1-CG2 3.9Å; I90-V105 HydrophobicContact CG1-CG2 4.45Å; V105-Y165 HydrophobicContact CB-CD2 4.39Å; V105-Y165 HydrophobicContact CG2-CD2 3.69Å; V105-Y165 HydrophobicContact CG2-CE2 4.22Å; V105-Y165 HydrophobicContact CG2-CG 4.09Å; V105-F167 HydrophobicContact CG1-CD2 3.93Å
106	Q	88.3	Confident	67.7	Low	146 Å²	146	69 Å²	69	68%	0.682	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	141.2	174.9	-68.9	-159.5	-34.8	0	0	110.7	Y165	Q106-Y165 WeakPolarHBondContact O-CB 3.48Å
107	V	87.5	Confident	67.4	Low	21 Å²	21	68.7 Å²	68.7	13%	0.127	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-84.6	125.7	172.8	-176.7	0	0	0	0	108.1	A85 E86 L88 R163 F181	A85-V107 WeakPolarHBondContact O-CG2 3.22Å; E86-V107 PolarHBondContact O-N 3.49Å; L88-V107 HydrophobicContact CD1-CG2 3.7Å; L88-V107 HydrophobicContact CD2-CG2 4.43Å; L88-V107 HydrophobicContact CG-CG2 3.67Å; V107-R163 HydrophobicContact CG1-CB 4.35Å; V107-F181 HydrophobicContact CG1-CE1 4.47Å; V107-F181 HydrophobicContact CG1-CZ 4.17Å; V107-F181 HydrophobicContact CG2-CZ 4.22Å
108	Q	88.3	Confident	66.5	Low	90 Å²	90	76.3 Å²	76.3	42%	0.421	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	152.9	177.2	-63	-178.6	-6.4	0	0	110	R163 Y164	Q108-R163 WeakPolarHBondContact O-CA 3.38Å; Q108-Y164 HydrophobicContact CB-CD1 4.41Å; Q108-Y164 HydrophobicContact CB-CE1 4.03Å; Q108-Y164 HydrophobicContact CB-CE2 4.17Å; Q108-Y164 PolarHBondContact N-O 3.46Å; Q108-Y164 PolarHBondContact O-N 3.04Å; Q108-Y164 VanDerWaalsContact OE1-CE2 3.27Å; Q108-Y164 VanDerWaalsContact OE1-CZ 3.29Å; Q108-Y164 PolarHBondContact OE1-OH 2.83Å; Q108-Y164 VanDerWaalsContact OE1-OH 3.12Å
109	T	84.6	Confident	65.5	Low	98 Å²	98	76.5 Å²	76.5	60%	0.601	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	129.6	-179.9	57.6	0	0	0	0	110	V161 L162 R163	T109-V161 HydrophobicContact CG2-CG1 4.27Å; T109-L162 CarbonylContact C-O 3.58Å; T109-L162 WeakPolarHBondContact CA-O 3.36Å; T109-R163 HydrophobicContact CG2-CG 3.98Å
110	E	81.7	Confident	64.3	Low	70 Å²	70	79.1 Å²	79.1	33%	0.327	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	130.7	-178.1	-174.9	171.6	-169.2	0	0	109.3	V161 L162 Y164 R171	E110-V161 CarbonylContact O-C 3.56Å; E110-V161 WeakPolarHBondContact O-CA 3.43Å; E110-L162 PolarHBondContact N-O 3.07Å; E110-L162 PolarHBondContact O-N 2.82Å; E110-Y164 HydrophobicContact CB-CE1 4.03Å; E110-R171 IonicContact OE2-NH2 3.28Å; E110-R171 PolarHBondContact OE2-NH2 2.93Å
111	A	75.6	Confident	62.7	Low	68 Å²	68	81.3 Å²	81.3	56%	0.562	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	131.4	-179.7	0	0	0	0	0	110.4
112	I	71.5	Confident	60.8	Low	21 Å²	21	87 Å²	87	11%	0.108	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.5	173.3	-58.3	174.2	0	0	0	108.1	V134 R160 L162 A213	I112-V134 HydrophobicContact CD1-CG1 4.23Å; I112-R160 PolarHBondContact N-O 2.97Å; I112-L162 HydrophobicContact CD1-CB 3.97Å; I112-L162 HydrophobicContact CG1-CB 4.28Å; I112-A213 HydrophobicContact CG1-CB 4.4Å
113	G	55.9	Low	58.4	Low	53 Å²	53	88.9 Å²	88.9	55%	0.546	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-64.7	140.8	180	0	0	0	0	0	113.2	G115	G113-G115 PolarHBondContact O-N 3.22Å
114	E	45.8	Very low	55.8	Low	112 Å²	112	94.5 Å²	94.5	52%	0.523	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-70.1	-25.4	-173.5	-81.1	-174.8	132.5	0	0	114.8	S116 G157 R158	E114-S116 PolarHBondContact O-N 2.88Å; E114-G157 VanDerWaalsContact CD-CA 3.45Å; E114-G157 VanDerWaalsContact OE1-C 3.23Å; E114-G157 WeakPolarHBondContact OE1-CA 3.28Å; E114-G157 WeakPolarHBondContact OE2-CA 3.36Å; E114-R158 WeakPolarHBondContact OE1-CA 3.19Å; E114-R158 PolarHBondContact OE1-N 2.84Å; E114-R158 VanDerWaalsContact OE1-O 3.11Å
115	G	44.9	Very low	53.6	Low	66 Å²	66	97.9 Å²	97.9	68%	0.68	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-74.1	19	-175.1	0	0	0	0	0	115.2	G113 Q206	G113-G115 PolarHBondContact O-N 3.22Å; G115-Q206 PolarHBondContact O-NE2 3.11Å
116	S	41.5	Very low	50.8	Low	29 Å²	29	105.7 Å²	105.7	20%	0.203	61%	0.608	C	S	.	*	G	3₁₀ helix	trans	-123.2	7	-163.9	-58.7	0	0	0	0	117.5	E114	E114-S116 PolarHBondContact O-N 2.88Å
117	L	38.8	Very low	47.9	Very low	112 Å²	112	105.6 Å²	105.6	59%	0.586	61%	0.612	S	S	*	*			trans	-148.4	64.3	179.9	-80.4	163.6	0	0	0	111.4
118	E	29.8	Very low	45.2	Very low	190 Å²	190	109 Å²	109	89%	0.888	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-98.4	120.9	155.9	-80.7	-169.4	162	0	0	108.3
119	P	28.8	Very low	42.2	Very low	104 Å²	104	113.2 Å²	113.2	68%	0.675	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-69.7	142.9	171.5	28.9	-30.6	0	0	0	109.4
120	P	27.5	Very low	39.7	Very low	115 Å²	115	114.4 Å²	114.4	75%	0.747	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-61.9	138.9	175.6	24.5	-31.4	0	0	0	110.2	Q122	P120-Q122 VanDerWaalsContact C-N 3.35Å; P120-Q122 PolarHBondContact O-N 2.83Å
121	P	30.3	Very low	37.2	Very low	124 Å²	124	119.8 Å²	119.8	81%	0.805	70%	0.702	S	S	*	*	S	Bend	trans	-80.3	84.4	178.8	32.1	-30.9	0	0	0	109.1
122	Q	29.8	Very low	35.1	Very low	192 Å²	192	120.3 Å²	120.3	90%	0.897	71%	0.706	S	S	*	*			trans	166.6	93.2	151.3	-93	162.1	21.1	0	0	110.9	P120	P120-Q122 VanDerWaalsContact C-N 3.35Å; P120-Q122 PolarHBondContact O-N 2.83Å
123	A	25.5	Very low	33.2	Very low	101 Å²	101	121.9 Å²	121.9	84%	0.835	72%	0.722	S	S	*	*			trans	-162.2	100.5	149.6	0	0	0	0	0	107.9
124	Q	27.5	Very low	32.2	Very low	190 Å²	190	120.8 Å²	120.8	89%	0.888	71%	0.705	S	S	*	*			trans	-67.1	131.2	171	-78.1	175.8	-35.2	0	0	109.6
125	V	35.2	Very low	31.6	Very low	134 Å²	134	116.6 Å²	116.6	81%	0.812	69%	0.691	S	S	*	*	S	Bend	trans	37.1	93.3	142.5	-167.1	0	0	0	0	116.2
126	E	28.8	Very low	30.8	Very low	183 Å²	183	116.1 Å²	116.1	86%	0.855	68%	0.681	S	S	*	*				179.6	141.1	125.1	-98.8	-180	177.8	0	0	110.1
127	D	26.1	Very low	30.3	Very low	144 Å²	144	119.6 Å²	119.6	77%	0.77	70%	0.701	S	S	*	*			trans	99	105.1	172.9	-70.7	-18.5	0	0	0	119.2	R129	D127-R129 VanDerWaalsContact C-N 3.26Å; D127-R129 PolarHBondContact O-N 2.76Å
128	G	30.6	Very low	29.8	Very low	93 Å²	93	119.9 Å²	119.9	96%	0.959	71%	0.709	S	S	*	*			trans	-71.8	65	173.8	0	0	0	0	0	114
129	R	27.2	Very low	29.8	Very low	178 Å²	178	120.7 Å²	120.7	67%	0.672	71%	0.713	S	S	*	*			trans	-114.8	106.4	170.4	-74.2	-176.2	178.8	-176.6	2.3	111.4	D127	D127-R129 VanDerWaalsContact C-N 3.26Å; D127-R129 PolarHBondContact O-N 2.76Å
130	S	30.2	Very low	30.1	Very low	123 Å²	123	119.2 Å²	119.2	86%	0.86	72%	0.717	S	S	*	*			trans	51.8	75.8	145.4	-46.6	0	0	0	0	118.5
131	Q	30.8	Very low	30.3	Very low	184 Å²	184	117.4 Å²	117.4	86%	0.86	71%	0.712	S	S	*	*			trans	-95.1	113.4	148.5	-71.8	-172.8	-2.5	0	0	108.4	A133	Q131-A133 VanDerWaalsContact C-N 3.28Å; Q131-A133 PolarHBondContact O-N 2.9Å
132	A	30.8	Very low	30.2	Very low	79 Å²	79	122.7 Å²	122.7	65%	0.653	72%	0.716	S	S	*	*			trans	-64.7	93	168.4	0	0	0	0	0	108.2	V134	A132-V134 PolarHBondContact O-N 3.5Å
133	A	30.9	Very low	30.1	Very low	54 Å²	54	123 Å²	123	45%	0.446	71%	0.714	S	S	.	*			trans	-68.8	87.3	171.6	0	0	0	0	0	108.5	Q131 G135 T177	Q131-A133 VanDerWaalsContact C-N 3.28Å; Q131-A133 PolarHBondContact O-N 2.9Å; A133-G135 VanDerWaalsContact C-N 3.34Å; A133-G135 PolarHBondContact O-N 3.02Å; A133-T177 HydrophobicContact CB-CG2 4.14Å
134	V	34.6	Very low	30.2	Very low	30 Å²	30	126.3 Å²	126.3	18%	0.182	72%	0.718	C	S	.	*			trans	-67.6	97.5	167.1	-177.1	0	0	0	0	106.5	I112 A132 L162	I112-V134 HydrophobicContact CD1-CG1 4.23Å; A132-V134 PolarHBondContact O-N 3.5Å; V134-L162 HydrophobicContact CG1-CD1 4.22Å
135	G	33	Very low	30.3	Very low	24 Å²	24	123.8 Å²	123.8	25%	0.247	72%	0.716	C	S	.	*	P	Polyproline II helix	trans	-64.9	130.9	-175	0	0	0	0	0	112.4	A133	A133-G135 VanDerWaalsContact C-N 3.34Å; A133-G135 PolarHBondContact O-N 3.02Å
136	A	29.3	Very low	29.8	Very low	55 Å²	55	122.4 Å²	122.4	46%	0.455	72%	0.718	S	S	.	*	P	Polyproline II helix	trans	-80.3	136.1	166.1	0	0	0	0	0	109.6	R160	A136-R160 HydrophobicContact CB-CG 4.45Å
137	V	30.2	Very low	29.7	Very low	103 Å²	103	122.5 Å²	122.5	62%	0.624	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-97.9	134.4	163.1	-179	0	0	0	0	107.7	E139	V137-E139 PolarHBondContact O-N 3.27Å
138	P	29.6	Very low	29.8	Very low	117 Å²	117	123 Å²	123	76%	0.76	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-66	124.8	170.7	-10.2	24.6	0	0	0	109.6	G140	P138-G140 PolarHBondContact O-N 2.94Å; P138-G140 VanDerWaalsContact O-N 3.12Å
139	E	29.8	Very low	29.7	Very low	207 Å²	207	127 Å²	127	97%	0.967	71%	0.714	S	S	*	*			trans	-65.2	111.3	166.5	-87.6	-169.4	156.4	0	0	109.3	V137	V137-E139 PolarHBondContact O-N 3.27Å
140	G	34.3	Very low	29.8	Very low	74 Å²	74	128.7 Å²	128.7	76%	0.763	73%	0.726	S	S	*	*			trans	-175.2	60.7	176.3	0	0	0	0	0	111.1	P138	P138-G140 PolarHBondContact O-N 2.94Å; P138-G140 VanDerWaalsContact O-N 3.12Å
141	A	30.8	Very low	29.6	Very low	77 Å²	77	127.1 Å²	127.1	64%	0.636	72%	0.715	S	S	*	*			trans	-167.1	37	166.3	0	0	0	0	0	113.8
142	W	28.3	Very low	29.4	Very low	235 Å²	235	127.1 Å²	127.1	89%	0.89	72%	0.715	S	S	*	*	S	Bend	trans	-127.6	128.9	167	-80.6	53.8	0	0	0	109
143	K	29.3	Very low	29.2	Very low	199 Å²	199	132.4 Å²	132.4	87%	0.865	73%	0.726	S	S	*	*			trans	90.9	85	179.5	-56.3	178.6	178.2	177.7	0	116.3
144	D	27.5	Very low	29.2	Very low	169 Å²	169	134.7 Å²	134.7	90%	0.904	75%	0.745	S	S	*	*			trans	-100.9	83.7	140.1	-103.1	-21.3	0	0	0	108
145	T	28.3	Very low	29.1	Very low	138 Å²	138	140.3 Å²	140.3	85%	0.847	78%	0.779	S	S	*	*	S	Bend	trans	-169.2	131.8	137.8	-3.6	0	0	0	0	109.1
146	A	25.8	Very low	29	Very low	104 Å²	104	144.7 Å²	144.7	86%	0.86	81%	0.806	S	S	*	*			trans	85	102.9	176.1	0	0	0	0	0	117.2
147	Q	27.4	Very low	29.3	Very low	185 Å²	185	144 Å²	144	86%	0.864	80%	0.804	S	S	*	*			trans	-64.2	168.2	165.2	-70.2	171.2	-28.1	0	0	112.7
148	L	28.1	Very low	29.7	Very low	155 Å²	155	149.4 Å²	149.4	81%	0.812	81%	0.813	S	S	*	*			trans	93.3	71.5	166.9	-72	125.3	0	0	0	118.7
149	H	27.5	Very low	30.6	Very low	178 Å²	178	151.2 Å²	151.2	82%	0.824	81%	0.809	S	S	*	*				-172.3	115.6	113.2	-109.6	64.6	0	0	0	109.3
150	K	29.3	Very low	32.2	Very low	212 Å²	212	146.8 Å²	146.8	92%	0.922	78%	0.784	S	S	*	*			trans	-90.2	118.9	161.2	-92.4	-177.6	173.2	179.1	0	106.8
151	S	25	Very low	34.2	Very low	90 Å²	90	146.2 Å²	146.2	63%	0.629	77%	0.765	S	S	*	*			trans	-172.7	126.2	146.1	49	0	0	0	0	110.3
152	E	27.5	Very low	36.8	Very low	184 Å²	184	142.6 Å²	142.6	86%	0.86	74%	0.735	S	S	*	*	S	Bend	trans	63	74.9	146.6	-63.1	177.3	154	0	0	118.7
153	E	27.1	Very low	39.6	Very low	190 Å²	190	133 Å²	133	89%	0.888	70%	0.699	S	S	*	*			trans	-155.6	30.4	152.5	-118.4	172.6	-157.4	0	0	112.7	V155	E153-V155 PolarHBondContact O-N 2.91Å
154	A	29.7	Very low	42.4	Very low	102 Å²	102	125.1 Å²	125.1	84%	0.843	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	49.2	179.7	0	0	0	0	0	112.7
155	V	32.7	Very low	45.4	Very low	148 Å²	148	117.6 Å²	117.6	90%	0.897	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.7	20.1	171.5	-164.5	0	0	0	0	113.6	E153	E153-V155 PolarHBondContact O-N 2.91Å
156	S	30.6	Very low	48.1	Very low	116 Å²	116	115.2 Å²	115.2	81%	0.811	61%	0.605	S	S	*	*	S	Bend	trans	-133.6	112.9	178.8	-156.4	0	0	0	0	114.3
157	G	35.8	Very low	50.9	Low	41 Å²	41	111.4 Å²	111.4	42%	0.423	57%	0.569	S	S	.	*			trans	67.9	103.8	146.3	0	0	0	0	0	120.3	E114 K159	E114-G157 VanDerWaalsContact CD-CA 3.45Å; E114-G157 VanDerWaalsContact OE1-C 3.23Å; E114-G157 WeakPolarHBondContact OE1-CA 3.28Å; E114-G157 WeakPolarHBondContact OE2-CA 3.36Å; G157-K159 PolarHBondContact O-N 3.41Å
158	R	39	Very low	53.4	Low	217 Å²	217	106 Å²	106	82%	0.819	54%	0.543	S	S	*	.			trans	-74.1	85.5	160.7	-84.8	-179.5	174.8	165.9	-0.6	109.6	E114 R160	E114-R158 WeakPolarHBondContact OE1-CA 3.19Å; E114-R158 PolarHBondContact OE1-N 2.84Å; E114-R158 VanDerWaalsContact OE1-O 3.11Å; R158-R160 PolarHBondContact O-N 3.35Å; R158-R160 VanDerWaalsContact O-N 3.11Å
159	K	48.2	Very low	55.8	Low	154 Å²	154	99.8 Å²	99.8	67%	0.67	52%	0.517	S	S	*	.			trans	-59.7	114.3	169.7	-73	177.5	-178.4	170.5	0	110.6	G157	G157-K159 PolarHBondContact O-N 3.41Å
160	R	63.8	Low	58.4	Low	114 Å²	114	92.6 Å²	92.6	43%	0.43	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	127.1	172	-66.4	-173.9	-174.6	-179.2	3.5	108.7	I112 A136 R158	I112-R160 PolarHBondContact N-O 2.97Å; A136-R160 HydrophobicContact CB-CG 4.45Å; R158-R160 PolarHBondContact O-N 3.35Å; R158-R160 VanDerWaalsContact O-N 3.11Å
161	V	76.8	Confident	61.1	Low	62 Å²	62	83.3 Å²	83.3	38%	0.376	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122	-177.3	-178.9	0	0	0	0	110	T109 E110	T109-V161 HydrophobicContact CG2-CG1 4.27Å; E110-V161 CarbonylContact O-C 3.56Å; E110-V161 WeakPolarHBondContact O-CA 3.43Å
162	L	84.2	Confident	64	Low	1 Å²	1	81.1 Å²	81.1	1%	0.005	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	125.1	171.8	-176.7	68.1	0	0	0	109.9	T109 E110 I112 V134 Y164 I173 A213	T109-L162 CarbonylContact C-O 3.58Å; T109-L162 WeakPolarHBondContact CA-O 3.36Å; E110-L162 PolarHBondContact N-O 3.07Å; E110-L162 PolarHBondContact O-N 2.82Å; I112-L162 HydrophobicContact CD1-CB 3.97Å; I112-L162 HydrophobicContact CG1-CB 4.28Å; V134-L162 HydrophobicContact CG1-CD1 4.22Å; L162-Y164 HydrophobicContact CD2-CD1 4.48Å; L162-Y164 HydrophobicContact CG-CD1 4.49Å; L162-I173 HydrophobicContact CD1-CB 4.35Å; L162-I173 HydrophobicContact CD1-CG2 4.24Å; L162-A213 WeakPolarHBondContact CD2-O 3.41Å
163	R	87.4	Confident	66.9	Low	35 Å²	35	72.8 Å²	72.8	13%	0.132	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.9	174.3	-62.1	-178.7	57.9	-134.5	7.5	110	L82 A83 A85 V107 Q108 T109 W174	L82-R163 PolarHBondContact O-NH2 3.14Å; A83-R163 VanDerWaalsContact C-NH1 3.32Å; A83-R163 PolarHBondContact O-NH1 2.72Å; A83-R163 PolarHBondContact O-NH2 3.38Å; A85-R163 PolarHBondContact O-NH2 3.39Å; V107-R163 HydrophobicContact CG1-CB 4.35Å; Q108-R163 WeakPolarHBondContact O-CA 3.38Å; T109-R163 HydrophobicContact CG2-CG 3.98Å; R163-W174 HydrophobicContact CB-CB 3.93Å; R163-W174 PolarHBondContact O-N 2.86Å
164	Y	88.9	Confident	69.6	Low	33 Å²	33	64.6 Å²	64.6	13%	0.129	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	164.8	179.8	71.1	-85.2	0	0	0	112.4	Q108 E110 L162 L166 R171 Y172	Q108-Y164 HydrophobicContact CB-CD1 4.41Å; Q108-Y164 HydrophobicContact CB-CE1 4.03Å; Q108-Y164 HydrophobicContact CB-CE2 4.17Å; Q108-Y164 PolarHBondContact N-O 3.46Å; Q108-Y164 PolarHBondContact O-N 3.04Å; Q108-Y164 VanDerWaalsContact OE1-CE2 3.27Å; Q108-Y164 VanDerWaalsContact OE1-CZ 3.29Å; Q108-Y164 PolarHBondContact OE1-OH 2.83Å; Q108-Y164 VanDerWaalsContact OE1-OH 3.12Å; E110-Y164 HydrophobicContact CB-CE1 4.03Å; L162-Y164 HydrophobicContact CD2-CD1 4.48Å; L162-Y164 HydrophobicContact CG-CD1 4.49Å; Y164-L166 HydrophobicContact CE2-CG 4.36Å; Y164-R171 HydrophobicContact CD2-CG 3.87Å; Y164-R171 HydrophobicContact CG-CG 4.38Å; Y164-Y172 CarbonylContact C-O 3.51Å; Y164-Y172 WeakPolarHBondContact CA-O 3.31Å; Y164-Y172 WeakPolarHBondContact CB-O 3.3Å
165	Y	89.8	Confident	71.9	Confident	10 Å²	10	61 Å²	61	4%	0.039	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	159.7	165.9	69.2	-90.9	0	0	0	110.4	L88 I90 V105 Q106 F167 Y172 F181	L88-Y165 HydrophobicContact CD1-CD1 3.31Å; L88-Y165 HydrophobicContact CD1-CE1 3.46Å; L88-Y165 VanDerWaalsContact CD1-CE1 3.46Å; L88-Y165 HydrophobicContact CD1-CG 3.92Å; I90-Y165 HydrophobicContact CD1-CE2 4.09Å; V105-Y165 HydrophobicContact CB-CD2 4.39Å; V105-Y165 HydrophobicContact CG2-CD2 3.69Å; V105-Y165 HydrophobicContact CG2-CE2 4.22Å; V105-Y165 HydrophobicContact CG2-CG 4.09Å; Q106-Y165 WeakPolarHBondContact O-CB 3.48Å; Y165-F167 HydrophobicContact CD2-CB 4.04Å; Y165-F167 HydrophobicContact CE2-CB 3.77Å; Y165-Y172 HydrophobicContact CD2-CD2 4.17Å; Y165-Y172 VanDerWaalsContact CE1-CB 3.42Å; Y165-Y172 HydrophobicContact CE1-CG 4.03Å; Y165-Y172 AromaticContact CE2-CD2 3.52Å; Y165-Y172 HydrophobicContact CE2-CD2 3.52Å; Y165-Y172 HydrophobicContact CE2-CE2 4.22Å; Y165-Y172 AromaticContact CE2-CG 3.76Å; Y165-Y172 HydrophobicContact CE2-CG 3.76Å; Y165-Y172 VanDerWaalsContact CZ-CB 3.42Å; Y165-Y172 AromaticContact CZ-CD2 3.77Å; Y165-Y172 AromaticContact CZ-CG 3.48Å; Y165-Y172 VanDerWaalsContact CZ-CG 3.48Å; Y165-Y172 PolarHBondContact N-O 2.72Å; Y165-Y172 PolarHBondContact O-N 3.21Å; Y165-F181 AromaticContact CD1-CD1 3.68Å; Y165-F181 HydrophobicContact CD1-CD1 3.68Å; Y165-F181 HydrophobicContact CD1-CD2 4.48Å; Y165-F181 AromaticContact CD1-CE1 3.89Å; Y165-F181 HydrophobicContact CD1-CE1 3.89Å; Y165-F181 HydrophobicContact CD1-CG 4Å; Y165-F181 HydrophobicContact CD1-CZ 4.4Å; Y165-F181 HydrophobicContact CE1-CB 3.65Å; Y165-F181 AromaticContact CE1-CD1 3.65Å; Y165-F181 HydrophobicContact CE1-CD1 3.65Å; Y165-F181 HydrophobicContact CE1-CD2 4.03Å; Y165-F181 HydrophobicContact CE1-CE1 4.28Å; Y165-F181 AromaticContact CE1-CG 3.52Å; Y165-F181 HydrophobicContact CE1-CG 3.52Å
166	L	86.1	Confident	73.9	Confident	89 Å²	89	57 Å²	57	47%	0.466	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.2	175.5	-65.7	169.3	0	0	0	109.2	Y164 Q170 R171	Y164-L166 HydrophobicContact CE2-CG 4.36Å; L166-Q170 WeakPolarHBondContact CA-O 3.16Å; L166-R171 HydrophobicContact CD2-CB 3.82Å; L166-R171 HydrophobicContact CD2-CG 3.97Å
167	F	85	Confident	75.9	Confident	23 Å²	23	56.5 Å²	56.5	10%	0.101	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	122.3	174.7	-178.4	-110.8	0	0	0	109.9	I90 I92 F103 V105 Y165 G169 Q170 Y172	I90-F167 HydrophobicContact CD1-CB 4.11Å; I90-F167 HydrophobicContact CD1-CD1 4.09Å; I90-F167 HydrophobicContact CD1-CD2 3.4Å; I90-F167 HydrophobicContact CD1-CE1 4.38Å; I90-F167 HydrophobicContact CD1-CE2 3.74Å; I90-F167 HydrophobicContact CD1-CG 3.59Å; I90-F167 HydrophobicContact CD1-CZ 4.22Å; I90-F167 HydrophobicContact CG2-CE1 4.49Å; I90-F167 HydrophobicContact CG2-CZ 4.24Å; I92-F167 HydrophobicContact CD1-CE1 4.21Å; I92-F167 HydrophobicContact CD1-CZ 3.91Å; F103-F167 HydrophobicContact CB-CE2 3.73Å; F103-F167 HydrophobicContact CB-CZ 4.47Å; F103-F167 HydrophobicContact CD1-CE2 4.17Å; F103-F167 HydrophobicContact CD2-CE2 4.1Å; F103-F167 HydrophobicContact CD2-CZ 4.04Å; F103-F167 HydrophobicContact CE2-CZ 4.49Å; F103-F167 AromaticContact CG-CE2 3.73Å; F103-F167 HydrophobicContact CG-CE2 3.73Å; F103-F167 HydrophobicContact CG-CZ 4.14Å; V105-F167 HydrophobicContact CG1-CD2 3.93Å; Y165-F167 HydrophobicContact CD2-CB 4.04Å; Y165-F167 HydrophobicContact CE2-CB 3.77Å; F167-G169 PolarHBondContact O-N 2.81Å; F167-Q170 PolarHBondContact N-O 2.98Å; F167-Q170 WeakPolarHBondContact O-CB 3.22Å; F167-Q170 PolarHBondContact O-N 3.31Å; F167-Y172 HydrophobicContact CB-CD2 4.35Å; F167-Y172 HydrophobicContact CB-CE2 4.06Å
168	Q	79.7	Confident	77.6	Confident	71 Å²	71	59.1 Å²	59.1	33%	0.332	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	36	-176.5	-59.6	-178	-15.1	0	0	113.8	Q170 S408 H412	Q168-Q170 PolarHBondContact O-N 2.97Å; Q168-S408 PolarHBondContact O-OG 3.4Å; Q168-H412 HydrophobicContact CG-CB 4.22Å
169	G	76.9	Confident	79.4	Confident	26 Å²	26	52.4 Å²	52.4	27%	0.268	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	-11.5	-176.9	0	0	0	0	0	114.7	F167 F399	F167-G169 PolarHBondContact O-N 2.81Å; G169-F399 WeakPolarHBondContact O-CB 3.32Å; G169-F399 WeakPolarHBondContact O-CD2 3.47Å; G169-F399 WeakPolarHBondContact O-CG 3.49Å
170	Q	82.5	Confident	80.8	Confident	27 Å²	27	45.5 Å²	45.5	13%	0.126	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	140.7	176.2	-61	-65.3	-19.6	0	0	111	L166 F167 Q168 Y172 Q183 F399	L166-Q170 WeakPolarHBondContact CA-O 3.16Å; F167-Q170 PolarHBondContact N-O 2.98Å; F167-Q170 WeakPolarHBondContact O-CB 3.22Å; F167-Q170 PolarHBondContact O-N 3.31Å; Q168-Q170 PolarHBondContact O-N 2.97Å; Q170-Y172 HydrophobicContact CB-CE2 3.87Å; Q170-Q183 VanDerWaalsContact CD-NE2 3.35Å; Q170-Q183 VanDerWaalsContact OE1-NE2 3.13Å; Q170-F399 PolarHBondContact NE2-O 2.81Å
171	R	86.6	Confident	81.7	Confident	17 Å²	17	40.8 Å²	40.8	6%	0.064	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	132	177.8	-165.7	173.1	-172.6	-178.6	0.3	110.5	E110 Y164 L166 V184 A213 I214	E110-R171 IonicContact OE2-NH2 3.28Å; E110-R171 PolarHBondContact OE2-NH2 2.93Å; Y164-R171 HydrophobicContact CD2-CG 3.87Å; Y164-R171 HydrophobicContact CG-CG 4.38Å; L166-R171 HydrophobicContact CD2-CB 3.82Å; L166-R171 HydrophobicContact CD2-CG 3.97Å; R171-V184 HydrophobicContact CB-CB 4.48Å; R171-V184 HydrophobicContact CB-CG2 3.92Å; R171-V184 HydrophobicContact CG-CG2 4.03Å; R171-V184 WeakPolarHBondContact O-CG2 3.27Å; R171-V184 PolarHBondContact O-N 3Å; R171-A213 PolarHBondContact NH1-O 2.84Å; R171-A213 PolarHBondContact NH2-O 2.79Å; R171-I214 WeakPolarHBondContact CD-O 3.49Å; R171-I214 PolarHBondContact NH1-O 3.05Å
172	Y	86.4	Confident	81.8	Confident	44 Å²	44	40.1 Å²	40.1	17%	0.173	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	120.5	176.5	-68.8	-98.4	0	0	0	109.6	Y164 Y165 F167 Q170 Y182 Q183	Y164-Y172 CarbonylContact C-O 3.51Å; Y164-Y172 WeakPolarHBondContact CA-O 3.31Å; Y164-Y172 WeakPolarHBondContact CB-O 3.3Å; Y165-Y172 HydrophobicContact CD2-CD2 4.17Å; Y165-Y172 VanDerWaalsContact CE1-CB 3.42Å; Y165-Y172 HydrophobicContact CE1-CG 4.03Å; Y165-Y172 AromaticContact CE2-CD2 3.52Å; Y165-Y172 HydrophobicContact CE2-CD2 3.52Å; Y165-Y172 HydrophobicContact CE2-CE2 4.22Å; Y165-Y172 AromaticContact CE2-CG 3.76Å; Y165-Y172 HydrophobicContact CE2-CG 3.76Å; Y165-Y172 VanDerWaalsContact CZ-CB 3.42Å; Y165-Y172 AromaticContact CZ-CD2 3.77Å; Y165-Y172 AromaticContact CZ-CG 3.48Å; Y165-Y172 VanDerWaalsContact CZ-CG 3.48Å; Y165-Y172 PolarHBondContact N-O 2.72Å; Y165-Y172 PolarHBondContact O-N 3.21Å; F167-Y172 HydrophobicContact CB-CD2 4.35Å; F167-Y172 HydrophobicContact CB-CE2 4.06Å; Q170-Y172 HydrophobicContact CB-CE2 3.87Å; Y172-Y182 CarbonylContact C-O 3.6Å; Y172-Y182 WeakPolarHBondContact CA-O 3.44Å; Y172-Q183 HydrophobicContact CD1-CB 3.91Å; Y172-Q183 HydrophobicContact CE1-CB 3.6Å; Y172-Q183 HydrophobicContact CE1-CG 4.07Å
173	I	87.5	Confident	81.8	Confident	9 Å²	9	42 Å²	42	5%	0.046	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	149.8	-179	61.4	159	0	0	0	111.3	L162 F181 Y182 V184 L187 I214	L162-I173 HydrophobicContact CD1-CB 4.35Å; L162-I173 HydrophobicContact CD1-CG2 4.24Å; I173-F181 CarbonylContact O-C 3.58Å; I173-F181 VanDerWaalsContact O-CA 3.28Å; I173-F181 WeakPolarHBondContact O-CA 3.23Å; I173-Y182 PolarHBondContact N-O 2.75Å; I173-Y182 PolarHBondContact O-N 3.31Å; I173-V184 HydrophobicContact CB-CG2 4.48Å; I173-V184 HydrophobicContact CG1-CG2 4.24Å; I173-V184 HydrophobicContact CG2-CG2 3.62Å; I173-L187 HydrophobicContact CD1-CD1 3.57Å; I173-L187 HydrophobicContact CD1-CD2 4.24Å; I173-L187 HydrophobicContact CD1-CG 4.45Å; I173-L187 HydrophobicContact CG1-CD1 4.33Å; I173-I214 HydrophobicContact CD1-CG2 4.25Å
174	W	84.6	Confident	81.5	Confident	17 Å²	17	40.4 Å²	40.4	6%	0.064	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	124.9	175.5	-178.8	-103.5	0	0	0	111.2	L82 A83 R163 E176 Q179 F181	L82-W174 HydrophobicContact CB-CH2 3.98Å; L82-W174 HydrophobicContact CB-CZ3 3.66Å; A83-W174 VanDerWaalsContact CA-CZ2 3.45Å; A83-W174 HydrophobicContact CB-CH2 3.78Å; A83-W174 HydrophobicContact CB-CZ2 3.43Å; A83-W174 VanDerWaalsContact CB-CZ2 3.43Å; A83-W174 VanDerWaalsContact N-CH2 3.34Å; R163-W174 HydrophobicContact CB-CB 3.93Å; R163-W174 PolarHBondContact O-N 2.86Å; W174-E176 PolarHBondContact NE1-OE2 3.08Å; W174-Q179 HydrophobicContact CH2-CB 4.35Å; W174-Q179 VanDerWaalsContact CH2-O 3.22Å; W174-Q179 WeakPolarHBondContact CH2-O 3.25Å; W174-Q179 HydrophobicContact CZ2-CB 4.42Å; W174-F181 HydrophobicContact CB-CD1 4.11Å; W174-F181 HydrophobicContact CB-CE1 3.82Å; W174-F181 HydrophobicContact CB-CZ 4.37Å; W174-F181 HydrophobicContact CD2-CZ 4.49Å; W174-F181 HydrophobicContact CE3-CD1 4.21Å; W174-F181 AromaticContact CE3-CD2 3.58Å; W174-F181 HydrophobicContact CE3-CD2 3.58Å; W174-F181 HydrophobicContact CE3-CE1 4.14Å; W174-F181 AromaticContact CE3-CE2 3.49Å; W174-F181 HydrophobicContact CE3-CE2 3.49Å; W174-F181 VanDerWaalsContact CE3-CE2 3.49Å; W174-F181 AromaticContact CE3-CG 3.94Å; W174-F181 HydrophobicContact CE3-CG 3.94Å; W174-F181 AromaticContact CE3-CZ 3.79Å; W174-F181 HydrophobicContact CE3-CZ 3.79Å; W174-F181 AromaticContact CZ3-CD2 3.88Å; W174-F181 HydrophobicContact CZ3-CD2 3.88Å; W174-F181 AromaticContact CZ3-CE2 3.87Å; W174-F181 HydrophobicContact CZ3-CE2 3.87Å
175	I	78.2	Confident	80.8	Confident	27 Å²	27	40 Å²	40	14%	0.138	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	112.8	173.7	-58.6	-173.9	0	0	0	108.9	T177 Q178 Q179 A180 Y182 L187	I175-T177 VanDerWaalsContact CG2-OG1 3.26Å; I175-T177 WeakPolarHBondContact CG2-OG1 3.41Å; I175-T177 PolarHBondContact O-N 2.87Å; I175-Q178 HydrophobicContact CG2-CB 4.2Å; I175-Q178 HydrophobicContact CG2-CG 4.29Å; I175-Q178 PolarHBondContact O-N 2.98Å; I175-Q179 PolarHBondContact O-N 3.36Å; I175-A180 PolarHBondContact N-O 2.85Å; I175-A180 PolarHBondContact O-N 3.27Å; I175-Y182 HydrophobicContact CB-CD2 4.22Å; I175-Y182 HydrophobicContact CD1-CD1 4.48Å; I175-Y182 HydrophobicContact CD1-CD2 3.66Å; I175-Y182 HydrophobicContact CD1-CE2 4.47Å; I175-Y182 HydrophobicContact CD1-CG 3.67Å; I175-Y182 HydrophobicContact CG1-CD2 4.03Å; I175-Y182 HydrophobicContact CG1-CG 4.37Å; I175-L187 HydrophobicContact CD1-CD2 4.05Å
176	E	74.6	Confident	80.1	Confident	63 Å²	63	42.6 Å²	42.6	29%	0.294	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-64.8	-39.5	-174	-166.3	62.9	-145.8	0	0	112.3	W174 Q178 Q179	W174-E176 PolarHBondContact NE1-OE2 3.08Å; E176-Q178 PolarHBondContact O-N 3.11Å; E176-Q179 VanDerWaalsContact CD-NE2 3.34Å; E176-Q179 PolarHBondContact O-N 3.18Å; E176-Q179 PolarHBondContact O-NE2 3.34Å; E176-Q179 PolarHBondContact OE1-NE2 3.47Å
177	T	72.3	Confident	79.6	Confident	107 Å²	107	41.2 Å²	41.2	66%	0.656	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-62.8	-29.3	-179.8	53.8	0	0	0	0	113	A133 I175	A133-T177 HydrophobicContact CB-CG2 4.14Å; I175-T177 VanDerWaalsContact CG2-OG1 3.26Å; I175-T177 WeakPolarHBondContact CG2-OG1 3.41Å; I175-T177 PolarHBondContact O-N 2.87Å
178	Q	70.7	Confident	78.9	Confident	96 Å²	96	41.6 Å²	41.6	45%	0.449	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-106.5	-2.4	-177.1	-66.8	174.5	-15.1	0	0	112.7	I175 E176 A180 Y182	I175-Q178 HydrophobicContact CG2-CB 4.2Å; I175-Q178 HydrophobicContact CG2-CG 4.29Å; I175-Q178 PolarHBondContact O-N 2.98Å; E176-Q178 PolarHBondContact O-N 3.11Å; Q178-A180 PolarHBondContact O-N 3.27Å; Q178-A180 VanDerWaalsContact O-N 3.12Å; Q178-Y182 HydrophobicContact CB-CE2 3.86Å; Q178-Y182 HydrophobicContact CG-CE2 4.44Å; Q178-Y182 PolarHBondContact OE1-OH 3.49Å
179	Q	77.8	Confident	78.3	Confident	76 Å²	76	43.7 Å²	43.7	36%	0.355	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	38.6	-177.6	-67.6	-67.8	-59.7	0	0	113.2	W174 I175 E176	W174-Q179 HydrophobicContact CH2-CB 4.35Å; W174-Q179 VanDerWaalsContact CH2-O 3.22Å; W174-Q179 WeakPolarHBondContact CH2-O 3.25Å; W174-Q179 HydrophobicContact CZ2-CB 4.42Å; I175-Q179 PolarHBondContact O-N 3.36Å; E176-Q179 VanDerWaalsContact CD-NE2 3.34Å; E176-Q179 PolarHBondContact O-N 3.18Å; E176-Q179 PolarHBondContact O-NE2 3.34Å; E176-Q179 PolarHBondContact OE1-NE2 3.47Å
180	A	78.1	Confident	77.9	Confident	9 Å²	9	45.2 Å²	45.2	7%	0.074	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	157.1	-175.1	0	0	0	0	0	112.3	L19 I175 Q178 Y182	L19-A180 HydrophobicContact CD1-CB 3.96Å; I175-A180 PolarHBondContact N-O 2.85Å; I175-A180 PolarHBondContact O-N 3.27Å; Q178-A180 PolarHBondContact O-N 3.27Å; Q178-A180 VanDerWaalsContact O-N 3.12Å; A180-Y182 HydrophobicContact CB-CD2 4.34Å; A180-Y182 HydrophobicContact CB-CE2 3.86Å
181	F	82	Confident	77.8	Confident	14 Å²	14	46.7 Å²	46.7	6%	0.061	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	125.4	171.9	-75.6	-82.6	0	0	0	110.4	L37 L82 L88 V107 Y165 I173 W174	L37-F181 HydrophobicContact CD2-CD2 4.18Å; L82-F181 HydrophobicContact CB-CE2 4.42Å; L88-F181 HydrophobicContact CD1-CD2 4.13Å; L88-F181 HydrophobicContact CD1-CE2 3.82Å; L88-F181 HydrophobicContact CD1-CZ 4.16Å; L88-F181 HydrophobicContact CD2-CE2 4.21Å; V107-F181 HydrophobicContact CG1-CE1 4.47Å; V107-F181 HydrophobicContact CG1-CZ 4.17Å; V107-F181 HydrophobicContact CG2-CZ 4.22Å; Y165-F181 AromaticContact CD1-CD1 3.68Å; Y165-F181 HydrophobicContact CD1-CD1 3.68Å; Y165-F181 HydrophobicContact CD1-CD2 4.48Å; Y165-F181 AromaticContact CD1-CE1 3.89Å; Y165-F181 HydrophobicContact CD1-CE1 3.89Å; Y165-F181 HydrophobicContact CD1-CG 4Å; Y165-F181 HydrophobicContact CD1-CZ 4.4Å; Y165-F181 HydrophobicContact CE1-CB 3.65Å; Y165-F181 AromaticContact CE1-CD1 3.65Å; Y165-F181 HydrophobicContact CE1-CD1 3.65Å; Y165-F181 HydrophobicContact CE1-CD2 4.03Å; Y165-F181 HydrophobicContact CE1-CE1 4.28Å; Y165-F181 AromaticContact CE1-CG 3.52Å; Y165-F181 HydrophobicContact CE1-CG 3.52Å; I173-F181 CarbonylContact O-C 3.58Å; I173-F181 VanDerWaalsContact O-CA 3.28Å; I173-F181 WeakPolarHBondContact O-CA 3.23Å; W174-F181 HydrophobicContact CB-CD1 4.11Å; W174-F181 HydrophobicContact CB-CE1 3.82Å; W174-F181 HydrophobicContact CB-CZ 4.37Å; W174-F181 HydrophobicContact CD2-CZ 4.49Å; W174-F181 HydrophobicContact CE3-CD1 4.21Å; W174-F181 AromaticContact CE3-CD2 3.58Å; W174-F181 HydrophobicContact CE3-CD2 3.58Å; W174-F181 HydrophobicContact CE3-CE1 4.14Å; W174-F181 AromaticContact CE3-CE2 3.49Å; W174-F181 HydrophobicContact CE3-CE2 3.49Å; W174-F181 VanDerWaalsContact CE3-CE2 3.49Å; W174-F181 AromaticContact CE3-CG 3.94Å; W174-F181 HydrophobicContact CE3-CG 3.94Å; W174-F181 AromaticContact CE3-CZ 3.79Å; W174-F181 HydrophobicContact CE3-CZ 3.79Å; W174-F181 AromaticContact CZ3-CD2 3.88Å; W174-F181 HydrophobicContact CZ3-CD2 3.88Å; W174-F181 AromaticContact CZ3-CE2 3.87Å; W174-F181 HydrophobicContact CZ3-CE2 3.87Å
182	Y	79.1	Confident	77.7	Confident	48 Å²	48	46.2 Å²	46.2	19%	0.188	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	140.3	178.6	-84.4	-99.4	0	0	0	111.4	Y172 I173 I175 Q178 A180 V184	Y172-Y182 CarbonylContact C-O 3.6Å; Y172-Y182 WeakPolarHBondContact CA-O 3.44Å; I173-Y182 PolarHBondContact N-O 2.75Å; I173-Y182 PolarHBondContact O-N 3.31Å; I175-Y182 HydrophobicContact CB-CD2 4.22Å; I175-Y182 HydrophobicContact CD1-CD1 4.48Å; I175-Y182 HydrophobicContact CD1-CD2 3.66Å; I175-Y182 HydrophobicContact CD1-CE2 4.47Å; I175-Y182 HydrophobicContact CD1-CG 3.67Å; I175-Y182 HydrophobicContact CG1-CD2 4.03Å; I175-Y182 HydrophobicContact CG1-CG 4.37Å; Q178-Y182 HydrophobicContact CB-CE2 3.86Å; Q178-Y182 HydrophobicContact CG-CE2 4.44Å; Q178-Y182 PolarHBondContact OE1-OH 3.49Å; A180-Y182 HydrophobicContact CB-CD2 4.34Å; A180-Y182 HydrophobicContact CB-CE2 3.86Å; Y182-V184 PolarHBondContact O-N 3.21Å
183	Q	83	Confident	77.7	Confident	40 Å²	40	44.4 Å²	44.4	19%	0.187	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	132.2	172.2	-167.3	177.6	-9.6	0	0	109.4	Q170 Y172 S185 L186	Q170-Q183 VanDerWaalsContact CD-NE2 3.35Å; Q170-Q183 VanDerWaalsContact OE1-NE2 3.13Å; Y172-Q183 HydrophobicContact CD1-CB 3.91Å; Y172-Q183 HydrophobicContact CE1-CB 3.6Å; Y172-Q183 HydrophobicContact CE1-CG 4.07Å; Q183-S185 VanDerWaalsContact C-N 3.25Å; Q183-S185 VanDerWaalsContact CD-OG 3.23Å; Q183-S185 WeakPolarHBondContact CG-OG 3.42Å; Q183-S185 PolarHBondContact NE2-OG 2.98Å; Q183-S185 PolarHBondContact O-N 2.95Å; Q183-L186 HydrophobicContact CB-CD1 4.02Å; Q183-L186 HydrophobicContact CB-CG 4.23Å; Q183-L186 WeakPolarHBondContact O-CB 3.49Å; Q183-L186 PolarHBondContact O-N 3.21Å
184	V	82.4	Confident	77.6	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.012	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-59.3	-36	-176.3	168.9	0	0	0	0	112.4	R171 I173 Y182 L186 L187 Y215	R171-V184 HydrophobicContact CB-CB 4.48Å; R171-V184 HydrophobicContact CB-CG2 3.92Å; R171-V184 HydrophobicContact CG-CG2 4.03Å; R171-V184 WeakPolarHBondContact O-CG2 3.27Å; R171-V184 PolarHBondContact O-N 3Å; I173-V184 HydrophobicContact CB-CG2 4.48Å; I173-V184 HydrophobicContact CG1-CG2 4.24Å; I173-V184 HydrophobicContact CG2-CG2 3.62Å; Y182-V184 PolarHBondContact O-N 3.21Å; V184-L186 PolarHBondContact O-N 2.99Å; V184-L186 VanDerWaalsContact O-N 3.08Å; V184-L187 HydrophobicContact CB-CD1 4.47Å; V184-L187 HydrophobicContact CG1-CD1 4.23Å; V184-L187 WeakPolarHBondContact O-CB 3.25Å; V184-L187 WeakPolarHBondContact O-CG 3.08Å; V184-L187 PolarHBondContact O-N 3.07Å; V184-Y215 HydrophobicContact CG1-CD1 3.13Å; V184-Y215 HydrophobicContact CG1-CE1 3.38Å; V184-Y215 HydrophobicContact CG1-CG 3.78Å
185	S	73.8	Confident	77.7	Confident	26 Å²	26	47.3 Å²	47.3	18%	0.182	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-59.9	-21.1	177.4	60.3	0	0	0	0	113.9	Q183 H189	Q183-S185 VanDerWaalsContact C-N 3.25Å; Q183-S185 VanDerWaalsContact CD-OG 3.23Å; Q183-S185 WeakPolarHBondContact CG-OG 3.42Å; Q183-S185 PolarHBondContact NE2-OG 2.98Å; Q183-S185 PolarHBondContact O-N 2.95Å; S185-H189 PolarHBondContact O-CD2 3.24Å
186	L	75.6	Confident	78.1	Confident	63 Å²	63	46.3 Å²	46.3	33%	0.33	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-82.9	-13.1	178.3	-63	171.9	0	0	0	113.4	Q183 V184 D188 H189	Q183-L186 HydrophobicContact CB-CD1 4.02Å; Q183-L186 HydrophobicContact CB-CG 4.23Å; Q183-L186 WeakPolarHBondContact O-CB 3.49Å; Q183-L186 PolarHBondContact O-N 3.21Å; V184-L186 PolarHBondContact O-N 2.99Å; V184-L186 VanDerWaalsContact O-N 3.08Å; L186-D188 VanDerWaalsContact C-N 3.27Å; L186-D188 PolarHBondContact O-N 3.36Å; L186-H189 PolarHBondContact O-N 3.12Å
187	L	75.6	Confident	78.8	Confident	60 Å²	60	44.3 Å²	44.3	31%	0.314	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-30.3	179.2	-62.6	171.2	0	0	0	112.3	I173 I175 V184 I214	I173-L187 HydrophobicContact CD1-CD1 3.57Å; I173-L187 HydrophobicContact CD1-CD2 4.24Å; I173-L187 HydrophobicContact CD1-CG 4.45Å; I173-L187 HydrophobicContact CG1-CD1 4.33Å; I175-L187 HydrophobicContact CD1-CD2 4.05Å; V184-L187 HydrophobicContact CB-CD1 4.47Å; V184-L187 HydrophobicContact CG1-CD1 4.23Å; V184-L187 WeakPolarHBondContact O-CB 3.25Å; V184-L187 WeakPolarHBondContact O-CG 3.08Å; V184-L187 PolarHBondContact O-N 3.07Å; L187-I214 HydrophobicContact CD1-CG2 3.84Å
188	D	69.9	Low	79.5	Confident	32 Å²	32	48 Å²	48	17%	0.171	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-0.8	179.8	-62.7	-45.5	0	0	0	113.5	L186 G190 R191 Y215	L186-D188 VanDerWaalsContact C-N 3.27Å; L186-D188 PolarHBondContact O-N 3.36Å; D188-G190 PolarHBondContact O-N 3.1Å; D188-R191 PolarHBondContact O-N 3.24Å; D188-R191 IonicContact OD1-CZ 2.69Å; D188-R191 IonicContact OD1-NE 3.66Å; D188-R191 PolarHBondContact OD1-NE 3.32Å; D188-R191 IonicContact OD1-NH2 2.89Å; D188-R191 PolarHBondContact OD1-NH2 3.29Å; D188-Y215 PolarHBondContact OD1-OH 3.23Å; D188-Y215 WeakPolarHBondContact OD2-CE1 3.49Å; D188-Y215 PolarHBondContact OD2-OH 3.03Å
189	H	67.6	Low	80.3	Confident	115 Å²	115	44.3 Å²	44.3	53%	0.532	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	119.1	175.2	-97.1	-84.6	0	0	0	109.8	S185 L186	S185-H189 PolarHBondContact O-CD2 3.24Å; L186-H189 PolarHBondContact O-N 3.12Å
190	G	67.1	Low	80.7	Confident	58 Å²	58	46.6 Å²	46.6	60%	0.598	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	103.8	1.8	179.9	0	0	0	0	0	115.2	D188 S192	D188-G190 PolarHBondContact O-N 3.1Å; G190-S192 PolarHBondContact O-N 2.99Å
191	R	80.4	Confident	81.1	Confident	57 Å²	57	51 Å²	51	22%	0.215	25%	0.249	C	C	.	.			trans	-58.9	133.5	165.6	-71.5	-168.6	-172.9	-167.5	4.6	109.7	D188 D195 Y363	D188-R191 PolarHBondContact O-N 3.24Å; D188-R191 IonicContact OD1-CZ 2.69Å; D188-R191 IonicContact OD1-NE 3.66Å; D188-R191 PolarHBondContact OD1-NE 3.32Å; D188-R191 IonicContact OD1-NH2 2.89Å; D188-R191 PolarHBondContact OD1-NH2 3.29Å; R191-D195 HydrophobicContact CB-CB 4.44Å; R191-Y363 PolarHBondContact O-N 3Å
192	S	84.9	Confident	81.3	Confident	8 Å²	8	50.9 Å²	50.9	6%	0.056	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-78.8	162	175.1	63.2	0	0	0	0	111.4	G190 D194 D195 I196 G361	G190-S192 PolarHBondContact O-N 2.99Å; S192-D194 PolarHBondContact O-N 2.84Å; S192-D195 PolarHBondContact N-OD2 2.82Å; S192-D195 PolarHBondContact O-N 2.94Å; S192-D195 VanDerWaalsContact O-N 3.16Å; S192-D195 PolarHBondContact OG-N 3.35Å; S192-D195 PolarHBondContact OG-OD2 3.19Å; S192-I196 PolarHBondContact O-N 3.36Å; S192-G361 CarbonylContact C-O 3.54Å; S192-G361 VanDerWaalsContact CA-O 3.25Å; S192-G361 WeakPolarHBondContact CA-O 3.47Å
193	C	85.9	Confident	81.8	Confident	6 Å²	6	49.2 Å²	49.2	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-58.4	-34.7	171.1	-62.6	0	0	0	0	111.2	D195 I196 H197 L356 G359 G361	C193-D195 PolarHBondContact O-N 2.9Å; C193-I196 WeakPolarHBondContact O-CB 3.4Å; C193-I196 PolarHBondContact O-N 2.85Å; C193-H197 PolarHBondContact O-CD2 2.56Å; C193-H197 PolarHBondContact O-N 2.91Å; C193-L356 HydrophobicContact CB-CD2 3.83Å; C193-L356 HydrophobicContact CB-CG 4.24Å; C193-G359 WeakPolarHBondContact CB-O 3.3Å; C193-G359 PolarHBondContact N-O 3.44Å; C193-G361 PolarHBondContact N-O 2.98Å
194	D	85.8	Confident	82.1	Confident	39 Å²	39	48.9 Å²	48.9	21%	0.209	25%	0.249	C	C	.	.	H	α-helix	trans	-63.2	-38.4	175	-64.7	-17.8	0	0	0	112.8	S192 I196 H197 R198 G359	S192-D194 PolarHBondContact O-N 2.84Å; D194-I196 VanDerWaalsContact C-N 3.25Å; D194-I196 PolarHBondContact O-N 3.39Å; D194-H197 PolarHBondContact O-N 3.35Å; D194-R198 WeakPolarHBondContact O-CG 3.34Å; D194-R198 PolarHBondContact O-N 3.3Å; D194-G359 VanDerWaalsContact CG-C 3.5Å; D194-G359 PolarHBondContact N-O 3.22Å; D194-G359 WeakPolarHBondContact OD1-CA 3.43Å; D194-G359 PolarHBondContact OD1-N 3.01Å
195	D	85.9	Confident	82.2	Confident	48 Å²	48	54.1 Å²	54.1	26%	0.257	28%	0.276	S	S	.	.	H	α-helix	trans	-64.1	-34.2	176.9	-61.5	-44.5	0	0	0	111.7	R191 S192 C193 S199	R191-D195 HydrophobicContact CB-CB 4.44Å; S192-D195 PolarHBondContact N-OD2 2.82Å; S192-D195 PolarHBondContact O-N 2.94Å; S192-D195 VanDerWaalsContact O-N 3.16Å; S192-D195 PolarHBondContact OG-N 3.35Å; S192-D195 PolarHBondContact OG-OD2 3.19Å; C193-D195 PolarHBondContact O-N 2.9Å; D195-S199 PolarHBondContact O-N 2.67Å; D195-S199 PolarHBondContact O-OG 2.85Å; D195-S199 VanDerWaalsContact O-OG 3.04Å
196	I	87.8	Confident	82.7	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-70.3	-44.9	175.1	-63.2	-179.7	0	0	0	110	S192 C193 D194 R198 S199 A331 V333 L356 Y363 V393 T395	S192-I196 PolarHBondContact O-N 3.36Å; C193-I196 WeakPolarHBondContact O-CB 3.4Å; C193-I196 PolarHBondContact O-N 2.85Å; D194-I196 VanDerWaalsContact C-N 3.25Å; D194-I196 PolarHBondContact O-N 3.39Å; I196-R198 VanDerWaalsContact C-N 3.33Å; I196-R198 PolarHBondContact O-N 3.01Å; I196-S199 WeakPolarHBondContact O-CA 3.25Å; I196-S199 VanDerWaalsContact O-CB 3.3Å; I196-S199 WeakPolarHBondContact O-CB 3.06Å; I196-S199 PolarHBondContact O-N 2.9Å; I196-A331 HydrophobicContact CD1-CB 4.45Å; I196-A331 HydrophobicContact CG2-CB 3.93Å; I196-V333 HydrophobicContact CG2-CG1 3.91Å; I196-L356 HydrophobicContact CB-CD2 4.29Å; I196-L356 HydrophobicContact CD1-CD2 4.31Å; I196-L356 HydrophobicContact CG2-CD2 4.2Å; I196-Y363 VanDerWaalsContact CD1-CB 3.41Å; I196-Y363 HydrophobicContact CD1-CD1 3.45Å; I196-Y363 VanDerWaalsContact CD1-CD1 3.45Å; I196-Y363 HydrophobicContact CD1-CD2 3.56Å; I196-Y363 HydrophobicContact CD1-CE1 4.03Å; I196-Y363 HydrophobicContact CD1-CE2 4.13Å; I196-Y363 HydrophobicContact CD1-CG 3.16Å; I196-V393 HydrophobicContact CG2-CB 3.91Å; I196-V393 HydrophobicContact CG2-CG1 4.13Å; I196-V393 HydrophobicContact CG2-CG2 4.35Å; I196-T395 HydrophobicContact CD1-CG2 4.37Å
197	H	88.9	Confident	83.2	Confident	22 Å²	22	58 Å²	58	10%	0.102	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-38.2	175.6	-85.7	-60.8	0	0	0	113.3	C193 D194 S199 R200 L356	C193-H197 PolarHBondContact O-CD2 2.56Å; C193-H197 PolarHBondContact O-N 2.91Å; D194-H197 PolarHBondContact O-N 3.35Å; H197-S199 PolarHBondContact O-N 2.81Å; H197-R200 WeakPolarHBondContact O-CB 3.17Å; H197-R200 WeakPolarHBondContact O-CD 3.4Å; H197-R200 WeakPolarHBondContact O-CG 3.42Å; H197-R200 PolarHBondContact O-N 3.2Å; H197-L356 PolarHBondContact CE1-O 3.31Å; H197-L356 VanDerWaalsContact CE1-O 3.23Å; H197-L356 PolarHBondContact NE2-O 3.48Å
198	R	87.6	Confident	83.7	Confident	184 Å²	184	55.7 Å²	55.7	69%	0.694	28%	0.28	S	S	*	.	H	α-helix	trans	-59.7	-29.5	173.2	-72.8	175.6	-166.6	-173.1	3.8	112.6	D194 I196 R200	D194-R198 WeakPolarHBondContact O-CG 3.34Å; D194-R198 PolarHBondContact O-N 3.3Å; I196-R198 VanDerWaalsContact C-N 3.33Å; I196-R198 PolarHBondContact O-N 3.01Å; R198-R200 PolarHBondContact O-N 3.01Å
199	S	86.8	Confident	84.5	Confident	19 Å²	19	58 Å²	58	13%	0.133	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-77.1	0.8	177.2	-52.6	0	0	0	0	113.2	D195 I196 H197 H201 G202	D195-S199 PolarHBondContact O-N 2.67Å; D195-S199 PolarHBondContact O-OG 2.85Å; D195-S199 VanDerWaalsContact O-OG 3.04Å; I196-S199 WeakPolarHBondContact O-CA 3.25Å; I196-S199 VanDerWaalsContact O-CB 3.3Å; I196-S199 WeakPolarHBondContact O-CB 3.06Å; I196-S199 PolarHBondContact O-N 2.9Å; H197-S199 PolarHBondContact O-N 2.81Å; S199-H201 PolarHBondContact O-N 2.82Å; S199-G202 PolarHBondContact O-N 2.77Å
200	R	86.9	Confident	85.3	Confident	123 Å²	123	53.7 Å²	53.7	46%	0.464	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-58.1	-27.8	175.6	74.4	-172.9	-176.8	177.7	-0	113.7	H197 R198 G202 C316 V333	H197-R200 WeakPolarHBondContact O-CB 3.17Å; H197-R200 WeakPolarHBondContact O-CD 3.4Å; H197-R200 WeakPolarHBondContact O-CG 3.42Å; H197-R200 PolarHBondContact O-N 3.2Å; R198-R200 PolarHBondContact O-N 3.01Å; R200-G202 PolarHBondContact O-N 2.95Å; R200-C316 PolarHBondContact O-SG 2.85Å; R200-V333 HydrophobicContact CB-CG2 4.4Å
201	H	86.3	Confident	86.3	Confident	101 Å²	101	53.8 Å²	53.8	47%	0.468	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-77.9	-4.4	177.6	-61.8	-68.4	0	0	0	112.3	S199 R298 P299	S199-H201 PolarHBondContact O-N 2.82Å; H201-R298 CarbonylContact O-C 3.59Å; H201-P299 WeakPolarHBondContact O-CA 3.39Å
202	G	86.8	Confident	86.7	Confident	13 Å²	13	54.5 Å²	54.5	13%	0.134	26%	0.264	C	S	.	.			trans	80.6	174.3	-179.9	0	0	0	0	0	114.3	S199 R200 C297	S199-G202 PolarHBondContact O-N 2.77Å; R200-G202 PolarHBondContact O-N 2.95Å; G202-C297 VanDerWaalsContact CA-O 3.31Å; G202-C297 WeakPolarHBondContact CA-O 3.38Å
203	L	89.3	Confident	86.7	Confident	12 Å²	12	54.8 Å²	54.8	6%	0.063	27%	0.267	C	S	.	.			trans	-98.8	144.9	-180	-66.9	177	0	0	0	111.6	D207 R298 P299 V312	L203-D207 HydrophobicContact CB-CB 4.47Å; L203-D207 HydrophobicContact CD2-CB 4.36Å; L203-R298 WeakPolarHBondContact O-CD 3.31Å; L203-R298 PolarHBondContact O-NH1 2.82Å; L203-R298 VanDerWaalsContact O-NH1 3.16Å; L203-P299 WeakPolarHBondContact O-CD 3.2Å; L203-V312 HydrophobicContact CD1-CG2 3.87Å
204	S	88.2	Confident	86.8	Confident	33 Å²	33	55.5 Å²	55.5	23%	0.231	27%	0.271	C	S	.	.			trans	-64.9	154.7	166.7	77.1	0	0	0	0	110.6	Q206 D207 Q208	S204-Q206 PolarHBondContact O-N 2.91Å; S204-D207 PolarHBondContact O-N 2.69Å; S204-D207 WeakPolarHBondContact OG-CB 3.36Å; S204-D207 PolarHBondContact OG-N 2.95Å; S204-D207 VanDerWaalsContact OG-N 3.09Å; S204-D207 PolarHBondContact OG-OD2 3.49Å; S204-Q208 WeakPolarHBondContact O-CB 3.37Å; S204-Q208 PolarHBondContact O-N 3.09Å
205	L	85.1	Confident	86.8	Confident	112 Å²	112	55.2 Å²	55.2	59%	0.586	27%	0.267	S	S	*	.	H	α-helix	trans	-59.9	-33	178.8	-161.4	78.9	0	0	0	112	T209	L205-T209 WeakPolarHBondContact O-CB 3.4Å; L205-T209 PolarHBondContact O-N 3.27Å; L205-T209 PolarHBondContact O-OG1 3.29Å
206	Q	84.4	Confident	86.9	Confident	93 Å²	93	53.2 Å²	53.2	44%	0.435	26%	0.257	S	S	.	.	H	α-helix	trans	-68.5	-49.1	177.9	-166.4	179.1	26.4	0	0	111	G115 S204 Q208 T209 V210	G115-Q206 PolarHBondContact O-NE2 3.11Å; S204-Q206 PolarHBondContact O-N 2.91Å; Q206-Q208 VanDerWaalsContact C-N 3.32Å; Q206-Q208 PolarHBondContact O-N 3.47Å; Q206-T209 PolarHBondContact O-N 3.44Å; Q206-V210 WeakPolarHBondContact O-CG2 3.39Å; Q206-V210 PolarHBondContact O-N 3.15Å
207	D	85.3	Confident	87.1	Confident	77 Å²	77	56.8 Å²	56.8	41%	0.412	28%	0.281	S	S	.	.	H	α-helix	trans	-62.5	-40.9	175.8	-68.9	-45.7	0	0	0	111.8	L203 S204 T209 V210 R211	L203-D207 HydrophobicContact CB-CB 4.47Å; L203-D207 HydrophobicContact CD2-CB 4.36Å; S204-D207 PolarHBondContact O-N 2.69Å; S204-D207 WeakPolarHBondContact OG-CB 3.36Å; S204-D207 PolarHBondContact OG-N 2.95Å; S204-D207 VanDerWaalsContact OG-N 3.09Å; S204-D207 PolarHBondContact OG-OD2 3.49Å; D207-T209 VanDerWaalsContact C-N 3.32Å; D207-T209 PolarHBondContact O-N 3.05Å; D207-V210 PolarHBondContact O-N 3.07Å; D207-R211 WeakPolarHBondContact O-CB 3.21Å; D207-R211 WeakPolarHBondContact O-CG 3.46Å; D207-R211 PolarHBondContact O-N 3.44Å
208	Q	87.3	Confident	87.2	Confident	12 Å²	12	56.2 Å²	56.2	6%	0.056	28%	0.278	C	S	.	.	H	α-helix	trans	-59.8	-44.7	176	-171.3	-178.3	38.6	0	0	110.8	S204 Q206 R211 K212 R298 V312 D315	S204-Q208 WeakPolarHBondContact O-CB 3.37Å; S204-Q208 PolarHBondContact O-N 3.09Å; Q206-Q208 VanDerWaalsContact C-N 3.32Å; Q206-Q208 PolarHBondContact O-N 3.47Å; Q208-R211 PolarHBondContact O-N 2.93Å; Q208-K212 VanDerWaalsContact O-CB 3.29Å; Q208-K212 WeakPolarHBondContact O-CB 3.49Å; Q208-K212 PolarHBondContact O-N 2.8Å; Q208-R298 VanDerWaalsContact OE1-NH1 3.13Å; Q208-V312 HydrophobicContact CG-CG2 3.84Å; Q208-D315 PolarHBondContact NE2-OD1 3.48Å; Q208-D315 PolarHBondContact NE2-OD2 2.86Å; Q208-D315 VanDerWaalsContact NE2-OD2 3.08Å
209	T	86.9	Confident	87.3	Confident	81 Å²	81	50.4 Å²	50.4	50%	0.497	26%	0.263	S	S	.	.	H	α-helix	trans	-63.3	-43.4	179	-58	0	0	0	0	111.8	L205 Q206 D207 K212 A213	L205-T209 WeakPolarHBondContact O-CB 3.4Å; L205-T209 PolarHBondContact O-N 3.27Å; L205-T209 PolarHBondContact O-OG1 3.29Å; Q206-T209 PolarHBondContact O-N 3.44Å; D207-T209 VanDerWaalsContact C-N 3.32Å; D207-T209 PolarHBondContact O-N 3.05Å; T209-K212 PolarHBondContact O-N 2.89Å; T209-A213 PolarHBondContact O-N 2.92Å
210	V	84.6	Confident	87.4	Confident	25 Å²	25	50.5 Å²	50.5	15%	0.152	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-45.5	176.5	173.8	0	0	0	0	111	Q206 D207 K212 A213 I214	Q206-V210 WeakPolarHBondContact O-CG2 3.39Å; Q206-V210 PolarHBondContact O-N 3.15Å; D207-V210 PolarHBondContact O-N 3.07Å; V210-K212 VanDerWaalsContact C-N 3.33Å; V210-K212 PolarHBondContact O-N 3.23Å; V210-A213 WeakPolarHBondContact O-CB 3.26Å; V210-A213 PolarHBondContact O-N 2.8Å; V210-I214 HydrophobicContact CG1-CD1 4.16Å; V210-I214 WeakPolarHBondContact O-CG1 3.17Å; V210-I214 PolarHBondContact O-N 2.94Å; V210-I214 VanDerWaalsContact O-N 3.15Å
211	R	87.6	Confident	87.2	Confident	59 Å²	59	48.4 Å²	48.4	22%	0.223	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-36.3	176.5	-69.9	-173.4	-170.9	-162	3.1	111.6	D207 Q208 A213 I214 Y215 V312 P313	D207-R211 WeakPolarHBondContact O-CB 3.21Å; D207-R211 WeakPolarHBondContact O-CG 3.46Å; D207-R211 PolarHBondContact O-N 3.44Å; Q208-R211 PolarHBondContact O-N 2.93Å; R211-A213 VanDerWaalsContact C-N 3.3Å; R211-A213 PolarHBondContact O-N 3.44Å; R211-I214 PolarHBondContact O-N 2.78Å; R211-I214 VanDerWaalsContact O-N 3.08Å; R211-Y215 HydrophobicContact CB-CD2 4.17Å; R211-Y215 HydrophobicContact CB-CE2 4.47Å; R211-Y215 VanDerWaalsContact O-CD2 3.3Å; R211-Y215 WeakPolarHBondContact O-CD2 3.14Å; R211-Y215 PolarHBondContact O-N 3.15Å; R211-V312 HydrophobicContact CB-CB 3.92Å; R211-V312 HydrophobicContact CB-CG1 4.26Å; R211-V312 HydrophobicContact CB-CG2 3.82Å; R211-P313 VanDerWaalsContact CD-O 3.22Å; R211-P313 WeakPolarHBondContact CD-O 3.42Å; R211-P313 PolarHBondContact NH1-O 3.23Å
212	K	87.8	Confident	87.1	Confident	72 Å²	72	44 Å²	44	31%	0.313	25%	0.246	S	C	.	.	H	α-helix	trans	-62.1	-40.1	176	-169.4	176.1	-175.2	175.6	0	111	Q208 T209 V210 I214 G216 E310 V312	Q208-K212 VanDerWaalsContact O-CB 3.29Å; Q208-K212 WeakPolarHBondContact O-CB 3.49Å; Q208-K212 PolarHBondContact O-N 2.8Å; T209-K212 PolarHBondContact O-N 2.89Å; V210-K212 VanDerWaalsContact C-N 3.33Å; V210-K212 PolarHBondContact O-N 3.23Å; K212-I214 VanDerWaalsContact C-N 3.33Å; K212-I214 PolarHBondContact O-N 3.05Å; K212-G216 WeakPolarHBondContact O-CA 3.08Å; K212-G216 PolarHBondContact O-N 3.13Å; K212-E310 IonicContact NZ-OE1 3.42Å; K212-E310 PolarHBondContact NZ-OE1 3.1Å; K212-V312 HydrophobicContact CB-CG1 3.86Å; K212-V312 HydrophobicContact CG-CG1 4.46Å
213	A	86.4	Confident	86.9	Confident	14 Å²	14	48 Å²	48	12%	0.116	27%	0.27	C	S	.	.	H	α-helix	trans	-62.1	-39.7	173.2	0	0	0	0	0	112	I112 L162 R171 T209 V210 R211	I112-A213 HydrophobicContact CG1-CB 4.4Å; L162-A213 WeakPolarHBondContact CD2-O 3.41Å; R171-A213 PolarHBondContact NH1-O 2.84Å; R171-A213 PolarHBondContact NH2-O 2.79Å; T209-A213 PolarHBondContact O-N 2.92Å; V210-A213 WeakPolarHBondContact O-CB 3.26Å; V210-A213 PolarHBondContact O-N 2.8Å; R211-A213 VanDerWaalsContact C-N 3.3Å; R211-A213 PolarHBondContact O-N 3.44Å
214	I	86.3	Confident	86.8	Confident	22 Å²	22	49 Å²	49	11%	0.113	28%	0.277	C	S	.	.	H	α-helix	trans	-74.7	-54.3	-179.4	-64.6	168.1	0	0	0	112.3	R171 I173 L187 V210 R211 K212	R171-I214 WeakPolarHBondContact CD-O 3.49Å; R171-I214 PolarHBondContact NH1-O 3.05Å; I173-I214 HydrophobicContact CD1-CG2 4.25Å; L187-I214 HydrophobicContact CD1-CG2 3.84Å; V210-I214 HydrophobicContact CG1-CD1 4.16Å; V210-I214 WeakPolarHBondContact O-CG1 3.17Å; V210-I214 PolarHBondContact O-N 2.94Å; V210-I214 VanDerWaalsContact O-N 3.15Å; R211-I214 PolarHBondContact O-N 2.78Å; R211-I214 VanDerWaalsContact O-N 3.08Å; K212-I214 VanDerWaalsContact C-N 3.33Å; K212-I214 PolarHBondContact O-N 3.05Å
215	Y	86.7	Confident	86.7	Confident	33 Å²	33	52 Å²	52	13%	0.129	29%	0.285	C	S	.	.	H	α-helix	trans	-81.9	-29.4	-173.2	-69.1	-93.8	0	0	0	112.9	V184 D188 R211 P313	V184-Y215 HydrophobicContact CG1-CD1 3.13Å; V184-Y215 HydrophobicContact CG1-CE1 3.38Å; V184-Y215 HydrophobicContact CG1-CG 3.78Å; D188-Y215 PolarHBondContact OD1-OH 3.23Å; D188-Y215 WeakPolarHBondContact OD2-CE1 3.49Å; D188-Y215 PolarHBondContact OD2-OH 3.03Å; R211-Y215 HydrophobicContact CB-CD2 4.17Å; R211-Y215 HydrophobicContact CB-CE2 4.47Å; R211-Y215 VanDerWaalsContact O-CD2 3.3Å; R211-Y215 WeakPolarHBondContact O-CD2 3.14Å; R211-Y215 PolarHBondContact O-N 3.15Å; Y215-P313 HydrophobicContact CD1-CG 3.64Å; Y215-P313 HydrophobicContact CD2-CG 4.41Å; Y215-P313 HydrophobicContact CE1-CB 4.37Å; Y215-P313 HydrophobicContact CE1-CG 3.68Å; Y215-P313 HydrophobicContact CE2-CG 4.46Å; Y215-P313 HydrophobicContact CG-CG 4.05Å
216	G	89	Confident	87	Confident	6 Å²	6	48.6 Å²	48.6	6%	0.062	27%	0.271	C	S	.	.			trans	83.1	178.4	-171	0	0	0	0	0	111.8	K212	K212-G216 WeakPolarHBondContact O-CA 3.08Å; K212-G216 PolarHBondContact O-N 3.13Å
217	P	90.7	Very high	87.3	Confident	79 Å²	79	49.1 Å²	49.1	51%	0.513	27%	0.27	S	S	.	.			trans	-69.3	148.9	179.5	29.8	-35.3	0	0	0	111.6	V219 S309	P217-V219 HydrophobicContact CB-CG2 4.29Å; P217-V219 PolarHBondContact O-N 3.08Å; P217-S309 CarbonylContact C-O 3.45Å; P217-S309 VanDerWaalsContact CA-O 3.31Å; P217-S309 WeakPolarHBondContact CA-O 3.29Å; P217-S309 WeakPolarHBondContact CB-O 3.45Å
218	N	92.1	Very high	87.5	Confident	10 Å²	10	49.6 Å²	49.6	5%	0.053	28%	0.277	C	S	.	.	S	Bend	trans	-75.1	67.3	174.2	-180	38.6	0	0	0	111.2	S308 S309 L311 P327 T397 G398	N218-S308 VanDerWaalsContact CB-O 3.28Å; N218-S308 WeakPolarHBondContact CB-O 3.32Å; N218-S308 PolarHBondContact ND2-O 3.16Å; N218-S309 PolarHBondContact N-O 3.15Å; N218-L311 HydrophobicContact CB-CB 4.22Å; N218-P327 PolarHBondContact ND2-O 2.81Å; N218-T397 HydrophobicContact CB-CG2 4.16Å; N218-T397 WeakPolarHBondContact OD1-CA 3.09Å; N218-T397 WeakPolarHBondContact OD1-CB 3.45Å; N218-G398 PolarHBondContact OD1-N 3.25Å
219	V	88.9	Confident	87.5	Confident	62 Å²	62	54.2 Å²	54.2	38%	0.376	30%	0.299	S	S	.	.			trans	-135.2	126	-179.4	-179.1	0	0	0	0	110.5	P217 S221	P217-V219 HydrophobicContact CB-CG2 4.29Å; P217-V219 PolarHBondContact O-N 3.08Å; V219-S221 PolarHBondContact O-N 3.3Å
220	I	88.3	Confident	87.5	Confident	21 Å²	21	51.1 Å²	51.1	11%	0.108	28%	0.279	C	S	.	.			trans	-87.7	91	170.5	-54.4	168.2	0	0	0	108	V222 V288 F399 K403 V407	I220-V222 PolarHBondContact O-N 3Å; I220-V288 HydrophobicContact CB-CG1 3.57Å; I220-V288 HydrophobicContact CD1-CG1 4.29Å; I220-V288 HydrophobicContact CG2-CG1 3.36Å; I220-F399 HydrophobicContact CG2-CD1 4.12Å; I220-F399 HydrophobicContact CG2-CE1 3.68Å; I220-F399 HydrophobicContact CG2-CE2 4.11Å; I220-F399 HydrophobicContact CG2-CZ 3.67Å; I220-K403 HydrophobicContact CD1-CG 4.39Å; I220-V407 HydrophobicContact CG2-CB 4.14Å; I220-V407 HydrophobicContact CG2-CG1 3.88Å
221	S	82.9	Confident	87.7	Confident	79 Å²	79	53.9 Å²	53.9	55%	0.552	29%	0.293	S	S	*	.			trans	-82.4	113.5	-176.5	58.7	0	0	0	0	111.9	V219	V219-S221 PolarHBondContact O-N 3.3Å
222	V	84	Confident	87.6	Confident	8 Å²	8	54.7 Å²	54.7	5%	0.048	30%	0.304	C	S	.	.			trans	-91.6	114.9	170.6	178.3	0	0	0	0	108.8	I220 V224 L284 R285 V288 V407 L411	I220-V222 PolarHBondContact O-N 3Å; V222-V224 PolarHBondContact O-N 3.18Å; V222-L284 HydrophobicContact CG1-CD2 4.25Å; V222-L284 HydrophobicContact CG1-CG 4.4Å; V222-L284 HydrophobicContact CG2-CG 4.49Å; V222-R285 HydrophobicContact CB-CB 4Å; V222-R285 HydrophobicContact CB-CG 4.35Å; V222-R285 HydrophobicContact CG1-CB 4.27Å; V222-V288 HydrophobicContact CG2-CB 4.24Å; V222-V288 HydrophobicContact CG2-CG1 4.26Å; V222-V288 HydrophobicContact CG2-CG2 4.48Å; V222-V407 HydrophobicContact CG2-CG1 4.3Å; V222-L411 HydrophobicContact CG1-CD2 3.98Å; V222-L411 HydrophobicContact CG2-CD1 4.38Å
223	P	83.6	Confident	87.3	Confident	97 Å²	97	54.1 Å²	54.1	63%	0.63	31%	0.305	S	S	*	.			trans	-71.8	115	-177.3	28	-33.4	0	0	0	110.9
224	V	86	Confident	87.1	Confident	34 Å²	34	55.7 Å²	55.7	21%	0.206	31%	0.31	C	S	.	.			trans	-98.7	100.9	173	-178.3	0	0	0	0	108.7	V222 R278 Q282 R285	V222-V224 PolarHBondContact O-N 3.18Å; V224-R278 HydrophobicContact CG1-CG 4.26Å; V224-Q282 HydrophobicContact CG1-CG 4.02Å; V224-R285 HydrophobicContact CG2-CB 4.11Å
225	K	86.9	Confident	86.8	Confident	95 Å²	95	56.4 Å²	56.4	41%	0.413	32%	0.318	S	S	.	.			trans	-61.6	144.6	177.1	-65.9	180	176.2	-175	0	111.3	Q229 L230 D233 R278	K225-Q229 HydrophobicContact CB-CB 4.42Å; K225-L230 HydrophobicContact CB-CD1 4.34Å; K225-L230 HydrophobicContact CB-CD2 3.72Å; K225-L230 HydrophobicContact CB-CG 3.67Å; K225-L230 HydrophobicContact CD-CD2 3.76Å; K225-L230 HydrophobicContact CD-CG 4.5Å; K225-L230 HydrophobicContact CG-CD2 4.35Å; K225-D233 WeakPolarHBondContact CD-OD2 3.13Å; K225-D233 IonicContact NZ-OD2 3.79Å; K225-D233 PolarHBondContact NZ-OD2 3.48Å; K225-R278 PolarHBondContact O-NH1 2.92Å
226	S	90.8	Very high	86.5	Confident	42 Å²	42	57.6 Å²	57.6	29%	0.294	33%	0.327	S	S	.	.			trans	-70.8	157	175.5	68.7	0	0	0	0	111.2	P228 Q229 L230	S226-P228 VanDerWaalsContact C-N 3.33Å; S226-Q229 PolarHBondContact O-N 3.23Å; S226-Q229 VanDerWaalsContact OG-CG 3.3Å; S226-Q229 WeakPolarHBondContact OG-CG 3.49Å; S226-Q229 PolarHBondContact OG-N 3.49Å; S226-L230 WeakPolarHBondContact O-CG 3.17Å; S226-L230 PolarHBondContact O-N 3.09Å
227	Y	90.7	Very high	85.9	Confident	103 Å²	103	60.6 Å²	60.6	40%	0.404	34%	0.341	S	S	.	.	H	α-helix	trans	-54.7	-42.5	175.8	-74.2	-67.2	0	0	0	113	Q229 L230 L231 L274 R278	Y227-Q229 PolarHBondContact O-N 3.37Å; Y227-L230 PolarHBondContact O-N 3.4Å; Y227-L231 VanDerWaalsContact O-CB 3.31Å; Y227-L231 WeakPolarHBondContact O-CB 3.29Å; Y227-L231 PolarHBondContact O-N 3.38Å; Y227-L274 HydrophobicContact CD1-CB 4.42Å; Y227-R278 HydrophobicContact CE1-CB 4.1Å; Y227-R278 VanDerWaalsContact CE1-CD 3.45Å; Y227-R278 HydrophobicContact CE1-CG 4.44Å; Y227-R278 VanDerWaalsContact CE2-CD 3.45Å
228	P	90.3	Very high	85.1	Confident	87 Å²	87	60.4 Å²	60.4	57%	0.565	34%	0.34	S	S	*	.	H	α-helix	trans	-62.4	-41.4	175.5	-25	35.1	0	0	0	113.6	S226 L231 V232	S226-P228 VanDerWaalsContact C-N 3.33Å; P228-L231 PolarHBondContact O-N 2.95Å; P228-V232 VanDerWaalsContact O-CG2 3.31Å; P228-V232 WeakPolarHBondContact O-CG2 3.39Å; P228-V232 PolarHBondContact O-N 3.21Å
229	Q	87.6	Confident	84.4	Confident	110 Å²	110	62.2 Å²	62.2	51%	0.514	35%	0.346	S	S	.	.	H	α-helix	trans	-64.3	-45	177.1	-73.7	171.6	-7.5	0	0	111.4	K225 S226 Y227 L231 V232 D233	K225-Q229 HydrophobicContact CB-CB 4.42Å; S226-Q229 PolarHBondContact O-N 3.23Å; S226-Q229 VanDerWaalsContact OG-CG 3.3Å; S226-Q229 WeakPolarHBondContact OG-CG 3.49Å; S226-Q229 PolarHBondContact OG-N 3.49Å; Y227-Q229 PolarHBondContact O-N 3.37Å; Q229-L231 VanDerWaalsContact C-N 3.33Å; Q229-V232 PolarHBondContact O-N 3.42Å; Q229-D233 WeakPolarHBondContact O-CB 3.42Å; Q229-D233 PolarHBondContact O-N 3.36Å
230	L	87.1	Confident	84	Confident	16 Å²	16	60.6 Å²	60.6	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-40.1	176.2	-70.7	171.9	0	0	0	111.6	K225 S226 Y227 V232 D233 E234 L274 T277 R278	K225-L230 HydrophobicContact CB-CD1 4.34Å; K225-L230 HydrophobicContact CB-CD2 3.72Å; K225-L230 HydrophobicContact CB-CG 3.67Å; K225-L230 HydrophobicContact CD-CD2 3.76Å; K225-L230 HydrophobicContact CD-CG 4.5Å; K225-L230 HydrophobicContact CG-CD2 4.35Å; S226-L230 WeakPolarHBondContact O-CG 3.17Å; S226-L230 PolarHBondContact O-N 3.09Å; Y227-L230 PolarHBondContact O-N 3.4Å; L230-V232 VanDerWaalsContact C-N 3.35Å; L230-D233 PolarHBondContact O-N 2.88Å; L230-E234 WeakPolarHBondContact O-CB 3.29Å; L230-E234 PolarHBondContact O-N 2.92Å; L230-L274 HydrophobicContact CB-CD2 3.39Å; L230-L274 WeakPolarHBondContact O-CD2 3.47Å; L230-T277 HydrophobicContact CD2-CG2 4.13Å; L230-R278 HydrophobicContact CD1-CB 4.01Å
231	L	88.3	Confident	83.6	Confident	82 Å²	82	61.3 Å²	61.3	43%	0.429	35%	0.346	S	S	.	.	H	α-helix	trans	-61.8	-44.6	176.3	177.4	65.3	0	0	0	110.8	Y227 P228 Q229 E234 A235 I270 L274	Y227-L231 VanDerWaalsContact O-CB 3.31Å; Y227-L231 WeakPolarHBondContact O-CB 3.29Å; Y227-L231 PolarHBondContact O-N 3.38Å; P228-L231 PolarHBondContact O-N 2.95Å; Q229-L231 VanDerWaalsContact C-N 3.33Å; L231-E234 PolarHBondContact O-N 3.26Å; L231-A235 WeakPolarHBondContact O-CB 3.33Å; L231-A235 PolarHBondContact O-N 3.41Å; L231-I270 HydrophobicContact CD1-CG2 3.68Å; L231-L274 HydrophobicContact CB-CD1 3.98Å; L231-L274 HydrophobicContact CD1-CD1 3.82Å; L231-L274 HydrophobicContact CG-CD1 4.49Å
232	V	86.3	Confident	83.6	Confident	76 Å²	76	60.1 Å²	60.1	46%	0.461	33%	0.331	S	S	.	.	H	α-helix	trans	-68	-37	177.8	172.2	0	0	0	0	111.3	R66 P228 Q229 L230 L236	R66-V232 PolarHBondContact NH1-O 2.83Å; R66-V232 PolarHBondContact NH2-O 3.43Å; P228-V232 VanDerWaalsContact O-CG2 3.31Å; P228-V232 WeakPolarHBondContact O-CG2 3.39Å; P228-V232 PolarHBondContact O-N 3.21Å; Q229-V232 PolarHBondContact O-N 3.42Å; L230-V232 VanDerWaalsContact C-N 3.35Å; V232-L236 WeakPolarHBondContact O-CB 3.4Å; V232-L236 WeakPolarHBondContact O-CG 3.44Å; V232-L236 PolarHBondContact O-N 3.21Å
233	D	80.9	Confident	83.6	Confident	61 Å²	61	60.2 Å²	60.2	33%	0.326	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-48.1	171.4	-77.6	-27.8	0	0	0	111.8	R66 K225 Q229 L230	R66-D233 IonicContact CZ-OD1 2.65Å; R66-D233 IonicContact NH2-OD1 3.66Å; R66-D233 PolarHBondContact NH2-OD1 3.19Å; K225-D233 WeakPolarHBondContact CD-OD2 3.13Å; K225-D233 IonicContact NZ-OD2 3.79Å; K225-D233 PolarHBondContact NZ-OD2 3.48Å; Q229-D233 WeakPolarHBondContact O-CB 3.42Å; Q229-D233 PolarHBondContact O-N 3.36Å; L230-D233 PolarHBondContact O-N 2.88Å
234	E	81.6	Confident	83.7	Confident	47 Å²	47	58.3 Å²	58.3	22%	0.22	32%	0.324	C	S	.	.	H	α-helix	trans	-71.6	-47.3	-177	-167.7	69.4	-174.8	0	0	111.4	L230 L231 L236 N237 Y240 I270 L274	L230-E234 WeakPolarHBondContact O-CB 3.29Å; L230-E234 PolarHBondContact O-N 2.92Å; L231-E234 PolarHBondContact O-N 3.26Å; E234-L236 VanDerWaalsContact C-N 3.29Å; E234-L236 PolarHBondContact O-N 2.92Å; E234-N237 WeakPolarHBondContact O-CB 3.01Å; E234-N237 PolarHBondContact O-N 3.43Å; E234-Y240 HydrophobicContact CG-CD2 4.33Å; E234-Y240 HydrophobicContact CG-CE2 3.79Å; E234-Y240 VanDerWaalsContact O-CD2 3.26Å; E234-Y240 WeakPolarHBondContact O-CD2 3.24Å; E234-Y240 WeakPolarHBondContact OE1-CE2 3.39Å; E234-I270 HydrophobicContact CG-CG1 4.43Å; E234-I270 HydrophobicContact CG-CG2 4.35Å; E234-L274 HydrophobicContact CB-CD2 4.27Å
235	A	80.2	Confident	83.8	Confident	36 Å²	36	61.3 Å²	61.3	30%	0.298	33%	0.334	S	S	.	.	H	α-helix	trans	-65.2	-29.5	-177.3	0	0	0	0	0	113.3	L231 N237	L231-A235 WeakPolarHBondContact O-CB 3.33Å; L231-A235 PolarHBondContact O-N 3.41Å; A235-N237 VanDerWaalsContact C-N 3.26Å; A235-N237 PolarHBondContact O-N 3.31Å
236	L	79.8	Confident	83.8	Confident	59 Å²	59	57 Å²	57	31%	0.309	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	10.7	174.9	-60.2	-161.5	0	0	0	113.4	L63 R66 W67 V232 E234	L63-L236 HydrophobicContact CD2-CB 4.32Å; L63-L236 HydrophobicContact CD2-CD1 3.59Å; L63-L236 HydrophobicContact CD2-CD2 3.63Å; L63-L236 HydrophobicContact CD2-CG 4.04Å; R66-L236 VanDerWaalsContact NH1-CB 3.34Å; W67-L236 PolarHBondContact NE1-O 2.89Å; V232-L236 WeakPolarHBondContact O-CB 3.4Å; V232-L236 WeakPolarHBondContact O-CG 3.44Å; V232-L236 PolarHBondContact O-N 3.21Å; E234-L236 VanDerWaalsContact C-N 3.29Å; E234-L236 PolarHBondContact O-N 2.92Å
237	N	76.8	Confident	83.7	Confident	69 Å²	69	56 Å²	56	37%	0.369	31%	0.307	S	S	.	.	S	Bend	trans	-61.4	132.3	163.9	-171.7	-42.7	0	0	0	108.8	E234 A235 Y239 Y240 G241	E234-N237 WeakPolarHBondContact O-CB 3.01Å; E234-N237 PolarHBondContact O-N 3.43Å; A235-N237 VanDerWaalsContact C-N 3.26Å; A235-N237 PolarHBondContact O-N 3.31Å; N237-Y239 PolarHBondContact O-N 3.33Å; N237-Y239 PolarHBondContact OD1-N 2.96Å; N237-Y240 HydrophobicContact CB-CD2 4.01Å; N237-Y240 PolarHBondContact O-N 3.36Å; N237-G241 PolarHBondContact O-N 2.63Å
238	P	74.7	Confident	83.7	Confident	74 Å²	74	54 Å²	54	48%	0.481	31%	0.312	S	S	.	.	H	α-helix	trans	-49.5	-31	-179.3	-28.8	33.1	0	0	0	114.2	W67 F242	W67-P238 HydrophobicContact CD2-CG 4.35Å; W67-P238 HydrophobicContact CH2-CB 4.43Å; W67-P238 HydrophobicContact CH2-CG 4.38Å; W67-P238 HydrophobicContact CZ2-CB 4.2Å; W67-P238 HydrophobicContact CZ2-CG 3.84Å; P238-F242 WeakPolarHBondContact O-CB 3.41Å; P238-F242 PolarHBondContact O-N 3.32Å
239	Y	76.4	Confident	83.6	Confident	48 Å²	48	50.5 Å²	50.5	19%	0.188	29%	0.288	C	S	.	.	H	α-helix	trans	-63.2	-54.9	177.2	177.8	-108	0	0	0	113.2	N237 G241 F242 Q243 P470 P473	N237-Y239 PolarHBondContact O-N 3.33Å; N237-Y239 PolarHBondContact OD1-N 2.96Å; Y239-G241 VanDerWaalsContact C-N 3.29Å; Y239-G241 PolarHBondContact O-N 3.21Å; Y239-F242 PolarHBondContact O-N 3.41Å; Y239-Q243 PolarHBondContact O-N 2.84Å; Y239-P470 VanDerWaalsContact CE2-C 3.46Å; Y239-P470 HydrophobicContact CE2-CB 4.13Å; Y239-P470 WeakPolarHBondContact CE2-O 3.17Å; Y239-P470 WeakPolarHBondContact OH-CB 3.2Å; Y239-P470 PolarHBondContact OH-O 3.41Å; Y239-P473 HydrophobicContact CD2-CG 3.85Å; Y239-P473 HydrophobicContact CE2-CG 4.27Å; Y239-P473 HydrophobicContact CG-CG 4.27Å
240	Y	80.9	Confident	83.7	Confident	29 Å²	29	45.9 Å²	45.9	11%	0.114	27%	0.266	C	S	.	.	H	α-helix	trans	-69.8	-29.4	178.6	-65.1	-66.9	0	0	0	111.8	E234 N237 Q243 A244 I270	E234-Y240 HydrophobicContact CG-CD2 4.33Å; E234-Y240 HydrophobicContact CG-CE2 3.79Å; E234-Y240 VanDerWaalsContact O-CD2 3.26Å; E234-Y240 WeakPolarHBondContact O-CD2 3.24Å; E234-Y240 WeakPolarHBondContact OE1-CE2 3.39Å; N237-Y240 HydrophobicContact CB-CD2 4.01Å; N237-Y240 PolarHBondContact O-N 3.36Å; Y240-Q243 PolarHBondContact O-N 2.7Å; Y240-A244 WeakPolarHBondContact O-CB 2.93Å; Y240-A244 PolarHBondContact O-N 3.12Å; Y240-I270 HydrophobicContact CD1-CD1 3.88Å; Y240-I270 HydrophobicContact CD1-CG1 4.2Å; Y240-I270 HydrophobicContact CE1-CD1 3.89Å; Y240-I270 HydrophobicContact CE1-CG1 3.7Å; Y240-I270 HydrophobicContact CE2-CG1 4.18Å; Y240-I270 HydrophobicContact CG-CD1 4.24Å
241	G	80.8	Confident	83.8	Confident	35 Å²	35	49 Å²	49	36%	0.361	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-47.4	170.7	0	0	0	0	0	112.5	N237 Y239 Q243 A244 F245	N237-G241 PolarHBondContact O-N 2.63Å; Y239-G241 VanDerWaalsContact C-N 3.29Å; Y239-G241 PolarHBondContact O-N 3.21Å; G241-Q243 VanDerWaalsContact C-N 3.31Å; G241-Q243 PolarHBondContact O-N 3.09Å; G241-A244 PolarHBondContact O-N 2.91Å; G241-F245 PolarHBondContact O-N 3.2Å; G241-F245 VanDerWaalsContact O-N 3.09Å
242	F	81.8	Confident	83.7	Confident	54 Å²	54	47.6 Å²	47.6	24%	0.237	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-38.3	174	-178.9	-104	0	0	0	112.1	P238 Y239 F245 S246 V468	P238-F242 WeakPolarHBondContact O-CB 3.41Å; P238-F242 PolarHBondContact O-N 3.32Å; Y239-F242 PolarHBondContact O-N 3.41Å; F242-F245 PolarHBondContact O-N 3.25Å; F242-S246 PolarHBondContact O-N 2.77Å; F242-S246 PolarHBondContact O-OG 3Å; F242-V468 HydrophobicContact CD1-CG1 4.4Å; F242-V468 HydrophobicContact CE1-CB 3.81Å; F242-V468 HydrophobicContact CE1-CG1 3.81Å; F242-V468 HydrophobicContact CZ-CB 3.69Å; F242-V468 HydrophobicContact CZ-CG1 4.04Å; F242-V468 HydrophobicContact CZ-CG2 4.27Å
243	Q	84	Confident	83.5	Confident	10 Å²	10	44.6 Å²	44.6	5%	0.047	26%	0.264	C	S	.	.	H	α-helix	trans	-67	-41.8	177.9	-165	176.2	11.6	0	0	112.6	Y239 Y240 G241 F245 S246 I247 I262 S266	Y239-Q243 PolarHBondContact O-N 2.84Å; Y240-Q243 PolarHBondContact O-N 2.7Å; G241-Q243 VanDerWaalsContact C-N 3.31Å; G241-Q243 PolarHBondContact O-N 3.09Å; Q243-F245 VanDerWaalsContact C-N 3.35Å; Q243-S246 PolarHBondContact O-N 2.92Å; Q243-I247 HydrophobicContact CG-CD1 4.27Å; Q243-I247 VanDerWaalsContact O-CG1 3.32Å; Q243-I247 WeakPolarHBondContact O-CG1 3.37Å; Q243-I247 PolarHBondContact O-N 3.19Å; Q243-I262 HydrophobicContact CG-CG2 4.31Å; Q243-S266 PolarHBondContact NE2-OG 3.05Å; Q243-S266 PolarHBondContact OE1-OG 2.94Å
244	A	86.1	Confident	83.6	Confident	58 Å²	58	47.2 Å²	47.2	48%	0.479	27%	0.274	S	S	.	.	H	α-helix	trans	-63.6	-40.7	175.3	0	0	0	0	0	111.8	Y240 G241 S246 I247 A248	Y240-A244 WeakPolarHBondContact O-CB 2.93Å; Y240-A244 PolarHBondContact O-N 3.12Å; G241-A244 PolarHBondContact O-N 2.91Å; A244-S246 VanDerWaalsContact C-N 3.34Å; A244-I247 PolarHBondContact O-N 3.16Å; A244-A248 PolarHBondContact O-N 3.09Å
245	F	87.3	Confident	83.7	Confident	96 Å²	96	45.7 Å²	45.7	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-58.8	-44.9	171.5	169.9	-100.6	0	0	0	111.8	G241 F242 Q243 A248 L249 T465	G241-F245 PolarHBondContact O-N 3.2Å; G241-F245 VanDerWaalsContact O-N 3.09Å; F242-F245 PolarHBondContact O-N 3.25Å; Q243-F245 VanDerWaalsContact C-N 3.35Å; F245-A248 PolarHBondContact O-N 3.39Å; F245-L249 HydrophobicContact CE1-CD1 4.38Å; F245-L249 HydrophobicContact CZ-CD1 4.24Å; F245-L249 PolarHBondContact O-N 3.4Å; F245-T465 HydrophobicContact CE1-CG2 4.26Å
246	S	87.9	Confident	84	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.028	28%	0.275	C	S	.	.	H	α-helix	trans	-64.4	-43.1	179	-51.9	0	0	0	0	111.8	F242 Q243 A244 A248 L249 W250	F242-S246 PolarHBondContact O-N 2.77Å; F242-S246 PolarHBondContact O-OG 3Å; Q243-S246 PolarHBondContact O-N 2.92Å; A244-S246 VanDerWaalsContact C-N 3.34Å; S246-A248 PolarHBondContact O-N 2.74Å; S246-L249 WeakPolarHBondContact O-CB 3.3Å; S246-L249 PolarHBondContact O-N 3.05Å; S246-W250 PolarHBondContact O-N 3.4Å
247	I	89.4	Confident	84.4	Confident	22 Å²	22	54.9 Å²	54.9	11%	0.113	29%	0.29	C	S	.	.	H	α-helix	trans	-60.1	-45.2	175.7	-69.6	164	0	0	0	111.1	Q243 A244 L249 W250 L251 A259 I262 F263	Q243-I247 HydrophobicContact CG-CD1 4.27Å; Q243-I247 VanDerWaalsContact O-CG1 3.32Å; Q243-I247 WeakPolarHBondContact O-CG1 3.37Å; Q243-I247 PolarHBondContact O-N 3.19Å; A244-I247 PolarHBondContact O-N 3.16Å; I247-L249 VanDerWaalsContact C-N 3.28Å; I247-L249 PolarHBondContact O-N 2.85Å; I247-W250 HydrophobicContact CG1-CE3 4.21Å; I247-W250 HydrophobicContact CG1-CZ3 4.18Å; I247-W250 PolarHBondContact O-N 3.42Å; I247-L251 HydrophobicContact CG2-CD1 4.14Å; I247-L251 VanDerWaalsContact O-CG 3.31Å; I247-L251 WeakPolarHBondContact O-CG 3.4Å; I247-L251 PolarHBondContact O-N 3.25Å; I247-A259 HydrophobicContact CG2-CB 4.28Å; I247-I262 HydrophobicContact CD1-CG2 4.37Å; I247-I262 HydrophobicContact CG1-CG2 4.44Å; I247-F263 HydrophobicContact CD1-CB 4.19Å
248	A	89.9	Confident	84.8	Confident	61 Å²	61	52 Å²	52	50%	0.504	27%	0.274	S	S	.	.	H	α-helix	trans	-61.5	-39	178	0	0	0	0	0	111.9	A244 F245 S246 A252	A244-A248 PolarHBondContact O-N 3.09Å; F245-A248 PolarHBondContact O-N 3.39Å; S246-A248 PolarHBondContact O-N 2.74Å; A248-A252 PolarHBondContact O-N 2.83Å
249	L	89	Confident	85.5	Confident	13 Å²	13	48.5 Å²	48.5	7%	0.068	25%	0.252	C	S	.	.	H	α-helix	trans	-66.2	-45.8	175.9	-173.2	151.8	0	0	0	112	F245 S246 I247 L251 A252 D253 L461 D462 T465	F245-L249 HydrophobicContact CE1-CD1 4.38Å; F245-L249 HydrophobicContact CZ-CD1 4.24Å; F245-L249 PolarHBondContact O-N 3.4Å; S246-L249 WeakPolarHBondContact O-CB 3.3Å; S246-L249 PolarHBondContact O-N 3.05Å; I247-L249 VanDerWaalsContact C-N 3.28Å; I247-L249 PolarHBondContact O-N 2.85Å; L249-L251 VanDerWaalsContact C-N 3.32Å; L249-L251 PolarHBondContact O-N 3.18Å; L249-A252 WeakPolarHBondContact O-CA 3.42Å; L249-A252 WeakPolarHBondContact O-CB 3.4Å; L249-A252 PolarHBondContact O-N 2.67Å; L249-D253 PolarHBondContact O-N 3.31Å; L249-L461 HydrophobicContact CD1-CB 3.31Å; L249-L461 HydrophobicContact CD1-CD1 4.49Å; L249-D462 HydrophobicContact CD2-CB 3.7Å; L249-T465 HydrophobicContact CD1-CG2 4.32Å
250	W	88.3	Confident	86.2	Confident	14 Å²	14	50.2 Å²	50.2	5%	0.053	26%	0.263	C	S	.	.	H	α-helix	trans	-64.5	-35	178.7	-63.8	-29.4	0	0	0	112.7	S246 I247 A252 D253 H254 Y255 Y258 A259 I262 D462 T465	S246-W250 PolarHBondContact O-N 3.4Å; I247-W250 HydrophobicContact CG1-CE3 4.21Å; I247-W250 HydrophobicContact CG1-CZ3 4.18Å; I247-W250 PolarHBondContact O-N 3.42Å; W250-A252 VanDerWaalsContact C-N 3.28Å; W250-A252 PolarHBondContact O-N 2.84Å; W250-D253 CarbonylContact O-C 3.55Å; W250-D253 PolarHBondContact O-N 3.48Å; W250-H254 PolarHBondContact O-N 3.13Å; W250-Y255 HydrophobicContact CB-CD2 4.48Å; W250-Y255 PolarHBondContact O-N 3.43Å; W250-Y258 AromaticContact CD2-CD1 3.93Å; W250-Y258 HydrophobicContact CD2-CD1 3.93Å; W250-Y258 AromaticContact CD2-CE1 3.77Å; W250-Y258 HydrophobicContact CD2-CE1 3.77Å; W250-Y258 AromaticContact CE2-CE1 3.77Å; W250-Y258 AromaticContact CE3-CD1 3.86Å; W250-Y258 HydrophobicContact CE3-CD1 3.86Å; W250-Y258 AromaticContact CE3-CE1 3.7Å; W250-Y258 HydrophobicContact CE3-CE1 3.7Å; W250-Y258 HydrophobicContact CG-CD1 4.38Å; W250-Y258 AromaticContact CH2-CE1 3.65Å; W250-Y258 HydrophobicContact CH2-CE1 3.65Å; W250-Y258 AromaticContact CZ2-CE1 3.72Å; W250-Y258 HydrophobicContact CZ2-CE1 3.72Å; W250-Y258 HydrophobicContact CZ3-CD1 4.22Å; W250-Y258 AromaticContact CZ3-CE1 3.64Å; W250-Y258 HydrophobicContact CZ3-CE1 3.64Å; W250-A259 HydrophobicContact CB-CB 4.11Å; W250-I262 HydrophobicContact CZ3-CB 4.42Å; W250-I262 HydrophobicContact CZ3-CG1 4.41Å; W250-I262 HydrophobicContact CZ3-CG2 4.16Å; W250-D462 PolarHBondContact NE1-OD1 3.29Å; W250-T465 PolarHBondContact NE1-OG1 3.15Å
251	L	88.9	Confident	86.5	Confident	80 Å²	80	50.4 Å²	50.4	42%	0.419	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-33.6	171.1	-70.7	171.9	0	0	0	112.3	I247 L249 Y256 A259	I247-L251 HydrophobicContact CG2-CD1 4.14Å; I247-L251 VanDerWaalsContact O-CG 3.31Å; I247-L251 WeakPolarHBondContact O-CG 3.4Å; I247-L251 PolarHBondContact O-N 3.25Å; L249-L251 VanDerWaalsContact C-N 3.32Å; L249-L251 PolarHBondContact O-N 3.18Å; L251-Y256 HydrophobicContact CD2-CD1 3.83Å; L251-Y256 HydrophobicContact CD2-CE1 4.44Å; L251-A259 HydrophobicContact CD2-CB 3.84Å; L251-A259 HydrophobicContact CG-CB 3.95Å
252	A	87.1	Confident	86.7	Confident	53 Å²	53	49.7 Å²	49.7	44%	0.438	26%	0.257	S	S	.	.	H	α-helix	trans	-74.7	-27.7	175.9	0	0	0	0	0	113	A248 L249 W250 H254	A248-A252 PolarHBondContact O-N 2.83Å; L249-A252 WeakPolarHBondContact O-CA 3.42Å; L249-A252 WeakPolarHBondContact O-CB 3.4Å; L249-A252 PolarHBondContact O-N 2.67Å; W250-A252 VanDerWaalsContact C-N 3.28Å; W250-A252 PolarHBondContact O-N 2.84Å; A252-H254 VanDerWaalsContact C-N 3.33Å
253	D	81.3	Confident	87.1	Confident	13 Å²	13	52.5 Å²	52.5	7%	0.07	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	19.1	176.5	-157.8	19.3	0	0	0	113.1	L249 W250 Y255 I458 R459	L249-D253 PolarHBondContact O-N 3.31Å; W250-D253 CarbonylContact O-C 3.55Å; W250-D253 PolarHBondContact O-N 3.48Å; D253-Y255 VanDerWaalsContact C-N 3.29Å; D253-Y255 HydrophobicContact CB-CD2 4.15Å; D253-Y255 HydrophobicContact CB-CE2 4.15Å; D253-Y255 PolarHBondContact O-N 3.45Å; D253-Y255 VanDerWaalsContact OD2-CE2 3.25Å; D253-Y255 WeakPolarHBondContact OD2-CE2 3.33Å; D253-I458 HydrophobicContact CB-CG2 3.71Å; D253-R459 IonicContact OD1-CZ 2.91Å; D253-R459 IonicContact OD1-NE 3.96Å; D253-R459 IonicContact OD1-NH1 2.68Å; D253-R459 PolarHBondContact OD1-NH1 3.28Å; D253-R459 IonicContact OD1-NH2 3.47Å; D253-R459 PolarHBondContact OD1-NH2 2.94Å; D253-R459 IonicContact OD2-CZ 2.78Å; D253-R459 IonicContact OD2-NE 2.67Å; D253-R459 IonicContact OD2-NH1 3.88Å; D253-R459 PolarHBondContact OD2-NH1 3.26Å; D253-R459 IonicContact OD2-NH2 3.63Å
254	H	83	Confident	87.4	Confident	116 Å²	116	56.2 Å²	56.2	54%	0.537	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	21.5	177.8	-55.1	-73.9	0	0	0	116.4	W250 A252 Y256	W250-H254 PolarHBondContact O-N 3.13Å; A252-H254 VanDerWaalsContact C-N 3.33Å; H254-Y256 VanDerWaalsContact C-N 3.3Å; H254-Y256 HydrophobicContact CB-CE2 4.01Å; H254-Y256 AromaticContact ND1-CE2 3.81Å; H254-Y256 AromaticContact ND1-CZ 3.61Å; H254-Y256 PolarHBondContact ND1-OH 2.93Å; H254-Y256 PolarHBondContact O-N 3.32Å; H254-Y256 VanDerWaalsContact O-N 3.16Å
255	Y	83.8	Confident	87.3	Confident	15 Å²	15	57 Å²	57	6%	0.059	28%	0.284	C	S	.	.			trans	-87.9	61.2	172.8	-60.6	-40.1	0	0	0	112.1	W250 D253 A259 R459 N956 D959 F962	W250-Y255 HydrophobicContact CB-CD2 4.48Å; W250-Y255 PolarHBondContact O-N 3.43Å; D253-Y255 VanDerWaalsContact C-N 3.29Å; D253-Y255 HydrophobicContact CB-CD2 4.15Å; D253-Y255 HydrophobicContact CB-CE2 4.15Å; D253-Y255 PolarHBondContact O-N 3.45Å; D253-Y255 VanDerWaalsContact OD2-CE2 3.25Å; D253-Y255 WeakPolarHBondContact OD2-CE2 3.33Å; Y255-A259 WeakPolarHBondContact O-CB 3.47Å; Y255-A259 PolarHBondContact O-N 3.49Å; Y255-R459 PolarHBondContact OH-NH1 2.97Å; Y255-N956 PolarHBondContact OH-ND2 2.91Å; Y255-D959 HydrophobicContact CD1-CB 4.06Å; Y255-F962 HydrophobicContact CE2-CE2 4.34Å
256	Y	87.4	Confident	87.1	Confident	122 Å²	122	53.2 Å²	53.2	48%	0.478	27%	0.269	S	S	.	.	H	α-helix	trans	-65.4	-43	-171.8	-59.8	-64.2	0	0	0	113.4	L251 H254 L260 D959	L251-Y256 HydrophobicContact CD2-CD1 3.83Å; L251-Y256 HydrophobicContact CD2-CE1 4.44Å; H254-Y256 VanDerWaalsContact C-N 3.3Å; H254-Y256 HydrophobicContact CB-CE2 4.01Å; H254-Y256 AromaticContact ND1-CE2 3.81Å; H254-Y256 AromaticContact ND1-CZ 3.61Å; H254-Y256 PolarHBondContact ND1-OH 2.93Å; H254-Y256 PolarHBondContact O-N 3.32Å; H254-Y256 VanDerWaalsContact O-N 3.16Å; Y256-L260 VanDerWaalsContact O-CB 3.27Å; Y256-L260 WeakPolarHBondContact O-CB 3.5Å; Y256-L260 PolarHBondContact O-N 3.28Å; Y256-D959 PolarHBondContact N-OD2 3.41Å
257	W	87.6	Confident	87.1	Confident	166 Å²	166	54.8 Å²	54.8	63%	0.629	28%	0.282	S	S	*	.	H	α-helix	trans	-72.3	-42.8	-175.3	-67	104.8	0	0	0	111.7	L260 C261 D959	W257-L260 HydrophobicContact CE3-CD2 4.47Å; W257-L260 PolarHBondContact O-N 2.86Å; W257-C261 WeakPolarHBondContact O-CB 3.24Å; W257-C261 PolarHBondContact O-N 2.8Å; W257-C261 PolarHBondContact O-SG 3.47Å; W257-D959 WeakPolarHBondContact CB-OD2 3.32Å; W257-D959 PolarHBondContact N-OD2 2.82Å
258	Y	85.7	Confident	87	Confident	8 Å²	8	58.7 Å²	58.7	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-48.9	175.2	-178.9	-118.3	0	0	0	111.5	W250 L260 C261 I262 D959 F962 L963 D966	W250-Y258 AromaticContact CD2-CD1 3.93Å; W250-Y258 HydrophobicContact CD2-CD1 3.93Å; W250-Y258 AromaticContact CD2-CE1 3.77Å; W250-Y258 HydrophobicContact CD2-CE1 3.77Å; W250-Y258 AromaticContact CE2-CE1 3.77Å; W250-Y258 AromaticContact CE3-CD1 3.86Å; W250-Y258 HydrophobicContact CE3-CD1 3.86Å; W250-Y258 AromaticContact CE3-CE1 3.7Å; W250-Y258 HydrophobicContact CE3-CE1 3.7Å; W250-Y258 HydrophobicContact CG-CD1 4.38Å; W250-Y258 AromaticContact CH2-CE1 3.65Å; W250-Y258 HydrophobicContact CH2-CE1 3.65Å; W250-Y258 AromaticContact CZ2-CE1 3.72Å; W250-Y258 HydrophobicContact CZ2-CE1 3.72Å; W250-Y258 HydrophobicContact CZ3-CD1 4.22Å; W250-Y258 AromaticContact CZ3-CE1 3.64Å; W250-Y258 HydrophobicContact CZ3-CE1 3.64Å; Y258-L260 VanDerWaalsContact C-N 3.34Å; Y258-L260 PolarHBondContact O-N 3.01Å; Y258-C261 PolarHBondContact O-N 2.91Å; Y258-I262 HydrophobicContact CD2-CG1 4.13Å; Y258-I262 HydrophobicContact CE2-CD1 4.03Å; Y258-I262 HydrophobicContact CE2-CG1 3.76Å; Y258-I262 WeakPolarHBondContact O-CG1 3.35Å; Y258-I262 PolarHBondContact O-N 2.77Å; Y258-D959 WeakPolarHBondContact CB-OD1 3.48Å; Y258-D959 PolarHBondContact N-OD1 2.9Å; Y258-F962 HydrophobicContact CD2-CB 4.23Å; Y258-F962 HydrophobicContact CE2-CB 4.4Å; Y258-F962 HydrophobicContact CG-CB 4.31Å; Y258-L963 HydrophobicContact CD2-CB 4.23Å; Y258-L963 HydrophobicContact CD2-CD1 4.12Å; Y258-D966 HydrophobicContact CE2-CB 4.08Å; Y258-D966 PolarHBondContact OH-OD2 3.05Å
259	A	89.1	Confident	86.6	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-57.8	-44	176.8	0	0	0	0	0	112.4	I247 W250 L251 Y255 F263	I247-A259 HydrophobicContact CG2-CB 4.28Å; W250-A259 HydrophobicContact CB-CB 4.11Å; L251-A259 HydrophobicContact CD2-CB 3.84Å; L251-A259 HydrophobicContact CG-CB 3.95Å; Y255-A259 WeakPolarHBondContact O-CB 3.47Å; Y255-A259 PolarHBondContact O-N 3.49Å; A259-F263 VanDerWaalsContact O-CB 3.29Å; A259-F263 WeakPolarHBondContact O-CB 3.46Å; A259-F263 PolarHBondContact O-N 3.37Å
260	L	90.6	Very high	86.4	Confident	84 Å²	84	58.8 Å²	58.8	44%	0.44	30%	0.299	S	S	.	.	H	α-helix	trans	-63.7	-46.4	178.5	-180	64.2	0	0	0	112.3	Y256 W257 Y258 F263 L264	Y256-L260 VanDerWaalsContact O-CB 3.27Å; Y256-L260 WeakPolarHBondContact O-CB 3.5Å; Y256-L260 PolarHBondContact O-N 3.28Å; W257-L260 HydrophobicContact CE3-CD2 4.47Å; W257-L260 PolarHBondContact O-N 2.86Å; Y258-L260 VanDerWaalsContact C-N 3.34Å; Y258-L260 PolarHBondContact O-N 3.01Å; L260-F263 WeakPolarHBondContact O-CB 3.48Å; L260-F263 PolarHBondContact O-N 2.91Å; L260-L264 HydrophobicContact CD1-CG 4.49Å; L260-L264 HydrophobicContact CG-CD1 4.34Å; L260-L264 WeakPolarHBondContact O-CG 3.16Å; L260-L264 PolarHBondContact O-N 2.88Å
261	C	87.9	Confident	86.4	Confident	34 Å²	34	62 Å²	62	23%	0.23	32%	0.322	C	S	.	.	H	α-helix	trans	-62.9	-45.9	-179.5	-69.7	0	0	0	0	111.6	W257 Y258 F263 L264 I265 L963	W257-C261 WeakPolarHBondContact O-CB 3.24Å; W257-C261 PolarHBondContact O-N 2.8Å; W257-C261 PolarHBondContact O-SG 3.47Å; Y258-C261 PolarHBondContact O-N 2.91Å; C261-F263 VanDerWaalsContact C-N 3.33Å; C261-F263 PolarHBondContact O-N 2.78Å; C261-L264 PolarHBondContact O-N 3.37Å; C261-I265 WeakPolarHBondContact O-CG1 3.29Å; C261-I265 PolarHBondContact O-N 3.49Å; C261-L963 HydrophobicContact CB-CD1 3.66Å
262	I	85.4	Confident	86.1	Confident	20 Å²	20	62.6 Å²	62.6	10%	0.103	33%	0.326	C	S	.	.	H	α-helix	trans	-65.3	-39	178.8	-65	-62.6	0	0	0	111.1	Q243 I247 W250 Y258 I265 S266	Q243-I262 HydrophobicContact CG-CG2 4.31Å; I247-I262 HydrophobicContact CD1-CG2 4.37Å; I247-I262 HydrophobicContact CG1-CG2 4.44Å; W250-I262 HydrophobicContact CZ3-CB 4.42Å; W250-I262 HydrophobicContact CZ3-CG1 4.41Å; W250-I262 HydrophobicContact CZ3-CG2 4.16Å; Y258-I262 HydrophobicContact CD2-CG1 4.13Å; Y258-I262 HydrophobicContact CE2-CD1 4.03Å; Y258-I262 HydrophobicContact CE2-CG1 3.76Å; Y258-I262 WeakPolarHBondContact O-CG1 3.35Å; Y258-I262 PolarHBondContact O-N 2.77Å; I262-I265 PolarHBondContact O-N 3.14Å; I262-S266 WeakPolarHBondContact O-CB 3.46Å; I262-S266 PolarHBondContact O-N 2.68Å; I262-S266 PolarHBondContact O-OG 3.29Å
263	F	89.1	Confident	85.8	Confident	112 Å²	112	61.7 Å²	61.7	49%	0.491	32%	0.316	S	S	.	.	H	α-helix	trans	-58.6	-48.8	172.8	173.7	-99.1	0	0	0	112.1	I247 A259 L260 C261 I265 S266 A267	I247-F263 HydrophobicContact CD1-CB 4.19Å; A259-F263 VanDerWaalsContact O-CB 3.29Å; A259-F263 WeakPolarHBondContact O-CB 3.46Å; A259-F263 PolarHBondContact O-N 3.37Å; L260-F263 WeakPolarHBondContact O-CB 3.48Å; L260-F263 PolarHBondContact O-N 2.91Å; C261-F263 VanDerWaalsContact C-N 3.33Å; C261-F263 PolarHBondContact O-N 2.78Å; F263-I265 PolarHBondContact O-N 2.9Å; F263-S266 PolarHBondContact O-N 3.34Å; F263-A267 WeakPolarHBondContact O-CB 3.32Å; F263-A267 PolarHBondContact O-N 3.44Å
264	L	89.9	Confident	86	Confident	88 Å²	88	61.9 Å²	61.9	46%	0.461	32%	0.317	S	S	.	.	H	α-helix	trans	-61.2	-44.3	179.4	-71.6	173.5	0	0	0	112.2	L260 C261 S266 A267 I268	L260-L264 HydrophobicContact CD1-CG 4.49Å; L260-L264 HydrophobicContact CG-CD1 4.34Å; L260-L264 WeakPolarHBondContact O-CG 3.16Å; L260-L264 PolarHBondContact O-N 2.88Å; C261-L264 PolarHBondContact O-N 3.37Å; L264-S266 PolarHBondContact O-N 3.41Å; L264-A267 PolarHBondContact O-N 2.92Å; L264-I268 WeakPolarHBondContact O-CG1 3.45Å; L264-I268 PolarHBondContact O-N 3.01Å
265	I	84.4	Confident	86.3	Confident	76 Å²	76	61.9 Å²	61.9	39%	0.39	31%	0.313	S	S	.	.	H	α-helix	trans	-62	-45	178.1	-69	166.8	0	0	0	110.7	C261 I262 F263 I268 S269 L967	C261-I265 WeakPolarHBondContact O-CG1 3.29Å; C261-I265 PolarHBondContact O-N 3.49Å; I262-I265 PolarHBondContact O-N 3.14Å; F263-I265 PolarHBondContact O-N 2.9Å; I265-I268 PolarHBondContact O-N 3.13Å; I265-S269 WeakPolarHBondContact O-CB 3.36Å; I265-S269 PolarHBondContact O-N 3.04Å; I265-L967 HydrophobicContact CD1-CD1 3.46Å; I265-L967 VanDerWaalsContact CD1-CD1 3.46Å; I265-L967 HydrophobicContact CD1-CD2 4.01Å; I265-L967 HydrophobicContact CD1-CG 4.38Å
266	S	83.8	Confident	86.1	Confident	15 Å²	15	67.5 Å²	67.5	11%	0.105	34%	0.338	C	S	.	.	H	α-helix	trans	-66.8	-39.3	177.9	-77.9	0	0	0	0	112.9	Q243 I262 F263 L264 S269 I270	Q243-S266 PolarHBondContact NE2-OG 3.05Å; Q243-S266 PolarHBondContact OE1-OG 2.94Å; I262-S266 WeakPolarHBondContact O-CB 3.46Å; I262-S266 PolarHBondContact O-N 2.68Å; I262-S266 PolarHBondContact O-OG 3.29Å; F263-S266 PolarHBondContact O-N 3.34Å; L264-S266 PolarHBondContact O-N 3.41Å; S266-S269 PolarHBondContact O-N 2.99Å; S266-I270 WeakPolarHBondContact O-CB 3.18Å; S266-I270 VanDerWaalsContact O-CG1 3.23Å; S266-I270 WeakPolarHBondContact O-CG1 3.32Å; S266-I270 PolarHBondContact O-N 3.35Å
267	A	87.5	Confident	85.7	Confident	37 Å²	37	64.4 Å²	64.4	31%	0.306	33%	0.332	S	S	.	.	H	α-helix	trans	-59.2	-48.6	174.3	0	0	0	0	0	111.2	F263 L264 S269 I270 C271	F263-A267 WeakPolarHBondContact O-CB 3.32Å; F263-A267 PolarHBondContact O-N 3.44Å; L264-A267 PolarHBondContact O-N 2.92Å; A267-S269 PolarHBondContact O-N 3.29Å; A267-I270 PolarHBondContact O-N 3.25Å; A267-C271 WeakPolarHBondContact O-CB 3.21Å; A267-C271 PolarHBondContact O-N 3.32Å; A267-C271 PolarHBondContact O-SG 2.88Å
268	I	86.9	Confident	85.7	Confident	104 Å²	104	59.1 Å²	59.1	53%	0.533	31%	0.312	S	S	.	.	H	α-helix	trans	-61.4	-44.9	176.9	-66.8	165.6	0	0	0	111	L264 I265 C271 L272	L264-I268 WeakPolarHBondContact O-CG1 3.45Å; L264-I268 PolarHBondContact O-N 3.01Å; I265-I268 PolarHBondContact O-N 3.13Å; I268-C271 PolarHBondContact O-N 3.18Å; I268-L272 HydrophobicContact CG2-CD1 3.89Å; I268-L272 HydrophobicContact CG2-CG 4.34Å; I268-L272 WeakPolarHBondContact O-CB 3.3Å; I268-L272 WeakPolarHBondContact O-CG 3.13Å; I268-L272 PolarHBondContact O-N 3.02Å
269	S	82.1	Confident	85.6	Confident	55 Å²	55	63.8 Å²	63.8	39%	0.385	33%	0.332	S	S	.	.	H	α-helix	trans	-59.1	-47.6	178.3	-179.8	0	0	0	0	111.9	I265 S266 A267 L272 S273	I265-S269 WeakPolarHBondContact O-CB 3.36Å; I265-S269 PolarHBondContact O-N 3.04Å; S266-S269 PolarHBondContact O-N 2.99Å; A267-S269 PolarHBondContact O-N 3.29Å; S269-L272 PolarHBondContact O-N 2.77Å; S269-S273 WeakPolarHBondContact O-CB 3.48Å; S269-S273 PolarHBondContact O-N 3.35Å
270	I	85.1	Confident	85.1	Confident	22 Å²	22	70 Å²	70	11%	0.113	36%	0.361	C	S	.	.	H	α-helix	trans	-61.6	-49.6	176.9	-68.9	166.2	0	0	0	109.7	L231 E234 Y240 S266 A267 L272 S273 L274	L231-I270 HydrophobicContact CD1-CG2 3.68Å; E234-I270 HydrophobicContact CG-CG1 4.43Å; E234-I270 HydrophobicContact CG-CG2 4.35Å; Y240-I270 HydrophobicContact CD1-CD1 3.88Å; Y240-I270 HydrophobicContact CD1-CG1 4.2Å; Y240-I270 HydrophobicContact CE1-CD1 3.89Å; Y240-I270 HydrophobicContact CE1-CG1 3.7Å; Y240-I270 HydrophobicContact CE2-CG1 4.18Å; Y240-I270 HydrophobicContact CG-CD1 4.24Å; S266-I270 WeakPolarHBondContact O-CB 3.18Å; S266-I270 VanDerWaalsContact O-CG1 3.23Å; S266-I270 WeakPolarHBondContact O-CG1 3.32Å; S266-I270 PolarHBondContact O-N 3.35Å; A267-I270 PolarHBondContact O-N 3.25Å; I270-L272 VanDerWaalsContact C-N 3.34Å; I270-L272 PolarHBondContact O-N 2.99Å; I270-S273 WeakPolarHBondContact O-CB 3.24Å; I270-S273 PolarHBondContact O-N 3.47Å; I270-S273 VanDerWaalsContact O-N 3.13Å; I270-L274 HydrophobicContact CG2-CD1 3.69Å; I270-L274 HydrophobicContact CG2-CG 4.07Å; I270-L274 WeakPolarHBondContact O-CB 3.23Å; I270-L274 WeakPolarHBondContact O-CG 3.48Å; I270-L274 PolarHBondContact O-N 2.68Å
271	C	87.5	Confident	84.6	Confident	81 Å²	81	67.6 Å²	67.6	55%	0.547	35%	0.351	S	S	.	.	H	α-helix	trans	-56.2	-45.4	178.2	-71.5	0	0	0	0	112.8	A267 I268 L274 Y275	A267-C271 WeakPolarHBondContact O-CB 3.21Å; A267-C271 PolarHBondContact O-N 3.32Å; A267-C271 PolarHBondContact O-SG 2.88Å; I268-C271 PolarHBondContact O-N 3.18Å; C271-L274 PolarHBondContact O-N 3.42Å; C271-Y275 WeakPolarHBondContact O-CB 3.44Å; C271-Y275 PolarHBondContact O-N 3.12Å
272	L	83.4	Confident	84.5	Confident	93 Å²	93	69.4 Å²	69.4	49%	0.487	36%	0.356	S	S	.	.	H	α-helix	trans	-65.5	-40.1	177	-72.4	173.7	0	0	0	112.3	I268 S269 I270 K276	I268-L272 HydrophobicContact CG2-CD1 3.89Å; I268-L272 HydrophobicContact CG2-CG 4.34Å; I268-L272 WeakPolarHBondContact O-CB 3.3Å; I268-L272 WeakPolarHBondContact O-CG 3.13Å; I268-L272 PolarHBondContact O-N 3.02Å; S269-L272 PolarHBondContact O-N 2.77Å; I270-L272 VanDerWaalsContact C-N 3.34Å; I270-L272 PolarHBondContact O-N 2.99Å; L272-K276 WeakPolarHBondContact O-CB 3.34Å; L272-K276 VanDerWaalsContact O-CG 3.32Å; L272-K276 WeakPolarHBondContact O-CG 3.22Å; L272-K276 PolarHBondContact O-N 3.31Å
273	S	80	Confident	84.3	Confident	34 Å²	34	72.1 Å²	72.1	24%	0.238	37%	0.374	C	S	.	.	H	α-helix	trans	-62.6	-46.2	176	-172.6	0	0	0	0	111.4	S269 I270 K276 T277	S269-S273 WeakPolarHBondContact O-CB 3.48Å; S269-S273 PolarHBondContact O-N 3.35Å; I270-S273 WeakPolarHBondContact O-CB 3.24Å; I270-S273 PolarHBondContact O-N 3.47Å; I270-S273 VanDerWaalsContact O-N 3.13Å; S273-K276 PolarHBondContact O-N 2.83Å; S273-T277 VanDerWaalsContact O-CB 3.29Å; S273-T277 WeakPolarHBondContact O-CB 3.21Å; S273-T277 PolarHBondContact O-N 3.08Å; S273-T277 PolarHBondContact O-OG1 3.32Å
274	L	86.7	Confident	83.6	Confident	16 Å²	16	68.5 Å²	68.5	8%	0.084	36%	0.359	C	S	.	.	H	α-helix	trans	-62.3	-46.1	177.9	-66.1	174.4	0	0	0	111.9	Y227 L230 L231 E234 I270 C271 T277 R278	Y227-L274 HydrophobicContact CD1-CB 4.42Å; L230-L274 HydrophobicContact CB-CD2 3.39Å; L230-L274 WeakPolarHBondContact O-CD2 3.47Å; L231-L274 HydrophobicContact CB-CD1 3.98Å; L231-L274 HydrophobicContact CD1-CD1 3.82Å; L231-L274 HydrophobicContact CG-CD1 4.49Å; E234-L274 HydrophobicContact CB-CD2 4.27Å; I270-L274 HydrophobicContact CG2-CD1 3.69Å; I270-L274 HydrophobicContact CG2-CG 4.07Å; I270-L274 WeakPolarHBondContact O-CB 3.23Å; I270-L274 WeakPolarHBondContact O-CG 3.48Å; I270-L274 PolarHBondContact O-N 2.68Å; C271-L274 PolarHBondContact O-N 3.42Å; L274-T277 PolarHBondContact O-N 2.83Å; L274-R278 WeakPolarHBondContact O-CB 3.29Å; L274-R278 PolarHBondContact O-N 3.26Å
275	Y	87.9	Confident	83.4	Confident	117 Å²	117	69.6 Å²	69.6	46%	0.459	36%	0.357	S	S	.	.	H	α-helix	trans	-60	-49.4	177	176.5	-97.4	0	0	0	111.5	C271 R278 K279	C271-Y275 WeakPolarHBondContact O-CB 3.44Å; C271-Y275 PolarHBondContact O-N 3.12Å; Y275-R278 PolarHBondContact O-N 3.32Å; Y275-K279 HydrophobicContact CE1-CD 3.93Å; Y275-K279 VanDerWaalsContact O-CB 3.27Å; Y275-K279 WeakPolarHBondContact O-CB 3.2Å; Y275-K279 PolarHBondContact O-N 3.12Å; Y275-K279 PolarHBondContact OH-NZ 3.47Å
276	K	80.6	Confident	83.3	Confident	133 Å²	133	71.5 Å²	71.5	58%	0.578	37%	0.368	S	S	*	.	H	α-helix	trans	-62.6	-46.5	179.5	-74.4	175.5	-177.9	173.2	0	112	L272 S273 R278 K279 Q280	L272-K276 WeakPolarHBondContact O-CB 3.34Å; L272-K276 VanDerWaalsContact O-CG 3.32Å; L272-K276 WeakPolarHBondContact O-CG 3.22Å; L272-K276 PolarHBondContact O-N 3.31Å; S273-K276 PolarHBondContact O-N 2.83Å; K276-R278 PolarHBondContact O-N 3.33Å; K276-K279 PolarHBondContact O-N 2.96Å; K276-Q280 WeakPolarHBondContact O-CB 3.41Å; K276-Q280 PolarHBondContact O-N 2.76Å
277	T	77.9	Confident	82.7	Confident	57 Å²	57	75.3 Å²	75.3	35%	0.35	39%	0.386	S	S	.	.	H	α-helix	trans	-62.1	-42.9	-179.2	-58.7	0	0	0	0	111.6	L230 S273 L274 S281	L230-T277 HydrophobicContact CD2-CG2 4.13Å; S273-T277 VanDerWaalsContact O-CB 3.29Å; S273-T277 WeakPolarHBondContact O-CB 3.21Å; S273-T277 PolarHBondContact O-N 3.08Å; S273-T277 PolarHBondContact O-OG1 3.32Å; L274-T277 PolarHBondContact O-N 2.83Å; T277-S281 PolarHBondContact O-N 3.12Å; T277-S281 VanDerWaalsContact O-N 3.07Å; T277-S281 PolarHBondContact O-OG 2.77Å
278	R	87.8	Confident	82.2	Confident	55 Å²	55	73.9 Å²	73.9	21%	0.208	37%	0.373	C	S	.	.	H	α-helix	trans	-69	-46.9	177.1	-171.1	-175.3	173.7	86.5	-6.4	111.8	V224 K225 Y227 L230 L274 Y275 K276 Q280 S281 Q282	V224-R278 HydrophobicContact CG1-CG 4.26Å; K225-R278 PolarHBondContact O-NH1 2.92Å; Y227-R278 HydrophobicContact CE1-CB 4.1Å; Y227-R278 VanDerWaalsContact CE1-CD 3.45Å; Y227-R278 HydrophobicContact CE1-CG 4.44Å; Y227-R278 VanDerWaalsContact CE2-CD 3.45Å; L230-R278 HydrophobicContact CD1-CB 4.01Å; L274-R278 WeakPolarHBondContact O-CB 3.29Å; L274-R278 PolarHBondContact O-N 3.26Å; Y275-R278 PolarHBondContact O-N 3.32Å; K276-R278 PolarHBondContact O-N 3.33Å; R278-Q280 VanDerWaalsContact C-N 3.27Å; R278-Q280 PolarHBondContact O-N 2.91Å; R278-S281 PolarHBondContact O-N 3.37Å; R278-S281 VanDerWaalsContact O-N 3.11Å; R278-Q282 HydrophobicContact CG-CG 4.39Å; R278-Q282 WeakPolarHBondContact O-CG 3.27Å; R278-Q282 PolarHBondContact O-N 3.48Å
279	K	85.1	Confident	81.6	Confident	106 Å²	106	75.1 Å²	75.1	46%	0.461	38%	0.375	S	S	.	.	H	α-helix	trans	-57.9	-41.5	178.5	-175.3	170.8	-173.2	169.4	0	111.5	Y275 K276 Q282 T283	Y275-K279 HydrophobicContact CE1-CD 3.93Å; Y275-K279 VanDerWaalsContact O-CB 3.27Å; Y275-K279 WeakPolarHBondContact O-CB 3.2Å; Y275-K279 PolarHBondContact O-N 3.12Å; Y275-K279 PolarHBondContact OH-NZ 3.47Å; K276-K279 PolarHBondContact O-N 2.96Å; K279-Q282 PolarHBondContact O-N 3.09Å; K279-T283 WeakPolarHBondContact O-CB 3.28Å; K279-T283 PolarHBondContact O-N 2.83Å; K279-T283 PolarHBondContact O-OG1 2.9Å
280	Q	77.1	Confident	81.4	Confident	132 Å²	132	74.8 Å²	74.8	62%	0.617	37%	0.368	S	S	*	.	H	α-helix	trans	-63.4	-45.6	174.8	-175.4	175.3	-11.9	0	0	111.9	K276 R278 Q282 T283 L284	K276-Q280 WeakPolarHBondContact O-CB 3.41Å; K276-Q280 PolarHBondContact O-N 2.76Å; R278-Q280 VanDerWaalsContact C-N 3.27Å; R278-Q280 PolarHBondContact O-N 2.91Å; Q280-Q282 VanDerWaalsContact C-N 3.33Å; Q280-Q282 PolarHBondContact O-N 2.93Å; Q280-T283 PolarHBondContact O-N 3.33Å; Q280-L284 PolarHBondContact O-N 3.32Å
281	S	80.8	Confident	81.1	Confident	33 Å²	33	77.4 Å²	77.4	23%	0.231	39%	0.388	C	S	.	.	H	α-helix	trans	-63.7	-36.8	177.2	-57.5	0	0	0	0	112.8	T277 R278 R285	T277-S281 PolarHBondContact O-N 3.12Å; T277-S281 VanDerWaalsContact O-N 3.07Å; T277-S281 PolarHBondContact O-OG 2.77Å; R278-S281 PolarHBondContact O-N 3.37Å; R278-S281 VanDerWaalsContact O-N 3.11Å; S281-R285 WeakPolarHBondContact O-CB 3.37Å; S281-R285 PolarHBondContact O-N 2.98Å
282	Q	86.3	Confident	81.2	Confident	71 Å²	71	75.9 Å²	75.9	33%	0.332	37%	0.374	S	S	.	.	H	α-helix	trans	-66.4	-49.8	175.2	-74.3	174.1	-44.2	0	0	111.2	V224 R278 K279 Q280 L284 R285 D286	V224-Q282 HydrophobicContact CG1-CG 4.02Å; R278-Q282 HydrophobicContact CG-CG 4.39Å; R278-Q282 WeakPolarHBondContact O-CG 3.27Å; R278-Q282 PolarHBondContact O-N 3.48Å; K279-Q282 PolarHBondContact O-N 3.09Å; Q280-Q282 VanDerWaalsContact C-N 3.33Å; Q280-Q282 PolarHBondContact O-N 2.93Å; Q282-L284 VanDerWaalsContact C-N 3.26Å; Q282-L284 PolarHBondContact O-N 2.89Å; Q282-R285 WeakPolarHBondContact O-CB 3.33Å; Q282-R285 PolarHBondContact O-N 2.79Å; Q282-D286 VanDerWaalsContact O-CG 3.24Å; Q282-D286 PolarHBondContact O-N 2.82Å
283	T	80.4	Confident	81.7	Confident	78 Å²	78	79.4 Å²	79.4	48%	0.479	38%	0.381	S	S	.	.	H	α-helix	trans	-56.3	-42.6	178.1	-50.8	0	0	0	0	111.3	K279 Q280 D286 M287	K279-T283 WeakPolarHBondContact O-CB 3.28Å; K279-T283 PolarHBondContact O-N 2.83Å; K279-T283 PolarHBondContact O-OG1 2.9Å; Q280-T283 PolarHBondContact O-N 3.33Å; T283-D286 PolarHBondContact O-N 3.47Å; T283-M287 WeakPolarHBondContact O-CB 3.41Å; T283-M287 PolarHBondContact O-N 2.81Å; T283-M287 VanDerWaalsContact O-N 3.11Å
284	L	75.1	Confident	82.2	Confident	35 Å²	35	78.6 Å²	78.6	18%	0.183	37%	0.374	C	S	.	.	H	α-helix	trans	-66.4	-40.4	176.3	-176.3	64.2	0	0	0	112.4	V222 Q280 Q282 M287 V288 I410 L411	V222-L284 HydrophobicContact CG1-CD2 4.25Å; V222-L284 HydrophobicContact CG1-CG 4.4Å; V222-L284 HydrophobicContact CG2-CG 4.49Å; Q280-L284 PolarHBondContact O-N 3.32Å; Q282-L284 VanDerWaalsContact C-N 3.26Å; Q282-L284 PolarHBondContact O-N 2.89Å; L284-M287 PolarHBondContact O-N 3.17Å; L284-V288 HydrophobicContact CD1-CG2 4.3Å; L284-V288 WeakPolarHBondContact O-CB 3.4Å; L284-V288 VanDerWaalsContact O-CG2 3.24Å; L284-V288 WeakPolarHBondContact O-CG2 3.41Å; L284-V288 PolarHBondContact O-N 2.95Å; L284-I410 HydrophobicContact CD2-CG2 4.36Å; L284-L411 HydrophobicContact CD2-CD2 3.6Å
285	R	84.7	Confident	82.6	Confident	111 Å²	111	78.1 Å²	78.1	42%	0.419	37%	0.372	S	S	.	.	H	α-helix	trans	-62	-44.1	175.9	-179.8	178.4	179.4	176.5	2.4	111.5	V222 V224 S281 Q282 M287 V288 K289	V222-R285 HydrophobicContact CB-CB 4Å; V222-R285 HydrophobicContact CB-CG 4.35Å; V222-R285 HydrophobicContact CG1-CB 4.27Å; V224-R285 HydrophobicContact CG2-CB 4.11Å; S281-R285 WeakPolarHBondContact O-CB 3.37Å; S281-R285 PolarHBondContact O-N 2.98Å; Q282-R285 WeakPolarHBondContact O-CB 3.33Å; Q282-R285 PolarHBondContact O-N 2.79Å; R285-M287 VanDerWaalsContact C-N 3.33Å; R285-V288 PolarHBondContact O-N 3.2Å; R285-K289 VanDerWaalsContact O-CB 3.26Å; R285-K289 WeakPolarHBondContact O-CB 3.37Å; R285-K289 PolarHBondContact O-N 3.4Å
286	D	81.9	Confident	82.8	Confident	117 Å²	117	72.6 Å²	72.6	63%	0.626	35%	0.351	S	S	*	.	H	α-helix	trans	-69.4	-32.8	-177.1	-61.3	-23.6	0	0	0	111.6	Q282 T283 V288	Q282-D286 VanDerWaalsContact O-CG 3.24Å; Q282-D286 PolarHBondContact O-N 2.82Å; T283-D286 PolarHBondContact O-N 3.47Å; D286-V288 VanDerWaalsContact C-N 3.34Å
287	M	72.2	Confident	83.3	Confident	95 Å²	95	67.1 Å²	67.1	47%	0.468	33%	0.329	S	S	.	.	H	α-helix	trans	-68.2	-30.5	173	-175.5	-168.7	-66.5	0	0	113.3	T283 L284 R285	T283-M287 WeakPolarHBondContact O-CB 3.41Å; T283-M287 PolarHBondContact O-N 2.81Å; T283-M287 VanDerWaalsContact O-N 3.11Å; L284-M287 PolarHBondContact O-N 3.17Å; R285-M287 VanDerWaalsContact C-N 3.33Å
288	V	75.9	Confident	83.9	Confident	7 Å²	7	65.5 Å²	65.5	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-98.6	-31.7	-172	172.2	0	0	0	0	112.8	I220 V222 L284 R285 D286 L290 V407	I220-V288 HydrophobicContact CB-CG1 3.57Å; I220-V288 HydrophobicContact CD1-CG1 4.29Å; I220-V288 HydrophobicContact CG2-CG1 3.36Å; V222-V288 HydrophobicContact CG2-CB 4.24Å; V222-V288 HydrophobicContact CG2-CG1 4.26Å; V222-V288 HydrophobicContact CG2-CG2 4.48Å; L284-V288 HydrophobicContact CD1-CG2 4.3Å; L284-V288 WeakPolarHBondContact O-CB 3.4Å; L284-V288 VanDerWaalsContact O-CG2 3.24Å; L284-V288 WeakPolarHBondContact O-CG2 3.41Å; L284-V288 PolarHBondContact O-N 2.95Å; R285-V288 PolarHBondContact O-N 3.2Å; D286-V288 VanDerWaalsContact C-N 3.34Å; V288-L290 PolarHBondContact O-N 2.85Å; V288-L290 VanDerWaalsContact O-N 3.11Å; V288-V407 HydrophobicContact CG1-CG1 4.2Å; V288-V407 HydrophobicContact CG1-CG2 4.07Å; V288-V407 HydrophobicContact CG2-CG1 4.07Å; V288-V407 HydrophobicContact CG2-CG2 3.63Å
289	K	76.1	Confident	83.7	Confident	129 Å²	129	66.5 Å²	66.5	56%	0.561	33%	0.33	S	S	*	.			trans	-67.3	113.4	-175.6	-174.4	-176	177.4	-166.2	0	109.7	R285	R285-K289 VanDerWaalsContact O-CB 3.26Å; R285-K289 WeakPolarHBondContact O-CB 3.37Å; R285-K289 PolarHBondContact O-N 3.4Å
290	L	76.2	Confident	83.2	Confident	48 Å²	48	64.9 Å²	64.9	25%	0.251	34%	0.344	S	S	.	.			trans	-114.3	125.1	173.3	-153.5	79.1	0	0	0	109.3	V288 M292 L325 P327	V288-L290 PolarHBondContact O-N 2.85Å; V288-L290 VanDerWaalsContact O-N 3.11Å; L290-M292 HydrophobicContact CD1-CE 4.01Å; L290-M292 HydrophobicContact CD2-CE 3.53Å; L290-M292 HydrophobicContact CG-CE 3.67Å; L290-L325 HydrophobicContact CD1-CD2 3.29Å; L290-L325 HydrophobicContact CD1-CG 4.5Å; L290-L325 HydrophobicContact CD2-CD2 4.1Å; L290-L325 HydrophobicContact CG-CD2 4.22Å; L290-P327 HydrophobicContact CD2-CB 3.86Å
291	S	80.3	Confident	83.3	Confident	77 Å²	77	61.3 Å²	61.3	54%	0.538	34%	0.342	S	S	.	.			trans	-143.8	115.2	175	-156	0	0	0	0	107.4	D307	S291-D307 PolarHBondContact OG-OD2 3.32Å
292	M	89.3	Confident	83.5	Confident	49 Å²	49	66.9 Å²	66.9	24%	0.241	36%	0.364	C	S	.	.			trans	-147.4	161.5	178.7	63.8	-177.5	65.9	0	0	109.7	L290 V294 S308 L325 P327	L290-M292 HydrophobicContact CD1-CE 4.01Å; L290-M292 HydrophobicContact CD2-CE 3.53Å; L290-M292 HydrophobicContact CG-CE 3.67Å; M292-V294 HydrophobicContact CG-CG1 4.22Å; M292-V294 HydrophobicContact SD-CG1 4.47Å; M292-S308 PolarHBondContact N-OG 2.73Å; M292-S308 WeakPolarHBondContact O-CB 3.42Å; M292-S308 PolarHBondContact O-N 2.86Å; M292-S308 PolarHBondContact O-OG 2.92Å; M292-S308 VanDerWaalsContact O-OG 3.08Å; M292-L325 HydrophobicContact CE-CB 3.77Å; M292-L325 HydrophobicContact CE-CD2 3.82Å; M292-L325 HydrophobicContact CE-CG 4.15Å; M292-P327 HydrophobicContact CG-CB 4.46Å; M292-P327 HydrophobicContact SD-CB 4.34Å; M292-P327 HydrophobicContact SD-CG 4.41Å
293	R	92.7	Very high	83.7	Confident	168 Å²	168	68 Å²	68	63%	0.634	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	138.4	169.6	-61.4	-167.3	77.3	-179	4.2	109.6	W305 V306	R293-W305 HydrophobicContact CB-CE3 4.04Å; R293-W305 PolarHBondContact NH2-O 3.26Å; R293-V306 WeakPolarHBondContact CA-O 2.97Å
294	V	92.4	Very high	84.2	Confident	17 Å²	17	68.1 Å²	68.1	10%	0.103	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.5	176.5	-69.5	0	0	0	0	110	M292 V296 W305 V306 L311 L317 P327	M292-V294 HydrophobicContact CG-CG1 4.22Å; M292-V294 HydrophobicContact SD-CG1 4.47Å; V294-V296 HydrophobicContact CG2-CG1 4.38Å; V294-W305 VanDerWaalsContact C-CE3 3.44Å; V294-W305 CarbonylContact O-C 3.49Å; V294-W305 WeakPolarHBondContact O-CA 3.36Å; V294-V306 PolarHBondContact N-O 3.31Å; V294-V306 PolarHBondContact O-N 2.8Å; V294-L311 HydrophobicContact CG2-CD1 4.05Å; V294-L311 HydrophobicContact CG2-CD2 3.87Å; V294-L311 HydrophobicContact CG2-CG 4.13Å; V294-L317 HydrophobicContact CB-CD2 4.5Å; V294-L317 HydrophobicContact CG2-CD2 4.35Å; V294-P327 HydrophobicContact CG1-CG 3.77Å
295	C	93.5	Very high	85.1	Confident	6 Å²	6	73.1 Å²	73.1	4%	0.041	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	127.7	174.2	-169.4	0	0	0	0	109.6	E303 E304 W305 L317 V318	C295-E303 PolarHBondContact SG-OE2 2.98Å; C295-E304 WeakPolarHBondContact CA-O 3.39Å; C295-W305 HydrophobicContact CB-CD2 4.16Å; C295-W305 HydrophobicContact CB-CE3 4.16Å; C295-W305 HydrophobicContact CB-CH2 4Å; C295-W305 HydrophobicContact CB-CZ2 3.97Å; C295-W305 HydrophobicContact CB-CZ3 4.08Å; C295-L317 WeakPolarHBondContact O-CA 3.29Å; C295-V318 HydrophobicContact CB-CB 4.12Å; C295-V318 PolarHBondContact O-N 3.45Å
296	V	93.5	Very high	85.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	140.9	175.4	-54.6	0	0	0	0	110.7	V294 E304 V306 L311 C316 L317	V294-V296 HydrophobicContact CG2-CG1 4.38Å; V296-E304 HydrophobicContact CG2-CB 4.12Å; V296-E304 PolarHBondContact N-O 2.86Å; V296-E304 PolarHBondContact O-N 2.89Å; V296-V306 HydrophobicContact CG2-CB 4.47Å; V296-V306 HydrophobicContact CG2-CG2 3.68Å; V296-L311 HydrophobicContact CG1-CD2 3.85Å; V296-C316 CarbonylContact C-O 3.25Å; V296-C316 WeakPolarHBondContact CA-O 3.37Å; V296-L317 HydrophobicContact CG1-CD2 3.95Å
297	C	90.9	Very high	86	Confident	19 Å²	19	65 Å²	65	13%	0.128	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	140	172.9	-173.1	0	0	0	0	110.1	G202 C316 V318	G202-C297 VanDerWaalsContact CA-O 3.31Å; G202-C297 WeakPolarHBondContact CA-O 3.38Å; C297-C316 HydrophobicContact CB-CB 4.2Å; C297-C316 PolarHBondContact N-O 2.97Å; C297-V318 HydrophobicContact CB-CG2 4.25Å
298	R	90.4	Very high	87	Confident	23 Å²	23	60.5 Å²	60.5	9%	0.087	33%	0.325	C	S	.	.			trans	-107.3	164.6	174.4	-61.5	-57.3	-171	179.7	0.6	111.8	H201 L203 Q208 G300 G301 E302 E304	H201-R298 CarbonylContact O-C 3.59Å; L203-R298 WeakPolarHBondContact O-CD 3.31Å; L203-R298 PolarHBondContact O-NH1 2.82Å; L203-R298 VanDerWaalsContact O-NH1 3.16Å; Q208-R298 VanDerWaalsContact OE1-NH1 3.13Å; R298-G300 PolarHBondContact O-N 3.05Å; R298-G301 PolarHBondContact O-N 2.91Å; R298-E302 PolarHBondContact N-O 3.34Å; R298-E304 IonicContact CZ-OE2 3.14Å; R298-E304 VanDerWaalsContact CZ-OE2 3.22Å; R298-E304 IonicContact NE-OE2 3.02Å; R298-E304 PolarHBondContact NE-OE2 2.78Å; R298-E304 IonicContact NH2-OE2 3.19Å; R298-E304 PolarHBondContact NH2-OE2 3.27Å
299	P	83.6	Confident	87.8	Confident	76 Å²	76	61.7 Å²	61.7	49%	0.494	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-17.4	-176.7	-29	35.9	0	0	0	116.2	H201 L203	H201-P299 WeakPolarHBondContact O-CA 3.39Å; L203-P299 WeakPolarHBondContact O-CD 3.2Å
300	G	74.6	Confident	88.6	Confident	72 Å²	72	59.1 Å²	59.1	74%	0.742	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	2.8	174.4	0	0	0	0	0	115.6	R298 E302	R298-G300 PolarHBondContact O-N 3.05Å; G300-E302 VanDerWaalsContact C-N 3.26Å; G300-E302 PolarHBondContact O-N 3.47Å
301	G	78.1	Confident	89.4	Confident	57 Å²	57	56.9 Å²	56.9	59%	0.588	31%	0.311	S	S	*	.	S	Bend	trans	79.4	3.7	-174.2	0	0	0	0	0	114.5	R298	R298-G301 PolarHBondContact O-N 2.91Å
302	E	85.9	Confident	90	Very high	149 Å²	149	53.2 Å²	53.2	70%	0.696	29%	0.286	S	S	*	.			trans	-73.1	138.5	175.1	-63.9	-175.6	170.4	0	0	111.1	R298 G300	R298-E302 PolarHBondContact N-O 3.34Å; G300-E302 VanDerWaalsContact C-N 3.26Å; G300-E302 PolarHBondContact O-N 3.47Å
303	E	89.9	Confident	90.1	Very high	94 Å²	94	50.9 Å²	50.9	44%	0.439	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.5	176.1	-74.4	-170.1	-169.4	0	0	111	C295 V318 H389	C295-E303 PolarHBondContact SG-OE2 2.98Å; E303-V318 HydrophobicContact CG-CG2 4.32Å; E303-H389 IonicContact OE1-CD2 3.21Å; E303-H389 PolarHBondContact OE1-CD2 3.2Å; E303-H389 VanDerWaalsContact OE1-CD2 3.28Å; E303-H389 IonicContact OE1-CE1 2.84Å; E303-H389 IonicContact OE1-NE2 3.21Å; E303-H389 PolarHBondContact OE1-NE2 2.6Å; E303-H389 VanDerWaalsContact OE1-NE2 3.15Å
304	E	91.8	Very high	90	Very high	82 Å²	82	42.9 Å²	42.9	38%	0.383	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132.8	-179.7	-169.8	-173.4	-179.8	0	0	110.8	C295 V296 R298 V306	C295-E304 WeakPolarHBondContact CA-O 3.39Å; V296-E304 HydrophobicContact CG2-CB 4.12Å; V296-E304 PolarHBondContact N-O 2.86Å; V296-E304 PolarHBondContact O-N 2.89Å; R298-E304 IonicContact CZ-OE2 3.14Å; R298-E304 VanDerWaalsContact CZ-OE2 3.22Å; R298-E304 IonicContact NE-OE2 3.02Å; R298-E304 PolarHBondContact NE-OE2 2.78Å; R298-E304 IonicContact NH2-OE2 3.19Å; R298-E304 PolarHBondContact NH2-OE2 3.27Å; E304-V306 HydrophobicContact CB-CG2 4.4Å; E304-V306 HydrophobicContact CG-CG2 3.92Å; E304-V306 PolarHBondContact O-N 2.93Å
305	W	92.7	Very high	90	Very high	140 Å²	140	42.1 Å²	42.1	53%	0.53	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	105.4	174.9	-74.5	93.7	0	0	0	111.4	R293 V294 C295	R293-W305 HydrophobicContact CB-CE3 4.04Å; R293-W305 PolarHBondContact NH2-O 3.26Å; V294-W305 VanDerWaalsContact C-CE3 3.44Å; V294-W305 CarbonylContact O-C 3.49Å; V294-W305 WeakPolarHBondContact O-CA 3.36Å; C295-W305 HydrophobicContact CB-CD2 4.16Å; C295-W305 HydrophobicContact CB-CE3 4.16Å; C295-W305 HydrophobicContact CB-CH2 4Å; C295-W305 HydrophobicContact CB-CZ2 3.97Å; C295-W305 HydrophobicContact CB-CZ3 4.08Å
306	V	92.4	Very high	90.1	Very high	6 Å²	6	41.9 Å²	41.9	4%	0.036	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	153.7	-177.5	-175.7	0	0	0	0	110.2	R293 V294 V296 E304 E310	R293-V306 WeakPolarHBondContact CA-O 2.97Å; V294-V306 PolarHBondContact N-O 3.31Å; V294-V306 PolarHBondContact O-N 2.8Å; V296-V306 HydrophobicContact CG2-CB 4.47Å; V296-V306 HydrophobicContact CG2-CG2 3.68Å; E304-V306 HydrophobicContact CB-CG2 4.4Å; E304-V306 HydrophobicContact CG-CG2 3.92Å; E304-V306 PolarHBondContact O-N 2.93Å; V306-E310 HydrophobicContact CG1-CB 3.71Å; V306-E310 HydrophobicContact CG1-CG 4.16Å; V306-E310 WeakPolarHBondContact CG1-OE2 3.34Å
307	D	93.8	Very high	90.1	Very high	51 Å²	51	42 Å²	42	27%	0.273	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	137.3	171.2	-175.2	-87.2	0	0	0	110.6	S291 S309 E310	S291-D307 PolarHBondContact OG-OD2 3.32Å; D307-S309 PolarHBondContact O-N 2.95Å; D307-S309 WeakPolarHBondContact OD1-CB 3.44Å; D307-S309 PolarHBondContact OD1-N 3.38Å; D307-S309 PolarHBondContact OD1-OG 3.22Å; D307-E310 HydrophobicContact CB-CG 4.42Å; D307-E310 PolarHBondContact O-N 3.14Å
308	S	93.1	Very high	90.3	Very high	1 Å²	1	42 Å²	42	1%	0.007	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-53.7	-24.1	-179.2	57.4	0	0	0	0	114.6	N218 M292 E310 L311	N218-S308 VanDerWaalsContact CB-O 3.28Å; N218-S308 WeakPolarHBondContact CB-O 3.32Å; N218-S308 PolarHBondContact ND2-O 3.16Å; M292-S308 PolarHBondContact N-OG 2.73Å; M292-S308 WeakPolarHBondContact O-CB 3.42Å; M292-S308 PolarHBondContact O-N 2.86Å; M292-S308 PolarHBondContact O-OG 2.92Å; M292-S308 VanDerWaalsContact O-OG 3.08Å; S308-E310 VanDerWaalsContact C-N 3.26Å; S308-E310 PolarHBondContact O-N 2.98Å; S308-L311 WeakPolarHBondContact O-CG 3.44Å
309	S	92.6	Very high	90.4	Very high	32 Å²	32	41.9 Å²	41.9	22%	0.224	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-72.5	-16.3	177.2	65.7	0	0	0	0	113.9	P217 N218 D307	P217-S309 CarbonylContact C-O 3.45Å; P217-S309 VanDerWaalsContact CA-O 3.31Å; P217-S309 WeakPolarHBondContact CA-O 3.29Å; P217-S309 WeakPolarHBondContact CB-O 3.45Å; N218-S309 PolarHBondContact N-O 3.15Å; D307-S309 PolarHBondContact O-N 2.95Å; D307-S309 WeakPolarHBondContact OD1-CB 3.44Å; D307-S309 PolarHBondContact OD1-N 3.38Å; D307-S309 PolarHBondContact OD1-OG 3.22Å
310	E	91.9	Very high	90.7	Very high	75 Å²	75	41.5 Å²	41.5	35%	0.35	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-93.8	-6.9	-179.5	-46.7	-154.5	118.7	0	0	113.5	K212 V306 D307 S308	K212-E310 IonicContact NZ-OE1 3.42Å; K212-E310 PolarHBondContact NZ-OE1 3.1Å; V306-E310 HydrophobicContact CG1-CB 3.71Å; V306-E310 HydrophobicContact CG1-CG 4.16Å; V306-E310 WeakPolarHBondContact CG1-OE2 3.34Å; D307-E310 HydrophobicContact CB-CG 4.42Å; D307-E310 PolarHBondContact O-N 3.14Å; S308-E310 VanDerWaalsContact C-N 3.26Å; S308-E310 PolarHBondContact O-N 2.98Å
311	L	93.7	Very high	91.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.233	C	C	.	.			trans	-60	138.1	178.6	-68	178.3	0	0	0	111.9	N218 V294 V296 S308 D315 L317 P327 C328 T397	N218-L311 HydrophobicContact CB-CB 4.22Å; V294-L311 HydrophobicContact CG2-CD1 4.05Å; V294-L311 HydrophobicContact CG2-CD2 3.87Å; V294-L311 HydrophobicContact CG2-CG 4.13Å; V296-L311 HydrophobicContact CG1-CD2 3.85Å; S308-L311 WeakPolarHBondContact O-CG 3.44Å; L311-D315 HydrophobicContact CD2-CB 4.36Å; L311-L317 HydrophobicContact CD1-CD2 4.22Å; L311-L317 HydrophobicContact CD2-CD2 3.73Å; L311-P327 HydrophobicContact CD1-CG 3.81Å; L311-C328 HydrophobicContact CD1-CB 4.44Å; L311-T397 HydrophobicContact CB-CG2 4.49Å
312	V	92.8	Very high	91.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.245	C	C	.	.			trans	-129.7	155.9	174.8	-60.6	0	0	0	0	110.9	L203 Q208 R211 K212 G314 D315 V394	L203-V312 HydrophobicContact CD1-CG2 3.87Å; Q208-V312 HydrophobicContact CG-CG2 3.84Å; R211-V312 HydrophobicContact CB-CB 3.92Å; R211-V312 HydrophobicContact CB-CG1 4.26Å; R211-V312 HydrophobicContact CB-CG2 3.82Å; K212-V312 HydrophobicContact CB-CG1 3.86Å; K212-V312 HydrophobicContact CG-CG1 4.46Å; V312-G314 PolarHBondContact O-N 3.19Å; V312-D315 WeakPolarHBondContact CG2-OD2 3.46Å; V312-D315 PolarHBondContact N-OD2 2.96Å; V312-D315 PolarHBondContact O-N 2.95Å; V312-D315 VanDerWaalsContact O-N 3.14Å; V312-V394 WeakPolarHBondContact O-CB 3.38Å; V312-V394 WeakPolarHBondContact O-CG1 3.37Å
313	P	91.7	Very high	91.5	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.006	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	129.4	173.7	-28.9	38.8	0	0	0	111.9	R211 Y215 V394 T397	R211-P313 VanDerWaalsContact CD-O 3.22Å; R211-P313 WeakPolarHBondContact CD-O 3.42Å; R211-P313 PolarHBondContact NH1-O 3.23Å; Y215-P313 HydrophobicContact CD1-CG 3.64Å; Y215-P313 HydrophobicContact CD2-CG 4.41Å; Y215-P313 HydrophobicContact CE1-CB 4.37Å; Y215-P313 HydrophobicContact CE1-CG 3.68Å; Y215-P313 HydrophobicContact CE2-CG 4.46Å; Y215-P313 HydrophobicContact CG-CG 4.05Å; P313-V394 CarbonylContact C-O 3.35Å; P313-V394 WeakPolarHBondContact CA-O 3.48Å; P313-T397 HydrophobicContact CG-CG2 4.46Å
314	G	90.3	Very high	91.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.9	-15.2	-175.8	0	0	0	0	0	115.5	V312 V394	V312-G314 PolarHBondContact O-N 3.19Å; G314-V394 PolarHBondContact N-O 2.88Å
315	D	93.7	Very high	91.5	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.21	C	C	.	.			trans	-60	141.7	171.1	-78.3	-27.2	0	0	0	109.9	Q208 L311 V312 V393 V394	Q208-D315 PolarHBondContact NE2-OD1 3.48Å; Q208-D315 PolarHBondContact NE2-OD2 2.86Å; Q208-D315 VanDerWaalsContact NE2-OD2 3.08Å; L311-D315 HydrophobicContact CD2-CB 4.36Å; V312-D315 WeakPolarHBondContact CG2-OD2 3.46Å; V312-D315 PolarHBondContact N-OD2 2.96Å; V312-D315 PolarHBondContact O-N 2.95Å; V312-D315 VanDerWaalsContact O-N 3.14Å; D315-V393 CarbonylContact O-C 3.46Å; D315-V393 WeakPolarHBondContact O-CA 3.22Å; D315-V394 HydrophobicContact CB-CB 4.43Å; D315-V394 HydrophobicContact CB-CG2 3.98Å; D315-V394 WeakPolarHBondContact O-CG2 3.23Å; D315-V394 PolarHBondContact O-N 2.75Å
316	C	94.2	Very high	91.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	115.2	178.3	-173.3	0	0	0	0	109.3	R200 V296 C297 V393	R200-C316 PolarHBondContact O-SG 2.85Å; V296-C316 CarbonylContact C-O 3.25Å; V296-C316 WeakPolarHBondContact CA-O 3.37Å; C297-C316 HydrophobicContact CB-CB 4.2Å; C297-C316 PolarHBondContact N-O 2.97Å; C316-V393 HydrophobicContact CB-CG2 4.5Å
317	L	94.6	Very high	91.5	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	137.3	179	-55.4	178.8	0	0	0	110.6	V294 C295 V296 L311 L319 M326 A330 L391 A392 V394	V294-L317 HydrophobicContact CB-CD2 4.5Å; V294-L317 HydrophobicContact CG2-CD2 4.35Å; C295-L317 WeakPolarHBondContact O-CA 3.29Å; V296-L317 HydrophobicContact CG1-CD2 3.95Å; L311-L317 HydrophobicContact CD1-CD2 4.22Å; L311-L317 HydrophobicContact CD2-CD2 3.73Å; L317-L319 HydrophobicContact CB-CD2 4.5Å; L317-M326 HydrophobicContact CD1-CE 4.03Å; L317-A330 HydrophobicContact CD1-CB 4.3Å; L317-L391 WeakPolarHBondContact O-CA 3.41Å; L317-A392 WeakPolarHBondContact CB-O 3.39Å; L317-A392 PolarHBondContact N-O 3.14Å; L317-A392 PolarHBondContact O-N 3.15Å; L317-V394 HydrophobicContact CD1-CG2 4.04Å; L317-V394 HydrophobicContact CD2-CG2 4.04Å; L317-V394 HydrophobicContact CG-CG2 3.87Å
318	V	93.7	Very high	91.5	Very high	19 Å²	19	31.4 Å²	31.4	12%	0.115	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	114.9	167	-178.7	0	0	0	0	108.2	C295 C297 E303 H389 L391	C295-V318 HydrophobicContact CB-CB 4.12Å; C295-V318 PolarHBondContact O-N 3.45Å; C297-V318 HydrophobicContact CB-CG2 4.25Å; E303-V318 HydrophobicContact CG-CG2 4.32Å; V318-H389 HydrophobicContact CG1-CB 4.13Å; V318-L391 HydrophobicContact CG2-CD2 3.88Å
319	L	93.2	Very high	91.6	Very high	20 Å²	20	31.4 Å²	31.4	11%	0.105	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	129.6	-177.7	-60.7	178.6	0	0	0	110.9	L317 M326 L332 L373 A382 V390 A392	L317-L319 HydrophobicContact CB-CD2 4.5Å; L319-M326 HydrophobicContact CD2-CE 4.45Å; L319-M326 HydrophobicContact CD2-SD 3.89Å; L319-L332 HydrophobicContact CD1-CD1 4.29Å; L319-L373 HydrophobicContact CD1-CD1 3.48Å; L319-L373 VanDerWaalsContact CD1-CD1 3.48Å; L319-A382 HydrophobicContact CB-CB 4.42Å; L319-V390 HydrophobicContact CB-CB 4.22Å; L319-V390 HydrophobicContact CB-CG1 4.21Å; L319-V390 HydrophobicContact CD1-CG1 4.04Å; L319-V390 PolarHBondContact N-O 2.88Å; L319-A392 HydrophobicContact CD1-CB 4.11Å; L319-A392 HydrophobicContact CG-CB 4.45Å
320	P	90.3	Very high	91.7	Very high	68 Å²	68	29.9 Å²	29.9	44%	0.442	16%	0.161	S	C	.	.			trans	-67.8	148.6	176.3	29.1	-35.3	0	0	0	111.3	E322 G323 A382	P320-E322 VanDerWaalsContact C-N 3.34Å; P320-E322 PolarHBondContact O-N 2.98Å; P320-G323 VanDerWaalsContact CG-O 3.32Å; P320-G323 WeakPolarHBondContact CG-O 3.25Å; P320-G323 WeakPolarHBondContact O-CA 3.27Å; P320-G323 PolarHBondContact O-N 3.16Å; P320-A382 WeakPolarHBondContact O-CB 3.47Å
321	Q	85.8	Confident	91.8	Very high	142 Å²	142	26.3 Å²	26.3	66%	0.664	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-37.7	-178.2	-68.3	-177.1	-0.9	0	0	113.1	G323 A382	Q321-G323 PolarHBondContact O-N 2.79Å; Q321-G323 VanDerWaalsContact O-N 3.17Å; Q321-A382 PolarHBondContact O-N 2.91Å
322	E	84.1	Confident	91.8	Very high	183 Å²	183	26.3 Å²	26.3	86%	0.855	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-3.9	174.5	-61.8	-173.7	173.1	0	0	113.1	P320	P320-E322 VanDerWaalsContact C-N 3.34Å; P320-E322 PolarHBondContact O-N 2.98Å
323	G	85.8	Confident	91.7	Very high	15 Å²	15	26.9 Å²	26.9	16%	0.155	15%	0.148	C	C	.	.			trans	73.9	-170.9	-176.9	0	0	0	0	0	113.1	P320 Q321 V379	P320-G323 VanDerWaalsContact CG-O 3.32Å; P320-G323 WeakPolarHBondContact CG-O 3.25Å; P320-G323 WeakPolarHBondContact O-CA 3.27Å; P320-G323 PolarHBondContact O-N 3.16Å; Q321-G323 PolarHBondContact O-N 2.79Å; Q321-G323 VanDerWaalsContact O-N 3.17Å; G323-V379 CarbonylContact C-O 3.49Å; G323-V379 VanDerWaalsContact CA-O 3.28Å; G323-V379 WeakPolarHBondContact CA-O 3.35Å
324	G	89.6	Confident	91.6	Very high	29 Å²	29	28.1 Å²	28.1	30%	0.299	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	171.5	168.1	-171.5	0	0	0	0	0	111.5	V379	G324-V379 PolarHBondContact N-O 2.77Å; G324-V379 WeakPolarHBondContact O-CB 3.49Å; G324-V379 PolarHBondContact O-N 3.06Å
325	L	91.4	Very high	91.4	Very high	60 Å²	60	28.7 Å²	28.7	31%	0.314	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	133.1	179.9	-169.5	76.8	0	0	0	110.2	L290 M292 P327 T377 L378	L290-L325 HydrophobicContact CD1-CD2 3.29Å; L290-L325 HydrophobicContact CD1-CG 4.5Å; L290-L325 HydrophobicContact CD2-CD2 4.1Å; L290-L325 HydrophobicContact CG-CD2 4.22Å; M292-L325 HydrophobicContact CE-CB 3.77Å; M292-L325 HydrophobicContact CE-CD2 3.82Å; M292-L325 HydrophobicContact CE-CG 4.15Å; L325-P327 WeakPolarHBondContact O-CD 3.46Å; L325-T377 WeakPolarHBondContact CD1-O 3.11Å; L325-L378 HydrophobicContact CB-CD1 4.42Å; L325-L378 HydrophobicContact CD1-CB 4.25Å; L325-L378 HydrophobicContact CD1-CD1 4.44Å
326	M	93.3	Very high	91.1	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.02	17%	0.173	C	C	.	.			trans	-79.4	124.6	-179.2	-71	-58.2	-57	0	0	111.7	L317 L319 A330 L373 F374 C375 G376 T377 V379	L317-M326 HydrophobicContact CD1-CE 4.03Å; L319-M326 HydrophobicContact CD2-CE 4.45Å; L319-M326 HydrophobicContact CD2-SD 3.89Å; M326-A330 HydrophobicContact CE-CB 4.09Å; M326-L373 HydrophobicContact CE-CB 3.84Å; M326-L373 HydrophobicContact CE-CD1 3.98Å; M326-L373 HydrophobicContact CG-CB 4.15Å; M326-L373 HydrophobicContact SD-CB 4.27Å; M326-L373 HydrophobicContact SD-CD1 4Å; M326-F374 VanDerWaalsContact CB-O 3.27Å; M326-F374 WeakPolarHBondContact CB-O 3.25Å; M326-C375 CarbonylContact O-C 3.18Å; M326-G376 PolarHBondContact O-N 2.88Å; M326-T377 PolarHBondContact N-O 3.15Å; M326-V379 HydrophobicContact CG-CG2 3.78Å; M326-V379 HydrophobicContact SD-CG2 3.82Å
327	P	93	Very high	90.8	Very high	6 Å²	6	30.4 Å²	30.4	4%	0.039	17%	0.173	C	C	.	.	S	Bend	trans	-90.3	-8.3	-179.8	34.2	-35.5	0	0	0	115.3	N218 L290 M292 V294 L311 L325 C375	N218-P327 PolarHBondContact ND2-O 2.81Å; L290-P327 HydrophobicContact CD2-CB 3.86Å; M292-P327 HydrophobicContact CG-CB 4.46Å; M292-P327 HydrophobicContact SD-CB 4.34Å; M292-P327 HydrophobicContact SD-CG 4.41Å; V294-P327 HydrophobicContact CG1-CG 3.77Å; L311-P327 HydrophobicContact CD1-CG 3.81Å; L325-P327 WeakPolarHBondContact O-CD 3.46Å; P327-C375 PolarHBondContact O-SG 2.69Å
328	C	93.4	Very high	90.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-149.6	174.8	-177.8	60.7	0	0	0	0	110	L311 F374 C375 V394 R396 T397	L311-C328 HydrophobicContact CD1-CB 4.44Å; C328-F374 CarbonylContact O-C 3.54Å; C328-C375 PolarHBondContact O-N 2.84Å; C328-V394 HydrophobicContact CB-CG1 4.18Å; C328-R396 WeakPolarHBondContact CB-O 3.42Å; C328-T397 HydrophobicContact CB-CG2 4.28Å
329	D	93.9	Very high	90.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	123	169.8	-62.6	-9.7	0	0	0	108.7	L373 F374 C375 T395 R396 T401 A402	D329-L373 CarbonylContact C-O 3.59Å; D329-L373 VanDerWaalsContact CA-O 3.24Å; D329-L373 WeakPolarHBondContact CA-O 3.31Å; D329-F374 WeakPolarHBondContact OD1-CA 3.4Å; D329-C375 WeakPolarHBondContact OD1-CB 3.31Å; D329-C375 PolarHBondContact OD1-N 3.09Å; D329-T395 PolarHBondContact O-N 3.37Å; D329-T395 PolarHBondContact O-OG1 3.05Å; D329-R396 HydrophobicContact CB-CB 4.1Å; D329-R396 PolarHBondContact N-O 3.49Å; D329-R396 VanDerWaalsContact N-O 3.08Å; D329-R396 PolarHBondContact O-N 3.48Å; D329-R396 VanDerWaalsContact O-N 3.1Å; D329-T401 HydrophobicContact CB-CG2 4.49Å; D329-T401 WeakPolarHBondContact OD2-CA 3.41Å; D329-A402 PolarHBondContact OD2-N 3.45Å
330	A	94.8	Very high	89.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	144.9	-175.7	0	0	0	0	0	111.6	L317 M326 T372 L373 A392 V393	L317-A330 HydrophobicContact CD1-CB 4.3Å; M326-A330 HydrophobicContact CE-CB 4.09Å; A330-T372 CarbonylContact O-C 3.52Å; A330-T372 WeakPolarHBondContact O-CA 3.35Å; A330-L373 PolarHBondContact N-O 2.86Å; A330-L373 PolarHBondContact O-N 3.39Å; A330-A392 HydrophobicContact CB-CB 4.06Å; A330-V393 CarbonylContact C-O 3.44Å; A330-V393 WeakPolarHBondContact CA-O 3.44Å; A330-V393 WeakPolarHBondContact CB-O 3.28Å
331	A	94.5	Very high	89.6	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	122.6	172.2	0	0	0	0	0	109.5	I196 V333 Y363 H371 A392 V393 T395	I196-A331 HydrophobicContact CD1-CB 4.45Å; I196-A331 HydrophobicContact CG2-CB 3.93Å; A331-V333 PolarHBondContact O-N 3.49Å; A331-Y363 HydrophobicContact CB-CE2 3.88Å; A331-H371 CarbonylContact C-O 3.58Å; A331-H371 WeakPolarHBondContact CA-O 3.42Å; A331-A392 CarbonylContact O-C 3.52Å; A331-A392 VanDerWaalsContact O-CA 3.27Å; A331-A392 WeakPolarHBondContact O-CA 3.28Å; A331-V393 PolarHBondContact N-O 2.88Å; A331-V393 PolarHBondContact O-N 2.94Å; A331-T395 HydrophobicContact CB-CG2 3.86Å
332	L	93.7	Very high	88.9	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	120.1	175.2	-173	64.4	0	0	0	108.8	L319 G335 C337 K353 A355 L356 H371 L373 V390 A392	L319-L332 HydrophobicContact CD1-CD1 4.29Å; L332-G335 WeakPolarHBondContact CD2-O 3.34Å; L332-C337 HydrophobicContact CD2-CB 4.43Å; L332-K353 HydrophobicContact CD2-CB 4.15Å; L332-A355 CarbonylContact O-C 3.57Å; L332-A355 WeakPolarHBondContact O-CA 3.15Å; L332-L356 WeakPolarHBondContact O-CB 3.41Å; L332-L356 PolarHBondContact O-N 3.35Å; L332-H371 PolarHBondContact N-O 3.12Å; L332-L373 HydrophobicContact CD1-CD1 4.46Å; L332-V390 HydrophobicContact CD1-CG1 3.68Å; L332-A392 HydrophobicContact CD1-CB 4.36Å
333	V	91.4	Very high	88.2	Confident	13 Å²	13	14.8 Å²	14.8	8%	0.079	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-24.4	-178.3	-67.6	0	0	0	0	112.7	I196 R200 A331 L391 V393	I196-V333 HydrophobicContact CG2-CG1 3.91Å; R200-V333 HydrophobicContact CB-CG2 4.4Å; A331-V333 PolarHBondContact O-N 3.49Å; V333-L391 HydrophobicContact CG2-CB 3.71Å; V333-L391 VanDerWaalsContact CG2-O 3.28Å; V333-L391 WeakPolarHBondContact CG2-O 3.5Å; V333-L391 PolarHBondContact N-O 2.93Å; V333-V393 HydrophobicContact CG1-CB 4.45Å; V333-V393 HydrophobicContact CG1-CG2 3.9Å; V333-V393 HydrophobicContact CG2-CG2 4.06Å
334	A	88.1	Confident	87.5	Confident	26 Å²	26	14.9 Å²	14.9	22%	0.215	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	139.8	175.3	0	0	0	0	0	111.3	V390 L391	A334-V390 WeakPolarHBondContact O-CA 3.46Å; A334-V390 VanDerWaalsContact O-CG1 3.27Å; A334-V390 WeakPolarHBondContact O-CG1 3.47Å; A334-L391 HydrophobicContact CB-CB 4.08Å; A334-L391 HydrophobicContact CB-CG 4.41Å; A334-L391 PolarHBondContact N-O 3.18Å; A334-L391 PolarHBondContact O-N 2.73Å
335	G	86.4	Confident	86.4	Confident	13 Å²	13	13.8 Å²	13.8	13%	0.134	8%	0.084	C	C	.	.	S	Bend	trans	86.3	-173.6	-179.4	0	0	0	0	0	114.7	L332 A355 R383	L332-G335 WeakPolarHBondContact CD2-O 3.34Å; G335-A355 PolarHBondContact O-N 2.79Å; G335-R383 CarbonylContact C-O 3.58Å; G335-R383 VanDerWaalsContact CA-O 3.29Å; G335-R383 WeakPolarHBondContact CA-O 3.49Å
336	E	87.1	Confident	84.8	Confident	36 Å²	36	11.6 Å²	11.6	17%	0.168	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	145.9	176.4	-62.5	-170.3	158.8	0	0	110.8	L352 K353 T354 A382 R383 Y385	E336-L352 HydrophobicContact CB-CD1 4.3Å; E336-K353 VanDerWaalsContact CA-O 3.3Å; E336-K353 WeakPolarHBondContact CA-O 3.21Å; E336-T354 HydrophobicContact CG-CG2 4.45Å; E336-A382 CarbonylContact O-C 3.54Å; E336-A382 WeakPolarHBondContact O-CA 3.46Å; E336-R383 PolarHBondContact N-O 3.32Å; E336-R383 PolarHBondContact O-N 3.27Å; E336-Y385 HydrophobicContact CB-CE2 4.09Å; E336-Y385 HydrophobicContact CG-CD2 4.11Å; E336-Y385 HydrophobicContact CG-CE2 3.86Å; E336-Y385 WeakPolarHBondContact OE2-CE2 3.46Å
337	C	88.7	Confident	83.6	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	132.5	179.1	-65.6	0	0	0	0	110.9	L332 V339 K353 L373 V379 Q381	L332-C337 HydrophobicContact CD2-CB 4.43Å; C337-V339 HydrophobicContact CB-CG2 3.94Å; C337-K353 HydrophobicContact CB-CB 4.27Å; C337-K353 PolarHBondContact N-O 3Å; C337-K353 WeakPolarHBondContact O-CB 3.25Å; C337-K353 PolarHBondContact O-N 3.39Å; C337-L373 HydrophobicContact CB-CD2 4.21Å; C337-V379 HydrophobicContact CB-CG1 4.04Å; C337-Q381 CarbonylContact C-O 3.52Å; C337-Q381 WeakPolarHBondContact CA-O 3.32Å
338	M	87.9	Confident	82	Confident	12 Å²	12	19.9 Å²	19.9	6%	0.059	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.4	165	-171.7	59.9	64.6	0	0	108.8	P350 L352 V379 L380 Q381	M338-P350 HydrophobicContact CG-CB 3.95Å; M338-P350 HydrophobicContact SD-CB 3.74Å; M338-L352 HydrophobicContact CE-CB 4.07Å; M338-L352 HydrophobicContact CE-CD1 3.99Å; M338-V379 CarbonylContact O-C 3.59Å; M338-L380 HydrophobicContact CG-CB 4.47Å; M338-L380 HydrophobicContact CG-CD1 4.33Å; M338-L380 PolarHBondContact O-N 3.41Å; M338-Q381 HydrophobicContact CB-CB 4.31Å; M338-Q381 PolarHBondContact N-O 2.85Å; M338-Q381 PolarHBondContact O-N 2.74Å
339	V	89.2	Confident	81.1	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.7	-170.9	-173	0	0	0	0	110.9	C337 E341 P350 V351 K353 L373 T377 L378 V379	C337-V339 HydrophobicContact CB-CG2 3.94Å; V339-E341 HydrophobicContact CG1-CG 4.04Å; V339-E341 PolarHBondContact O-N 2.94Å; V339-P350 WeakPolarHBondContact O-CA 3.12Å; V339-V351 PolarHBondContact N-O 3.26Å; V339-V351 PolarHBondContact O-N 2.98Å; V339-K353 HydrophobicContact CB-CG 4.25Å; V339-K353 HydrophobicContact CG2-CB 4.46Å; V339-K353 HydrophobicContact CG2-CG 3.64Å; V339-L373 HydrophobicContact CG2-CD2 3.57Å; V339-T377 HydrophobicContact CG1-CG2 4.33Å; V339-T377 WeakPolarHBondContact CG1-OG1 3.39Å; V339-L378 CarbonylContact C-O 3.58Å; V339-L378 WeakPolarHBondContact CA-O 3.43Å; V339-V379 HydrophobicContact CG2-CG2 4.22Å
340	N	86.1	Confident	80.5	Confident	36 Å²	36	23.5 Å²	23.5	19%	0.193	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	106.8	164.4	-173.3	-6.3	0	0	0	109.5	S342 L378 L380	N340-S342 WeakPolarHBondContact OD1-CB 3.46Å; N340-S342 PolarHBondContact OD1-N 3.32Å; N340-S342 PolarHBondContact OD1-OG 3.48Å; N340-S342 VanDerWaalsContact OD1-OG 3.09Å; N340-L378 HydrophobicContact CB-CB 4.36Å; N340-L378 PolarHBondContact N-O 3.32Å; N340-L378 PolarHBondContact O-N 3.2Å; N340-L378 VanDerWaalsContact O-N 3.09Å; N340-L380 HydrophobicContact CB-CD1 4.15Å; N340-L380 HydrophobicContact CB-CD2 4.29Å; N340-L380 HydrophobicContact CB-CG 4.21Å
341	E	83.3	Confident	79.9	Confident	6 Å²	6	25.9 Å²	25.9	3%	0.028	16%	0.162	C	C	.	.			trans	-90.6	8.7	177.6	-57.7	-154.9	155.5	0	0	114	V339 S343 L344 T345 K353 R369 F374 T377	V339-E341 HydrophobicContact CG1-CG 4.04Å; V339-E341 PolarHBondContact O-N 2.94Å; E341-S343 PolarHBondContact O-N 3.23Å; E341-L344 PolarHBondContact O-N 3.01Å; E341-T345 HydrophobicContact CB-CG2 3.9Å; E341-T345 PolarHBondContact O-N 3.04Å; E341-T345 PolarHBondContact O-OG1 3.2Å; E341-T345 WeakPolarHBondContact OE2-CG2 3.38Å; E341-K353 WeakPolarHBondContact OE1-CE 3.25Å; E341-K353 IonicContact OE1-NZ 2.63Å; E341-K353 PolarHBondContact OE1-NZ 3.43Å; E341-K353 IonicContact OE2-NZ 3.06Å; E341-R369 IonicContact OE2-CZ 2.73Å; E341-R369 IonicContact OE2-NE 2.79Å; E341-R369 IonicContact OE2-NH2 2.93Å; E341-R369 PolarHBondContact OE2-NH2 3.28Å; E341-F374 WeakPolarHBondContact OE1-CD2 3.45Å; E341-T377 HydrophobicContact CB-CG2 4.13Å; E341-T377 HydrophobicContact CG-CG2 3.98Å
342	S	72.1	Confident	79.4	Confident	38 Å²	38	27.8 Å²	27.8	27%	0.266	17%	0.171	S	C	.	.	H	α-helix	trans	-55.1	-29.5	-172.6	69.6	0	0	0	0	113.9	N340 L344 G346 E347 A897	N340-S342 WeakPolarHBondContact OD1-CB 3.46Å; N340-S342 PolarHBondContact OD1-N 3.32Å; N340-S342 PolarHBondContact OD1-OG 3.48Å; N340-S342 VanDerWaalsContact OD1-OG 3.09Å; S342-L344 VanDerWaalsContact C-N 3.27Å; S342-L344 PolarHBondContact O-N 3.16Å; S342-G346 WeakPolarHBondContact O-CA 3.27Å; S342-G346 PolarHBondContact O-N 3.2Å; S342-E347 WeakPolarHBondContact CA-O 3.37Å; S342-E347 VanDerWaalsContact CB-O 3.25Å; S342-E347 WeakPolarHBondContact CB-O 3.41Å; S342-E347 PolarHBondContact N-O 2.88Å; S342-A897 WeakPolarHBondContact O-CB 3.45Å
343	S	69.5	Low	79.1	Confident	16 Å²	16	28 Å²	28	11%	0.112	17%	0.172	C	C	.	.	H	α-helix	trans	-64.3	-29.5	175.3	55.1	0	0	0	0	113.6	E341 G376 E898 A899	E341-S343 PolarHBondContact O-N 3.23Å; S343-G376 WeakPolarHBondContact CB-O 3.36Å; S343-G376 VanDerWaalsContact OG-C 3.3Å; S343-G376 PolarHBondContact OG-O 2.94Å; S343-E898 VanDerWaalsContact CB-OE2 3.3Å; S343-E898 WeakPolarHBondContact CB-OE2 3.2Å; S343-E898 VanDerWaalsContact O-CB 3.31Å; S343-E898 WeakPolarHBondContact O-CB 3.31Å; S343-A899 PolarHBondContact O-N 3.04Å; S343-A899 VanDerWaalsContact O-N 3.12Å
344	L	70.3	Confident	78.9	Confident	18 Å²	18	28.5 Å²	28.5	9%	0.094	18%	0.176	C	C	.	.	H	α-helix	trans	-108.5	-34.7	-176.1	-89.6	140.1	0	0	0	113.7	E341 S342 F374 C375 T377 A402 K403 L406 A899	E341-L344 PolarHBondContact O-N 3.01Å; S342-L344 VanDerWaalsContact C-N 3.27Å; S342-L344 PolarHBondContact O-N 3.16Å; L344-F374 HydrophobicContact CD1-CB 3.41Å; L344-F374 VanDerWaalsContact CD1-CB 3.41Å; L344-F374 HydrophobicContact CD1-CG 4.44Å; L344-C375 WeakPolarHBondContact CD1-O 3.31Å; L344-T377 HydrophobicContact CD1-CG2 3.29Å; L344-A402 HydrophobicContact CD2-CB 3.68Å; L344-K403 HydrophobicContact CD2-CB 4.3Å; L344-L406 HydrophobicContact CD2-CD1 4.44Å; L344-A899 WeakPolarHBondContact O-CB 3.41Å
345	T	66.3	Low	78.8	Confident	6 Å²	6	29 Å²	29	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-98.9	-28	-179.5	58.2	0	0	0	0	113.1	E341 E347 A879	E341-T345 HydrophobicContact CB-CG2 3.9Å; E341-T345 PolarHBondContact O-N 3.04Å; E341-T345 PolarHBondContact O-OG1 3.2Å; E341-T345 WeakPolarHBondContact OE2-CG2 3.38Å; T345-E347 PolarHBondContact O-N 2.67Å; T345-E347 PolarHBondContact OG1-N 2.68Å; T345-A879 HydrophobicContact CG2-CB 3.84Å; T345-A879 WeakPolarHBondContact O-CA 3.45Å; T345-A879 VanDerWaalsContact O-CB 3.32Å; T345-A879 WeakPolarHBondContact O-CB 3.21Å; T345-A879 PolarHBondContact O-N 2.8Å
346	G	58.8	Low	78.9	Confident	14 Å²	14	28.5 Å²	28.5	14%	0.144	17%	0.174	C	C	.	.			trans	73.2	3.9	-168.6	0	0	0	0	0	116.2	S342 S895	S342-G346 WeakPolarHBondContact O-CA 3.27Å; S342-G346 PolarHBondContact O-N 3.2Å; G346-S895 PolarHBondContact O-OG 3.42Å
347	E	66.6	Low	78.7	Confident	84 Å²	84	30.3 Å²	30.3	39%	0.393	19%	0.188	S	C	.	.			trans	-85.2	127.9	171.4	-64.7	174.9	-177.9	0	0	108.6	S342 T345 V349	S342-E347 WeakPolarHBondContact CA-O 3.37Å; S342-E347 VanDerWaalsContact CB-O 3.25Å; S342-E347 WeakPolarHBondContact CB-O 3.41Å; S342-E347 PolarHBondContact N-O 2.88Å; T345-E347 PolarHBondContact O-N 2.67Å; T345-E347 PolarHBondContact OG1-N 2.68Å; E347-V349 VanDerWaalsContact C-N 3.34Å
348	S	60.6	Low	78.1	Confident	99 Å²	99	37.4 Å²	37.4	69%	0.692	22%	0.222	S	C	*	.			trans	-82.8	-12.4	-177	54.6	0	0	0	0	113.7	P350	S348-P350 VanDerWaalsContact O-CD 3.32Å; S348-P350 WeakPolarHBondContact O-CD 3.24Å
349	V	74.1	Confident	77.5	Confident	57 Å²	57	38.1 Å²	38.1	35%	0.345	23%	0.232	S	C	.	.	S	Bend	trans	-80.3	121.1	-178.2	-178	0	0	0	0	109.2	E347 G569	E347-V349 VanDerWaalsContact C-N 3.34Å; V349-G569 WeakPolarHBondContact CG1-O 3.45Å
350	P	81	Confident	76.5	Confident	20 Å²	20	45 Å²	45	13%	0.13	27%	0.268	C	S	.	.			trans	-59.2	144.9	174.4	-25.2	33.9	0	0	0	113.1	M338 V339 S348 L380 V568	M338-P350 HydrophobicContact CG-CB 3.95Å; M338-P350 HydrophobicContact SD-CB 3.74Å; V339-P350 WeakPolarHBondContact O-CA 3.12Å; S348-P350 VanDerWaalsContact O-CD 3.32Å; S348-P350 WeakPolarHBondContact O-CD 3.24Å; P350-L380 HydrophobicContact CB-CD1 3.77Å; P350-L380 HydrophobicContact CG-CD1 3.59Å; P350-V568 HydrophobicContact CB-CG1 3.7Å; P350-V568 VanDerWaalsContact CD-CG1 3.44Å; P350-V568 HydrophobicContact CG-CG1 3.65Å
351	V	81.6	Confident	76.1	Confident	50 Å²	50	45.1 Å²	45.1	30%	0.303	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.6	-176.1	-177.6	0	0	0	0	109.8	V339	V339-V351 PolarHBondContact N-O 3.26Å; V339-V351 PolarHBondContact O-N 2.98Å
352	L	84.3	Confident	76.1	Confident	40 Å²	40	49.1 Å²	49.1	21%	0.209	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	130.5	172.3	-175.2	68.1	0	0	0	110.9	E336 M338	E336-L352 HydrophobicContact CB-CD1 4.3Å; M338-L352 HydrophobicContact CE-CB 4.07Å; M338-L352 HydrophobicContact CE-CD1 3.99Å
353	K	87.6	Confident	76.8	Confident	3 Å²	3	48.7 Å²	48.7	1%	0.013	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.3	176.7	-58.6	-68.4	-174.9	168.1	0	109.6	L332 E336 C337 V339 E341 R369 R370 T372 L373	L332-K353 HydrophobicContact CD2-CB 4.15Å; E336-K353 VanDerWaalsContact CA-O 3.3Å; E336-K353 WeakPolarHBondContact CA-O 3.21Å; C337-K353 HydrophobicContact CB-CB 4.27Å; C337-K353 PolarHBondContact N-O 3Å; C337-K353 WeakPolarHBondContact O-CB 3.25Å; C337-K353 PolarHBondContact O-N 3.39Å; V339-K353 HydrophobicContact CB-CG 4.25Å; V339-K353 HydrophobicContact CG2-CB 4.46Å; V339-K353 HydrophobicContact CG2-CG 3.64Å; E341-K353 WeakPolarHBondContact OE1-CE 3.25Å; E341-K353 IonicContact OE1-NZ 2.63Å; E341-K353 PolarHBondContact OE1-NZ 3.43Å; E341-K353 IonicContact OE2-NZ 3.06Å; K353-R369 PolarHBondContact NZ-O 2.85Å; K353-R370 VanDerWaalsContact CA-O 3.31Å; K353-R370 WeakPolarHBondContact CA-O 3.29Å; K353-R370 WeakPolarHBondContact CD-O 3.41Å; K353-T372 PolarHBondContact NZ-O 2.95Å; K353-L373 HydrophobicContact CB-CD2 4.12Å; K353-L373 HydrophobicContact CG-CD2 3.87Å
354	T	86.6	Confident	77.3	Confident	25 Å²	25	50 Å²	50	15%	0.153	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	156.4	-178.2	64.8	0	0	0	0	110.5	E336 R370 H371	E336-T354 HydrophobicContact CG-CG2 4.45Å; T354-R370 PolarHBondContact N-O 3.14Å; T354-H371 WeakPolarHBondContact O-CA 3.28Å; T354-H371 PolarHBondContact O-ND1 2.99Å; T354-H371 PolarHBondContact OG1-CE1 2.83Å; T354-H371 PolarHBondContact OG1-ND1 3.2Å
355	A	87.9	Confident	77.8	Confident	35 Å²	35	49.1 Å²	49.1	29%	0.289	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-53.7	144.6	175.5	0	0	0	0	0	112.6	L332 G335 H371	L332-A355 CarbonylContact O-C 3.57Å; L332-A355 WeakPolarHBondContact O-CA 3.15Å; G335-A355 PolarHBondContact O-N 2.79Å; A355-H371 PolarHBondContact O-CE1 2.83Å; A355-H371 PolarHBondContact O-ND1 3.38Å
356	L	87.5	Confident	78.1	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-65.2	128.2	176.7	-173.9	73.4	0	0	0	109	C193 I196 H197 L332 Y363 H368 H371	C193-L356 HydrophobicContact CB-CD2 3.83Å; C193-L356 HydrophobicContact CB-CG 4.24Å; I196-L356 HydrophobicContact CB-CD2 4.29Å; I196-L356 HydrophobicContact CD1-CD2 4.31Å; I196-L356 HydrophobicContact CG2-CD2 4.2Å; H197-L356 PolarHBondContact CE1-O 3.31Å; H197-L356 VanDerWaalsContact CE1-O 3.23Å; H197-L356 PolarHBondContact NE2-O 3.48Å; L332-L356 WeakPolarHBondContact O-CB 3.41Å; L332-L356 PolarHBondContact O-N 3.35Å; L356-Y363 HydrophobicContact CD1-CD2 4.08Å; L356-Y363 HydrophobicContact CD1-CE2 4.27Å; L356-Y363 HydrophobicContact CD2-CD2 4.17Å; L356-H368 HydrophobicContact CD1-CB 4.19Å; L356-H371 HydrophobicContact CB-CB 4.04Å; L356-H371 HydrophobicContact CD1-CB 3.68Å
357	P	81.9	Confident	78.8	Confident	73 Å²	73	57.9 Å²	57.9	47%	0.474	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-66.6	147.1	174.7	26.5	-33.7	0	0	0	111.5
358	E	77.6	Confident	79.6	Confident	150 Å²	150	55.7 Å²	55.7	70%	0.701	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-68.3	142.8	171.2	-65.3	-175.8	172.6	0	0	110.5
359	G	74.4	Confident	80.7	Confident	27 Å²	27	54.7 Å²	54.7	28%	0.278	32%	0.316	S	S	.	.			trans	164.2	153	179	0	0	0	0	0	114.9	C193 D194 G361	C193-G359 WeakPolarHBondContact CB-O 3.3Å; C193-G359 PolarHBondContact N-O 3.44Å; D194-G359 VanDerWaalsContact CG-C 3.5Å; D194-G359 PolarHBondContact N-O 3.22Å; D194-G359 WeakPolarHBondContact OD1-CA 3.43Å; D194-G359 PolarHBondContact OD1-N 3.01Å; G359-G361 PolarHBondContact O-N 3.39Å; G359-G361 VanDerWaalsContact O-N 3.16Å
360	L	69.6	Low	81.1	Confident	145 Å²	145	56.4 Å²	56.4	76%	0.759	32%	0.316	S	S	*	.	S	Bend	trans	-71.3	-3.1	177.9	-81.6	127.9	0	0	0	114.7
361	G	77.3	Confident	81.5	Confident	38 Å²	38	56.9 Å²	56.9	39%	0.392	32%	0.316	S	S	.	.	S	Bend	trans	-67.5	148.5	-179.9	0	0	0	0	0	112.6	S192 C193 G359 Y363	S192-G361 CarbonylContact C-O 3.54Å; S192-G361 VanDerWaalsContact CA-O 3.25Å; S192-G361 WeakPolarHBondContact CA-O 3.47Å; C193-G361 PolarHBondContact N-O 2.98Å; G359-G361 PolarHBondContact O-N 3.39Å; G359-G361 VanDerWaalsContact O-N 3.16Å; G361-Y363 PolarHBondContact O-N 2.84Å
362	P	83.1	Confident	82	Confident	89 Å²	89	54.5 Å²	54.5	58%	0.578	30%	0.302	S	S	*	.	B	Isolated β-bridge	trans	-68.5	130.8	178.2	28.5	-33.7	0	0	0	110.7	H368	P362-H368 PolarHBondContact O-CE1 3.21Å
363	Y	85.6	Confident	82.4	Confident	30 Å²	30	52.6 Å²	52.6	12%	0.118	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-70.5	136.4	171.3	174.4	-99.3	0	0	0	110.6	R191 I196 A331 L356 G361 A365 H368 T372 T395	R191-Y363 PolarHBondContact O-N 3Å; I196-Y363 VanDerWaalsContact CD1-CB 3.41Å; I196-Y363 HydrophobicContact CD1-CD1 3.45Å; I196-Y363 VanDerWaalsContact CD1-CD1 3.45Å; I196-Y363 HydrophobicContact CD1-CD2 3.56Å; I196-Y363 HydrophobicContact CD1-CE1 4.03Å; I196-Y363 HydrophobicContact CD1-CE2 4.13Å; I196-Y363 HydrophobicContact CD1-CG 3.16Å; A331-Y363 HydrophobicContact CB-CE2 3.88Å; L356-Y363 HydrophobicContact CD1-CD2 4.08Å; L356-Y363 HydrophobicContact CD1-CE2 4.27Å; L356-Y363 HydrophobicContact CD2-CD2 4.17Å; G361-Y363 PolarHBondContact O-N 2.84Å; Y363-A365 HydrophobicContact CE1-CB 4.47Å; Y363-H368 HydrophobicContact CD2-CB 4.15Å; Y363-H368 HydrophobicContact CE2-CB 3.93Å; Y363-T372 WeakPolarHBondContact OH-CG2 3.32Å; Y363-T372 PolarHBondContact OH-OG1 3.18Å; Y363-T395 HydrophobicContact CD1-CG2 4.45Å; Y363-T395 HydrophobicContact CE1-CG2 3.62Å
364	C	80.7	Confident	82.7	Confident	42 Å²	42	52.5 Å²	52.5	28%	0.284	29%	0.292	S	S	.	.			trans	-146.4	124.3	172.3	175.3	0	0	0	0	108.1	E366 T367 H368	C364-E366 PolarHBondContact O-N 2.86Å; C364-T367 HydrophobicContact CB-CG2 4.4Å; C364-T367 WeakPolarHBondContact CB-OG1 3.45Å; C364-T367 PolarHBondContact O-N 2.92Å; C364-T367 PolarHBondContact O-OG1 2.72Å; C364-H368 PolarHBondContact N-ND1 3.25Å; C364-H368 VanDerWaalsContact N-ND1 3.18Å; C364-H368 VanDerWaalsContact O-CB 3.29Å; C364-H368 WeakPolarHBondContact O-CB 3.38Å; C364-H368 PolarHBondContact O-N 3.29Å; C364-H368 PolarHBondContact O-ND1 2.61Å
365	A	80.5	Confident	82.8	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.008	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-30.8	-176.9	0	0	0	0	0	113.1	Y363 H368 R369 T372 F374	Y363-A365 HydrophobicContact CE1-CB 4.47Å; A365-H368 CarbonylContact O-C 3.58Å; A365-R369 WeakPolarHBondContact O-CA 3.42Å; A365-R369 PolarHBondContact O-N 3.38Å; A365-T372 HydrophobicContact CB-CG2 4.19Å; A365-F374 HydrophobicContact CB-CE1 4.48Å
366	E	72.3	Confident	82.8	Confident	97 Å²	97	50.2 Å²	50.2	45%	0.453	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-45.8	178.9	-59.4	-58.2	159.8	0	0	111.8	C364	C364-E366 PolarHBondContact O-N 2.86Å
367	T	74.3	Confident	82.9	Confident	106 Å²	106	50 Å²	50	65%	0.65	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-31.2	178.8	62.6	0	0	0	0	111.9	C364	C364-T367 HydrophobicContact CB-CG2 4.4Å; C364-T367 WeakPolarHBondContact CB-OG1 3.45Å; C364-T367 PolarHBondContact O-N 2.92Å; C364-T367 PolarHBondContact O-OG1 2.72Å
368	H	84.1	Confident	83.4	Confident	39 Å²	39	50 Å²	50	18%	0.181	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	24.9	179.8	-57.4	91.1	0	0	0	112.5	L356 P362 Y363 C364 A365 R370 H371 T372	L356-H368 HydrophobicContact CD1-CB 4.19Å; P362-H368 PolarHBondContact O-CE1 3.21Å; Y363-H368 HydrophobicContact CD2-CB 4.15Å; Y363-H368 HydrophobicContact CE2-CB 3.93Å; C364-H368 PolarHBondContact N-ND1 3.25Å; C364-H368 VanDerWaalsContact N-ND1 3.18Å; C364-H368 VanDerWaalsContact O-CB 3.29Å; C364-H368 WeakPolarHBondContact O-CB 3.38Å; C364-H368 PolarHBondContact O-N 3.29Å; C364-H368 PolarHBondContact O-ND1 2.61Å; A365-H368 CarbonylContact O-C 3.58Å; H368-R370 PolarHBondContact O-N 3.32Å; H368-H371 WeakPolarHBondContact O-CA 3.45Å; H368-H371 PolarHBondContact O-N 3.34Å; H368-T372 PolarHBondContact O-N 2.77Å; H368-T372 PolarHBondContact O-OG1 3.45Å
369	R	82.6	Confident	84	Confident	77 Å²	77	43 Å²	43	29%	0.291	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-47.5	-33.4	-177.5	-170.5	-177.2	-178.9	91.6	15	113.9	E341 K353 A365 H371 T372 F374	E341-R369 IonicContact OE2-CZ 2.73Å; E341-R369 IonicContact OE2-NE 2.79Å; E341-R369 IonicContact OE2-NH2 2.93Å; E341-R369 PolarHBondContact OE2-NH2 3.28Å; K353-R369 PolarHBondContact NZ-O 2.85Å; A365-R369 WeakPolarHBondContact O-CA 3.42Å; A365-R369 PolarHBondContact O-N 3.38Å; R369-H371 VanDerWaalsContact C-N 3.28Å; R369-H371 PolarHBondContact O-N 2.98Å; R369-T372 PolarHBondContact O-N 2.79Å; R369-T372 VanDerWaalsContact O-O 3.09Å; R369-F374 HydrophobicContact CB-CZ 4.49Å; R369-F374 HydrophobicContact CG-CE2 3.62Å; R369-F374 HydrophobicContact CG-CZ 3.79Å
370	R	82.3	Confident	84.7	Confident	93 Å²	93	44 Å²	44	35%	0.351	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-68.2	-24.9	178.1	-69.8	-178.9	175.6	-120	-5	114.4	K353 T354 H368 F629	K353-R370 VanDerWaalsContact CA-O 3.31Å; K353-R370 WeakPolarHBondContact CA-O 3.29Å; K353-R370 WeakPolarHBondContact CD-O 3.41Å; T354-R370 PolarHBondContact N-O 3.14Å; H368-R370 PolarHBondContact O-N 3.32Å; R370-F629 PolarHBondContact NE-O 2.75Å; R370-F629 VanDerWaalsContact NE-O 3.12Å; R370-F629 PolarHBondContact NH1-O 2.76Å; R370-F629 PolarHBondContact NH2-O 3.23Å; R370-F629 VanDerWaalsContact NH2-O 3.08Å
371	H	89.8	Confident	85.6	Confident	30 Å²	30	40 Å²	40	14%	0.139	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-101.4	-2.6	177.8	-48.5	-63.7	0	0	0	111.3	A331 L332 T354 A355 L356 H368 R369	A331-H371 CarbonylContact C-O 3.58Å; A331-H371 WeakPolarHBondContact CA-O 3.42Å; L332-H371 PolarHBondContact N-O 3.12Å; T354-H371 WeakPolarHBondContact O-CA 3.28Å; T354-H371 PolarHBondContact O-ND1 2.99Å; T354-H371 PolarHBondContact OG1-CE1 2.83Å; T354-H371 PolarHBondContact OG1-ND1 3.2Å; A355-H371 PolarHBondContact O-CE1 2.83Å; A355-H371 PolarHBondContact O-ND1 3.38Å; L356-H371 HydrophobicContact CB-CB 4.04Å; L356-H371 HydrophobicContact CD1-CB 3.68Å; H368-H371 WeakPolarHBondContact O-CA 3.45Å; H368-H371 PolarHBondContact O-N 3.34Å; R369-H371 VanDerWaalsContact C-N 3.28Å; R369-H371 PolarHBondContact O-N 2.98Å
372	T	92	Very high	86.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.7	-178.9	-49.6	0	0	0	0	110.5	A330 K353 Y363 A365 H368 R369 F374	A330-T372 CarbonylContact O-C 3.52Å; A330-T372 WeakPolarHBondContact O-CA 3.35Å; K353-T372 PolarHBondContact NZ-O 2.95Å; Y363-T372 WeakPolarHBondContact OH-CG2 3.32Å; Y363-T372 PolarHBondContact OH-OG1 3.18Å; A365-T372 HydrophobicContact CB-CG2 4.19Å; H368-T372 PolarHBondContact O-N 2.77Å; H368-T372 PolarHBondContact O-OG1 3.45Å; R369-T372 PolarHBondContact O-N 2.79Å; R369-T372 VanDerWaalsContact O-O 3.09Å; T372-F374 HydrophobicContact CG2-CD1 4.19Å; T372-F374 HydrophobicContact CG2-CE1 3.79Å; T372-F374 HydrophobicContact CG2-CE2 4.26Å; T372-F374 HydrophobicContact CG2-CZ 3.82Å
373	L	94.2	Very high	86.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	133.4	167.3	-57.2	176.6	0	0	0	108.1	L319 M326 D329 A330 L332 C337 V339 K353 A392	L319-L373 HydrophobicContact CD1-CD1 3.48Å; L319-L373 VanDerWaalsContact CD1-CD1 3.48Å; M326-L373 HydrophobicContact CE-CB 3.84Å; M326-L373 HydrophobicContact CE-CD1 3.98Å; M326-L373 HydrophobicContact CG-CB 4.15Å; M326-L373 HydrophobicContact SD-CB 4.27Å; M326-L373 HydrophobicContact SD-CD1 4Å; D329-L373 CarbonylContact C-O 3.59Å; D329-L373 VanDerWaalsContact CA-O 3.24Å; D329-L373 WeakPolarHBondContact CA-O 3.31Å; A330-L373 PolarHBondContact N-O 2.86Å; A330-L373 PolarHBondContact O-N 3.39Å; L332-L373 HydrophobicContact CD1-CD1 4.46Å; C337-L373 HydrophobicContact CB-CD2 4.21Å; V339-L373 HydrophobicContact CG2-CD2 3.57Å; K353-L373 HydrophobicContact CB-CD2 4.12Å; K353-L373 HydrophobicContact CG-CD2 3.87Å; L373-A392 HydrophobicContact CD1-CB 4.03Å
374	F	91.9	Very high	85.9	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.009	19%	0.185	C	C	.	.			trans	-109.8	148.7	-172.5	-65.3	-81.6	0	0	0	112.8	M326 C328 D329 E341 L344 A365 R369 T372 G376 T377 A402	M326-F374 VanDerWaalsContact CB-O 3.27Å; M326-F374 WeakPolarHBondContact CB-O 3.25Å; C328-F374 CarbonylContact O-C 3.54Å; D329-F374 WeakPolarHBondContact OD1-CA 3.4Å; E341-F374 WeakPolarHBondContact OE1-CD2 3.45Å; L344-F374 HydrophobicContact CD1-CB 3.41Å; L344-F374 VanDerWaalsContact CD1-CB 3.41Å; L344-F374 HydrophobicContact CD1-CG 4.44Å; A365-F374 HydrophobicContact CB-CE1 4.48Å; R369-F374 HydrophobicContact CB-CZ 4.49Å; R369-F374 HydrophobicContact CG-CE2 3.62Å; R369-F374 HydrophobicContact CG-CZ 3.79Å; T372-F374 HydrophobicContact CG2-CD1 4.19Å; T372-F374 HydrophobicContact CG2-CE1 3.79Å; T372-F374 HydrophobicContact CG2-CE2 4.26Å; T372-F374 HydrophobicContact CG2-CZ 3.82Å; F374-G376 PolarHBondContact O-N 3.05Å; F374-T377 HydrophobicContact CB-CG2 3.86Å; F374-T377 WeakPolarHBondContact O-CB 3.38Å; F374-T377 WeakPolarHBondContact O-CG2 3.48Å; F374-T377 PolarHBondContact O-N 3.28Å; F374-T377 VanDerWaalsContact O-N 3.08Å; F374-T377 PolarHBondContact O-OG1 2.93Å; F374-A402 HydrophobicContact CD1-CB 3.86Å; F374-A402 HydrophobicContact CE1-CB 4.37Å
375	C	90.6	Very high	85.3	Confident	6 Å²	6	37.3 Å²	37.3	4%	0.041	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	122.3	178.9	-179.3	0	0	0	0	112	M326 P327 C328 D329 L344 T401 K403	M326-C375 CarbonylContact O-C 3.18Å; P327-C375 PolarHBondContact O-SG 2.69Å; C328-C375 PolarHBondContact O-N 2.84Å; D329-C375 WeakPolarHBondContact OD1-CB 3.31Å; D329-C375 PolarHBondContact OD1-N 3.09Å; L344-C375 WeakPolarHBondContact CD1-O 3.31Å; C375-T401 HydrophobicContact CB-CG2 3.86Å; C375-K403 HydrophobicContact CB-CB 4.23Å; C375-K403 WeakPolarHBondContact O-CB 3.47Å; C375-K403 WeakPolarHBondContact O-CD 3.41Å
376	G	87.6	Confident	84.6	Confident	6 Å²	6	41.9 Å²	41.9	6%	0.062	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.7	-0.6	-178.8	0	0	0	0	0	114.7	M326 S343 F374	M326-G376 PolarHBondContact O-N 2.88Å; S343-G376 WeakPolarHBondContact CB-O 3.36Å; S343-G376 VanDerWaalsContact OG-C 3.3Å; S343-G376 PolarHBondContact OG-O 2.94Å; F374-G376 PolarHBondContact O-N 3.05Å
377	T	89.9	Confident	84.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.			trans	-78.1	148.4	168.3	62.3	0	0	0	0	110.8	L325 M326 V339 E341 L344 F374	L325-T377 WeakPolarHBondContact CD1-O 3.11Å; M326-T377 PolarHBondContact N-O 3.15Å; V339-T377 HydrophobicContact CG1-CG2 4.33Å; V339-T377 WeakPolarHBondContact CG1-OG1 3.39Å; E341-T377 HydrophobicContact CB-CG2 4.13Å; E341-T377 HydrophobicContact CG-CG2 3.98Å; L344-T377 HydrophobicContact CD1-CG2 3.29Å; F374-T377 HydrophobicContact CB-CG2 3.86Å; F374-T377 WeakPolarHBondContact O-CB 3.38Å; F374-T377 WeakPolarHBondContact O-CG2 3.48Å; F374-T377 PolarHBondContact O-N 3.28Å; F374-T377 VanDerWaalsContact O-N 3.08Å; F374-T377 PolarHBondContact O-OG1 2.93Å
378	L	90.5	Very high	84.5	Confident	72 Å²	72	39.6 Å²	39.6	38%	0.377	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	113.3	178.2	179.6	66.7	0	0	0	109.2	L325 V339 N340 L380	L325-L378 HydrophobicContact CB-CD1 4.42Å; L325-L378 HydrophobicContact CD1-CB 4.25Å; L325-L378 HydrophobicContact CD1-CD1 4.44Å; V339-L378 CarbonylContact C-O 3.58Å; V339-L378 WeakPolarHBondContact CA-O 3.43Å; N340-L378 HydrophobicContact CB-CB 4.36Å; N340-L378 PolarHBondContact N-O 3.32Å; N340-L378 PolarHBondContact O-N 3.2Å; N340-L378 VanDerWaalsContact O-N 3.09Å; L378-L380 HydrophobicContact CD2-CD2 3.67Å; L378-L380 HydrophobicContact CG-CD2 3.97Å; L378-L380 PolarHBondContact O-N 3.43Å
379	V	92.2	Very high	84.6	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.024	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	117.3	165.8	-175.1	0	0	0	0	106.7	G323 G324 M326 C337 M338 V339 A382	G323-V379 CarbonylContact C-O 3.49Å; G323-V379 VanDerWaalsContact CA-O 3.28Å; G323-V379 WeakPolarHBondContact CA-O 3.35Å; G324-V379 PolarHBondContact N-O 2.77Å; G324-V379 WeakPolarHBondContact O-CB 3.49Å; G324-V379 PolarHBondContact O-N 3.06Å; M326-V379 HydrophobicContact CG-CG2 3.78Å; M326-V379 HydrophobicContact SD-CG2 3.82Å; C337-V379 HydrophobicContact CB-CG1 4.04Å; M338-V379 CarbonylContact O-C 3.59Å; V339-V379 HydrophobicContact CG2-CG2 4.22Å; V379-A382 HydrophobicContact CG1-CB 4.37Å
380	L	88.8	Confident	85	Confident	48 Å²	48	38 Å²	38	25%	0.251	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-33	179.6	-60.6	175.8	0	0	0	111.6	M338 N340 P350 L378 L563	M338-L380 HydrophobicContact CG-CB 4.47Å; M338-L380 HydrophobicContact CG-CD1 4.33Å; M338-L380 PolarHBondContact O-N 3.41Å; N340-L380 HydrophobicContact CB-CD1 4.15Å; N340-L380 HydrophobicContact CB-CD2 4.29Å; N340-L380 HydrophobicContact CB-CG 4.21Å; P350-L380 HydrophobicContact CB-CD1 3.77Å; P350-L380 HydrophobicContact CG-CD1 3.59Å; L378-L380 HydrophobicContact CD2-CD2 3.67Å; L378-L380 HydrophobicContact CG-CD2 3.97Å; L378-L380 PolarHBondContact O-N 3.43Å; L380-L563 HydrophobicContact CB-CD1 4.2Å; L380-L563 HydrophobicContact CD1-CD2 3.7Å
381	Q	87.5	Confident	85.5	Confident	61 Å²	61	35.3 Å²	35.3	29%	0.285	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	140.3	-179.7	-167.9	176.3	15.9	0	0	109.3	C337 M338 R383	C337-Q381 CarbonylContact C-O 3.52Å; C337-Q381 WeakPolarHBondContact CA-O 3.32Å; M338-Q381 HydrophobicContact CB-CB 4.31Å; M338-Q381 PolarHBondContact N-O 2.85Å; M338-Q381 PolarHBondContact O-N 2.74Å; Q381-R383 HydrophobicContact CG-CG 4.37Å; Q381-R383 VanDerWaalsContact NE2-NE 3.15Å
382	A	88.4	Confident	85.7	Confident	3 Å²	3	33.9 Å²	33.9	3%	0.025	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	135.5	172	0	0	0	0	0	109.9	L319 P320 Q321 E336 V379 V390	L319-A382 HydrophobicContact CB-CB 4.42Å; P320-A382 WeakPolarHBondContact O-CB 3.47Å; Q321-A382 PolarHBondContact O-N 2.91Å; E336-A382 CarbonylContact O-C 3.54Å; E336-A382 WeakPolarHBondContact O-CA 3.46Å; V379-A382 HydrophobicContact CG1-CB 4.37Å; A382-V390 HydrophobicContact CB-CB 4.29Å; A382-V390 HydrophobicContact CB-CG1 4.27Å; A382-V390 HydrophobicContact CB-CG2 4.03Å
383	R	84.6	Confident	85.8	Confident	51 Å²	51	34 Å²	34	19%	0.192	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.3	-177.2	-62.6	-176.3	-174.3	168	3.9	110.5	G335 E336 Q381 Y385 V390 E586	G335-R383 CarbonylContact C-O 3.58Å; G335-R383 VanDerWaalsContact CA-O 3.29Å; G335-R383 WeakPolarHBondContact CA-O 3.49Å; E336-R383 PolarHBondContact N-O 3.32Å; E336-R383 PolarHBondContact O-N 3.27Å; Q381-R383 HydrophobicContact CG-CG 4.37Å; Q381-R383 VanDerWaalsContact NE2-NE 3.15Å; R383-Y385 HydrophobicContact CB-CE2 3.93Å; R383-V390 WeakPolarHBondContact O-CG2 3.27Å; R383-E586 IonicContact CZ-OE2 2.61Å; R383-E586 VanDerWaalsContact CZ-OE2 3.26Å; R383-E586 IonicContact NH1-OE1 2.86Å; R383-E586 IonicContact NH1-OE2 3.28Å; R383-E586 PolarHBondContact NH1-OE2 3.19Å; R383-E586 IonicContact NH2-OE2 3.92Å; R383-E586 PolarHBondContact NH2-OE2 2.76Å
384	A	80.3	Confident	85.9	Confident	33 Å²	33	34 Å²	34	27%	0.273	20%	0.197	S	C	.	.			trans	-96.4	114.7	173	0	0	0	0	0	109	V390	A384-V390 HydrophobicContact CB-CG2 3.86Å
385	Y	67.9	Low	85.9	Confident	54 Å²	54	34.7 Å²	34.7	21%	0.212	20%	0.202	C	C	.	.	S	Bend	trans	-96.6	-26.2	174.2	-66.2	-78	0	0	0	112.2	E336 R383 L599	E336-Y385 HydrophobicContact CB-CE2 4.09Å; E336-Y385 HydrophobicContact CG-CD2 4.11Å; E336-Y385 HydrophobicContact CG-CE2 3.86Å; E336-Y385 WeakPolarHBondContact OE2-CE2 3.46Å; R383-Y385 HydrophobicContact CB-CE2 3.93Å; Y385-L599 HydrophobicContact CD1-CD2 3.91Å; Y385-L599 HydrophobicContact CD2-CD2 4.44Å; Y385-L599 HydrophobicContact CE1-CD2 3.71Å; Y385-L599 HydrophobicContact CE2-CD2 4.28Å; Y385-L599 HydrophobicContact CG-CD2 4.27Å
386	V	64.7	Low	85.9	Confident	97 Å²	97	37.3 Å²	37.3	59%	0.588	21%	0.211	S	C	*	.	S	Bend	trans	-129.7	114.1	-179.1	-177.4	0	0	0	0	107.9
387	G	69.3	Low	86.1	Confident	54 Å²	54	37.4 Å²	37.4	56%	0.557	21%	0.21	S	C	*	.	S	Bend	trans	80.6	175.3	-174	0	0	0	0	0	113.9
388	P	76.3	Confident	86.1	Confident	102 Å²	102	37.6 Å²	37.6	66%	0.662	21%	0.212	S	C	*	.	S	Bend	trans	-81.2	-15	-173.1	18.8	-14.7	0	0	0	114.6
389	H	85.1	Confident	86	Confident	80 Å²	80	35 Å²	35	37%	0.37	20%	0.198	S	C	.	.	S	Bend	trans	-132.4	148.3	-168.3	-56.7	87.1	0	0	0	112.5	E303 V318 L391	E303-H389 IonicContact OE1-CD2 3.21Å; E303-H389 PolarHBondContact OE1-CD2 3.2Å; E303-H389 VanDerWaalsContact OE1-CD2 3.28Å; E303-H389 IonicContact OE1-CE1 2.84Å; E303-H389 IonicContact OE1-NE2 3.21Å; E303-H389 PolarHBondContact OE1-NE2 2.6Å; E303-H389 VanDerWaalsContact OE1-NE2 3.15Å; V318-H389 HydrophobicContact CG1-CB 4.13Å; H389-L391 HydrophobicContact CB-CD2 4.11Å; H389-L391 HydrophobicContact CB-CG 4.47Å
390	V	90.6	Very high	85.8	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.018	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	122.5	167.8	-178	0	0	0	0	108.1	L319 L332 A334 A382 R383 A384	L319-V390 HydrophobicContact CB-CB 4.22Å; L319-V390 HydrophobicContact CB-CG1 4.21Å; L319-V390 HydrophobicContact CD1-CG1 4.04Å; L319-V390 PolarHBondContact N-O 2.88Å; L332-V390 HydrophobicContact CD1-CG1 3.68Å; A334-V390 WeakPolarHBondContact O-CA 3.46Å; A334-V390 VanDerWaalsContact O-CG1 3.27Å; A334-V390 WeakPolarHBondContact O-CG1 3.47Å; A382-V390 HydrophobicContact CB-CB 4.29Å; A382-V390 HydrophobicContact CB-CG1 4.27Å; A382-V390 HydrophobicContact CB-CG2 4.03Å; R383-V390 WeakPolarHBondContact O-CG2 3.27Å; A384-V390 HydrophobicContact CB-CG2 3.86Å
391	L	92.8	Very high	85.7	Confident	35 Å²	35	34.1 Å²	34.1	18%	0.183	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134.1	-170.9	-61.8	178.3	0	0	0	111.3	L317 V318 V333 A334 H389	L317-L391 WeakPolarHBondContact O-CA 3.41Å; V318-L391 HydrophobicContact CG2-CD2 3.88Å; V333-L391 HydrophobicContact CG2-CB 3.71Å; V333-L391 VanDerWaalsContact CG2-O 3.28Å; V333-L391 WeakPolarHBondContact CG2-O 3.5Å; V333-L391 PolarHBondContact N-O 2.93Å; A334-L391 HydrophobicContact CB-CB 4.08Å; A334-L391 HydrophobicContact CB-CG 4.41Å; A334-L391 PolarHBondContact N-O 3.18Å; A334-L391 PolarHBondContact O-N 2.73Å; H389-L391 HydrophobicContact CB-CD2 4.11Å; H389-L391 HydrophobicContact CB-CG 4.47Å
392	A	94.9	Very high	85.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	128.4	176.1	0	0	0	0	0	111.9	L317 L319 A330 A331 L332 L373	L317-A392 WeakPolarHBondContact CB-O 3.39Å; L317-A392 PolarHBondContact N-O 3.14Å; L317-A392 PolarHBondContact O-N 3.15Å; L319-A392 HydrophobicContact CD1-CB 4.11Å; L319-A392 HydrophobicContact CG-CB 4.45Å; A330-A392 HydrophobicContact CB-CB 4.06Å; A331-A392 CarbonylContact O-C 3.52Å; A331-A392 VanDerWaalsContact O-CA 3.27Å; A331-A392 WeakPolarHBondContact O-CA 3.28Å; L332-A392 HydrophobicContact CD1-CB 4.36Å; L373-A392 HydrophobicContact CD1-CB 4.03Å
393	V	94.8	Very high	85.2	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	127.5	-178.3	175.9	0	0	0	0	110.5	I196 D315 C316 A330 A331 V333 T395	I196-V393 HydrophobicContact CG2-CB 3.91Å; I196-V393 HydrophobicContact CG2-CG1 4.13Å; I196-V393 HydrophobicContact CG2-CG2 4.35Å; D315-V393 CarbonylContact O-C 3.46Å; D315-V393 WeakPolarHBondContact O-CA 3.22Å; C316-V393 HydrophobicContact CB-CG2 4.5Å; A330-V393 CarbonylContact C-O 3.44Å; A330-V393 WeakPolarHBondContact CA-O 3.44Å; A330-V393 WeakPolarHBondContact CB-O 3.28Å; A331-V393 PolarHBondContact N-O 2.88Å; A331-V393 PolarHBondContact O-N 2.94Å; V333-V393 HydrophobicContact CG1-CB 4.45Å; V333-V393 HydrophobicContact CG1-CG2 3.9Å; V333-V393 HydrophobicContact CG2-CG2 4.06Å; V393-T395 PolarHBondContact O-N 3.35Å
394	V	94.6	Very high	85.2	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	129.4	178.7	-177.9	0	0	0	0	110.2	V312 P313 G314 D315 L317 C328 T397	V312-V394 WeakPolarHBondContact O-CB 3.38Å; V312-V394 WeakPolarHBondContact O-CG1 3.37Å; P313-V394 CarbonylContact C-O 3.35Å; P313-V394 WeakPolarHBondContact CA-O 3.48Å; G314-V394 PolarHBondContact N-O 2.88Å; D315-V394 HydrophobicContact CB-CB 4.43Å; D315-V394 HydrophobicContact CB-CG2 3.98Å; D315-V394 WeakPolarHBondContact O-CG2 3.23Å; D315-V394 PolarHBondContact O-N 2.75Å; L317-V394 HydrophobicContact CD1-CG2 4.04Å; L317-V394 HydrophobicContact CD2-CG2 4.04Å; L317-V394 HydrophobicContact CG-CG2 3.87Å; C328-V394 HydrophobicContact CB-CG1 4.18Å; V394-T397 HydrophobicContact CG1-CG2 3.55Å
395	T	92.1	Very high	85.1	Confident	16 Å²	16	30.9 Å²	30.9	10%	0.098	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	-38	179.9	62	0	0	0	0	112.8	I196 D329 A331 Y363 V393	I196-T395 HydrophobicContact CD1-CG2 4.37Å; D329-T395 PolarHBondContact O-N 3.37Å; D329-T395 PolarHBondContact O-OG1 3.05Å; A331-T395 HydrophobicContact CB-CG2 3.86Å; Y363-T395 HydrophobicContact CD1-CG2 4.45Å; Y363-T395 HydrophobicContact CE1-CG2 3.62Å; V393-T395 PolarHBondContact O-N 3.35Å
396	R	91.1	Very high	85.4	Confident	61 Å²	61	30.1 Å²	30.1	23%	0.23	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	146.1	178.1	-56.7	176.3	172.7	169.3	-5.1	110.8	C328 D329 C400 T401	C328-R396 WeakPolarHBondContact CB-O 3.42Å; D329-R396 HydrophobicContact CB-CB 4.1Å; D329-R396 PolarHBondContact N-O 3.49Å; D329-R396 VanDerWaalsContact N-O 3.08Å; D329-R396 PolarHBondContact O-N 3.48Å; D329-R396 VanDerWaalsContact O-N 3.1Å; R396-C400 HydrophobicContact CB-CB 4.33Å; R396-C400 WeakPolarHBondContact CD-O 3.47Å; R396-T401 HydrophobicContact CB-CG2 4.44Å; R396-T401 WeakPolarHBondContact O-CG2 3.43Å
397	T	92.2	Very high	86.1	Confident	8 Å²	8	26 Å²	26	5%	0.049	16%	0.161	C	C	.	.			trans	-132.5	157.7	-177.9	58.2	0	0	0	0	111.8	N218 L311 P313 C328 V394 F399 C400	N218-T397 HydrophobicContact CB-CG2 4.16Å; N218-T397 WeakPolarHBondContact OD1-CA 3.09Å; N218-T397 WeakPolarHBondContact OD1-CB 3.45Å; L311-T397 HydrophobicContact CB-CG2 4.49Å; P313-T397 HydrophobicContact CG-CG2 4.46Å; C328-T397 HydrophobicContact CB-CG2 4.28Å; V394-T397 HydrophobicContact CG1-CG2 3.55Å; T397-F399 PolarHBondContact O-N 3.01Å; T397-C400 WeakPolarHBondContact O-CB 3.3Å; T397-C400 PolarHBondContact O-N 3.42Å; T397-C400 VanDerWaalsContact O-N 3.1Å
398	G	90.3	Very high	86.6	Confident	4 Å²	4	23.8 Å²	23.8	4%	0.041	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	56.8	-133.7	176.3	0	0	0	0	0	113.4	N218 C400 T401	N218-G398 PolarHBondContact OD1-N 3.25Å; G398-C400 PolarHBondContact O-N 3.25Å; G398-T401 WeakPolarHBondContact O-CB 3.28Å; G398-T401 WeakPolarHBondContact O-CG2 3.39Å; G398-T401 PolarHBondContact O-N 2.96Å; G398-T401 PolarHBondContact O-OG1 3.47Å
399	F	87.2	Confident	86.3	Confident	19 Å²	19	20.3 Å²	20.3	8%	0.083	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-66.6	-11.6	178.1	-81.8	-77.9	0	0	0	114.5	G169 Q170 I220 T397 T401 G404 G405 V407 L411	G169-F399 WeakPolarHBondContact O-CB 3.32Å; G169-F399 WeakPolarHBondContact O-CD2 3.47Å; G169-F399 WeakPolarHBondContact O-CG 3.49Å; Q170-F399 PolarHBondContact NE2-O 2.81Å; I220-F399 HydrophobicContact CG2-CD1 4.12Å; I220-F399 HydrophobicContact CG2-CE1 3.68Å; I220-F399 HydrophobicContact CG2-CE2 4.11Å; I220-F399 HydrophobicContact CG2-CZ 3.67Å; T397-F399 PolarHBondContact O-N 3.01Å; F399-T401 VanDerWaalsContact C-N 3.35Å; F399-G404 WeakPolarHBondContact CD1-O 3.03Å; F399-G404 CarbonylContact O-C 3.58Å; F399-G405 PolarHBondContact O-N 3.03Å; F399-V407 HydrophobicContact CE1-CG1 4.43Å; F399-L411 HydrophobicContact CE1-CD1 4.31Å; F399-L411 HydrophobicContact CZ-CD1 4.31Å
400	C	87.6	Confident	85.8	Confident	30 Å²	30	18.9 Å²	18.9	20%	0.203	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-80.2	-18.1	175.2	-58.7	0	0	0	0	112.5	R396 T397 G398	R396-C400 HydrophobicContact CB-CB 4.33Å; R396-C400 WeakPolarHBondContact CD-O 3.47Å; T397-C400 WeakPolarHBondContact O-CB 3.3Å; T397-C400 PolarHBondContact O-N 3.42Å; T397-C400 VanDerWaalsContact O-N 3.1Å; G398-C400 PolarHBondContact O-N 3.25Å
401	T	88.3	Confident	85	Confident	2 Å²	2	21 Å²	21	1%	0.012	12%	0.122	C	C	.	.	S	Bend	trans	-65.2	160.7	175.5	61.9	0	0	0	0	111.7	D329 C375 R396 G398 F399 K403 G404 G405	D329-T401 HydrophobicContact CB-CG2 4.49Å; D329-T401 WeakPolarHBondContact OD2-CA 3.41Å; C375-T401 HydrophobicContact CB-CG2 3.86Å; R396-T401 HydrophobicContact CB-CG2 4.44Å; R396-T401 WeakPolarHBondContact O-CG2 3.43Å; G398-T401 WeakPolarHBondContact O-CB 3.28Å; G398-T401 WeakPolarHBondContact O-CG2 3.39Å; G398-T401 PolarHBondContact O-N 2.96Å; G398-T401 PolarHBondContact O-OG1 3.47Å; F399-T401 VanDerWaalsContact C-N 3.35Å; T401-K403 VanDerWaalsContact C-N 3.32Å; T401-K403 PolarHBondContact O-N 2.64Å; T401-G404 PolarHBondContact O-N 2.82Å; T401-G404 VanDerWaalsContact O-N 3.15Å; T401-G404 PolarHBondContact OG1-N 2.85Å; T401-G405 PolarHBondContact O-N 3.38Å
402	A	82.4	Confident	84	Confident	28 Å²	28	23.4 Å²	23.4	23%	0.231	13%	0.132	C	C	.	.	H	α-helix	trans	-54.7	-47.6	173.6	0	0	0	0	0	111.6	D329 L344 F374 G404 G405 L406	D329-A402 PolarHBondContact OD2-N 3.45Å; L344-A402 HydrophobicContact CD2-CB 3.68Å; F374-A402 HydrophobicContact CD1-CB 3.86Å; F374-A402 HydrophobicContact CE1-CB 4.37Å; A402-G404 PolarHBondContact O-N 2.99Å; A402-G405 PolarHBondContact O-N 2.85Å; A402-L406 WeakPolarHBondContact O-CG 3.45Å; A402-L406 PolarHBondContact O-N 2.96Å
403	K	83	Confident	82.5	Confident	27 Å²	27	26.7 Å²	26.7	12%	0.117	15%	0.153	C	C	.	.	H	α-helix	trans	-62.2	-42.2	175.8	-178	168.9	179.6	165.3	0	112	I220 L344 C375 T401 G405 L406 V407 E898	I220-K403 HydrophobicContact CD1-CG 4.39Å; L344-K403 HydrophobicContact CD2-CB 4.3Å; C375-K403 HydrophobicContact CB-CB 4.23Å; C375-K403 WeakPolarHBondContact O-CB 3.47Å; C375-K403 WeakPolarHBondContact O-CD 3.41Å; T401-K403 VanDerWaalsContact C-N 3.32Å; T401-K403 PolarHBondContact O-N 2.64Å; K403-G405 PolarHBondContact O-N 3.33Å; K403-L406 WeakPolarHBondContact O-CB 3.17Å; K403-L406 PolarHBondContact O-N 3.3Å; K403-V407 WeakPolarHBondContact O-CG2 3.06Å; K403-V407 PolarHBondContact O-N 3.49Å; K403-E898 IonicContact NZ-OE2 2.81Å
404	G	83.4	Confident	81.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.3	-42.9	175.9	0	0	0	0	0	113.4	F399 T401 A402 L406 V407 S408	F399-G404 WeakPolarHBondContact CD1-O 3.03Å; F399-G404 CarbonylContact O-C 3.58Å; T401-G404 PolarHBondContact O-N 2.82Å; T401-G404 VanDerWaalsContact O-N 3.15Å; T401-G404 PolarHBondContact OG1-N 2.85Å; A402-G404 PolarHBondContact O-N 2.99Å; G404-L406 VanDerWaalsContact C-N 3.35Å; G404-L406 PolarHBondContact O-N 2.99Å; G404-V407 PolarHBondContact O-N 2.94Å; G404-S408 WeakPolarHBondContact O-CB 3.34Å; G404-S408 PolarHBondContact O-N 2.93Å
405	G	78.3	Confident	79.6	Confident	25 Å²	25	33.5 Å²	33.5	26%	0.258	19%	0.187	S	C	.	.	H	α-helix	trans	-61.6	-39.9	174.7	0	0	0	0	0	113.1	F399 T401 A402 K403 S409	F399-G405 PolarHBondContact O-N 3.03Å; T401-G405 PolarHBondContact O-N 3.38Å; A402-G405 PolarHBondContact O-N 2.85Å; K403-G405 PolarHBondContact O-N 3.33Å; G405-S409 PolarHBondContact O-N 3.03Å; G405-S409 PolarHBondContact O-OG 3.01Å
406	L	75.1	Confident	78.2	Confident	39 Å²	39	35.2 Å²	35.2	20%	0.204	20%	0.195	C	C	.	.	H	α-helix	trans	-63.1	-49.3	174.1	-63.8	-178.1	0	0	0	111.4	L344 A402 K403 G404 S408 S409 I410 V902	L344-L406 HydrophobicContact CD2-CD1 4.44Å; A402-L406 WeakPolarHBondContact O-CG 3.45Å; A402-L406 PolarHBondContact O-N 2.96Å; K403-L406 WeakPolarHBondContact O-CB 3.17Å; K403-L406 PolarHBondContact O-N 3.3Å; G404-L406 VanDerWaalsContact C-N 3.35Å; G404-L406 PolarHBondContact O-N 2.99Å; L406-S408 PolarHBondContact O-N 3.19Å; L406-S409 WeakPolarHBondContact O-CB 3.45Å; L406-S409 PolarHBondContact O-N 3.3Å; L406-S409 VanDerWaalsContact O-N 3.17Å; L406-I410 WeakPolarHBondContact O-CG1 3.32Å; L406-I410 PolarHBondContact O-N 3.24Å; L406-I410 VanDerWaalsContact O-N 3.13Å; L406-V902 HydrophobicContact CB-CG2 4.05Å; L406-V902 HydrophobicContact CD1-CG2 4.21Å; L406-V902 HydrophobicContact CD2-CG1 4.48Å; L406-V902 HydrophobicContact CD2-CG2 3.61Å; L406-V902 HydrophobicContact CG-CG2 4.14Å
407	V	79.9	Confident	76.9	Confident	9 Å²	9	36.3 Å²	36.3	6%	0.055	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-44.3	179.4	175.5	0	0	0	0	111.7	I220 V222 V288 F399 K403 G404 S409 I410 L411	I220-V407 HydrophobicContact CG2-CB 4.14Å; I220-V407 HydrophobicContact CG2-CG1 3.88Å; V222-V407 HydrophobicContact CG2-CG1 4.3Å; V288-V407 HydrophobicContact CG1-CG1 4.2Å; V288-V407 HydrophobicContact CG1-CG2 4.07Å; V288-V407 HydrophobicContact CG2-CG1 4.07Å; V288-V407 HydrophobicContact CG2-CG2 3.63Å; F399-V407 HydrophobicContact CE1-CG1 4.43Å; K403-V407 WeakPolarHBondContact O-CG2 3.06Å; K403-V407 PolarHBondContact O-N 3.49Å; G404-V407 PolarHBondContact O-N 2.94Å; V407-S409 PolarHBondContact O-N 2.81Å; V407-I410 PolarHBondContact O-N 3.12Å; V407-L411 HydrophobicContact CG1-CD1 3.98Å; V407-L411 HydrophobicContact CG1-CG 4.28Å; V407-L411 WeakPolarHBondContact O-CG 3.2Å; V407-L411 PolarHBondContact O-N 2.99Å
408	S	79.6	Confident	75.8	Confident	9 Å²	9	36.9 Å²	36.9	6%	0.063	21%	0.207	C	C	.	.	H	α-helix	trans	-54.8	-39	176.2	174.5	0	0	0	0	111.7	Q168 G404 L406 L411 H412	Q168-S408 PolarHBondContact O-OG 3.4Å; G404-S408 WeakPolarHBondContact O-CB 3.34Å; G404-S408 PolarHBondContact O-N 2.93Å; L406-S408 PolarHBondContact O-N 3.19Å; S408-L411 PolarHBondContact O-N 3.23Å; S408-H412 PolarHBondContact O-N 3.01Å; S408-H412 PolarHBondContact O-ND1 3.49Å
409	S	70.2	Confident	75	Confident	29 Å²	29	43.1 Å²	43.1	20%	0.203	23%	0.233	C	C	.	.	H	α-helix	trans	-72.1	-29.7	179.9	-57.4	0	0	0	0	113.9	G405 L406 V407 H412 K886	G405-S409 PolarHBondContact O-N 3.03Å; G405-S409 PolarHBondContact O-OG 3.01Å; L406-S409 WeakPolarHBondContact O-CB 3.45Å; L406-S409 PolarHBondContact O-N 3.3Å; L406-S409 VanDerWaalsContact O-N 3.17Å; V407-S409 PolarHBondContact O-N 2.81Å; S409-H412 CarbonylContact O-C 3.58Å; S409-K886 PolarHBondContact OG-NZ 3.13Å
410	I	73	Confident	74.5	Confident	50 Å²	50	42.2 Å²	42.2	26%	0.256	23%	0.229	S	C	.	.	H	α-helix	trans	-72.1	-40.6	172.4	-66.6	165.9	0	0	0	110.1	L284 L406 V407 V901	L284-I410 HydrophobicContact CD2-CG2 4.36Å; L406-I410 WeakPolarHBondContact O-CG1 3.32Å; L406-I410 PolarHBondContact O-N 3.24Å; L406-I410 VanDerWaalsContact O-N 3.13Å; V407-I410 PolarHBondContact O-N 3.12Å; I410-V901 HydrophobicContact CD1-CG1 3.9Å
411	L	74.1	Confident	73.8	Confident	47 Å²	47	44 Å²	44	25%	0.246	23%	0.232	C	C	.	.	H	α-helix	trans	-70.5	-32.4	178.9	-66.9	174.2	0	0	0	112.9	V222 L284 F399 V407 S408 P413	V222-L411 HydrophobicContact CG1-CD2 3.98Å; V222-L411 HydrophobicContact CG2-CD1 4.38Å; L284-L411 HydrophobicContact CD2-CD2 3.6Å; F399-L411 HydrophobicContact CE1-CD1 4.31Å; F399-L411 HydrophobicContact CZ-CD1 4.31Å; V407-L411 HydrophobicContact CG1-CD1 3.98Å; V407-L411 HydrophobicContact CG1-CG 4.28Å; V407-L411 WeakPolarHBondContact O-CG 3.2Å; V407-L411 PolarHBondContact O-N 2.99Å; S408-L411 PolarHBondContact O-N 3.23Å; L411-P413 VanDerWaalsContact C-CD 3.46Å; L411-P413 WeakPolarHBondContact O-CD 3.44Å
412	H	72.9	Confident	73.2	Confident	86 Å²	86	48.9 Å²	48.9	40%	0.398	25%	0.253	S	S	.	.	S	Bend	trans	-124.6	68.2	-176.8	-50.4	96.5	0	0	0	110.7	Q168 S408 S409	Q168-H412 HydrophobicContact CG-CB 4.22Å; S408-H412 PolarHBondContact O-N 3.01Å; S408-H412 PolarHBondContact O-ND1 3.49Å; S409-H412 CarbonylContact O-C 3.58Å
413	P	63.4	Low	73.1	Confident	68 Å²	68	49.4 Å²	49.4	44%	0.442	25%	0.25	S	S	.	.	P	Polyproline II helix	trans	-66.5	151	-177.7	28.9	-35.2	0	0	0	111.4	L411	L411-P413 VanDerWaalsContact C-CD 3.46Å; L411-P413 WeakPolarHBondContact O-CD 3.44Å
414	R	63.8	Low	73	Confident	82 Å²	82	48.6 Å²	48.6	31%	0.309	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-62.3	137.8	173.6	-67.7	-174.5	-176.6	170.5	1.5	110.8	L28 I416	L28-R414 PolarHBondContact O-NH2 2.68Å; R414-I416 PolarHBondContact O-N 3.12Å
415	P	62.9	Low	72.7	Confident	65 Å²	65	54.9 Å²	54.9	42%	0.422	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-60.9	133.6	178	31.4	-41.6	0	0	0	111.1	N417	P415-N417 PolarHBondContact O-N 3.31Å
416	I	64.6	Low	73	Confident	51 Å²	51	59.2 Å²	59.2	26%	0.262	29%	0.291	S	S	.	.			trans	-84.5	110.2	175.6	-64	170.5	0	0	0	109.5	R414 F418 H496 L498 R499 L502	R414-I416 PolarHBondContact O-N 3.12Å; I416-F418 VanDerWaalsContact C-N 3.33Å; I416-F418 HydrophobicContact CG2-CB 3.98Å; I416-F418 PolarHBondContact O-N 2.91Å; I416-F418 VanDerWaalsContact O-N 3.07Å; I416-H496 VanDerWaalsContact CD1-CE1 3.42Å; I416-H496 WeakPolarHBondContact CD1-CE1 3.31Å; I416-L498 HydrophobicContact CD1-CB 4.05Å; I416-R499 HydrophobicContact CD1-CG 3.54Å; I416-R499 HydrophobicContact CG1-CG 4.47Å; I416-L502 HydrophobicContact CG2-CD1 3.78Å; I416-L502 HydrophobicContact CG2-CD2 4.48Å; I416-L502 HydrophobicContact CG2-CG 4.36Å
417	N	61.9	Low	73.3	Confident	85 Å²	85	58.2 Å²	58.2	46%	0.455	29%	0.285	S	S	.	.			trans	-86.6	68.4	178.1	-161.6	-3.4	0	0	0	112.6	D97 P415	D97-N417 VanDerWaalsContact CG-ND2 3.29Å; D97-N417 PolarHBondContact OD2-ND2 2.84Å; P415-N417 PolarHBondContact O-N 3.31Å
418	F	70.3	Confident	73.4	Confident	20 Å²	20	59.4 Å²	59.4	9%	0.088	29%	0.292	C	S	.	.			trans	-93.3	119.6	-179.4	-168.5	-128.2	0	0	0	112.3	I416 F420 Y421 N501 L502 K505 L926	I416-F418 VanDerWaalsContact C-N 3.33Å; I416-F418 HydrophobicContact CG2-CB 3.98Å; I416-F418 PolarHBondContact O-N 2.91Å; I416-F418 VanDerWaalsContact O-N 3.07Å; F418-F420 HydrophobicContact CD1-CB 3.36Å; F418-F420 HydrophobicContact CD1-CG 4.35Å; F418-F420 HydrophobicContact CE1-CB 3.16Å; F418-F420 AromaticContact CE1-CG 3.93Å; F418-F420 HydrophobicContact CE1-CG 3.93Å; F418-F420 HydrophobicContact CG-CB 4.28Å; F418-F420 HydrophobicContact CZ-CB 3.97Å; F418-F420 PolarHBondContact O-N 3.23Å; F418-F420 VanDerWaalsContact O-N 3.07Å; F418-Y421 HydrophobicContact CB-CD2 4.11Å; F418-Y421 AromaticContact CD1-CD2 3.88Å; F418-Y421 HydrophobicContact CD1-CD2 3.88Å; F418-Y421 AromaticContact CD1-CE2 3.85Å; F418-Y421 HydrophobicContact CD1-CE2 3.85Å; F418-Y421 HydrophobicContact CG-CD2 4.5Å; F418-Y421 PolarHBondContact O-N 3.21Å; F418-N501 HydrophobicContact CE1-CB 4.42Å; F418-L502 HydrophobicContact CB-CD2 4.33Å; F418-L502 HydrophobicContact CD2-CD2 3.53Å; F418-L502 HydrophobicContact CE2-CD2 4.04Å; F418-L502 HydrophobicContact CG-CD2 4.09Å; F418-K505 HydrophobicContact CE2-CG 4.12Å; F418-L926 HydrophobicContact CE1-CD1 3.7Å; F418-L926 HydrophobicContact CZ-CD1 3.65Å; F418-L926 HydrophobicContact CZ-CD2 4.07Å
419	K	72.9	Confident	73.6	Confident	134 Å²	134	61.6 Å²	61.6	58%	0.583	31%	0.311	S	S	*	.	H	α-helix	trans	-52.1	-35	-177	-70.5	-175.3	-179.5	179.2	0	113.6	Y421 K422 H423	K419-Y421 PolarHBondContact O-N 2.96Å; K419-K422 PolarHBondContact O-N 2.83Å; K419-H423 WeakPolarHBondContact O-CB 3.35Å; K419-H423 PolarHBondContact O-CD2 3.16Å; K419-H423 PolarHBondContact O-N 2.94Å
420	F	76.9	Confident	74.3	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-52.5	-53.9	179.4	-175.7	-91.4	0	0	0	112.2	F418 K422 H423 S424 M476 L926 F930 F933 L995	F418-F420 HydrophobicContact CD1-CB 3.36Å; F418-F420 HydrophobicContact CD1-CG 4.35Å; F418-F420 HydrophobicContact CE1-CB 3.16Å; F418-F420 AromaticContact CE1-CG 3.93Å; F418-F420 HydrophobicContact CE1-CG 3.93Å; F418-F420 HydrophobicContact CG-CB 4.28Å; F418-F420 HydrophobicContact CZ-CB 3.97Å; F418-F420 PolarHBondContact O-N 3.23Å; F418-F420 VanDerWaalsContact O-N 3.07Å; F420-K422 PolarHBondContact O-N 3.09Å; F420-H423 PolarHBondContact O-N 3.03Å; F420-S424 PolarHBondContact O-N 3.27Å; F420-M476 HydrophobicContact CD1-CE 4.11Å; F420-M476 HydrophobicContact CE1-CE 3.48Å; F420-M476 VanDerWaalsContact CE1-CE 3.48Å; F420-M476 HydrophobicContact CE1-SD 4.01Å; F420-L926 HydrophobicContact CD2-CD1 4.41Å; F420-F930 AromaticContact CD2-CD2 3.93Å; F420-F930 HydrophobicContact CD2-CD2 3.93Å; F420-F930 HydrophobicContact CD2-CE1 4.23Å; F420-F930 AromaticContact CD2-CE2 3.41Å; F420-F930 HydrophobicContact CD2-CE2 3.41Å; F420-F930 VanDerWaalsContact CD2-CE2 3.41Å; F420-F930 AromaticContact CD2-CZ 3.57Å; F420-F930 HydrophobicContact CD2-CZ 3.57Å; F420-F930 HydrophobicContact CE2-CD1 4.13Å; F420-F930 AromaticContact CE2-CD2 3.55Å; F420-F930 HydrophobicContact CE2-CD2 3.55Å; F420-F930 HydrophobicContact CE2-CE1 4.15Å; F420-F930 AromaticContact CE2-CE2 3.54Å; F420-F930 HydrophobicContact CE2-CE2 3.54Å; F420-F930 AromaticContact CE2-CG 3.84Å; F420-F930 HydrophobicContact CE2-CG 3.84Å; F420-F930 AromaticContact CE2-CZ 3.85Å; F420-F930 HydrophobicContact CE2-CZ 3.85Å; F420-F933 HydrophobicContact CZ-CB 4.33Å; F420-L995 HydrophobicContact CD1-CD1 4.25Å; F420-L995 HydrophobicContact CD2-CD1 3.82Å; F420-L995 HydrophobicContact CD2-CD2 3.9Å; F420-L995 HydrophobicContact CD2-CG 3.57Å; F420-L995 HydrophobicContact CE1-CD1 4.17Å; F420-L995 HydrophobicContact CE2-CD1 3.77Å; F420-L995 HydrophobicContact CE2-CD2 3.36Å; F420-L995 HydrophobicContact CE2-CG 3.56Å; F420-L995 HydrophobicContact CG-CD1 4.06Å; F420-L995 HydrophobicContact CG-CG 4.25Å; F420-L995 HydrophobicContact CZ-CD1 3.94Å; F420-L995 HydrophobicContact CZ-CD2 3.96Å; F420-L995 HydrophobicContact CZ-CG 4.21Å; F420-L995 VanDerWaalsContact O-CD1 3.31Å; F420-L995 WeakPolarHBondContact O-CD1 3.35Å
421	Y	72.1	Confident	74.8	Confident	69 Å²	69	60.9 Å²	60.9	27%	0.271	31%	0.313	S	S	.	.	H	α-helix	trans	-64.7	-42.1	-178.2	-66.3	-77.9	0	0	0	112.1	F418 K419 H423 S424 M425 M476 L498	F418-Y421 HydrophobicContact CB-CD2 4.11Å; F418-Y421 AromaticContact CD1-CD2 3.88Å; F418-Y421 HydrophobicContact CD1-CD2 3.88Å; F418-Y421 AromaticContact CD1-CE2 3.85Å; F418-Y421 HydrophobicContact CD1-CE2 3.85Å; F418-Y421 HydrophobicContact CG-CD2 4.5Å; F418-Y421 PolarHBondContact O-N 3.21Å; K419-Y421 PolarHBondContact O-N 2.96Å; Y421-H423 VanDerWaalsContact C-N 3.32Å; Y421-H423 PolarHBondContact O-N 2.85Å; Y421-S424 WeakPolarHBondContact O-CB 3.36Å; Y421-S424 PolarHBondContact O-N 3.48Å; Y421-S424 VanDerWaalsContact O-N 3.15Å; Y421-M425 PolarHBondContact O-N 3.33Å; Y421-M425 VanDerWaalsContact O-N 3.1Å; Y421-M476 HydrophobicContact CD1-CE 3.62Å; Y421-M476 HydrophobicContact CE1-CE 3.23Å; Y421-L498 HydrophobicContact CE1-CD2 4.24Å; Y421-L498 HydrophobicContact CE2-CD2 3.98Å; Y421-L498 VanDerWaalsContact CZ-CD2 3.48Å; Y421-L498 WeakPolarHBondContact OH-CD2 3.15Å
422	K	76.1	Confident	75.2	Confident	103 Å²	103	61.4 Å²	61.4	45%	0.448	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-40.3	175.6	-169.2	172	-171.9	165.2	0	112.1	D97 K419 F420 K426	D97-K422 IonicContact OD1-NZ 3.98Å; D97-K422 IonicContact OD2-NZ 3.28Å; K419-K422 PolarHBondContact O-N 2.83Å; F420-K422 PolarHBondContact O-N 3.09Å; K422-K426 WeakPolarHBondContact O-CG 3.46Å; K422-K426 PolarHBondContact O-N 3.18Å
423	H	81.7	Confident	75.9	Confident	39 Å²	39	61.5 Å²	61.5	18%	0.181	33%	0.327	C	S	.	.	H	α-helix	trans	-72.5	-32.1	175.2	-74.6	-71.1	0	0	0	112.7	K419 F420 Y421 M425 K426 F427 L995 L996	K419-H423 WeakPolarHBondContact O-CB 3.35Å; K419-H423 PolarHBondContact O-CD2 3.16Å; K419-H423 PolarHBondContact O-N 2.94Å; F420-H423 PolarHBondContact O-N 3.03Å; Y421-H423 VanDerWaalsContact C-N 3.32Å; Y421-H423 PolarHBondContact O-N 2.85Å; H423-M425 VanDerWaalsContact C-N 3.35Å; H423-K426 PolarHBondContact O-N 3.2Å; H423-F427 WeakPolarHBondContact O-CB 2.91Å; H423-F427 PolarHBondContact O-N 3.35Å; H423-L995 HydrophobicContact CB-CB 3.89Å; H423-L995 HydrophobicContact CB-CD1 4.47Å; H423-L996 HydrophobicContact CB-CD1 4.33Å; H423-L996 HydrophobicContact CB-CG 4.29Å; H423-L996 WeakPolarHBondContact ND1-CD1 3.1Å
424	S	79.4	Confident	77.1	Confident	10 Å²	10	61.6 Å²	61.6	7%	0.07	32%	0.323	C	S	.	.	H	α-helix	trans	-58.9	-47.1	173.8	-173	0	0	0	0	110.6	F420 Y421 K426 F427 V428 F933	F420-S424 PolarHBondContact O-N 3.27Å; Y421-S424 WeakPolarHBondContact O-CB 3.36Å; Y421-S424 PolarHBondContact O-N 3.48Å; Y421-S424 VanDerWaalsContact O-N 3.15Å; S424-K426 PolarHBondContact O-N 3.31Å; S424-F427 WeakPolarHBondContact O-CB 3.49Å; S424-F427 PolarHBondContact O-N 2.77Å; S424-F427 VanDerWaalsContact O-N 3.11Å; S424-V428 WeakPolarHBondContact O-CG2 3.43Å; S424-V428 PolarHBondContact O-N 3.28Å; S424-F933 WeakPolarHBondContact OG-CE2 3.47Å
425	M	78	Confident	78.2	Confident	132 Å²	132	57.8 Å²	57.8	65%	0.65	31%	0.309	S	S	*	.	H	α-helix	trans	-62.9	-39.6	176.3	-65.6	-54.8	-63.7	0	0	112.8	Y421 H423 F427 V428 A429	Y421-M425 PolarHBondContact O-N 3.33Å; Y421-M425 VanDerWaalsContact O-N 3.1Å; H423-M425 VanDerWaalsContact C-N 3.35Å; M425-F427 VanDerWaalsContact C-N 3.28Å; M425-F427 PolarHBondContact O-N 2.93Å; M425-V428 PolarHBondContact O-N 3.36Å; M425-A429 PolarHBondContact O-N 3.24Å
426	K	83.7	Confident	79.5	Confident	117 Å²	117	59.8 Å²	59.8	51%	0.509	32%	0.316	S	S	.	.	H	α-helix	trans	-64.3	-33.9	173.9	-70.3	-179.8	179.1	-169.4	0	112.6	K422 H423 S424 A429 A430 L996	K422-K426 WeakPolarHBondContact O-CG 3.46Å; K422-K426 PolarHBondContact O-N 3.18Å; H423-K426 PolarHBondContact O-N 3.2Å; S424-K426 PolarHBondContact O-N 3.31Å; K426-A429 PolarHBondContact O-N 3.47Å; K426-A430 PolarHBondContact O-N 2.78Å; K426-L996 HydrophobicContact CB-CD1 3.87Å; K426-L996 HydrophobicContact CD-CD1 4.25Å
427	F	82.6	Confident	80.8	Confident	18 Å²	18	62.3 Å²	62.3	8%	0.079	33%	0.329	C	S	.	.	H	α-helix	trans	-70.8	-43.5	176.5	-179.4	-96	0	0	0	111.6	H423 S424 M425 A429 A430 L431 F933 A937 L996 L1004	H423-F427 WeakPolarHBondContact O-CB 2.91Å; H423-F427 PolarHBondContact O-N 3.35Å; S424-F427 WeakPolarHBondContact O-CB 3.49Å; S424-F427 PolarHBondContact O-N 2.77Å; S424-F427 VanDerWaalsContact O-N 3.11Å; M425-F427 VanDerWaalsContact C-N 3.28Å; M425-F427 PolarHBondContact O-N 2.93Å; F427-A429 PolarHBondContact O-N 3.31Å; F427-A430 WeakPolarHBondContact O-CA 3.42Å; F427-A430 WeakPolarHBondContact O-CB 3.44Å; F427-A430 PolarHBondContact O-N 3.17Å; F427-L431 HydrophobicContact CD1-CD1 4Å; F427-L431 HydrophobicContact CD1-CG 4.12Å; F427-L431 HydrophobicContact CE1-CD1 3.56Å; F427-L431 HydrophobicContact CE1-CD2 4.07Å; F427-L431 HydrophobicContact CE1-CG 3.76Å; F427-L431 HydrophobicContact CZ-CD1 4.34Å; F427-L431 HydrophobicContact CZ-CD2 4.02Å; F427-L431 HydrophobicContact CZ-CG 4.16Å; F427-L431 PolarHBondContact O-N 2.7Å; F427-F933 HydrophobicContact CB-CZ 3.85Å; F427-F933 AromaticContact CD1-CE1 3.95Å; F427-F933 HydrophobicContact CD1-CE1 3.95Å; F427-F933 HydrophobicContact CD1-CE2 4.1Å; F427-F933 AromaticContact CD1-CZ 3.26Å; F427-F933 HydrophobicContact CD1-CZ 3.26Å; F427-F933 HydrophobicContact CD2-CZ 4.34Å; F427-F933 HydrophobicContact CE1-CE1 4.1Å; F427-F933 AromaticContact CE1-CZ 3.8Å; F427-F933 HydrophobicContact CE1-CZ 3.8Å; F427-F933 HydrophobicContact CG-CE1 4.15Å; F427-F933 AromaticContact CG-CZ 3.56Å; F427-F933 HydrophobicContact CG-CZ 3.56Å; F427-F933 HydrophobicContact CZ-CE1 4.48Å; F427-A937 HydrophobicContact CE1-CB 3.61Å; F427-A937 HydrophobicContact CZ-CB 3.65Å; F427-L996 HydrophobicContact CD2-CD2 4.33Å; F427-L1004 HydrophobicContact CE2-CD1 3.94Å; F427-L1004 HydrophobicContact CZ-CD1 4.07Å
428	V	81.5	Confident	82.1	Confident	33 Å²	33	58.5 Å²	58.5	20%	0.2	31%	0.31	C	S	.	.	H	α-helix	trans	-55.7	-43.4	171.7	174.2	0	0	0	0	110.4	S424 M425 A430 L431 S432 V468 L472	S424-V428 WeakPolarHBondContact O-CG2 3.43Å; S424-V428 PolarHBondContact O-N 3.28Å; M425-V428 PolarHBondContact O-N 3.36Å; V428-A430 VanDerWaalsContact C-N 3.31Å; V428-A430 PolarHBondContact O-N 2.87Å; V428-L431 WeakPolarHBondContact O-CB 3.35Å; V428-L431 PolarHBondContact O-N 2.99Å; V428-L431 VanDerWaalsContact O-N 3.17Å; V428-S432 PolarHBondContact O-N 2.96Å; V428-S432 PolarHBondContact O-OG 3.44Å; V428-V468 HydrophobicContact CG1-CG1 4.43Å; V428-L472 HydrophobicContact CG2-CD2 4.07Å
429	A	82.9	Confident	83.1	Confident	56 Å²	56	58.3 Å²	58.3	46%	0.463	31%	0.31	S	S	.	.	H	α-helix	trans	-62.4	-34.8	174.5	0	0	0	0	0	113.4	M425 K426 F427 S432 V433	M425-A429 PolarHBondContact O-N 3.24Å; K426-A429 PolarHBondContact O-N 3.47Å; F427-A429 PolarHBondContact O-N 3.31Å; A429-S432 WeakPolarHBondContact O-CB 3.37Å; A429-S432 PolarHBondContact O-N 3.29Å; A429-V433 PolarHBondContact O-N 3.44Å
430	A	84.8	Confident	84	Confident	53 Å²	53	56.6 Å²	56.6	44%	0.438	31%	0.307	S	S	.	.	H	α-helix	trans	-68.8	-37.3	174.1	0	0	0	0	0	112.1	K426 F427 V428 S432 V433 L434	K426-A430 PolarHBondContact O-N 2.78Å; F427-A430 WeakPolarHBondContact O-CA 3.42Å; F427-A430 WeakPolarHBondContact O-CB 3.44Å; F427-A430 PolarHBondContact O-N 3.17Å; V428-A430 VanDerWaalsContact C-N 3.31Å; V428-A430 PolarHBondContact O-N 2.87Å; A430-S432 VanDerWaalsContact C-N 3.3Å; A430-S432 PolarHBondContact O-N 2.95Å; A430-V433 WeakPolarHBondContact O-CB 3.43Å; A430-V433 PolarHBondContact O-N 3.49Å; A430-L434 PolarHBondContact O-N 3.28Å
431	L	84.7	Confident	84.7	Confident	10 Å²	10	61.3 Å²	61.3	5%	0.052	33%	0.325	C	S	.	.	H	α-helix	trans	-62.2	-37.3	171.7	-69.1	-178.8	0	0	0	111.6	F427 V428 V433 L434 A435 V467 L941	F427-L431 HydrophobicContact CD1-CD1 4Å; F427-L431 HydrophobicContact CD1-CG 4.12Å; F427-L431 HydrophobicContact CE1-CD1 3.56Å; F427-L431 HydrophobicContact CE1-CD2 4.07Å; F427-L431 HydrophobicContact CE1-CG 3.76Å; F427-L431 HydrophobicContact CZ-CD1 4.34Å; F427-L431 HydrophobicContact CZ-CD2 4.02Å; F427-L431 HydrophobicContact CZ-CG 4.16Å; F427-L431 PolarHBondContact O-N 2.7Å; V428-L431 WeakPolarHBondContact O-CB 3.35Å; V428-L431 PolarHBondContact O-N 2.99Å; V428-L431 VanDerWaalsContact O-N 3.17Å; L431-V433 VanDerWaalsContact C-N 3.25Å; L431-V433 PolarHBondContact O-N 3.14Å; L431-L434 WeakPolarHBondContact O-CB 3.27Å; L431-L434 PolarHBondContact O-N 2.82Å; L431-L434 VanDerWaalsContact O-N 3.08Å; L431-A435 PolarHBondContact O-N 3.47Å; L431-V467 HydrophobicContact CB-CG1 3.84Å; L431-V467 WeakPolarHBondContact O-CG1 3.28Å; L431-L941 HydrophobicContact CD2-CD1 4.41Å; L431-L941 HydrophobicContact CD2-CD2 3.91Å; L431-L941 HydrophobicContact CD2-CG 4.31Å
432	S	82.9	Confident	85.4	Confident	58 Å²	58	58.1 Å²	58.1	41%	0.406	31%	0.313	S	S	.	.	H	α-helix	trans	-60.8	-32.3	174.6	-51.9	0	0	0	0	113.2	V428 A429 A430 L436	V428-S432 PolarHBondContact O-N 2.96Å; V428-S432 PolarHBondContact O-OG 3.44Å; A429-S432 WeakPolarHBondContact O-CB 3.37Å; A429-S432 PolarHBondContact O-N 3.29Å; A430-S432 VanDerWaalsContact C-N 3.3Å; A430-S432 PolarHBondContact O-N 2.95Å; S432-L436 WeakPolarHBondContact O-CB 3.4Å; S432-L436 PolarHBondContact O-N 2.84Å
433	V	87.9	Confident	86.1	Confident	89 Å²	89	56.6 Å²	56.6	54%	0.539	31%	0.309	S	S	.	.	H	α-helix	trans	-67.5	-42	173.6	178.1	0	0	0	0	110.7	A429 A430 L431 L436 L437	A429-V433 PolarHBondContact O-N 3.44Å; A430-V433 WeakPolarHBondContact O-CB 3.43Å; A430-V433 PolarHBondContact O-N 3.49Å; L431-V433 VanDerWaalsContact C-N 3.25Å; L431-V433 PolarHBondContact O-N 3.14Å; V433-L436 WeakPolarHBondContact O-CB 3.48Å; V433-L436 PolarHBondContact O-N 3Å; V433-L437 WeakPolarHBondContact O-CG 3.49Å; V433-L437 PolarHBondContact O-N 2.91Å; V433-L437 VanDerWaalsContact O-N 3.09Å
434	L	87.4	Confident	86.4	Confident	69 Å²	69	60.7 Å²	60.7	36%	0.361	33%	0.326	S	S	.	.	H	α-helix	trans	-66.1	-41	175.9	-174.6	67.6	0	0	0	111.7	A430 L431 L436 L437 G438 L941 F944	A430-L434 PolarHBondContact O-N 3.28Å; L431-L434 WeakPolarHBondContact O-CB 3.27Å; L431-L434 PolarHBondContact O-N 2.82Å; L431-L434 VanDerWaalsContact O-N 3.08Å; L434-L436 VanDerWaalsContact C-N 3.31Å; L434-L436 PolarHBondContact O-N 3.42Å; L434-L437 PolarHBondContact O-N 3.34Å; L434-G438 PolarHBondContact O-N 3.22Å; L434-L941 HydrophobicContact CD2-CD2 3.3Å; L434-F944 HydrophobicContact CD2-CE1 4.35Å; L434-F944 HydrophobicContact CG-CE1 4.19Å; L434-F944 HydrophobicContact CG-CZ 4.47Å
435	A	88.1	Confident	86.8	Confident	2 Å²	2	61.3 Å²	61.3	2%	0.017	33%	0.329	C	S	.	.	H	α-helix	trans	-56.6	-46.8	173.4	0	0	0	0	0	110.7	L431 L437 G438 T439 V467	L431-A435 PolarHBondContact O-N 3.47Å; A435-L437 PolarHBondContact O-N 3.5Å; A435-G438 PolarHBondContact O-N 3.08Å; A435-T439 WeakPolarHBondContact O-CB 3.26Å; A435-T439 PolarHBondContact O-N 2.81Å; A435-T439 PolarHBondContact O-OG1 3.21Å; A435-V467 HydrophobicContact CB-CB 3.87Å; A435-V467 HydrophobicContact CB-CG1 3.86Å; A435-V467 HydrophobicContact CB-CG2 3.92Å
436	L	90.1	Very high	87	Confident	107 Å²	107	55.2 Å²	55.2	56%	0.56	30%	0.299	S	S	*	.	H	α-helix	trans	-58.9	-45.3	177.4	-177.8	66.7	0	0	0	112.2	S432 V433 L434 T439 I440	S432-L436 WeakPolarHBondContact O-CB 3.4Å; S432-L436 PolarHBondContact O-N 2.84Å; V433-L436 WeakPolarHBondContact O-CB 3.48Å; V433-L436 PolarHBondContact O-N 3Å; L434-L436 VanDerWaalsContact C-N 3.31Å; L434-L436 PolarHBondContact O-N 3.42Å; L436-T439 PolarHBondContact O-N 3.11Å; L436-I440 HydrophobicContact CD1-CD1 4.38Å; L436-I440 HydrophobicContact CG-CD1 4.07Å; L436-I440 VanDerWaalsContact O-CG1 3.26Å; L436-I440 WeakPolarHBondContact O-CG1 3.32Å; L436-I440 PolarHBondContact O-N 3.43Å
437	L	91.2	Very high	87.1	Confident	105 Å²	105	57.6 Å²	57.6	55%	0.55	31%	0.306	S	S	.	.	H	α-helix	trans	-61.7	-43.4	176.4	-68.4	172.5	0	0	0	111.8	V433 L434 A435 I440 Y441	V433-L437 WeakPolarHBondContact O-CG 3.49Å; V433-L437 PolarHBondContact O-N 2.91Å; V433-L437 VanDerWaalsContact O-N 3.09Å; L434-L437 PolarHBondContact O-N 3.34Å; A435-L437 PolarHBondContact O-N 3.5Å; L437-I440 PolarHBondContact O-N 3.15Å; L437-Y441 PolarHBondContact O-N 2.57Å
438	G	89.4	Confident	87.3	Confident	5 Å²	5	65.5 Å²	65.5	5%	0.052	34%	0.335	C	S	.	.	H	α-helix	trans	-61.9	-42.6	174.5	0	0	0	0	0	113	L434 A435 Y441 S442 L463	L434-G438 PolarHBondContact O-N 3.22Å; A435-G438 PolarHBondContact O-N 3.08Å; G438-Y441 PolarHBondContact O-N 2.78Å; G438-S442 WeakPolarHBondContact O-CB 3.27Å; G438-S442 PolarHBondContact O-N 3.12Å; G438-L463 WeakPolarHBondContact O-CD2 3.34Å
439	T	90.3	Very high	87.1	Confident	15 Å²	15	66.3 Å²	66.3	9%	0.092	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-42.6	178.3	-62.9	0	0	0	0	110.8	A435 L436 Y441 S442 I443 A460	A435-T439 WeakPolarHBondContact O-CB 3.26Å; A435-T439 PolarHBondContact O-N 2.81Å; A435-T439 PolarHBondContact O-OG1 3.21Å; L436-T439 PolarHBondContact O-N 3.11Å; T439-Y441 PolarHBondContact O-N 3.21Å; T439-S442 PolarHBondContact O-N 3.08Å; T439-I443 HydrophobicContact CG2-CD1 3.77Å; T439-I443 HydrophobicContact CG2-CG1 4.33Å; T439-I443 WeakPolarHBondContact O-CB 3.44Å; T439-I443 VanDerWaalsContact O-CG1 3.22Å; T439-I443 WeakPolarHBondContact O-CG1 3.42Å; T439-I443 PolarHBondContact O-N 2.76Å; T439-A460 HydrophobicContact CG2-CB 3.62Å; T439-A460 PolarHBondContact OG1-O 2.84Å
440	I	92	Very high	87.1	Confident	99 Å²	99	74.8 Å²	74.8	51%	0.508	36%	0.358	S	S	.	.	H	α-helix	trans	-60.4	-46.1	174.5	-68.8	164.6	0	0	0	110.6	L436 L437 I443 F444	L436-I440 HydrophobicContact CD1-CD1 4.38Å; L436-I440 HydrophobicContact CG-CD1 4.07Å; L436-I440 VanDerWaalsContact O-CG1 3.26Å; L436-I440 WeakPolarHBondContact O-CG1 3.32Å; L436-I440 PolarHBondContact O-N 3.43Å; L437-I440 PolarHBondContact O-N 3.15Å; I440-I443 PolarHBondContact O-N 2.76Å; I440-F444 WeakPolarHBondContact O-CB 3.43Å; I440-F444 PolarHBondContact O-N 2.78Å
441	Y	91.1	Very high	86.9	Confident	99 Å²	99	73.6 Å²	73.6	39%	0.388	34%	0.344	S	S	.	.	H	α-helix	trans	-60.7	-46.6	176.4	173.2	-92.1	0	0	0	112	L437 G438 T439 F444 I445 L948 T952	L437-Y441 PolarHBondContact O-N 2.57Å; G438-Y441 PolarHBondContact O-N 2.78Å; T439-Y441 PolarHBondContact O-N 3.21Å; Y441-F444 PolarHBondContact O-N 2.98Å; Y441-I445 HydrophobicContact CD1-CG1 4.36Å; Y441-I445 HydrophobicContact CD2-CG1 4.5Å; Y441-I445 HydrophobicContact CE1-CG1 3.93Å; Y441-I445 HydrophobicContact CE2-CD1 4.42Å; Y441-I445 HydrophobicContact CE2-CG1 4.05Å; Y441-I445 WeakPolarHBondContact O-CG1 3.38Å; Y441-I445 PolarHBondContact O-N 2.74Å; Y441-L948 HydrophobicContact CD1-CD1 3.48Å; Y441-L948 VanDerWaalsContact CD1-CD1 3.48Å; Y441-L948 HydrophobicContact CD1-CD2 4.45Å; Y441-L948 HydrophobicContact CD1-CG 4.09Å; Y441-L948 HydrophobicContact CE1-CD1 3.88Å; Y441-L948 HydrophobicContact CE1-CG 4.06Å; Y441-T952 PolarHBondContact OH-OG1 2.67Å
442	S	87.6	Confident	86.9	Confident	1 Å²	1	76 Å²	76	1%	0.007	36%	0.36	C	S	.	.	H	α-helix	trans	-60.7	-48.8	178.5	-177.6	0	0	0	0	111.2	G438 T439 F444 I445 L446 Y951	G438-S442 WeakPolarHBondContact O-CB 3.27Å; G438-S442 PolarHBondContact O-N 3.12Å; T439-S442 PolarHBondContact O-N 3.08Å; S442-F444 VanDerWaalsContact C-N 3.29Å; S442-F444 PolarHBondContact O-N 3.29Å; S442-I445 PolarHBondContact O-N 2.98Å; S442-I445 VanDerWaalsContact O-N 3.16Å; S442-L446 WeakPolarHBondContact O-CB 3.33Å; S442-L446 WeakPolarHBondContact O-CG 3.36Å; S442-L446 PolarHBondContact O-N 3.42Å; S442-L446 WeakPolarHBondContact OG-CD1 3.38Å; S442-Y951 WeakPolarHBondContact OG-CD2 3.22Å
443	I	90.3	Very high	87	Confident	71 Å²	71	79.6 Å²	79.6	36%	0.364	38%	0.375	S	S	.	.	H	α-helix	trans	-56.3	-44.9	176.6	-70.1	166.8	0	0	0	110.8	T439 I440 I445 Y447 I456 A460	T439-I443 HydrophobicContact CG2-CD1 3.77Å; T439-I443 HydrophobicContact CG2-CG1 4.33Å; T439-I443 WeakPolarHBondContact O-CB 3.44Å; T439-I443 VanDerWaalsContact O-CG1 3.22Å; T439-I443 WeakPolarHBondContact O-CG1 3.42Å; T439-I443 PolarHBondContact O-N 2.76Å; I440-I443 PolarHBondContact O-N 2.76Å; I443-I445 PolarHBondContact O-N 3.18Å; I443-Y447 WeakPolarHBondContact O-CB 3.41Å; I443-Y447 PolarHBondContact O-N 3.48Å; I443-I456 HydrophobicContact CB-CG2 4.46Å; I443-I456 HydrophobicContact CG1-CG2 4.11Å; I443-I456 HydrophobicContact CG2-CG2 4.25Å; I443-A460 HydrophobicContact CD1-CB 4.02Å; I443-A460 HydrophobicContact CG1-CB 3.89Å
444	F	89.6	Confident	86.9	Confident	125 Å²	125	80.1 Å²	80.1	55%	0.548	37%	0.374	S	S	.	.	H	α-helix	trans	-61.3	-45.1	178.5	175.7	-99.3	0	0	0	112.4	I440 Y441 S442 R448	I440-F444 WeakPolarHBondContact O-CB 3.43Å; I440-F444 PolarHBondContact O-N 2.78Å; Y441-F444 PolarHBondContact O-N 2.98Å; S442-F444 VanDerWaalsContact C-N 3.29Å; S442-F444 PolarHBondContact O-N 3.29Å; F444-R448 WeakPolarHBondContact O-CB 3.48Å; F444-R448 PolarHBondContact O-N 3.38Å
445	I	86.1	Confident	86.6	Confident	23 Å²	23	79.5 Å²	79.5	12%	0.118	37%	0.37	C	S	.	.	H	α-helix	trans	-69.8	-45.2	179.3	-68.7	-66	0	0	0	111.9	Y441 S442 I443 Y447 R448 N449	Y441-I445 HydrophobicContact CD1-CG1 4.36Å; Y441-I445 HydrophobicContact CD2-CG1 4.5Å; Y441-I445 HydrophobicContact CE1-CG1 3.93Å; Y441-I445 HydrophobicContact CE2-CD1 4.42Å; Y441-I445 HydrophobicContact CE2-CG1 4.05Å; Y441-I445 WeakPolarHBondContact O-CG1 3.38Å; Y441-I445 PolarHBondContact O-N 2.74Å; S442-I445 PolarHBondContact O-N 2.98Å; S442-I445 VanDerWaalsContact O-N 3.16Å; I443-I445 PolarHBondContact O-N 3.18Å; I445-Y447 VanDerWaalsContact C-N 3.31Å; I445-Y447 PolarHBondContact O-N 3.39Å; I445-R448 WeakPolarHBondContact O-CB 3.48Å; I445-R448 PolarHBondContact O-N 2.86Å; I445-R448 VanDerWaalsContact O-N 3.15Å; I445-N449 WeakPolarHBondContact O-CB 3.48Å; I445-N449 VanDerWaalsContact O-CG 3.29Å; I445-N449 PolarHBondContact O-N 3.03Å; I445-N449 PolarHBondContact O-ND2 2.97Å
446	L	83.3	Confident	86.6	Confident	4 Å²	4	80 Å²	80	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-65.5	-36.8	179.8	-63.2	172.6	0	0	0	111.3	S442 N449 R450 L451 I456 R459	S442-L446 WeakPolarHBondContact O-CB 3.33Å; S442-L446 WeakPolarHBondContact O-CG 3.36Å; S442-L446 PolarHBondContact O-N 3.42Å; S442-L446 WeakPolarHBondContact OG-CD1 3.38Å; L446-N449 PolarHBondContact O-N 3.09Å; L446-R450 PolarHBondContact O-N 2.84Å; L446-L451 HydrophobicContact CB-CD1 3.96Å; L446-L451 HydrophobicContact CD2-CD1 3.35Å; L446-L451 HydrophobicContact CG-CD1 4.21Å; L446-L451 PolarHBondContact O-N 3.28Å; L446-I456 HydrophobicContact CB-CG1 3.96Å; L446-R459 HydrophobicContact CD1-CB 3.91Å
447	Y	86.5	Confident	86.5	Confident	168 Å²	168	79 Å²	79	66%	0.659	37%	0.37	S	S	*	.	H	α-helix	trans	-63	-44.8	170.9	-179.9	-100.8	0	0	0	111.7	I443 I445 N449 R450	I443-Y447 WeakPolarHBondContact O-CB 3.41Å; I443-Y447 PolarHBondContact O-N 3.48Å; I445-Y447 VanDerWaalsContact C-N 3.31Å; I445-Y447 PolarHBondContact O-N 3.39Å; Y447-N449 PolarHBondContact O-N 3.33Å; Y447-R450 PolarHBondContact O-N 2.78Å
448	R	85.2	Confident	86.2	Confident	183 Å²	183	76.1 Å²	76.1	69%	0.691	35%	0.354	S	S	*	.	H	α-helix	trans	-60.2	-34.5	175	-179.2	177.2	178.7	160.6	1	112.3	F444 I445 R450	F444-R448 WeakPolarHBondContact O-CB 3.48Å; F444-R448 PolarHBondContact O-N 3.38Å; I445-R448 WeakPolarHBondContact O-CB 3.48Å; I445-R448 PolarHBondContact O-N 2.86Å; I445-R448 VanDerWaalsContact O-N 3.15Å; R448-R450 PolarHBondContact O-N 3.24Å
449	N	77.7	Confident	85.9	Confident	50 Å²	50	76.5 Å²	76.5	27%	0.267	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	1.6	177.4	-68.1	-17.1	0	0	0	113.7	I445 L446 Y447 L451	I445-N449 WeakPolarHBondContact O-CB 3.48Å; I445-N449 VanDerWaalsContact O-CG 3.29Å; I445-N449 PolarHBondContact O-N 3.03Å; I445-N449 PolarHBondContact O-ND2 2.97Å; L446-N449 PolarHBondContact O-N 3.09Å; Y447-N449 PolarHBondContact O-N 3.33Å; N449-L451 HydrophobicContact CB-CD1 4.49Å; N449-L451 PolarHBondContact O-N 3.17Å
450	R	82.6	Confident	85.8	Confident	234 Å²	234	76.2 Å²	76.2	88%	0.883	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	37.4	177.1	-56.7	-171	178.4	-179.3	-0.1	114.6	L446 Y447 R448	L446-R450 PolarHBondContact O-N 2.84Å; Y447-R450 PolarHBondContact O-N 2.78Å; R448-R450 PolarHBondContact O-N 3.24Å
451	L	80.5	Confident	85.6	Confident	29 Å²	29	75 Å²	75	15%	0.152	35%	0.348	C	S	.	.			trans	-76.5	155.6	173.8	-71.7	164.5	0	0	0	112.1	L446 N449 I456 N954	L446-L451 HydrophobicContact CB-CD1 3.96Å; L446-L451 HydrophobicContact CD2-CD1 3.35Å; L446-L451 HydrophobicContact CG-CD1 4.21Å; L446-L451 PolarHBondContact O-N 3.28Å; N449-L451 HydrophobicContact CB-CD1 4.49Å; N449-L451 PolarHBondContact O-N 3.17Å; L451-I456 HydrophobicContact CB-CD1 4.47Å; L451-I456 HydrophobicContact CB-CG1 4.18Å; L451-I456 WeakPolarHBondContact O-CD1 3.3Å; L451-N954 WeakPolarHBondContact CD1-OD1 3.45Å
452	P	85.8	Confident	85.4	Confident	59 Å²	59	70.4 Å²	70.4	38%	0.383	33%	0.33	S	S	.	.			trans	-71	150.5	179.6	33.1	-37.3	0	0	0	111.6	N454 E455 I456	P452-N454 VanDerWaalsContact C-N 3.29Å; P452-N454 VanDerWaalsContact CB-OD1 3.22Å; P452-N454 WeakPolarHBondContact CB-OD1 3.39Å; P452-N454 WeakPolarHBondContact CG-OD1 3.48Å; P452-N454 PolarHBondContact O-N 3.44Å; P452-E455 HydrophobicContact CG-CB 4.08Å; P452-E455 HydrophobicContact CG-CG 3.8Å; P452-E455 WeakPolarHBondContact CG-OE1 3.2Å; P452-E455 PolarHBondContact O-N 3.24Å; P452-E455 VanDerWaalsContact O-N 3.16Å; P452-I456 WeakPolarHBondContact O-CG1 3.36Å; P452-I456 PolarHBondContact O-N 2.7Å; P452-I456 VanDerWaalsContact O-N 3.16Å
453	L	85.6	Confident	85.4	Confident	135 Å²	135	70.3 Å²	70.3	71%	0.707	33%	0.329	S	S	*	.	H	α-helix	trans	-61.5	-34	-171	-68.4	175.3	0	0	0	113.6	I456 V457	L453-I456 HydrophobicContact CD2-CD1 4.49Å; L453-I456 PolarHBondContact O-N 2.83Å; L453-V457 VanDerWaalsContact O-CG2 3.31Å; L453-V457 WeakPolarHBondContact O-CG2 3.34Å; L453-V457 PolarHBondContact O-N 3.17Å
454	N	84.3	Confident	85.3	Confident	100 Å²	100	69.4 Å²	69.4	54%	0.535	33%	0.327	S	S	.	.	H	α-helix	trans	-61.1	-45.8	176.2	60	-33.2	0	0	0	111.7	P452 V457 I458	P452-N454 VanDerWaalsContact C-N 3.29Å; P452-N454 VanDerWaalsContact CB-OD1 3.22Å; P452-N454 WeakPolarHBondContact CB-OD1 3.39Å; P452-N454 WeakPolarHBondContact CG-OD1 3.48Å; P452-N454 PolarHBondContact O-N 3.44Å; N454-V457 PolarHBondContact O-N 3.39Å; N454-I458 WeakPolarHBondContact O-CG1 3.43Å; N454-I458 PolarHBondContact O-N 3.08Å
455	E	81.4	Confident	85.2	Confident	56 Å²	56	63.7 Å²	63.7	26%	0.262	30%	0.302	S	S	.	.	H	α-helix	trans	-67	-40.4	178	-71.4	179.5	-150.8	0	0	111.6	P452 V457 I458 R459	P452-E455 HydrophobicContact CG-CB 4.08Å; P452-E455 HydrophobicContact CG-CG 3.8Å; P452-E455 WeakPolarHBondContact CG-OE1 3.2Å; P452-E455 PolarHBondContact O-N 3.24Å; P452-E455 VanDerWaalsContact O-N 3.16Å; E455-V457 VanDerWaalsContact C-N 3.3Å; E455-V457 PolarHBondContact O-N 3.21Å; E455-I458 PolarHBondContact O-N 3.23Å; E455-R459 WeakPolarHBondContact O-CB 3.35Å; E455-R459 WeakPolarHBondContact O-CG 3.46Å; E455-R459 PolarHBondContact O-N 2.91Å
456	I	87.3	Confident	85.3	Confident	13 Å²	13	63.1 Å²	63.1	7%	0.067	30%	0.3	C	S	.	.	H	α-helix	trans	-58.4	-45.1	176.1	-64.4	171.9	0	0	0	110.6	I443 L446 L451 P452 L453 A460	I443-I456 HydrophobicContact CB-CG2 4.46Å; I443-I456 HydrophobicContact CG1-CG2 4.11Å; I443-I456 HydrophobicContact CG2-CG2 4.25Å; L446-I456 HydrophobicContact CB-CG1 3.96Å; L451-I456 HydrophobicContact CB-CD1 4.47Å; L451-I456 HydrophobicContact CB-CG1 4.18Å; L451-I456 WeakPolarHBondContact O-CD1 3.3Å; P452-I456 WeakPolarHBondContact O-CG1 3.36Å; P452-I456 PolarHBondContact O-N 2.7Å; P452-I456 VanDerWaalsContact O-N 3.16Å; L453-I456 HydrophobicContact CD2-CD1 4.49Å; L453-I456 PolarHBondContact O-N 2.83Å; I456-A460 WeakPolarHBondContact O-CB 3.15Å; I456-A460 PolarHBondContact O-N 3.03Å
457	V	88.4	Confident	85.4	Confident	85 Å²	85	63 Å²	63	52%	0.515	30%	0.299	S	S	.	.	H	α-helix	trans	-66.6	-45.8	179.7	172	0	0	0	0	111.5	L453 N454 E455 A460 L461	L453-V457 VanDerWaalsContact O-CG2 3.31Å; L453-V457 WeakPolarHBondContact O-CG2 3.34Å; L453-V457 PolarHBondContact O-N 3.17Å; N454-V457 PolarHBondContact O-N 3.39Å; E455-V457 VanDerWaalsContact C-N 3.3Å; E455-V457 PolarHBondContact O-N 3.21Å; V457-A460 PolarHBondContact O-N 2.91Å; V457-L461 HydrophobicContact CG1-CD1 4.02Å; V457-L461 WeakPolarHBondContact O-CG 3.46Å; V457-L461 PolarHBondContact O-N 3.46Å; V457-L461 VanDerWaalsContact O-N 3.08Å
458	I	86.3	Confident	85.2	Confident	44 Å²	44	56.1 Å²	56.1	23%	0.226	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-48.4	179.7	-68.9	168.8	0	0	0	110.4	D253 N454 E455 A460 L461 D462	D253-I458 HydrophobicContact CB-CG2 3.71Å; N454-I458 WeakPolarHBondContact O-CG1 3.43Å; N454-I458 PolarHBondContact O-N 3.08Å; E455-I458 PolarHBondContact O-N 3.23Å; I458-A460 PolarHBondContact O-N 2.8Å; I458-L461 PolarHBondContact O-N 2.86Å; I458-D462 WeakPolarHBondContact O-CB 3.22Å; I458-D462 PolarHBondContact O-N 3.3Å
459	R	83.3	Confident	84.7	Confident	14 Å²	14	47.8 Å²	47.8	5%	0.053	24%	0.244	C	C	.	.	H	α-helix	trans	-66.2	-36.5	179.5	-64.6	-71.5	179.2	-161.6	-4.1	113	D253 Y255 L446 E455 L461 D462 L463 Y951 N956	D253-R459 IonicContact OD1-CZ 2.91Å; D253-R459 IonicContact OD1-NE 3.96Å; D253-R459 IonicContact OD1-NH1 2.68Å; D253-R459 PolarHBondContact OD1-NH1 3.28Å; D253-R459 IonicContact OD1-NH2 3.47Å; D253-R459 PolarHBondContact OD1-NH2 2.94Å; D253-R459 IonicContact OD2-CZ 2.78Å; D253-R459 IonicContact OD2-NE 2.67Å; D253-R459 IonicContact OD2-NH1 3.88Å; D253-R459 PolarHBondContact OD2-NH1 3.26Å; D253-R459 IonicContact OD2-NH2 3.63Å; Y255-R459 PolarHBondContact OH-NH1 2.97Å; L446-R459 HydrophobicContact CD1-CB 3.91Å; E455-R459 WeakPolarHBondContact O-CB 3.35Å; E455-R459 WeakPolarHBondContact O-CG 3.46Å; E455-R459 PolarHBondContact O-N 2.91Å; R459-L461 VanDerWaalsContact C-N 3.33Å; R459-D462 PolarHBondContact O-N 3.05Å; R459-L463 PolarHBondContact O-N 2.99Å; R459-L463 VanDerWaalsContact O-N 3.15Å; R459-Y951 HydrophobicContact CB-CE2 4.17Å; R459-Y951 VanDerWaalsContact CD-OH 3.27Å; R459-Y951 WeakPolarHBondContact CD-OH 3.49Å; R459-N956 PolarHBondContact NH1-ND2 3.17Å
460	A	87.3	Confident	84.3	Confident	8 Å²	8	46.5 Å²	46.5	7%	0.066	24%	0.239	C	C	.	.	H	α-helix	trans	-62	-41.5	174.8	0	0	0	0	0	112.1	T439 I443 I456 V457 I458	T439-A460 HydrophobicContact CG2-CB 3.62Å; T439-A460 PolarHBondContact OG1-O 2.84Å; I443-A460 HydrophobicContact CD1-CB 4.02Å; I443-A460 HydrophobicContact CG1-CB 3.89Å; I456-A460 WeakPolarHBondContact O-CB 3.15Å; I456-A460 PolarHBondContact O-N 3.03Å; V457-A460 PolarHBondContact O-N 2.91Å; I458-A460 PolarHBondContact O-N 2.8Å
461	L	87.9	Confident	84	Confident	75 Å²	75	37.1 Å²	37.1	39%	0.393	21%	0.211	S	C	.	.	H	α-helix	trans	-76.1	-35.9	177.5	-67.7	173	0	0	0	112	L249 V457 I458 R459 L463 V464 T465	L249-L461 HydrophobicContact CD1-CB 3.31Å; L249-L461 HydrophobicContact CD1-CD1 4.49Å; V457-L461 HydrophobicContact CG1-CD1 4.02Å; V457-L461 WeakPolarHBondContact O-CG 3.46Å; V457-L461 PolarHBondContact O-N 3.46Å; V457-L461 VanDerWaalsContact O-N 3.08Å; I458-L461 PolarHBondContact O-N 2.86Å; R459-L461 VanDerWaalsContact C-N 3.33Å; L461-L463 VanDerWaalsContact C-N 3.3Å; L461-L463 PolarHBondContact O-N 3.31Å; L461-V464 WeakPolarHBondContact O-CB 3.41Å; L461-V464 PolarHBondContact O-N 3.49Å; L461-V464 VanDerWaalsContact O-N 3.11Å; L461-T465 PolarHBondContact O-N 3.35Å
462	D	87	Confident	83.8	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-57.6	-44.8	175.6	-172.6	36.9	0	0	0	111	L249 W250 I458 R459 V464 T465 V466 Y951	L249-D462 HydrophobicContact CD2-CB 3.7Å; W250-D462 PolarHBondContact NE1-OD1 3.29Å; I458-D462 WeakPolarHBondContact O-CB 3.22Å; I458-D462 PolarHBondContact O-N 3.3Å; R459-D462 PolarHBondContact O-N 3.05Å; D462-V464 PolarHBondContact O-N 3.43Å; D462-V464 VanDerWaalsContact O-N 3.17Å; D462-T465 WeakPolarHBondContact O-CA 3.21Å; D462-T465 WeakPolarHBondContact O-CB 3.23Å; D462-T465 PolarHBondContact O-N 3.4Å; D462-T465 PolarHBondContact O-OG1 2.92Å; D462-T465 PolarHBondContact OD1-OG1 3.41Å; D462-V466 PolarHBondContact O-N 3.02Å; D462-V466 VanDerWaalsContact O-N 3.07Å; D462-Y951 PolarHBondContact OD2-OH 3.31Å
463	L	88.3	Confident	83.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.7	-32.3	178.2	-166.7	66.8	0	0	0	113	G438 R459 L461 T465 V467 F944 V947 Y951	G438-L463 WeakPolarHBondContact O-CD2 3.34Å; R459-L463 PolarHBondContact O-N 2.99Å; R459-L463 VanDerWaalsContact O-N 3.15Å; L461-L463 VanDerWaalsContact C-N 3.3Å; L461-L463 PolarHBondContact O-N 3.31Å; L463-T465 VanDerWaalsContact C-N 3.33Å; L463-V467 WeakPolarHBondContact O-CG2 3.36Å; L463-V467 PolarHBondContact O-N 3.36Å; L463-F944 HydrophobicContact CD1-CD2 3.46Å; L463-F944 VanDerWaalsContact CD1-CD2 3.46Å; L463-F944 HydrophobicContact CD1-CE2 3.62Å; L463-F944 HydrophobicContact CD2-CD2 4.49Å; L463-F944 HydrophobicContact CD2-CE2 3.79Å; L463-F944 HydrophobicContact CG-CD2 3.88Å; L463-F944 HydrophobicContact CG-CE2 3.62Å; L463-V947 HydrophobicContact CD1-CB 4.49Å; L463-V947 HydrophobicContact CD1-CG1 3.98Å; L463-Y951 HydrophobicContact CD1-CE2 4.48Å
464	V	86.8	Confident	82.6	Confident	51 Å²	51	32.6 Å²	32.6	31%	0.309	20%	0.195	S	C	.	.	H	α-helix	trans	-67.3	-36.3	173.8	179.3	0	0	0	0	111	L461 D462	L461-V464 WeakPolarHBondContact O-CB 3.41Å; L461-V464 PolarHBondContact O-N 3.49Å; L461-V464 VanDerWaalsContact O-N 3.11Å; D462-V464 PolarHBondContact O-N 3.43Å; D462-V464 VanDerWaalsContact O-N 3.17Å
465	T	87.3	Confident	82.4	Confident	5 Å²	5	28.3 Å²	28.3	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-70.5	-34.7	177.9	75.7	0	0	0	0	112.7	F245 L249 W250 L461 D462 L463	F245-T465 HydrophobicContact CE1-CG2 4.26Å; L249-T465 HydrophobicContact CD1-CG2 4.32Å; W250-T465 PolarHBondContact NE1-OG1 3.15Å; L461-T465 PolarHBondContact O-N 3.35Å; D462-T465 WeakPolarHBondContact O-CA 3.21Å; D462-T465 WeakPolarHBondContact O-CB 3.23Å; D462-T465 PolarHBondContact O-N 3.4Å; D462-T465 PolarHBondContact O-OG1 2.92Å; D462-T465 PolarHBondContact OD1-OG1 3.41Å; L463-T465 VanDerWaalsContact C-N 3.33Å
466	V	87.9	Confident	82.1	Confident	12 Å²	12	26.2 Å²	26.2	7%	0.073	16%	0.163	C	C	.	.	H	α-helix	trans	-67.2	-35.8	177.6	175.6	0	0	0	0	112.6	D462 S940 Q943 F944 V947	D462-V466 PolarHBondContact O-N 3.02Å; D462-V466 VanDerWaalsContact O-N 3.07Å; V466-S940 PolarHBondContact O-OG 2.75Å; V466-Q943 HydrophobicContact CG1-CB 4.09Å; V466-Q943 HydrophobicContact CG1-CG 3.81Å; V466-F944 HydrophobicContact CG1-CB 4.33Å; V466-V947 HydrophobicContact CG1-CG2 4.49Å
467	V	86.1	Confident	81.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-75.9	-22.7	-177.6	174.4	0	0	0	0	113.4	L431 A435 L463 P469 S940 F944	L431-V467 HydrophobicContact CB-CG1 3.84Å; L431-V467 WeakPolarHBondContact O-CG1 3.28Å; A435-V467 HydrophobicContact CB-CB 3.87Å; A435-V467 HydrophobicContact CB-CG1 3.86Å; A435-V467 HydrophobicContact CB-CG2 3.92Å; L463-V467 WeakPolarHBondContact O-CG2 3.36Å; L463-V467 PolarHBondContact O-N 3.36Å; V467-P469 VanDerWaalsContact O-CD 3.23Å; V467-P469 WeakPolarHBondContact O-CD 3.33Å; V467-S940 VanDerWaalsContact CA-OG 3.3Å; V467-S940 WeakPolarHBondContact CA-OG 3.28Å; V467-S940 PolarHBondContact O-OG 2.71Å; V467-F944 HydrophobicContact CG2-CB 3.93Å; V467-F944 HydrophobicContact CG2-CD1 4.49Å; V467-F944 HydrophobicContact CG2-CD2 3.07Å; V467-F944 HydrophobicContact CG2-CE2 3.55Å; V467-F944 HydrophobicContact CG2-CG 3.6Å; V467-F944 HydrophobicContact CG2-CZ 4.44Å
468	V	81.8	Confident	81.7	Confident	25 Å²	25	26.7 Å²	26.7	15%	0.152	17%	0.167	C	C	.	.	S	Bend	trans	-104.8	98.4	-179.3	-178.5	0	0	0	0	108.6	F242 V428 P470	F242-V468 HydrophobicContact CD1-CG1 4.4Å; F242-V468 HydrophobicContact CE1-CB 3.81Å; F242-V468 HydrophobicContact CE1-CG1 3.81Å; F242-V468 HydrophobicContact CZ-CB 3.69Å; F242-V468 HydrophobicContact CZ-CG1 4.04Å; F242-V468 HydrophobicContact CZ-CG2 4.27Å; V428-V468 HydrophobicContact CG1-CG1 4.43Å; V468-P470 VanDerWaalsContact O-CD 3.27Å; V468-P470 WeakPolarHBondContact O-CD 3.28Å; V468-P470 VanDerWaalsContact O-N 3.14Å
469	P	75.3	Confident	81.7	Confident	8 Å²	8	24.7 Å²	24.7	5%	0.052	16%	0.157	C	C	.	.			trans	-64.3	118	-174.7	21	-29.8	0	0	0	110.2	V467 A471 L472	V467-P469 VanDerWaalsContact O-CD 3.23Å; V467-P469 WeakPolarHBondContact O-CD 3.33Å; P469-A471 PolarHBondContact O-N 3.48Å; P469-L472 HydrophobicContact CB-CB 4.44Å; P469-L472 HydrophobicContact CG-CB 4.1Å; P469-L472 HydrophobicContact CG-CD2 4.47Å; P469-L472 WeakPolarHBondContact O-CB 3.44Å; P469-L472 PolarHBondContact O-N 2.83Å
470	P	70.1	Confident	81.9	Confident	23 Å²	23	24.2 Å²	24.2	15%	0.149	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-45.3	-179.1	22.8	-30.8	0	0	0	109.6	Y239 V468 L472 P473	Y239-P470 VanDerWaalsContact CE2-C 3.46Å; Y239-P470 HydrophobicContact CE2-CB 4.13Å; Y239-P470 WeakPolarHBondContact CE2-O 3.17Å; Y239-P470 WeakPolarHBondContact OH-CB 3.2Å; Y239-P470 PolarHBondContact OH-O 3.41Å; V468-P470 VanDerWaalsContact O-CD 3.27Å; V468-P470 WeakPolarHBondContact O-CD 3.28Å; V468-P470 VanDerWaalsContact O-N 3.14Å; P470-L472 PolarHBondContact O-N 3.23Å; P470-P473 WeakPolarHBondContact O-CD 3.29Å
471	A	74.8	Confident	81.9	Confident	36 Å²	36	27.9 Å²	27.9	30%	0.298	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-3.1	-176.1	0	0	0	0	0	116.3	P469 A474 A475 M936	P469-A471 PolarHBondContact O-N 3.48Å; A471-A474 PolarHBondContact O-N 2.85Å; A471-A475 VanDerWaalsContact O-CB 3.31Å; A471-A475 WeakPolarHBondContact O-CB 3.4Å; A471-A475 PolarHBondContact O-N 3.02Å; A471-M936 HydrophobicContact CB-CE 4.36Å
472	L	76.4	Confident	82.1	Confident	15 Å²	15	27.4 Å²	27.4	8%	0.079	17%	0.167	C	C	.	.	H	α-helix	trans	-57.3	-50.8	-173	-178.7	69.2	0	0	0	114.2	V428 P469 P470 A474 M476 F933 M936	V428-L472 HydrophobicContact CG2-CD2 4.07Å; P469-L472 HydrophobicContact CB-CB 4.44Å; P469-L472 HydrophobicContact CG-CB 4.1Å; P469-L472 HydrophobicContact CG-CD2 4.47Å; P469-L472 WeakPolarHBondContact O-CB 3.44Å; P469-L472 PolarHBondContact O-N 2.83Å; P470-L472 PolarHBondContact O-N 3.23Å; L472-A474 PolarHBondContact O-N 3.4Å; L472-M476 HydrophobicContact CD1-SD 4.48Å; L472-M476 WeakPolarHBondContact O-CG 3.44Å; L472-M476 PolarHBondContact O-N 2.82Å; L472-F933 HydrophobicContact CD1-CD2 3.93Å; L472-F933 HydrophobicContact CD1-CE2 4.42Å; L472-F933 HydrophobicContact CD2-CE2 4.39Å; L472-M936 HydrophobicContact CD1-CB 3.6Å; L472-M936 HydrophobicContact CD1-CG 4Å
473	P	72.4	Confident	82.3	Confident	62 Å²	62	27.4 Å²	27.4	40%	0.403	17%	0.167	S	C	.	.	H	α-helix	trans	-66.6	-37	179	-20.6	35	0	0	0	112.8	Y239 P470 T477	Y239-P473 HydrophobicContact CD2-CG 3.85Å; Y239-P473 HydrophobicContact CE2-CG 4.27Å; Y239-P473 HydrophobicContact CG-CG 4.27Å; P470-P473 WeakPolarHBondContact O-CD 3.29Å; P473-T477 PolarHBondContact O-N 3.31Å; P473-T477 PolarHBondContact O-OG1 3.47Å
474	A	75.2	Confident	82.5	Confident	51 Å²	51	29.9 Å²	29.9	42%	0.421	18%	0.179	S	C	.	.	H	α-helix	trans	-65.5	-47.2	178.7	0	0	0	0	0	111.2	A471 L472 M476 T477 V478	A471-A474 PolarHBondContact O-N 2.85Å; L472-A474 PolarHBondContact O-N 3.4Å; A474-M476 VanDerWaalsContact C-N 3.31Å; A474-M476 PolarHBondContact O-N 3.45Å; A474-T477 WeakPolarHBondContact O-CB 3.41Å; A474-T477 PolarHBondContact O-N 3.18Å; A474-V478 WeakPolarHBondContact O-CG2 3.5Å; A474-V478 PolarHBondContact O-N 2.91Å
475	A	79.3	Confident	82.7	Confident	10 Å²	10	30 Å²	30	8%	0.083	18%	0.182	C	C	.	.	H	α-helix	trans	-61.7	-37.8	179.5	0	0	0	0	0	112.7	A471 T477 V478 C479 V932 M936	A471-A475 VanDerWaalsContact O-CB 3.31Å; A471-A475 WeakPolarHBondContact O-CB 3.4Å; A471-A475 PolarHBondContact O-N 3.02Å; A475-T477 VanDerWaalsContact C-N 3.32Å; A475-T477 PolarHBondContact O-N 3.47Å; A475-V478 PolarHBondContact O-N 3.22Å; A475-C479 PolarHBondContact O-SG 2.91Å; A475-C479 VanDerWaalsContact O-SG 3.4Å; A475-V932 HydrophobicContact CB-CG1 3.7Å; A475-M936 HydrophobicContact CB-CE 3.53Å; A475-M936 HydrophobicContact CB-CG 4.44Å
476	M	75.8	Confident	83	Confident	12 Å²	12	32 Å²	32	6%	0.059	19%	0.189	C	C	.	.	H	α-helix	trans	-64.9	-36.3	173.5	-74.5	-179.9	35.5	0	0	112.7	F420 Y421 L472 A474 C479 F933	F420-M476 HydrophobicContact CD1-CE 4.11Å; F420-M476 HydrophobicContact CE1-CE 3.48Å; F420-M476 VanDerWaalsContact CE1-CE 3.48Å; F420-M476 HydrophobicContact CE1-SD 4.01Å; Y421-M476 HydrophobicContact CD1-CE 3.62Å; Y421-M476 HydrophobicContact CE1-CE 3.23Å; L472-M476 HydrophobicContact CD1-SD 4.48Å; L472-M476 WeakPolarHBondContact O-CG 3.44Å; L472-M476 PolarHBondContact O-N 2.82Å; A474-M476 VanDerWaalsContact C-N 3.31Å; A474-M476 PolarHBondContact O-N 3.45Å; M476-C479 WeakPolarHBondContact O-CB 3.4Å; M476-F933 HydrophobicContact SD-CD2 4.36Å
477	T	80.1	Confident	83.3	Confident	74 Å²	74	31.5 Å²	31.5	45%	0.454	19%	0.186	S	C	.	.	H	α-helix	trans	-68.8	-42.3	178.3	-56.3	0	0	0	0	111.3	P473 A474 A475 C479 T480 L481	P473-T477 PolarHBondContact O-N 3.31Å; P473-T477 PolarHBondContact O-OG1 3.47Å; A474-T477 WeakPolarHBondContact O-CB 3.41Å; A474-T477 PolarHBondContact O-N 3.18Å; A475-T477 VanDerWaalsContact C-N 3.32Å; A475-T477 PolarHBondContact O-N 3.47Å; T477-C479 PolarHBondContact O-N 2.89Å; T477-T480 PolarHBondContact O-N 2.99Å; T477-T480 PolarHBondContact O-OG1 3.26Å; T477-L481 HydrophobicContact CG2-CD1 4.15Å; T477-L481 HydrophobicContact CG2-CG 4.27Å; T477-L481 WeakPolarHBondContact O-CG 3.43Å; T477-L481 PolarHBondContact O-N 3Å
478	V	85.4	Confident	83.5	Confident	34 Å²	34	39.7 Å²	39.7	21%	0.206	22%	0.217	C	C	.	.	H	α-helix	trans	-53.7	-39.3	178	171	0	0	0	0	112.1	A474 A475 T480 L481 Y482	A474-V478 WeakPolarHBondContact O-CG2 3.5Å; A474-V478 PolarHBondContact O-N 2.91Å; A475-V478 PolarHBondContact O-N 3.22Å; V478-T480 PolarHBondContact O-N 3.43Å; V478-L481 PolarHBondContact O-N 3.05Å; V478-Y482 HydrophobicContact CG1-CD2 3.78Å; V478-Y482 HydrophobicContact CG1-CE2 3.42Å; V478-Y482 VanDerWaalsContact CG1-CE2 3.42Å; V478-Y482 WeakPolarHBondContact O-CD2 3.47Å; V478-Y482 PolarHBondContact O-N 3.42Å; V478-Y482 VanDerWaalsContact O-N 3.11Å
479	C	86.4	Confident	84	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.014	25%	0.247	C	C	.	.	H	α-helix	trans	-55.5	-50.8	175.5	-62	0	0	0	0	112.1	A475 M476 T477 L481 Y482 A483 T928 S978	A475-C479 PolarHBondContact O-SG 2.91Å; A475-C479 VanDerWaalsContact O-SG 3.4Å; M476-C479 WeakPolarHBondContact O-CB 3.4Å; T477-C479 PolarHBondContact O-N 2.89Å; C479-L481 VanDerWaalsContact C-N 3.34Å; C479-L481 PolarHBondContact O-N 3.08Å; C479-Y482 PolarHBondContact O-N 3.24Å; C479-A483 PolarHBondContact O-N 3.41Å; C479-T928 HydrophobicContact CB-CG2 4.41Å; C479-S978 PolarHBondContact SG-OG 3.42Å
480	T	87.4	Confident	84.7	Confident	4 Å²	4	51.8 Å²	51.8	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-69.9	-31.3	-177.9	60.5	0	0	0	0	112.4	T477 V478 A483 Q484	T477-T480 PolarHBondContact O-N 2.99Å; T477-T480 PolarHBondContact O-OG1 3.26Å; V478-T480 PolarHBondContact O-N 3.43Å; T480-A483 PolarHBondContact O-N 3.03Å; T480-Q484 WeakPolarHBondContact O-CB 3.5Å; T480-Q484 PolarHBondContact O-N 3.41Å
481	L	88.4	Confident	85.6	Confident	86 Å²	86	51.2 Å²	51.2	45%	0.45	26%	0.26	S	S	.	.	H	α-helix	trans	-66.6	-42.2	176.1	-69.3	175.2	0	0	0	112.1	T477 V478 C479 Q484 S485	T477-L481 HydrophobicContact CG2-CD1 4.15Å; T477-L481 HydrophobicContact CG2-CG 4.27Å; T477-L481 WeakPolarHBondContact O-CG 3.43Å; T477-L481 PolarHBondContact O-N 3Å; V478-L481 PolarHBondContact O-N 3.05Å; C479-L481 VanDerWaalsContact C-N 3.34Å; C479-L481 PolarHBondContact O-N 3.08Å; L481-Q484 PolarHBondContact O-N 3.11Å; L481-S485 WeakPolarHBondContact O-CB 3.26Å; L481-S485 PolarHBondContact O-N 3.17Å
482	Y	91.2	Very high	86.5	Confident	65 Å²	65	49.5 Å²	49.5	26%	0.255	25%	0.246	S	C	.	.	H	α-helix	trans	-65.2	-40.9	174.5	-75.3	-51.3	0	0	0	112	V478 C479 S485 R486 V975 R979	V478-Y482 HydrophobicContact CG1-CD2 3.78Å; V478-Y482 HydrophobicContact CG1-CE2 3.42Å; V478-Y482 VanDerWaalsContact CG1-CE2 3.42Å; V478-Y482 WeakPolarHBondContact O-CD2 3.47Å; V478-Y482 PolarHBondContact O-N 3.42Å; V478-Y482 VanDerWaalsContact O-N 3.11Å; C479-Y482 PolarHBondContact O-N 3.24Å; Y482-S485 PolarHBondContact O-N 3.33Å; Y482-R486 WeakPolarHBondContact O-CG 3.43Å; Y482-R486 PolarHBondContact O-N 2.91Å; Y482-V975 HydrophobicContact CE2-CG1 4.3Å; Y482-V975 VanDerWaalsContact OH-CG1 3.31Å; Y482-V975 WeakPolarHBondContact OH-CG1 3.42Å; Y482-R979 HydrophobicContact CE2-CB 4.44Å
483	A	92.4	Very high	87	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-44.3	174.8	0	0	0	0	0	111.9	C479 T480 S485 R486 L487 I500	C479-A483 PolarHBondContact O-N 3.41Å; T480-A483 PolarHBondContact O-N 3.03Å; A483-S485 VanDerWaalsContact C-N 3.34Å; A483-S485 PolarHBondContact O-N 3.4Å; A483-R486 PolarHBondContact O-N 2.82Å; A483-L487 WeakPolarHBondContact O-CG 3.27Å; A483-L487 PolarHBondContact O-N 2.94Å; A483-I500 HydrophobicContact CB-CD1 4.44Å; A483-I500 HydrophobicContact CB-CG2 3.97Å
484	Q	92.2	Very high	87.7	Confident	52 Å²	52	50 Å²	50	24%	0.243	24%	0.243	C	C	.	.	H	α-helix	trans	-60.6	-42.4	175.2	-171.1	-174.5	18.7	0	0	111.6	T480 L481 R486 L487 R488 C494 I500	T480-Q484 WeakPolarHBondContact O-CB 3.5Å; T480-Q484 PolarHBondContact O-N 3.41Å; L481-Q484 PolarHBondContact O-N 3.11Å; Q484-R486 PolarHBondContact O-N 3.08Å; Q484-L487 PolarHBondContact O-N 2.74Å; Q484-R488 WeakPolarHBondContact O-CB 3.2Å; Q484-R488 PolarHBondContact O-N 3.46Å; Q484-C494 HydrophobicContact CG-CB 4.4Å; Q484-C494 PolarHBondContact NE2-O 2.79Å; Q484-I500 HydrophobicContact CB-CD1 3.77Å; Q484-I500 HydrophobicContact CG-CD1 4.41Å
485	S	90.6	Very high	87.9	Confident	54 Å²	54	51.2 Å²	51.2	38%	0.378	24%	0.241	S	C	.	.	H	α-helix	trans	-62.7	-41.3	177	-174.8	0	0	0	0	112.1	L481 Y482 A483 R488 R489	L481-S485 WeakPolarHBondContact O-CB 3.26Å; L481-S485 PolarHBondContact O-N 3.17Å; Y482-S485 PolarHBondContact O-N 3.33Å; A483-S485 VanDerWaalsContact C-N 3.34Å; A483-S485 PolarHBondContact O-N 3.4Å; S485-R488 PolarHBondContact O-N 3.04Å; S485-R489 WeakPolarHBondContact O-CG 3.48Å; S485-R489 PolarHBondContact O-N 3.11Å; S485-R489 VanDerWaalsContact O-N 3.11Å
486	R	94	Very high	87.8	Confident	48 Å²	48	53.6 Å²	53.6	18%	0.181	25%	0.25	C	S	.	.	H	α-helix	trans	-67.1	-43.5	176.6	-71.1	-169.6	-57.2	-95.4	-3.1	112.5	Y482 A483 Q484 R488 R489 Q490 E921	Y482-R486 WeakPolarHBondContact O-CG 3.43Å; Y482-R486 PolarHBondContact O-N 2.91Å; A483-R486 PolarHBondContact O-N 2.82Å; Q484-R486 PolarHBondContact O-N 3.08Å; R486-R488 VanDerWaalsContact C-N 3.32Å; R486-R488 PolarHBondContact O-N 3.35Å; R486-R489 PolarHBondContact O-N 2.92Å; R486-Q490 PolarHBondContact O-N 3.28Å; R486-E921 IonicContact CZ-OE1 2.66Å; R486-E921 IonicContact CZ-OE2 3.57Å; R486-E921 IonicContact NE-OE1 2.78Å; R486-E921 PolarHBondContact NE-OE1 3.44Å; R486-E921 IonicContact NE-OE2 3.98Å; R486-E921 PolarHBondContact NE-OE2 3.47Å; R486-E921 IonicContact NH2-OE1 3.22Å; R486-E921 IonicContact NH2-OE2 2.74Å; R486-E921 PolarHBondContact NH2-OE2 3.35Å
487	L	93.6	Very high	88	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.1	-43.3	173.9	-74.7	171.8	0	0	0	111.3	A483 Q484 R489 Q490 G491 I492 I500 F905 V918 E921	A483-L487 WeakPolarHBondContact O-CG 3.27Å; A483-L487 PolarHBondContact O-N 2.94Å; Q484-L487 PolarHBondContact O-N 2.74Å; L487-R489 VanDerWaalsContact C-N 3.3Å; L487-R489 PolarHBondContact O-N 3.43Å; L487-Q490 CarbonylContact O-C 3.57Å; L487-Q490 WeakPolarHBondContact O-CA 3.39Å; L487-Q490 WeakPolarHBondContact O-CB 3.05Å; L487-Q490 PolarHBondContact O-N 3.02Å; L487-G491 PolarHBondContact O-N 3.22Å; L487-I492 CarbonylContact C-O 2.94Å; L487-I492 HydrophobicContact CB-CB 4.24Å; L487-I492 WeakPolarHBondContact CB-O 3.22Å; L487-I492 HydrophobicContact CD2-CB 4.34Å; L487-I492 HydrophobicContact CD2-CD1 4.12Å; L487-I492 HydrophobicContact CD2-CG2 4.41Å; L487-I492 PolarHBondContact O-N 2.74Å; L487-I500 HydrophobicContact CD1-CD1 4.23Å; L487-I500 HydrophobicContact CD1-CG1 4.21Å; L487-I500 HydrophobicContact CD1-CG2 4.37Å; L487-F905 HydrophobicContact CD1-CE1 4.11Å; L487-V918 HydrophobicContact CD2-CG2 4.32Å; L487-E921 HydrophobicContact CD1-CB 4.36Å; L487-E921 HydrophobicContact CD2-CB 3.99Å; L487-E921 HydrophobicContact CD2-CG 3.84Å; L487-E921 HydrophobicContact CG-CB 4.17Å; L487-E921 HydrophobicContact CG-CG 4.08Å
488	R	90.8	Very high	88	Confident	173 Å²	173	54.4 Å²	54.4	65%	0.653	25%	0.254	S	S	*	.	H	α-helix	trans	-60.5	-38	177.3	-174.3	176.6	178.4	170.5	1.4	112.4	Q484 S485 R486 Q490 G491 I492 F493	Q484-R488 WeakPolarHBondContact O-CB 3.2Å; Q484-R488 PolarHBondContact O-N 3.46Å; S485-R488 PolarHBondContact O-N 3.04Å; R486-R488 VanDerWaalsContact C-N 3.32Å; R486-R488 PolarHBondContact O-N 3.35Å; R488-Q490 PolarHBondContact O-N 2.86Å; R488-G491 PolarHBondContact O-N 3.41Å; R488-G491 VanDerWaalsContact O-N 3.12Å; R488-I492 WeakPolarHBondContact CA-O 3.43Å; R488-I492 PolarHBondContact N-O 3.15Å; R488-I492 VanDerWaalsContact N-O 3.17Å; R488-F493 HydrophobicContact CG-CD1 4.1Å; R488-F493 HydrophobicContact CG-CE1 3.9Å
489	R	92	Very high	88.1	Confident	206 Å²	206	54.3 Å²	54.3	78%	0.777	25%	0.25	S	C	*	.	H	α-helix	trans	-65.7	-22.1	174.1	-70.5	178.2	-171.1	-161.7	-1.9	113.2	S485 R486 L487 G491	S485-R489 WeakPolarHBondContact O-CG 3.48Å; S485-R489 PolarHBondContact O-N 3.11Å; S485-R489 VanDerWaalsContact O-N 3.11Å; R486-R489 PolarHBondContact O-N 2.92Å; L487-R489 VanDerWaalsContact C-N 3.3Å; L487-R489 PolarHBondContact O-N 3.43Å; R489-G491 VanDerWaalsContact C-N 3.34Å
490	Q	90.8	Very high	88.3	Confident	81 Å²	81	54.3 Å²	54.3	38%	0.379	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	12.4	174.9	-64.6	178.3	-17.6	0	0	112.5	R486 L487 R488 I492 M909	R486-Q490 PolarHBondContact O-N 3.28Å; L487-Q490 CarbonylContact O-C 3.57Å; L487-Q490 WeakPolarHBondContact O-CA 3.39Å; L487-Q490 WeakPolarHBondContact O-CB 3.05Å; L487-Q490 PolarHBondContact O-N 3.02Å; R488-Q490 PolarHBondContact O-N 2.86Å; Q490-I492 VanDerWaalsContact C-N 3.3Å; Q490-I492 PolarHBondContact O-N 3.25Å; Q490-M909 VanDerWaalsContact O-CE 3.24Å; Q490-M909 WeakPolarHBondContact O-CE 3.35Å
491	G	89.3	Confident	88.5	Confident	11 Å²	11	54.1 Å²	54.1	11%	0.113	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	15.7	-178.3	0	0	0	0	0	114.4	L487 R488 R489 S907 S908	L487-G491 PolarHBondContact O-N 3.22Å; R488-G491 PolarHBondContact O-N 3.41Å; R488-G491 VanDerWaalsContact O-N 3.12Å; R489-G491 VanDerWaalsContact C-N 3.34Å; G491-S907 CarbonylContact O-C 3.57Å; G491-S907 WeakPolarHBondContact O-CA 3.42Å; G491-S908 WeakPolarHBondContact CA-OG 3.46Å; G491-S908 PolarHBondContact O-N 3.48Å; G491-S908 PolarHBondContact O-OG 2.77Å
492	I	92	Very high	88.5	Confident	0 Å²	0	51 Å²	51	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	111	177.7	-55.1	169.8	0	0	0	109.2	L487 R488 Q490 F905 T906 C914 M917 V918	L487-I492 CarbonylContact C-O 2.94Å; L487-I492 HydrophobicContact CB-CB 4.24Å; L487-I492 WeakPolarHBondContact CB-O 3.22Å; L487-I492 HydrophobicContact CD2-CB 4.34Å; L487-I492 HydrophobicContact CD2-CD1 4.12Å; L487-I492 HydrophobicContact CD2-CG2 4.41Å; L487-I492 PolarHBondContact O-N 2.74Å; R488-I492 WeakPolarHBondContact CA-O 3.43Å; R488-I492 PolarHBondContact N-O 3.15Å; R488-I492 VanDerWaalsContact N-O 3.17Å; Q490-I492 VanDerWaalsContact C-N 3.3Å; Q490-I492 PolarHBondContact O-N 3.25Å; I492-F905 HydrophobicContact CG2-CD1 4.22Å; I492-T906 CarbonylContact C-O 3.59Å; I492-T906 WeakPolarHBondContact CA-O 3.48Å; I492-C914 HydrophobicContact CD1-CB 3.66Å; I492-C914 HydrophobicContact CG1-CB 4.1Å; I492-M917 HydrophobicContact CD1-CB 4.06Å; I492-M917 HydrophobicContact CD1-SD 4.21Å; I492-V918 HydrophobicContact CD1-CG2 4.23Å; I492-V918 HydrophobicContact CG2-CG2 4.03Å
493	F	88.6	Confident	88.5	Confident	78 Å²	78	47.9 Å²	47.9	34%	0.342	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	134.6	-179.6	-57.6	-89.3	0	0	0	109.7	R488 F905 T906	R488-F493 HydrophobicContact CG-CD1 4.1Å; R488-F493 HydrophobicContact CG-CE1 3.9Å; F493-F905 CarbonylContact O-C 3.54Å; F493-F905 VanDerWaalsContact O-CA 3.26Å; F493-F905 WeakPolarHBondContact O-CA 3.45Å; F493-T906 PolarHBondContact N-O 3.01Å; F493-T906 PolarHBondContact O-N 3.01Å
494	C	86.2	Confident	88.4	Confident	9 Å²	9	47.9 Å²	47.9	6%	0.061	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124.4	175.6	-177.9	0	0	0	0	109.3	Q484 H496 I500 P904 F905	Q484-C494 HydrophobicContact CG-CB 4.4Å; Q484-C494 PolarHBondContact NE2-O 2.79Å; C494-H496 VanDerWaalsContact SG-C 3.58Å; C494-H496 PolarHBondContact SG-O 3.45Å; C494-H496 VanDerWaalsContact SG-O 3.39Å; C494-I500 HydrophobicContact CB-CD1 4.42Å; C494-I500 HydrophobicContact CB-CG1 4.44Å; C494-P904 WeakPolarHBondContact CA-O 3.36Å; C494-F905 HydrophobicContact CB-CD1 3.72Å; C494-F905 HydrophobicContact CB-CE1 3.61Å; C494-F905 HydrophobicContact CB-CZ 4.47Å; C494-F905 WeakPolarHBondContact SG-CE1 3.27Å
495	I	79.8	Confident	88.3	Confident	77 Å²	77	46.9 Å²	46.9	40%	0.395	22%	0.215	S	C	.	.	S	Bend	trans	-80.8	-35.4	-179.5	-59.2	171.8	0	0	0	110.3	P497 V901 P904	I495-P497 WeakPolarHBondContact O-CD 3.18Å; I495-V901 HydrophobicContact CD1-CB 4.48Å; I495-V901 HydrophobicContact CD1-CG1 3.82Å; I495-V901 WeakPolarHBondContact CD1-O 3.34Å; I495-P904 PolarHBondContact N-O 3.07Å; I495-P904 VanDerWaalsContact N-O 3.15Å
496	H	76.9	Confident	88.3	Confident	59 Å²	59	44.4 Å²	44.4	27%	0.273	20%	0.197	S	C	.	.			trans	-121.2	92.1	-174.8	-161.3	-64.7	0	0	0	111.7	I416 C494 L498 R499	I416-H496 VanDerWaalsContact CD1-CE1 3.42Å; I416-H496 WeakPolarHBondContact CD1-CE1 3.31Å; C494-H496 VanDerWaalsContact SG-C 3.58Å; C494-H496 PolarHBondContact SG-O 3.45Å; C494-H496 VanDerWaalsContact SG-O 3.39Å; H496-L498 PolarHBondContact O-N 3.02Å; H496-R499 HydrophobicContact CB-CG 4.34Å; H496-R499 WeakPolarHBondContact O-CB 3.23Å; H496-R499 PolarHBondContact O-N 2.7Å
497	P	80.9	Confident	88.3	Confident	35 Å²	35	42.9 Å²	42.9	23%	0.227	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.2	-170.4	-28	34.4	0	0	0	115	I495 R499 I500	I495-P497 WeakPolarHBondContact O-CD 3.18Å; P497-R499 PolarHBondContact O-N 3.22Å; P497-I500 HydrophobicContact CB-CD1 4.47Å; P497-I500 VanDerWaalsContact O-CB 3.25Å; P497-I500 WeakPolarHBondContact O-CB 3.31Å; P497-I500 VanDerWaalsContact O-CG1 3.29Å; P497-I500 WeakPolarHBondContact O-CG1 3.43Å; P497-I500 PolarHBondContact O-N 2.85Å
498	L	79.8	Confident	88.3	Confident	68 Å²	68	42.9 Å²	42.9	36%	0.356	19%	0.192	S	C	.	.	H	α-helix	trans	-61.9	-25.1	177.5	-63.3	168.5	0	0	0	113.4	I416 Y421 H496 I500 N501	I416-L498 HydrophobicContact CD1-CB 4.05Å; Y421-L498 HydrophobicContact CE1-CD2 4.24Å; Y421-L498 HydrophobicContact CE2-CD2 3.98Å; Y421-L498 VanDerWaalsContact CZ-CD2 3.48Å; Y421-L498 WeakPolarHBondContact OH-CD2 3.15Å; H496-L498 PolarHBondContact O-N 3.02Å; L498-I500 VanDerWaalsContact C-N 3.27Å; L498-I500 PolarHBondContact O-N 3.43Å; L498-N501 PolarHBondContact O-N 3.05Å
499	R	86.3	Confident	88.6	Confident	33 Å²	33	34.7 Å²	34.7	13%	0.125	16%	0.161	C	C	.	.	H	α-helix	trans	-73.4	-16.4	176.7	-69.2	-171.7	172.2	-134.1	20.5	112.8	I416 H496 P497 N501 L502 G503 A888 D889 P904 F905	I416-R499 HydrophobicContact CD1-CG 3.54Å; I416-R499 HydrophobicContact CG1-CG 4.47Å; H496-R499 HydrophobicContact CB-CG 4.34Å; H496-R499 WeakPolarHBondContact O-CB 3.23Å; H496-R499 PolarHBondContact O-N 2.7Å; P497-R499 PolarHBondContact O-N 3.22Å; R499-N501 VanDerWaalsContact C-N 3.3Å; R499-N501 PolarHBondContact O-N 3.22Å; R499-L502 HydrophobicContact CG-CD1 4.33Å; R499-L502 WeakPolarHBondContact O-CB 3.19Å; R499-L502 PolarHBondContact O-N 3.1Å; R499-L502 VanDerWaalsContact O-N 3.12Å; R499-G503 PolarHBondContact O-N 2.85Å; R499-G503 VanDerWaalsContact O-N 3.17Å; R499-A888 PolarHBondContact NH1-O 2.92Å; R499-D889 PolarHBondContact NH1-O 3.34Å; R499-P904 HydrophobicContact CB-CB 4.47Å; R499-P904 VanDerWaalsContact CD-CB 3.42Å; R499-F905 HydrophobicContact CB-CE2 4.08Å; R499-F905 HydrophobicContact CB-CZ 4.35Å
500	I	91.6	Very high	88.8	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-58.7	-44.5	172.9	-60.4	170.4	0	0	0	110.2	A483 Q484 L487 C494 P497 L498 L502 G503 F905 G922	A483-I500 HydrophobicContact CB-CD1 4.44Å; A483-I500 HydrophobicContact CB-CG2 3.97Å; Q484-I500 HydrophobicContact CB-CD1 3.77Å; Q484-I500 HydrophobicContact CG-CD1 4.41Å; L487-I500 HydrophobicContact CD1-CD1 4.23Å; L487-I500 HydrophobicContact CD1-CG1 4.21Å; L487-I500 HydrophobicContact CD1-CG2 4.37Å; C494-I500 HydrophobicContact CB-CD1 4.42Å; C494-I500 HydrophobicContact CB-CG1 4.44Å; P497-I500 HydrophobicContact CB-CD1 4.47Å; P497-I500 VanDerWaalsContact O-CB 3.25Å; P497-I500 WeakPolarHBondContact O-CB 3.31Å; P497-I500 VanDerWaalsContact O-CG1 3.29Å; P497-I500 WeakPolarHBondContact O-CG1 3.43Å; P497-I500 PolarHBondContact O-N 2.85Å; L498-I500 VanDerWaalsContact C-N 3.27Å; L498-I500 PolarHBondContact O-N 3.43Å; I500-L502 VanDerWaalsContact C-N 3.27Å; I500-L502 PolarHBondContact O-N 3.39Å; I500-G503 PolarHBondContact O-N 3.44Å; I500-G503 VanDerWaalsContact O-N 3.08Å; I500-F905 HydrophobicContact CB-CZ 4.48Å; I500-F905 HydrophobicContact CG1-CE1 3.85Å; I500-F905 HydrophobicContact CG1-CZ 3.89Å; I500-G922 WeakPolarHBondContact O-CA 3.47Å
501	N	90.4	Very high	89.1	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.1	-29	178.4	-75.7	-10.8	0	0	0	113	F418 L498 R499 G504 S925 L926	F418-N501 HydrophobicContact CE1-CB 4.42Å; L498-N501 PolarHBondContact O-N 3.05Å; R499-N501 VanDerWaalsContact C-N 3.3Å; R499-N501 PolarHBondContact O-N 3.22Å; N501-G504 PolarHBondContact O-N 3.45Å; N501-S925 VanDerWaalsContact OD1-CB 3.28Å; N501-S925 WeakPolarHBondContact OD1-CB 3.32Å; N501-S925 PolarHBondContact OD1-OG 3.13Å; N501-L926 HydrophobicContact CB-CD1 4.27Å; N501-L926 PolarHBondContact OD1-N 2.86Å
502	L	88.8	Confident	89.2	Confident	21 Å²	21	20.9 Å²	20.9	11%	0.11	10%	0.103	C	C	.	.	H	α-helix	trans	-70.2	-33.8	173.2	-67	176.9	0	0	0	112	I416 F418 R499 I500 G504 K505 L506 V890	I416-L502 HydrophobicContact CG2-CD1 3.78Å; I416-L502 HydrophobicContact CG2-CD2 4.48Å; I416-L502 HydrophobicContact CG2-CG 4.36Å; F418-L502 HydrophobicContact CB-CD2 4.33Å; F418-L502 HydrophobicContact CD2-CD2 3.53Å; F418-L502 HydrophobicContact CE2-CD2 4.04Å; F418-L502 HydrophobicContact CG-CD2 4.09Å; R499-L502 HydrophobicContact CG-CD1 4.33Å; R499-L502 WeakPolarHBondContact O-CB 3.19Å; R499-L502 PolarHBondContact O-N 3.1Å; R499-L502 VanDerWaalsContact O-N 3.12Å; I500-L502 VanDerWaalsContact C-N 3.27Å; I500-L502 PolarHBondContact O-N 3.39Å; L502-G504 PolarHBondContact O-N 3.2Å; L502-G504 VanDerWaalsContact O-N 3.11Å; L502-K505 WeakPolarHBondContact O-CA 3.41Å; L502-K505 WeakPolarHBondContact O-CB 3.24Å; L502-K505 PolarHBondContact O-N 3.39Å; L502-L506 PolarHBondContact O-N 2.85Å; L502-V890 HydrophobicContact CB-CG2 3.93Å
503	G	90.8	Very high	89.1	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-51.7	-34.3	172.3	0	0	0	0	0	113	R499 I500 K505 L506	R499-G503 PolarHBondContact O-N 2.85Å; R499-G503 VanDerWaalsContact O-N 3.17Å; I500-G503 PolarHBondContact O-N 3.44Å; I500-G503 VanDerWaalsContact O-N 3.08Å; G503-K505 PolarHBondContact O-N 3.33Å; G503-L506 PolarHBondContact O-N 3.4Å
504	G	90.3	Very high	88.7	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-11.6	176.1	0	0	0	0	0	115.5	N501 L502 G922	N501-G504 PolarHBondContact O-N 3.45Å; L502-G504 PolarHBondContact O-N 3.2Å; L502-G504 VanDerWaalsContact O-N 3.11Å; G504-G922 VanDerWaalsContact CA-C 3.43Å
505	K	90.1	Very high	88.4	Confident	31 Å²	31	19.4 Å²	19.4	14%	0.135	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-5.9	-180	-65.5	-56.2	-172.1	-142	0	114.5	F418 L502 G503 Q507 C871 L926 P991 P992 G993	F418-K505 HydrophobicContact CE2-CG 4.12Å; L502-K505 WeakPolarHBondContact O-CA 3.41Å; L502-K505 WeakPolarHBondContact O-CB 3.24Å; L502-K505 PolarHBondContact O-N 3.39Å; G503-K505 PolarHBondContact O-N 3.33Å; K505-Q507 VanDerWaalsContact O-CG 3.24Å; K505-Q507 WeakPolarHBondContact O-CG 3.18Å; K505-Q507 PolarHBondContact O-N 3.44Å; K505-C871 HydrophobicContact CB-CB 4.36Å; K505-C871 WeakPolarHBondContact O-CB 3.36Å; K505-L926 HydrophobicContact CD-CD2 4.13Å; K505-L926 HydrophobicContact CG-CD2 4.31Å; K505-P991 VanDerWaalsContact NZ-C 3.26Å; K505-P991 PolarHBondContact NZ-O 2.81Å; K505-P992 PolarHBondContact NZ-O 3.01Å; K505-G993 VanDerWaalsContact CE-CA 3.41Å
506	L	92.3	Very high	88.8	Confident	2 Å²	2	15.8 Å²	15.8	1%	0.01	8%	0.082	C	C	.	.			trans	-49.3	133.2	-179.4	-77.5	175.1	0	0	0	111.6	L502 G503 V890 I919	L502-L506 PolarHBondContact O-N 2.85Å; G503-L506 PolarHBondContact O-N 3.4Å; L506-V890 HydrophobicContact CD1-CB 4.05Å; L506-V890 HydrophobicContact CD1-CG1 4.04Å; L506-V890 HydrophobicContact CD1-CG2 4.28Å; L506-V890 HydrophobicContact CD2-CB 4.07Å; L506-V890 HydrophobicContact CD2-CG2 4.14Å; L506-V890 HydrophobicContact CG-CB 4.36Å; L506-V890 HydrophobicContact CG-CG2 4.21Å; L506-I919 HydrophobicContact CB-CG1 4.36Å; L506-I919 HydrophobicContact CD1-CD1 4.39Å; L506-I919 HydrophobicContact CD1-CG1 3.79Å
507	Q	92.3	Very high	89.5	Confident	15 Å²	15	13 Å²	13	7%	0.07	7%	0.068	C	C	.	.			trans	-118.4	-30.5	-178.6	-52.7	-160.6	-128.7	0	0	111.6	K505 R744 Y870 C871 R990	K505-Q507 VanDerWaalsContact O-CG 3.24Å; K505-Q507 WeakPolarHBondContact O-CG 3.18Å; K505-Q507 PolarHBondContact O-N 3.44Å; Q507-R744 PolarHBondContact O-N 2.86Å; Q507-Y870 HydrophobicContact CB-CD1 3.99Å; Q507-C871 HydrophobicContact CG-CB 4.13Å; Q507-C871 PolarHBondContact N-O 3.26Å; Q507-R990 VanDerWaalsContact CG-NH1 3.27Å
508	L	94.8	Very high	89.7	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	138.9	-177.5	-178.5	154.8	0	0	0	107.7	C510 R744 V746 L865 Y870 C871 V872 G873	L508-C510 VanDerWaalsContact CD2-SG 3.52Å; L508-R744 CarbonylContact C-O 3.59Å; L508-R744 VanDerWaalsContact CA-O 3.22Å; L508-R744 WeakPolarHBondContact CA-O 3.22Å; L508-R744 HydrophobicContact CB-CB 4.29Å; L508-R744 HydrophobicContact CD1-CB 4.3Å; L508-R744 HydrophobicContact CD1-CG 4.11Å; L508-R744 HydrophobicContact CG-CB 4.16Å; L508-R744 HydrophobicContact CG-CG 4.3Å; L508-V746 HydrophobicContact CD1-CG2 3.81Å; L508-V746 HydrophobicContact CD2-CB 4.47Å; L508-V746 HydrophobicContact CD2-CG2 4.08Å; L508-V746 HydrophobicContact CG-CG2 3.96Å; L508-L865 HydrophobicContact CD1-CD1 4.26Å; L508-L865 HydrophobicContact CD1-CD2 4.09Å; L508-L865 HydrophobicContact CD2-CD1 3.9Å; L508-Y870 HydrophobicContact CB-CD1 4.32Å; L508-C871 PolarHBondContact N-O 3.39Å; L508-V872 HydrophobicContact CD2-CG1 4.12Å; L508-G873 PolarHBondContact O-N 3.08Å
509	V	96.9	Very high	89.9	Confident	1 Å²	1	12 Å²	12	1%	0.006	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	122.5	171.7	-174.3	0	0	0	0	108.2	F511 I743 R744 A745 V746 G873 C875 V915	V509-F511 HydrophobicContact CB-CD2 4.41Å; V509-F511 HydrophobicContact CB-CE2 3.7Å; V509-F511 HydrophobicContact CB-CZ 4.03Å; V509-F511 HydrophobicContact CG1-CD2 4.13Å; V509-F511 HydrophobicContact CG1-CE1 4.11Å; V509-F511 HydrophobicContact CG1-CE2 3.6Å; V509-F511 HydrophobicContact CG1-CZ 3.58Å; V509-I743 HydrophobicContact CG2-CG2 4.09Å; V509-R744 PolarHBondContact N-O 2.84Å; V509-A745 WeakPolarHBondContact O-CA 3.44Å; V509-V746 PolarHBondContact O-N 2.9Å; V509-G873 CarbonylContact C-O 3.54Å; V509-G873 WeakPolarHBondContact CA-O 3.27Å; V509-C875 HydrophobicContact CG1-CB 4.42Å; V509-V915 HydrophobicContact CG1-CG1 4.22Å; V509-V915 HydrophobicContact CG2-CG1 4.14Å
510	C	96.9	Very high	88.9	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	134.8	167.9	-62.9	0	0	0	0	108.7	L508 V746 V748 G873 M874 C875	L508-C510 VanDerWaalsContact CD2-SG 3.52Å; C510-V746 CarbonylContact C-O 3.56Å; C510-V746 VanDerWaalsContact CA-O 3.27Å; C510-V746 WeakPolarHBondContact CA-O 3.23Å; C510-V748 HydrophobicContact CB-CG2 4.03Å; C510-G873 PolarHBondContact N-O 2.91Å; C510-M874 HydrophobicContact CB-SD 3.48Å; C510-M874 WeakPolarHBondContact CB-SD 3.11Å; C510-M874 CarbonylContact O-C 3.44Å; C510-M874 WeakPolarHBondContact O-CA 3.14Å; C510-C875 PolarHBondContact O-N 3.24Å
511	F	95.8	Very high	87.6	Confident	0 Å²	0	17 Å²	17	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	131.2	177.5	-68.9	-87.3	0	0	0	109.4	V509 T516 L517 I735 L738 A745 V746 M747 V748 M765 C875 I912 V915	V509-F511 HydrophobicContact CB-CD2 4.41Å; V509-F511 HydrophobicContact CB-CE2 3.7Å; V509-F511 HydrophobicContact CB-CZ 4.03Å; V509-F511 HydrophobicContact CG1-CD2 4.13Å; V509-F511 HydrophobicContact CG1-CE1 4.11Å; V509-F511 HydrophobicContact CG1-CE2 3.6Å; V509-F511 HydrophobicContact CG1-CZ 3.58Å; F511-T516 HydrophobicContact CD1-CG2 4.33Å; F511-L517 HydrophobicContact CB-CD1 4.01Å; F511-L517 HydrophobicContact CB-CD2 4.1Å; F511-L517 HydrophobicContact CB-CG 4.16Å; F511-L517 HydrophobicContact CD1-CD2 4.09Å; F511-L517 HydrophobicContact CG-CD2 4.17Å; F511-I735 HydrophobicContact CD2-CD1 4.28Å; F511-I735 HydrophobicContact CE2-CD1 3.94Å; F511-I735 HydrophobicContact CZ-CD1 4.16Å; F511-L738 HydrophobicContact CE2-CD1 3.9Å; F511-L738 HydrophobicContact CZ-CD1 3.62Å; F511-A745 HydrophobicContact CD2-CB 4.27Å; F511-A745 HydrophobicContact CE2-CB 4.04Å; F511-V746 PolarHBondContact N-O 2.87Å; F511-M747 WeakPolarHBondContact O-CA 3.05Å; F511-V748 PolarHBondContact O-N 3.15Å; F511-M765 HydrophobicContact CB-CE 4.15Å; F511-M765 HydrophobicContact CD2-CE 3.89Å; F511-M765 HydrophobicContact CG-CE 4.2Å; F511-C875 WeakPolarHBondContact CA-O 3.42Å; F511-C875 HydrophobicContact CD1-CB 3.85Å; F511-C875 HydrophobicContact CE1-CB 3.97Å; F511-I912 HydrophobicContact CD1-CG2 4.18Å; F511-I912 HydrophobicContact CE1-CB 4.2Å; F511-I912 HydrophobicContact CE1-CD1 4.35Å; F511-I912 HydrophobicContact CE1-CG2 4.15Å; F511-V915 HydrophobicContact CE1-CG2 3.94Å; F511-V915 HydrophobicContact CZ-CG1 4.26Å; F511-V915 HydrophobicContact CZ-CG2 4.33Å
512	D	92.6	Very high	86.8	Confident	9 Å²	9	18 Å²	18	5%	0.048	10%	0.101	C	C	.	.			trans	-67.9	159.2	159.6	-167.2	66.3	0	0	0	110.5	T514 T516 L517 V748 K858 M874 C875 D881	D512-T514 PolarHBondContact OD2-N 3.19Å; D512-T514 VanDerWaalsContact OD2-O 3.12Å; D512-T516 VanDerWaalsContact O-CB 3.27Å; D512-T516 WeakPolarHBondContact O-CB 3.27Å; D512-T516 WeakPolarHBondContact O-CG2 3.3Å; D512-L517 WeakPolarHBondContact O-CD1 3.44Å; D512-L517 VanDerWaalsContact O-CG 3.25Å; D512-L517 WeakPolarHBondContact O-CG 3.41Å; D512-V748 WeakPolarHBondContact CA-O 3.48Å; D512-K858 IonicContact OD1-NZ 3.56Å; D512-K858 PolarHBondContact OD1-NZ 3.48Å; D512-M874 HydrophobicContact CB-CE 4.4Å; D512-C875 PolarHBondContact N-O 2.79Å; D512-D881 VanDerWaalsContact CB-OD2 3.23Å; D512-D881 WeakPolarHBondContact CB-OD2 3.4Å
513	K	88.6	Confident	86.5	Confident	1 Å²	1	19.8 Å²	19.8	0%	0.004	11%	0.111	C	C	.	.	S	Bend	trans	-93.6	-55.5	-178.4	-173.1	-122.8	57.1	152.1	0	111.5	L517 T518 N725 M747 T749 D751 V759	K513-L517 PolarHBondContact O-N 3.36Å; K513-T518 HydrophobicContact CD-CG2 4.27Å; K513-T518 HydrophobicContact CG-CG2 4.23Å; K513-T518 PolarHBondContact O-N 3.16Å; K513-T518 PolarHBondContact O-OG1 3.25Å; K513-N725 PolarHBondContact NZ-ND2 3.46Å; K513-N725 VanDerWaalsContact NZ-ND2 3.12Å; K513-M747 HydrophobicContact CB-CG 4.36Å; K513-M747 HydrophobicContact CB-SD 4.21Å; K513-M747 HydrophobicContact CG-CE 4.48Å; K513-M747 HydrophobicContact CG-SD 4.13Å; K513-T749 HydrophobicContact CB-CG2 4.19Å; K513-T749 WeakPolarHBondContact CB-OG1 3.44Å; K513-D751 HydrophobicContact CD-CB 4.46Å; K513-D751 WeakPolarHBondContact CD-OD2 3.44Å; K513-D751 WeakPolarHBondContact CE-OD2 3.4Å; K513-D751 IonicContact NZ-OD2 3.15Å; K513-D751 PolarHBondContact NZ-OD2 2.72Å; K513-V759 HydrophobicContact CD-CG2 4.32Å; K513-V759 HydrophobicContact CG-CG1 4Å
514	T	81.4	Confident	86.4	Confident	54 Å²	54	20.8 Å²	20.8	33%	0.331	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	133	-170.3	-57.1	0	0	0	0	108.2	D512 T516	D512-T514 PolarHBondContact OD2-N 3.19Å; D512-T514 VanDerWaalsContact OD2-O 3.12Å; T514-T516 PolarHBondContact O-N 3.32Å
515	G	79.7	Confident	86.3	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.01	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	-5.9	-176	0	0	0	0	0	117.3	T518 D520 K728 D877	G515-T518 CarbonylContact C-O 3.47Å; G515-T518 VanDerWaalsContact CA-O 3.28Å; G515-T518 WeakPolarHBondContact CA-O 3.46Å; G515-T518 PolarHBondContact N-O 2.88Å; G515-D520 WeakPolarHBondContact CA-OD1 3.49Å; G515-K728 PolarHBondContact O-NZ 3.23Å; G515-D877 VanDerWaalsContact C-OD2 3.28Å; G515-D877 WeakPolarHBondContact CA-OD2 3.06Å
516	T	87.8	Confident	86.5	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-60.5	171	-63.9	0	0	0	0	111.9	F511 D512 T514 G876 D877 L894 I912	F511-T516 HydrophobicContact CD1-CG2 4.33Å; D512-T516 VanDerWaalsContact O-CB 3.27Å; D512-T516 WeakPolarHBondContact O-CB 3.27Å; D512-T516 WeakPolarHBondContact O-CG2 3.3Å; T514-T516 PolarHBondContact O-N 3.32Å; T516-G876 WeakPolarHBondContact OG1-CA 3.34Å; T516-D877 PolarHBondContact OG1-N 3.47Å; T516-D877 PolarHBondContact OG1-OD1 3.38Å; T516-L894 HydrophobicContact CG2-CD1 3.97Å; T516-I912 HydrophobicContact CG2-CG2 3.84Å; T516-I912 WeakPolarHBondContact O-CG2 3.47Å
517	L	90.6	Very high	86.5	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-34.5	178.7	-63.8	171.3	0	0	0	112.2	F511 D512 K513 K728 T731 I735 M747 M765 I912	F511-L517 HydrophobicContact CB-CD1 4.01Å; F511-L517 HydrophobicContact CB-CD2 4.1Å; F511-L517 HydrophobicContact CB-CG 4.16Å; F511-L517 HydrophobicContact CD1-CD2 4.09Å; F511-L517 HydrophobicContact CG-CD2 4.17Å; D512-L517 WeakPolarHBondContact O-CD1 3.44Å; D512-L517 VanDerWaalsContact O-CG 3.25Å; D512-L517 WeakPolarHBondContact O-CG 3.41Å; K513-L517 PolarHBondContact O-N 3.36Å; L517-K728 PolarHBondContact O-N 3.49Å; L517-T731 HydrophobicContact CB-CG2 4.07Å; L517-T731 HydrophobicContact CD2-CG2 3.66Å; L517-T731 HydrophobicContact CG-CG2 4.45Å; L517-T731 PolarHBondContact O-OG1 2.92Å; L517-I735 HydrophobicContact CD2-CD1 4.38Å; L517-M747 HydrophobicContact CD1-CE 3.74Å; L517-M747 HydrophobicContact CD1-CG 4.34Å; L517-M765 HydrophobicContact CD1-CE 3.57Å; L517-M765 HydrophobicContact CD2-CE 3.95Å; L517-M765 HydrophobicContact CG-CE 4.44Å; L517-I912 HydrophobicContact CD2-CD1 3.92Å
518	T	86.9	Confident	86.6	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	-101.1	163.8	175.7	67	0	0	0	0	110.4	K513 G515 N725 L726 L727 K728 V759	K513-T518 HydrophobicContact CD-CG2 4.27Å; K513-T518 HydrophobicContact CG-CG2 4.23Å; K513-T518 PolarHBondContact O-N 3.16Å; K513-T518 PolarHBondContact O-OG1 3.25Å; G515-T518 CarbonylContact C-O 3.47Å; G515-T518 VanDerWaalsContact CA-O 3.28Å; G515-T518 WeakPolarHBondContact CA-O 3.46Å; G515-T518 PolarHBondContact N-O 2.88Å; T518-N725 HydrophobicContact CG2-CB 4.3Å; T518-L726 CarbonylContact C-O 3.55Å; T518-L726 WeakPolarHBondContact CA-O 3.28Å; T518-L726 WeakPolarHBondContact CB-O 3.41Å; T518-L727 HydrophobicContact CG2-CD2 4.31Å; T518-K728 WeakPolarHBondContact O-CE 3.42Å; T518-V759 HydrophobicContact CG2-CG1 4.22Å; T518-V759 HydrophobicContact CG2-CG2 4.49Å
519	E	83.1	Confident	86.5	Confident	82 Å²	82	21.1 Å²	21.1	38%	0.383	12%	0.121	S	C	.	.			trans	-63.6	159.6	169.1	-63.3	-179.4	170.5	0	0	111.1	G521 L726 K728	E519-G521 PolarHBondContact O-N 2.92Å; E519-L726 PolarHBondContact N-O 2.81Å; E519-K728 HydrophobicContact CG-CG 3.98Å
520	D	64.6	Low	86.2	Confident	105 Å²	105	22.4 Å²	22.4	56%	0.561	13%	0.128	S	C	*	.	S	Bend	trans	-75.7	-12.7	-174.5	-58.7	0.7	0	0	0	112.1	G515 K728	G515-D520 WeakPolarHBondContact CA-OD1 3.49Å; D520-K728 IonicContact OD1-NZ 3.26Å
521	G	64.3	Low	85.7	Confident	34 Å²	34	30 Å²	30	35%	0.351	16%	0.161	S	C	.	.			trans	-107.7	152.1	-178.4	0	0	0	0	0	114.1	E519	E519-G521 PolarHBondContact O-N 2.92Å
522	L	75	Confident	85	Confident	21 Å²	21	33 Å²	33	11%	0.11	19%	0.191	C	C	.	.			trans	-99.8	138	167.6	-75.8	154.8	0	0	0	108.7	M572 K575 R685 M723 N725	L522-M572 HydrophobicContact CD1-CB 3.82Å; L522-M572 HydrophobicContact CD1-CG 3.9Å; L522-K575 VanDerWaalsContact O-CG 3.31Å; L522-K575 WeakPolarHBondContact O-CG 3.24Å; L522-R685 HydrophobicContact CD2-CB 4.36Å; L522-M723 HydrophobicContact CB-CE 3.58Å; L522-M723 HydrophobicContact CB-SD 4.31Å; L522-M723 HydrophobicContact CD1-CE 4.35Å; L522-M723 HydrophobicContact CD1-SD 4.32Å; L522-M723 HydrophobicContact CD2-CB 4.17Å; L522-M723 HydrophobicContact CG-CE 4.5Å; L522-N725 WeakPolarHBondContact CD2-OD1 3.43Å
523	D	82.2	Confident	84.5	Confident	60 Å²	60	37.7 Å²	37.7	32%	0.321	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.2	173.7	-171.5	29.8	0	0	0	110.3	M525 M723 R724	D523-M525 PolarHBondContact O-N 3.03Å; D523-M723 CarbonylContact O-C 3.59Å; D523-M723 WeakPolarHBondContact O-CA 3.43Å; D523-R724 HydrophobicContact CB-CG 3.82Å; D523-R724 PolarHBondContact N-O 3.28Å; D523-R724 PolarHBondContact O-N 3.45Å; D523-R724 IonicContact OD2-CZ 2.68Å; D523-R724 IonicContact OD2-NE 3.17Å; D523-R724 PolarHBondContact OD2-NE 3.4Å; D523-R724 IonicContact OD2-NH2 3.63Å; D523-R724 PolarHBondContact OD2-NH2 3.21Å
524	V	87.9	Confident	84.5	Confident	20 Å²	20	40.4 Å²	40.4	12%	0.121	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	115.3	-179.1	176.6	0	0	0	0	107.8	P542 K575 L721 M723	V524-P542 HydrophobicContact CG1-CG 4.11Å; V524-K575 HydrophobicContact CG2-CB 4.24Å; V524-L721 HydrophobicContact CG1-CD1 3.93Å; V524-M723 HydrophobicContact CG2-CE 3.82Å
525	M	89.4	Confident	84.9	Confident	39 Å²	39	39 Å²	39	19%	0.192	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-36.5	175.6	-165.3	-86.2	-74	0	0	110.8	D523 L538 P540 Y679 Y684 V722	D523-M525 PolarHBondContact O-N 3.03Å; M525-L538 HydrophobicContact CE-CD1 3.26Å; M525-L538 HydrophobicContact CE-CD2 4.1Å; M525-L538 HydrophobicContact CE-CG 4.29Å; M525-L538 HydrophobicContact SD-CD1 3.66Å; M525-L538 HydrophobicContact SD-CD2 3.38Å; M525-L538 WeakPolarHBondContact SD-CD2 3.36Å; M525-L538 HydrophobicContact SD-CG 4.16Å; M525-P540 WeakPolarHBondContact O-CA 3.29Å; M525-Y679 HydrophobicContact CE-CD1 4.32Å; M525-Y679 HydrophobicContact CE-CE1 3.85Å; M525-Y684 HydrophobicContact CG-CE1 4.27Å; M525-V722 HydrophobicContact CB-CG1 4.43Å; M525-V722 WeakPolarHBondContact CB-O 3.49Å; M525-V722 HydrophobicContact CE-CB 4.05Å; M525-V722 HydrophobicContact CE-CG1 3.59Å; M525-V722 PolarHBondContact N-O 3.37Å
526	G	92.6	Very high	85.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160	-171.8	175.5	0	0	0	0	0	112.1	V539 V722	G526-V539 CarbonylContact C-O 3.55Å; G526-V539 WeakPolarHBondContact CA-O 3.3Å; G526-V722 PolarHBondContact N-O 2.95Å; G526-V722 PolarHBondContact O-N 2.89Å
527	V	93.8	Very high	85.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	138	178.1	179	0	0	0	0	108.6	P529 L538 V539 P542 L545 L550 L554 L720 L721	V527-P529 WeakPolarHBondContact O-CD 3.24Å; V527-L538 WeakPolarHBondContact O-CA 3.37Å; V527-V539 PolarHBondContact N-O 2.84Å; V527-V539 PolarHBondContact O-N 2.93Å; V527-P542 HydrophobicContact CG2-CB 4.18Å; V527-P542 HydrophobicContact CG2-CG 3.8Å; V527-L545 HydrophobicContact CB-CD1 4.37Å; V527-L545 HydrophobicContact CG1-CD1 4.37Å; V527-L550 HydrophobicContact CG1-CD1 4.13Å; V527-L550 HydrophobicContact CG1-CD2 3.81Å; V527-L550 HydrophobicContact CG1-CG 4.23Å; V527-L554 HydrophobicContact CG1-CD1 4.36Å; V527-L554 HydrophobicContact CG2-CD1 3.76Å; V527-L554 HydrophobicContact CG2-CD2 4.15Å; V527-L720 CarbonylContact C-O 3.52Å; V527-L720 WeakPolarHBondContact CA-O 3.49Å; V527-L721 HydrophobicContact CG2-CD1 3.8Å
528	V	94.2	Very high	85.6	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	100.7	174.1	-172.2	0	0	0	0	107.4	F535 L536 L538 M675 Y679 G719 L720 V722	V528-F535 HydrophobicContact CG1-CB 4.07Å; V528-F535 HydrophobicContact CG1-CD1 3.75Å; V528-F535 HydrophobicContact CG1-CG 4.22Å; V528-L536 VanDerWaalsContact CG1-O 3.28Å; V528-L536 WeakPolarHBondContact CG1-O 3.39Å; V528-L538 HydrophobicContact CG2-CB 4.2Å; V528-L538 HydrophobicContact CG2-CD1 3.87Å; V528-L538 HydrophobicContact CG2-CG 4.47Å; V528-M675 HydrophobicContact CG1-SD 3.98Å; V528-Y679 HydrophobicContact CG2-CE2 3.81Å; V528-G719 CarbonylContact O-C 3.05Å; V528-G719 WeakPolarHBondContact O-CA 3.22Å; V528-L720 HydrophobicContact CB-CB 4.2Å; V528-L720 PolarHBondContact N-O 2.84Å; V528-L720 PolarHBondContact O-N 2.89Å; V528-V722 HydrophobicContact CG2-CG2 3.91Å
529	P	92.1	Very high	85.9	Confident	15 Å²	15	51.5 Å²	51.5	10%	0.097	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	154.5	-177.8	-12.9	29.5	0	0	0	111.4	V527 L536 V539 L545 L550	V527-P529 WeakPolarHBondContact O-CD 3.24Å; P529-L536 HydrophobicContact CB-CB 4.31Å; P529-L536 HydrophobicContact CB-CD1 4.23Å; P529-L536 HydrophobicContact CG-CB 4.4Å; P529-L536 PolarHBondContact O-N 3.08Å; P529-V539 HydrophobicContact CG-CG2 3.95Å; P529-L545 HydrophobicContact CG-CD2 3.96Å; P529-L550 HydrophobicContact CB-CD2 3.7Å; P529-L550 HydrophobicContact CG-CD2 4.19Å
530	L	90.6	Very high	86.1	Confident	28 Å²	28	51.8 Å²	51.8	15%	0.147	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135.3	171.5	-167.6	72.3	0	0	0	111.1	A534 F535 T667 P669 L717 L718	L530-A534 WeakPolarHBondContact CD1-O 3.33Å; L530-F535 HydrophobicContact CD1-CD1 3.73Å; L530-F535 HydrophobicContact CD1-CD2 4.4Å; L530-F535 HydrophobicContact CD1-CE1 3.88Å; L530-F535 HydrophobicContact CD1-CG 4.02Å; L530-F535 HydrophobicContact CD1-CZ 4.29Å; L530-T667 WeakPolarHBondContact CD2-O 3.47Å; L530-P669 HydrophobicContact CD1-CG 3.27Å; L530-P669 HydrophobicContact CD2-CG 4.18Å; L530-P669 HydrophobicContact CG-CG 4.35Å; L530-L717 HydrophobicContact CD2-CB 4.04Å; L530-L717 HydrophobicContact CD2-CD2 4.12Å; L530-L717 HydrophobicContact CD2-CG 4.16Å; L530-L717 WeakPolarHBondContact CD2-O 3.45Å; L530-L718 VanDerWaalsContact CB-O 3.23Å; L530-L718 WeakPolarHBondContact CB-O 3.35Å; L530-L718 PolarHBondContact N-O 3Å
531	K	86.3	Confident	87.2	Confident	160 Å²	160	50.6 Å²	50.6	70%	0.696	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	111.4	170.6	-169.3	175.8	-177	178.5	0	109.7	Q533 A534 L536	K531-Q533 PolarHBondContact O-N 3.47Å; K531-A534 PolarHBondContact N-O 2.84Å; K531-A534 PolarHBondContact O-N 3.39Å; K531-L536 HydrophobicContact CB-CD1 4Å; K531-L536 HydrophobicContact CB-CG 4.26Å
532	G	82.2	Confident	88.3	Confident	62 Å²	62	49.1 Å²	49.1	64%	0.639	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	-121.9	-170.5	0	0	0	0	0	110.3
533	Q	82.2	Confident	88.8	Confident	109 Å²	109	54.5 Å²	54.5	51%	0.509	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	16.6	176.1	-70.6	-172	-1.3	0	0	113.8	K531 E666 P669	K531-Q533 PolarHBondContact O-N 3.47Å; Q533-E666 WeakPolarHBondContact CG-O 3.24Å; Q533-E666 PolarHBondContact NE2-O 2.89Å; Q533-P669 VanDerWaalsContact O-CB 3.3Å; Q533-P669 WeakPolarHBondContact O-CB 3.07Å
534	A	87.6	Confident	88.8	Confident	57 Å²	57	59.2 Å²	59.2	47%	0.471	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132.4	-179.3	0	0	0	0	0	111.7	L530 K531	L530-A534 WeakPolarHBondContact CD1-O 3.33Å; K531-A534 PolarHBondContact N-O 2.84Å; K531-A534 PolarHBondContact O-N 3.39Å
535	F	90.4	Very high	88.7	Confident	24 Å²	24	58.7 Å²	58.7	11%	0.105	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	135.2	169.5	-75.2	-69.3	0	0	0	111.1	V528 L530 P669 F672 M675 L717 L720	V528-F535 HydrophobicContact CG1-CB 4.07Å; V528-F535 HydrophobicContact CG1-CD1 3.75Å; V528-F535 HydrophobicContact CG1-CG 4.22Å; L530-F535 HydrophobicContact CD1-CD1 3.73Å; L530-F535 HydrophobicContact CD1-CD2 4.4Å; L530-F535 HydrophobicContact CD1-CE1 3.88Å; L530-F535 HydrophobicContact CD1-CG 4.02Å; L530-F535 HydrophobicContact CD1-CZ 4.29Å; F535-P669 HydrophobicContact CD2-CB 4.19Å; F535-P669 HydrophobicContact CD2-CG 4Å; F535-P669 HydrophobicContact CE2-CB 3.9Å; F535-P669 HydrophobicContact CE2-CG 3.63Å; F535-P669 HydrophobicContact CZ-CG 4.05Å; F535-F672 HydrophobicContact CE2-CB 4.39Å; F535-F672 HydrophobicContact CE2-CD2 4.23Å; F535-F672 AromaticContact CZ-CD2 3.8Å; F535-F672 HydrophobicContact CZ-CD2 3.8Å; F535-F672 HydrophobicContact CZ-CE2 4.43Å; F535-M675 HydrophobicContact CB-CE 3.73Å; F535-M675 HydrophobicContact CB-SD 3.41Å; F535-M675 WeakPolarHBondContact CB-SD 3.38Å; F535-M675 HydrophobicContact CD1-SD 4.06Å; F535-M675 HydrophobicContact CD2-CB 4.32Å; F535-M675 HydrophobicContact CD2-CE 3.98Å; F535-M675 HydrophobicContact CD2-CG 4.41Å; F535-M675 HydrophobicContact CD2-SD 3.45Å; F535-M675 WeakPolarHBondContact CD2-SD 3.45Å; F535-M675 HydrophobicContact CE2-CB 4.35Å; F535-M675 HydrophobicContact CE2-SD 4.18Å; F535-M675 HydrophobicContact CG-CE 4.12Å; F535-M675 HydrophobicContact CG-SD 3.36Å; F535-M675 WeakPolarHBondContact CG-SD 3.4Å; F535-L717 HydrophobicContact CZ-CD2 4.45Å; F535-L720 HydrophobicContact CE1-CD1 4.01Å; F535-L720 HydrophobicContact CE1-CG 3.96Å; F535-L720 HydrophobicContact CZ-CD1 4.05Å; F535-L720 HydrophobicContact CZ-CG 4.3Å
536	L	89.9	Confident	88.4	Confident	75 Å²	75	61.5 Å²	61.5	39%	0.393	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-88.6	161.8	172.7	-65.4	178.8	0	0	0	110.5	V528 P529 K531	V528-L536 VanDerWaalsContact CG1-O 3.28Å; V528-L536 WeakPolarHBondContact CG1-O 3.39Å; P529-L536 HydrophobicContact CB-CB 4.31Å; P529-L536 HydrophobicContact CB-CD1 4.23Å; P529-L536 HydrophobicContact CG-CB 4.4Å; P529-L536 PolarHBondContact O-N 3.08Å; K531-L536 HydrophobicContact CB-CD1 4Å; K531-L536 HydrophobicContact CB-CG 4.26Å
537	P	90.8	Very high	87.6	Confident	110 Å²	110	64.4 Å²	64.4	71%	0.714	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-54.6	148.5	173.6	-25.7	35	0	0	0	112.5	V539	P537-V539 PolarHBondContact O-N 3.1Å
538	L	92.4	Very high	87.3	Confident	42 Å²	42	65 Å²	65	22%	0.22	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-60.9	129.5	177.9	178.1	129.6	0	0	0	111	M525 V527 V528 P540 Y679 V722	M525-L538 HydrophobicContact CE-CD1 3.26Å; M525-L538 HydrophobicContact CE-CD2 4.1Å; M525-L538 HydrophobicContact CE-CG 4.29Å; M525-L538 HydrophobicContact SD-CD1 3.66Å; M525-L538 HydrophobicContact SD-CD2 3.38Å; M525-L538 WeakPolarHBondContact SD-CD2 3.36Å; M525-L538 HydrophobicContact SD-CG 4.16Å; V527-L538 WeakPolarHBondContact O-CA 3.37Å; V528-L538 HydrophobicContact CG2-CB 4.2Å; V528-L538 HydrophobicContact CG2-CD1 3.87Å; V528-L538 HydrophobicContact CG2-CG 4.47Å; L538-P540 HydrophobicContact CD2-CG 4.24Å; L538-P540 WeakPolarHBondContact O-CD 3.21Å; L538-Y679 HydrophobicContact CD1-CE1 4.35Å; L538-V722 HydrophobicContact CD1-CB 4.11Å; L538-V722 HydrophobicContact CD1-CG2 4.02Å
539	V	92	Very high	87.1	Confident	38 Å²	38	67.4 Å²	67.4	23%	0.23	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-95.6	111.9	173.3	-178	0	0	0	0	108.3	G526 V527 P529 P537 E541 L545	G526-V539 CarbonylContact C-O 3.55Å; G526-V539 WeakPolarHBondContact CA-O 3.3Å; V527-V539 PolarHBondContact N-O 2.84Å; V527-V539 PolarHBondContact O-N 2.93Å; P529-V539 HydrophobicContact CG-CG2 3.95Å; P537-V539 PolarHBondContact O-N 3.1Å; V539-E541 VanDerWaalsContact C-N 3.35Å; V539-E541 PolarHBondContact O-N 3.4Å; V539-L545 HydrophobicContact CB-CD2 4.23Å; V539-L545 HydrophobicContact CG1-CD2 4.26Å; V539-L545 HydrophobicContact CG2-CD2 4.03Å
540	P	88.3	Confident	87.1	Confident	88 Å²	88	67.7 Å²	67.7	57%	0.571	37%	0.372	S	S	*	.	S	Bend	trans	-68	-31.7	-175	-20.9	32.6	0	0	0	113.9	M525 L538 P542	M525-P540 WeakPolarHBondContact O-CA 3.29Å; L538-P540 HydrophobicContact CD2-CG 4.24Å; L538-P540 WeakPolarHBondContact O-CD 3.21Å; P540-P542 WeakPolarHBondContact O-CD 3.45Å
541	E	87.3	Confident	87.1	Confident	79 Å²	79	66.8 Å²	66.8	37%	0.369	37%	0.368	S	S	.	.			trans	-112.6	100.7	-178.4	-75.6	-179.7	-146.6	0	0	110.6	V539 R543 R544	V539-E541 VanDerWaalsContact C-N 3.35Å; V539-E541 PolarHBondContact O-N 3.4Å; E541-R543 HydrophobicContact CB-CG 4.14Å; E541-R543 PolarHBondContact O-N 2.78Å; E541-R543 VanDerWaalsContact O-N 3.15Å; E541-R544 HydrophobicContact CB-CG 4.01Å; E541-R544 WeakPolarHBondContact O-CB 3.22Å; E541-R544 PolarHBondContact O-N 2.78Å; E541-R544 IonicContact OE1-CZ 3.54Å; E541-R544 IonicContact OE1-NE 3.58Å; E541-R544 IonicContact OE1-NH2 2.68Å; E541-R544 PolarHBondContact OE1-NH2 3.04Å; E541-R544 IonicContact OE2-CZ 3.14Å; E541-R544 IonicContact OE2-NE 3.86Å; E541-R544 PolarHBondContact OE2-NE 3.42Å; E541-R544 IonicContact OE2-NH2 2.83Å; E541-R544 PolarHBondContact OE2-NH2 3.3Å
542	P	87.6	Confident	87.3	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.019	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-58.9	-28.4	-176.8	-29.8	40	0	0	0	114.5	V524 V527 P540 R544 L545 L554 S579 T580	V524-P542 HydrophobicContact CG1-CG 4.11Å; V527-P542 HydrophobicContact CG2-CB 4.18Å; V527-P542 HydrophobicContact CG2-CG 3.8Å; P540-P542 WeakPolarHBondContact O-CD 3.45Å; P542-R544 PolarHBondContact O-N 3.43Å; P542-R544 VanDerWaalsContact O-N 3.12Å; P542-L545 HydrophobicContact CB-CD1 4.3Å; P542-L545 VanDerWaalsContact O-CB 3.28Å; P542-L545 WeakPolarHBondContact O-CB 3.42Å; P542-L545 WeakPolarHBondContact O-CD1 3.45Å; P542-L545 VanDerWaalsContact O-CG 3.28Å; P542-L545 WeakPolarHBondContact O-CG 3.43Å; P542-L545 PolarHBondContact O-N 3.29Å; P542-L554 HydrophobicContact CB-CD1 4.25Å; P542-S579 WeakPolarHBondContact CG-OG 3.43Å; P542-T580 HydrophobicContact CB-CG2 4.46Å
543	R	84.7	Confident	87.8	Confident	134 Å²	134	57.9 Å²	57.9	51%	0.506	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-57.6	-18.3	171.6	63	-179.9	65	-163	-1.4	115.3	E541 E578 S579 T580	E541-R543 HydrophobicContact CB-CG 4.14Å; E541-R543 PolarHBondContact O-N 2.78Å; E541-R543 VanDerWaalsContact O-N 3.15Å; R543-E578 PolarHBondContact NH2-O 3.02Å; R543-S579 PolarHBondContact N-O 2.89Å; R543-S579 VanDerWaalsContact N-O 3.15Å; R543-T580 WeakPolarHBondContact CB-O 3.34Å
544	R	83.6	Confident	88.3	Confident	160 Å²	160	52.7 Å²	52.7	60%	0.604	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-90.5	-0.2	177.1	-58.2	-173.3	-171.1	-176.7	3.5	113.2	E541 P542	E541-R544 HydrophobicContact CB-CG 4.01Å; E541-R544 WeakPolarHBondContact O-CB 3.22Å; E541-R544 PolarHBondContact O-N 2.78Å; E541-R544 IonicContact OE1-CZ 3.54Å; E541-R544 IonicContact OE1-NE 3.58Å; E541-R544 IonicContact OE1-NH2 2.68Å; E541-R544 PolarHBondContact OE1-NH2 3.04Å; E541-R544 IonicContact OE2-CZ 3.14Å; E541-R544 IonicContact OE2-NE 3.86Å; E541-R544 PolarHBondContact OE2-NE 3.42Å; E541-R544 IonicContact OE2-NH2 2.83Å; E541-R544 PolarHBondContact OE2-NH2 3.3Å; P542-R544 PolarHBondContact O-N 3.43Å; P542-R544 VanDerWaalsContact O-N 3.12Å
545	L	84.6	Confident	88.5	Confident	9 Å²	9	50 Å²	50	5%	0.047	26%	0.264	C	S	.	.	S	Bend	trans	-68.2	145.8	176.1	-69.9	169.2	0	0	0	110.7	V527 P529 V539 P542 L550 L551 L554	V527-L545 HydrophobicContact CB-CD1 4.37Å; V527-L545 HydrophobicContact CG1-CD1 4.37Å; P529-L545 HydrophobicContact CG-CD2 3.96Å; V539-L545 HydrophobicContact CB-CD2 4.23Å; V539-L545 HydrophobicContact CG1-CD2 4.26Å; V539-L545 HydrophobicContact CG2-CD2 4.03Å; P542-L545 HydrophobicContact CB-CD1 4.3Å; P542-L545 VanDerWaalsContact O-CB 3.28Å; P542-L545 WeakPolarHBondContact O-CB 3.42Å; P542-L545 WeakPolarHBondContact O-CD1 3.45Å; P542-L545 VanDerWaalsContact O-CG 3.28Å; P542-L545 WeakPolarHBondContact O-CG 3.43Å; P542-L545 PolarHBondContact O-N 3.29Å; L545-L550 HydrophobicContact CD1-CD2 4.22Å; L545-L550 HydrophobicContact CD1-CG 4.32Å; L545-L550 HydrophobicContact CD2-CD2 4.42Å; L545-L551 HydrophobicContact CB-CB 4.4Å; L545-L551 HydrophobicContact CB-CD1 4.44Å; L545-L554 HydrophobicContact CD1-CD1 3.73Å
546	P	83.1	Confident	88.5	Confident	97 Å²	97	48.8 Å²	48.8	63%	0.63	26%	0.259	S	S	*	.			trans	-62	146.9	172.4	27.3	-34	0	0	0	110.6	G548	P546-G548 PolarHBondContact O-N 3.07Å
547	V	77	Confident	88.6	Confident	61 Å²	61	45.2 Å²	45.2	37%	0.37	24%	0.24	S	C	.	.	S	Bend	trans	-63.1	110.1	174.7	174.9	0	0	0	0	107.9	L551 M614 P618	V547-L551 HydrophobicContact CG2-CD2 4.29Å; V547-M614 HydrophobicContact CB-CE 3.85Å; V547-M614 HydrophobicContact CG2-CE 3.49Å; V547-M614 VanDerWaalsContact CG2-CE 3.49Å; V547-M614 HydrophobicContact CG2-SD 4.07Å; V547-P618 HydrophobicContact CG2-CB 4.08Å
548	G	85.9	Confident	88.6	Confident	14 Å²	14	40 Å²	40	14%	0.144	21%	0.206	C	C	.	.	S	Bend	trans	-172.1	-173.7	-174.9	0	0	0	0	0	111.4	P546 L550 L551 R552	P546-G548 PolarHBondContact O-N 3.07Å; G548-L550 VanDerWaalsContact C-N 3.28Å; G548-L550 PolarHBondContact O-N 2.8Å; G548-L551 PolarHBondContact O-N 3.11Å; G548-R552 PolarHBondContact O-N 2.93Å
549	P	89.7	Confident	88.3	Confident	50 Å²	50	39.3 Å²	39.3	33%	0.325	21%	0.206	S	C	.	.	H	α-helix	trans	-56.7	-38.1	-173.2	-27	34.8	0	0	0	113.9	R552 A553 Y651 L718	P549-R552 PolarHBondContact O-N 3.19Å; P549-A553 VanDerWaalsContact O-CB 3.29Å; P549-A553 WeakPolarHBondContact O-CB 3.28Å; P549-A553 PolarHBondContact O-N 3.47Å; P549-Y651 HydrophobicContact CB-CE1 4.12Å; P549-Y651 WeakPolarHBondContact O-CE1 3.24Å; P549-L718 HydrophobicContact CB-CD1 3.93Å; P549-L718 HydrophobicContact CB-CD2 3.71Å; P549-L718 HydrophobicContact CB-CG 4.49Å
550	L	92	Very high	88	Confident	21 Å²	21	37.5 Å²	37.5	11%	0.11	20%	0.195	C	C	.	.	H	α-helix	trans	-67.6	-44.9	-179.1	-178.2	61.6	0	0	0	112.9	V527 P529 L545 G548 A553 L554 L689 L718	V527-L550 HydrophobicContact CG1-CD1 4.13Å; V527-L550 HydrophobicContact CG1-CD2 3.81Å; V527-L550 HydrophobicContact CG1-CG 4.23Å; P529-L550 HydrophobicContact CB-CD2 3.7Å; P529-L550 HydrophobicContact CG-CD2 4.19Å; L545-L550 HydrophobicContact CD1-CD2 4.22Å; L545-L550 HydrophobicContact CD1-CG 4.32Å; L545-L550 HydrophobicContact CD2-CD2 4.42Å; G548-L550 VanDerWaalsContact C-N 3.28Å; G548-L550 PolarHBondContact O-N 2.8Å; L550-A553 PolarHBondContact O-N 3.11Å; L550-L554 HydrophobicContact CG-CD1 4.44Å; L550-L554 WeakPolarHBondContact O-CG 3.46Å; L550-L554 PolarHBondContact O-N 3.24Å; L550-L689 HydrophobicContact CD1-CB 4.28Å; L550-L689 HydrophobicContact CD1-CD1 3.81Å; L550-L718 HydrophobicContact CB-CB 4.46Å; L550-L718 HydrophobicContact CD1-CB 3.96Å
551	L	90.8	Very high	87.7	Confident	9 Å²	9	33.6 Å²	33.6	5%	0.047	17%	0.17	C	C	.	.	H	α-helix	trans	-66.3	-41.5	176.9	-177	62.7	0	0	0	110.8	L545 V547 G548 A553 L554 A555 T580	L545-L551 HydrophobicContact CB-CB 4.4Å; L545-L551 HydrophobicContact CB-CD1 4.44Å; V547-L551 HydrophobicContact CG2-CD2 4.29Å; G548-L551 PolarHBondContact O-N 3.11Å; L551-A553 VanDerWaalsContact C-N 3.35Å; L551-A553 PolarHBondContact O-N 2.81Å; L551-L554 PolarHBondContact O-N 3.03Å; L551-A555 WeakPolarHBondContact O-CB 3.47Å; L551-A555 PolarHBondContact O-N 3.08Å; L551-T580 HydrophobicContact CD1-CG2 3.99Å
552	R	91.3	Very high	87.3	Confident	35 Å²	35	33 Å²	33	13%	0.132	16%	0.164	C	C	.	.	H	α-helix	trans	-62	-40.7	174.2	-73.3	-168.5	-68.1	-110.1	8.5	111.9	G548 P549 A555 T556 V621 E649 Y651	G548-R552 PolarHBondContact O-N 2.93Å; P549-R552 PolarHBondContact O-N 3.19Å; R552-A555 PolarHBondContact O-N 2.81Å; R552-T556 WeakPolarHBondContact O-CB 3.34Å; R552-T556 WeakPolarHBondContact O-CG2 3.35Å; R552-T556 PolarHBondContact O-N 2.91Å; R552-T556 PolarHBondContact O-OG1 2.84Å; R552-V621 HydrophobicContact CG-CG2 4.45Å; R552-E649 IonicContact NE-OE2 2.71Å; R552-E649 IonicContact NH2-OE2 2.87Å; R552-Y651 HydrophobicContact CB-CE1 4.5Å; R552-Y651 HydrophobicContact CB-CE2 3.86Å; R552-Y651 WeakPolarHBondContact CB-OH 3.29Å; R552-Y651 PolarHBondContact NE-OH 2.99Å
553	A	92.6	Very high	86.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-45.9	175.6	0	0	0	0	0	112	P549 L550 L551 A555 C557 Y651 L689 L718	P549-A553 VanDerWaalsContact O-CB 3.29Å; P549-A553 WeakPolarHBondContact O-CB 3.28Å; P549-A553 PolarHBondContact O-N 3.47Å; L550-A553 PolarHBondContact O-N 3.11Å; L551-A553 VanDerWaalsContact C-N 3.35Å; L551-A553 PolarHBondContact O-N 2.81Å; A553-A555 VanDerWaalsContact C-N 3.34Å; A553-C557 WeakPolarHBondContact O-CB 3.45Å; A553-C557 PolarHBondContact O-N 2.89Å; A553-Y651 HydrophobicContact CB-CD1 3.49Å; A553-Y651 VanDerWaalsContact CB-CD1 3.49Å; A553-Y651 HydrophobicContact CB-CE1 4.04Å; A553-Y651 HydrophobicContact CB-CG 3.94Å; A553-L689 HydrophobicContact CB-CD2 4.04Å; A553-L718 HydrophobicContact CB-CD1 4Å
554	L	92.5	Very high	86.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-38.3	176.6	-70.8	162.5	0	0	0	112.4	V527 P542 L545 L550 L551 M576 T580 L689 L721	V527-L554 HydrophobicContact CG1-CD1 4.36Å; V527-L554 HydrophobicContact CG2-CD1 3.76Å; V527-L554 HydrophobicContact CG2-CD2 4.15Å; P542-L554 HydrophobicContact CB-CD1 4.25Å; L545-L554 HydrophobicContact CD1-CD1 3.73Å; L550-L554 HydrophobicContact CG-CD1 4.44Å; L550-L554 WeakPolarHBondContact O-CG 3.46Å; L550-L554 PolarHBondContact O-N 3.24Å; L551-L554 PolarHBondContact O-N 3.03Å; L554-M576 HydrophobicContact CB-CG 4.47Å; L554-M576 HydrophobicContact CD2-CG 3.75Å; L554-M576 HydrophobicContact CD2-SD 4.05Å; L554-M576 VanDerWaalsContact O-CE 3.23Å; L554-M576 WeakPolarHBondContact O-CE 3.48Å; L554-T580 HydrophobicContact CB-CG2 3.62Å; L554-L689 HydrophobicContact CD2-CD1 3.55Å; L554-L689 HydrophobicContact CG-CD1 3.89Å; L554-L721 HydrophobicContact CD2-CD1 4.19Å; L554-L721 HydrophobicContact CD2-CD2 4.4Å
555	A	91.3	Very high	85.6	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-77.4	-32.1	-178.8	0	0	0	0	0	113.1	L551 R552 A553 H558 W582 M602	L551-A555 WeakPolarHBondContact O-CB 3.47Å; L551-A555 PolarHBondContact O-N 3.08Å; R552-A555 PolarHBondContact O-N 2.81Å; A553-A555 VanDerWaalsContact C-N 3.34Å; A555-H558 PolarHBondContact O-CD2 3.46Å; A555-H558 PolarHBondContact O-NE2 2.9Å; A555-H558 VanDerWaalsContact O-NE2 3.14Å; A555-W582 HydrophobicContact CB-CB 4.09Å; A555-W582 HydrophobicContact CB-CD2 3.68Å; A555-W582 HydrophobicContact CB-CE3 4Å; A555-W582 HydrophobicContact CB-CG 3.74Å; A555-M602 WeakPolarHBondContact O-CE 3.48Å
556	T	91.1	Very high	85.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-112.6	-27.1	-168.7	62.7	0	0	0	0	114.7	R552 H558 M602 V621 V640	R552-T556 WeakPolarHBondContact O-CB 3.34Å; R552-T556 WeakPolarHBondContact O-CG2 3.35Å; R552-T556 PolarHBondContact O-N 2.91Å; R552-T556 PolarHBondContact O-OG1 2.84Å; T556-H558 PolarHBondContact O-CD2 2.84Å; T556-H558 PolarHBondContact O-N 2.89Å; T556-M602 HydrophobicContact CG2-CB 4.27Å; T556-M602 HydrophobicContact CG2-CG 4.08Å; T556-V621 HydrophobicContact CG2-CB 4.08Å; T556-V621 HydrophobicContact CG2-CG1 3.73Å; T556-V640 HydrophobicContact CG2-CG1 4.22Å
557	C	92.9	Very high	85.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-80.4	67	-177.1	-163.3	0	0	0	0	110.5	A553 M576 V638 Y651 K653	A553-C557 WeakPolarHBondContact O-CB 3.45Å; A553-C557 PolarHBondContact O-N 2.89Å; C557-M576 WeakPolarHBondContact O-CE 3.24Å; C557-V638 HydrophobicContact CB-CG2 3.87Å; C557-Y651 PolarHBondContact SG-O 3.33Å; C557-Y651 VanDerWaalsContact SG-O 3.35Å; C557-K653 WeakPolarHBondContact O-CD 3.49Å; C557-K653 WeakPolarHBondContact O-CE 3.31Å; C557-K653 PolarHBondContact O-NZ 3.3Å
558	H	90.8	Very high	85.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-138.8	170.2	178	62.5	86.4	0	0	0	111.4	A555 T556 L560 D573 M576 V577 M602 R626 M636	A555-H558 PolarHBondContact O-CD2 3.46Å; A555-H558 PolarHBondContact O-NE2 2.9Å; A555-H558 VanDerWaalsContact O-NE2 3.14Å; T556-H558 PolarHBondContact O-CD2 2.84Å; T556-H558 PolarHBondContact O-N 2.89Å; H558-L560 HydrophobicContact CB-CG 4.24Å; H558-L560 VanDerWaalsContact ND1-CB 3.3Å; H558-L560 WeakPolarHBondContact ND1-CB 3.48Å; H558-L560 PolarHBondContact ND1-N 3.36Å; H558-L560 VanDerWaalsContact ND1-N 3.15Å; H558-D573 VanDerWaalsContact CA-OD2 3.24Å; H558-D573 WeakPolarHBondContact CA-OD2 3.46Å; H558-D573 HydrophobicContact CB-CB 3.96Å; H558-D573 WeakPolarHBondContact CB-OD2 3.29Å; H558-M576 HydrophobicContact CB-CE 4.05Å; H558-V577 HydrophobicContact CB-CG2 4.24Å; H558-M602 PolarHBondContact NE2-SD 2.99Å; H558-M602 VanDerWaalsContact NE2-SD 3.38Å; H558-R626 VanDerWaalsContact C-NH2 3.35Å; H558-R626 PolarHBondContact CE1-NH2 2.79Å; H558-R626 PolarHBondContact ND1-NH2 2.92Å; H558-R626 VanDerWaalsContact ND1-NH2 3.11Å; H558-R626 VanDerWaalsContact O-CZ 3.22Å; H558-R626 PolarHBondContact O-NE 3.05Å; H558-R626 PolarHBondContact O-NH2 2.87Å; H558-M636 WeakPolarHBondContact O-CE 3.34Å
559	A	85.1	Confident	85.2	Confident	27 Å²	27	34.5 Å²	34.5	22%	0.223	19%	0.188	C	C	.	.			trans	-110.6	12.3	173.6	0	0	0	0	0	113.6	D573 M636	A559-D573 PolarHBondContact N-OD2 3.26Å; A559-M636 HydrophobicContact CB-CE 4.32Å
560	L	86.3	Confident	84.6	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	20%	0.195	C	C	.	.			trans	-59.9	148.7	174.7	-50.6	174	0	0	0	112.3	H558 V568 D573 L574 V577 L584 R626	H558-L560 HydrophobicContact CB-CG 4.24Å; H558-L560 VanDerWaalsContact ND1-CB 3.3Å; H558-L560 WeakPolarHBondContact ND1-CB 3.48Å; H558-L560 PolarHBondContact ND1-N 3.36Å; H558-L560 VanDerWaalsContact ND1-N 3.15Å; L560-V568 WeakPolarHBondContact CA-O 3.46Å; L560-D573 HydrophobicContact CD2-CB 3.78Å; L560-D573 HydrophobicContact CG-CB 3.98Å; L560-L574 HydrophobicContact CD1-CD1 4.45Å; L560-L574 HydrophobicContact CD2-CB 4.17Å; L560-V577 HydrophobicContact CD1-CB 3.95Å; L560-V577 HydrophobicContact CD1-CG1 4.45Å; L560-V577 HydrophobicContact CD1-CG2 3.76Å; L560-L584 HydrophobicContact CB-CD2 4.12Å; L560-R626 PolarHBondContact O-NH1 3.06Å; L560-R626 PolarHBondContact O-NH2 2.67Å
561	S	81.4	Confident	84	Confident	5 Å²	5	37.8 Å²	37.8	4%	0.035	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	165.1	170.4	-74.1	0	0	0	0	111.1	P567 V568 E586	S561-P567 WeakPolarHBondContact O-CA 3.33Å; S561-V568 PolarHBondContact N-O 3.43Å; S561-V568 PolarHBondContact O-N 3.21Å; S561-E586 WeakPolarHBondContact CA-OE1 3.49Å; S561-E586 VanDerWaalsContact CB-OE1 3.32Å; S561-E586 WeakPolarHBondContact CB-OE1 3.46Å; S561-E586 PolarHBondContact OG-OE1 3.48Å
562	R	79.1	Confident	83.7	Confident	67 Å²	67	38.3 Å²	38.3	25%	0.253	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.7	-178	-168.7	168.1	174.6	161.5	-7.8	110.1	D565 T566 L584 E586	R562-D565 IonicContact CZ-OD1 2.72Å; R562-D565 VanDerWaalsContact CZ-OD1 3.31Å; R562-D565 IonicContact NE-OD1 2.72Å; R562-D565 PolarHBondContact NE-OD1 3.09Å; R562-D565 VanDerWaalsContact NE-OD1 3.08Å; R562-D565 IonicContact NH2-OD1 2.83Å; R562-D565 PolarHBondContact NH2-OD1 3.25Å; R562-T566 WeakPolarHBondContact CA-O 3.48Å; R562-L584 WeakPolarHBondContact CD-O 3.49Å; R562-L584 PolarHBondContact NH1-O 2.7Å; R562-E586 HydrophobicContact CB-CB 4.41Å; R562-E586 HydrophobicContact CB-CG 4.19Å; R562-E586 VanDerWaalsContact N-CD 3.29Å; R562-E586 PolarHBondContact N-OE2 2.97Å
563	L	76.1	Confident	83.6	Confident	32 Å²	32	36.9 Å²	36.9	17%	0.168	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	116.5	176.3	-175.1	76.5	0	0	0	108.7	L380 D565 T566 V568	L380-L563 HydrophobicContact CB-CD1 4.2Å; L380-L563 HydrophobicContact CD1-CD2 3.7Å; L563-D565 VanDerWaalsContact C-N 3.28Å; L563-D565 PolarHBondContact O-N 3.26Å; L563-T566 PolarHBondContact N-O 3.06Å; L563-T566 PolarHBondContact O-N 3.13Å; L563-T566 PolarHBondContact O-OG1 3.4Å; L563-V568 HydrophobicContact CB-CG2 3.9Å
564	Q	72.9	Confident	83.3	Confident	183 Å²	183	38.9 Å²	38.9	86%	0.855	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.1	49.9	179	-60.9	178.8	-16.5	0	0	112.5	T566	Q564-T566 PolarHBondContact O-N 2.8Å
565	D	72.1	Confident	83.1	Confident	123 Å²	123	42.8 Å²	42.8	66%	0.658	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.4	6.1	-176.5	-69.7	-41.3	0	0	0	118.3	R562 L563	R562-D565 IonicContact CZ-OD1 2.72Å; R562-D565 VanDerWaalsContact CZ-OD1 3.31Å; R562-D565 IonicContact NE-OD1 2.72Å; R562-D565 PolarHBondContact NE-OD1 3.09Å; R562-D565 VanDerWaalsContact NE-OD1 3.08Å; R562-D565 IonicContact NH2-OD1 2.83Å; R562-D565 PolarHBondContact NH2-OD1 3.25Å; L563-D565 VanDerWaalsContact C-N 3.28Å; L563-D565 PolarHBondContact O-N 3.26Å
566	T	79.2	Confident	83.1	Confident	77 Å²	77	42.8 Å²	42.8	47%	0.472	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.1	172.8	60.6	0	0	0	0	111.2	R562 L563 Q564 V568	R562-T566 WeakPolarHBondContact CA-O 3.48Å; L563-T566 PolarHBondContact N-O 3.06Å; L563-T566 PolarHBondContact O-N 3.13Å; L563-T566 PolarHBondContact O-OG1 3.4Å; Q564-T566 PolarHBondContact O-N 2.8Å; T566-V568 PolarHBondContact O-N 3.33Å
567	P	81.4	Confident	83.1	Confident	64 Å²	64	43.2 Å²	43.2	42%	0.416	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	126.1	170.5	28.4	-31.9	0	0	0	109.4	S561 L574	S561-P567 WeakPolarHBondContact O-CA 3.33Å; P567-L574 HydrophobicContact CB-CD1 4.01Å; P567-L574 HydrophobicContact CG-CD1 3.83Å
568	V	80.8	Confident	83	Confident	18 Å²	18	47.2 Å²	47.2	11%	0.109	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.9	-177	-179.1	0	0	0	0	109.5	P350 L560 S561 L563 T566	P350-V568 HydrophobicContact CB-CG1 3.7Å; P350-V568 VanDerWaalsContact CD-CG1 3.44Å; P350-V568 HydrophobicContact CG-CG1 3.65Å; L560-V568 WeakPolarHBondContact CA-O 3.46Å; S561-V568 PolarHBondContact N-O 3.43Å; S561-V568 PolarHBondContact O-N 3.21Å; L563-V568 HydrophobicContact CB-CG2 3.9Å; T566-V568 PolarHBondContact O-N 3.33Å
569	G	79.1	Confident	82.9	Confident	13 Å²	13	48 Å²	48	13%	0.134	26%	0.257	C	S	.	.	S	Bend	trans	157.3	-160.1	175	0	0	0	0	0	111.3	V349	V349-G569 WeakPolarHBondContact CG1-O 3.45Å
570	D	78.8	Confident	83.1	Confident	88 Å²	88	46.8 Å²	46.8	47%	0.471	25%	0.247	S	C	.	.			trans	-56.3	131	-176.7	-171.8	-76	0	0	0	111.8	M572 D573 L574	D570-M572 PolarHBondContact O-N 2.74Å; D570-M572 WeakPolarHBondContact OD1-CA 3.23Å; D570-M572 WeakPolarHBondContact OD1-CB 3.43Å; D570-M572 PolarHBondContact OD1-N 3.38Å; D570-D573 HydrophobicContact CB-CB 4.16Å; D570-D573 WeakPolarHBondContact O-CB 3.31Å; D570-D573 PolarHBondContact O-N 3.15Å; D570-L574 PolarHBondContact O-N 3.29Å
571	P	78.9	Confident	83.1	Confident	51 Å²	51	47.8 Å²	47.8	33%	0.331	26%	0.257	S	S	.	.	H	α-helix	trans	-58.2	-30.8	-179.1	-26.4	34.4	0	0	0	114.4	K575	P571-K575 WeakPolarHBondContact O-CB 3.42Å; P571-K575 VanDerWaalsContact O-CG 3.3Å; P571-K575 WeakPolarHBondContact O-CG 3.02Å; P571-K575 PolarHBondContact O-N 2.97Å
572	M	83.9	Confident	83.5	Confident	20 Å²	20	48.2 Å²	48.2	10%	0.099	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-45.5	174.4	-171.2	-168.6	75.8	0	0	110.5	L522 D570 K575 M576 K653 V687 M723	L522-M572 HydrophobicContact CD1-CB 3.82Å; L522-M572 HydrophobicContact CD1-CG 3.9Å; D570-M572 PolarHBondContact O-N 2.74Å; D570-M572 WeakPolarHBondContact OD1-CA 3.23Å; D570-M572 WeakPolarHBondContact OD1-CB 3.43Å; D570-M572 PolarHBondContact OD1-N 3.38Å; M572-K575 PolarHBondContact O-N 3Å; M572-M576 VanDerWaalsContact O-CB 3.25Å; M572-M576 WeakPolarHBondContact O-CB 3.32Å; M572-M576 PolarHBondContact O-N 2.83Å; M572-K653 HydrophobicContact CE-CD 4.5Å; M572-V687 HydrophobicContact SD-CG2 4.05Å; M572-M723 HydrophobicContact CG-CE 3.78Å; M572-M723 HydrophobicContact CG-SD 3.49Å; M572-M723 WeakPolarHBondContact CG-SD 3.26Å; M572-M723 HydrophobicContact SD-SD 4.31Å
573	D	88.5	Confident	83.9	Confident	6 Å²	6	48.6 Å²	48.6	3%	0.032	27%	0.268	C	S	.	.	H	α-helix	trans	-66.8	-41.5	179.8	-76.1	16.5	0	0	0	110.9	H558 A559 L560 D570 M576 V577 K653	H558-D573 VanDerWaalsContact CA-OD2 3.24Å; H558-D573 WeakPolarHBondContact CA-OD2 3.46Å; H558-D573 HydrophobicContact CB-CB 3.96Å; H558-D573 WeakPolarHBondContact CB-OD2 3.29Å; A559-D573 PolarHBondContact N-OD2 3.26Å; L560-D573 HydrophobicContact CD2-CB 3.78Å; L560-D573 HydrophobicContact CG-CB 3.98Å; D570-D573 HydrophobicContact CB-CB 4.16Å; D570-D573 WeakPolarHBondContact O-CB 3.31Å; D570-D573 PolarHBondContact O-N 3.15Å; D573-M576 PolarHBondContact O-N 3.49Å; D573-V577 WeakPolarHBondContact O-CG2 3.37Å; D573-V577 PolarHBondContact O-N 2.8Å; D573-K653 IonicContact OD1-NZ 3.66Å; D573-K653 PolarHBondContact OD1-NZ 3.22Å; D573-K653 IonicContact OD2-NZ 3.31Å; D573-K653 PolarHBondContact OD2-NZ 3.44Å
574	L	87.5	Confident	84.3	Confident	42 Å²	42	47.5 Å²	47.5	22%	0.22	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-51.9	176.8	-176.5	67	0	0	0	110.2	L560 P567 D570 M576 V577 E578	L560-L574 HydrophobicContact CD1-CD1 4.45Å; L560-L574 HydrophobicContact CD2-CB 4.17Å; P567-L574 HydrophobicContact CB-CD1 4.01Å; P567-L574 HydrophobicContact CG-CD1 3.83Å; D570-L574 PolarHBondContact O-N 3.29Å; L574-M576 VanDerWaalsContact C-N 3.32Å; L574-M576 PolarHBondContact O-N 2.58Å; L574-V577 PolarHBondContact O-N 2.65Å; L574-E578 HydrophobicContact CD1-CG 4.43Å; L574-E578 HydrophobicContact CG-CG 4.41Å; L574-E578 WeakPolarHBondContact O-CB 3.25Å; L574-E578 VanDerWaalsContact O-CG 3.25Å; L574-E578 WeakPolarHBondContact O-CG 3.46Å; L574-E578 PolarHBondContact O-N 2.59Å
575	K	87.9	Confident	84.7	Confident	81 Å²	81	41.7 Å²	41.7	35%	0.352	24%	0.235	S	C	.	.	H	α-helix	trans	-65.3	-35.4	179.6	-71.7	-78.1	166.2	-141.6	0	112.8	L522 V524 P571 M572 E578 S579 M723	L522-K575 VanDerWaalsContact O-CG 3.31Å; L522-K575 WeakPolarHBondContact O-CG 3.24Å; V524-K575 HydrophobicContact CG2-CB 4.24Å; P571-K575 WeakPolarHBondContact O-CB 3.42Å; P571-K575 VanDerWaalsContact O-CG 3.3Å; P571-K575 WeakPolarHBondContact O-CG 3.02Å; P571-K575 PolarHBondContact O-N 2.97Å; M572-K575 PolarHBondContact O-N 3Å; K575-E578 WeakPolarHBondContact CD-OE2 3.16Å; K575-E578 WeakPolarHBondContact CE-OE2 3.38Å; K575-E578 IonicContact NZ-OE2 2.69Å; K575-E578 PolarHBondContact NZ-OE2 3.31Å; K575-S579 WeakPolarHBondContact O-CB 3.34Å; K575-S579 PolarHBondContact O-N 2.73Å; K575-M723 HydrophobicContact CB-CE 4.3Å
576	M	91.4	Very high	84.5	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.1	-49.6	173.8	-177	-173.7	67.4	0	0	111.2	L554 C557 H558 M572 D573 L574 S579 K653 L721	L554-M576 HydrophobicContact CB-CG 4.47Å; L554-M576 HydrophobicContact CD2-CG 3.75Å; L554-M576 HydrophobicContact CD2-SD 4.05Å; L554-M576 VanDerWaalsContact O-CE 3.23Å; L554-M576 WeakPolarHBondContact O-CE 3.48Å; C557-M576 WeakPolarHBondContact O-CE 3.24Å; H558-M576 HydrophobicContact CB-CE 4.05Å; M572-M576 VanDerWaalsContact O-CB 3.25Å; M572-M576 WeakPolarHBondContact O-CB 3.32Å; M572-M576 PolarHBondContact O-N 2.83Å; D573-M576 PolarHBondContact O-N 3.49Å; L574-M576 VanDerWaalsContact C-N 3.32Å; L574-M576 PolarHBondContact O-N 2.58Å; M576-S579 PolarHBondContact O-N 3.34Å; M576-S579 PolarHBondContact O-OG 2.98Å; M576-K653 HydrophobicContact CE-CD 4.34Å; M576-K653 HydrophobicContact SD-CD 4.22Å; M576-L721 HydrophobicContact CB-CD2 4.3Å; M576-L721 HydrophobicContact CG-CD2 3.9Å; M576-L721 HydrophobicContact SD-CD2 3.99Å
577	V	90.8	Very high	83.5	Confident	9 Å²	9	41.2 Å²	41.2	6%	0.055	22%	0.223	C	C	.	.	H	α-helix	trans	-69.8	-42.1	179.8	175.7	0	0	0	0	111.7	H558 L560 D573 L574 S579 T580 G581 W582 M602	H558-V577 HydrophobicContact CB-CG2 4.24Å; L560-V577 HydrophobicContact CD1-CB 3.95Å; L560-V577 HydrophobicContact CD1-CG1 4.45Å; L560-V577 HydrophobicContact CD1-CG2 3.76Å; D573-V577 WeakPolarHBondContact O-CG2 3.37Å; D573-V577 PolarHBondContact O-N 2.8Å; L574-V577 PolarHBondContact O-N 2.65Å; V577-S579 PolarHBondContact O-N 3.45Å; V577-T580 PolarHBondContact O-N 3.46Å; V577-T580 PolarHBondContact O-OG1 2.8Å; V577-G581 PolarHBondContact O-N 3.21Å; V577-W582 WeakPolarHBondContact CG1-O 3.42Å; V577-M602 HydrophobicContact CG1-CE 3.64Å
578	E	89.9	Confident	81.9	Confident	84 Å²	84	44.6 Å²	44.6	39%	0.393	25%	0.245	S	C	.	.	H	α-helix	trans	-56.2	-34.9	173.9	-76	175.9	174.1	0	0	112.3	R543 L574 K575 T580 G581	R543-E578 PolarHBondContact NH2-O 3.02Å; L574-E578 HydrophobicContact CD1-CG 4.43Å; L574-E578 HydrophobicContact CG-CG 4.41Å; L574-E578 WeakPolarHBondContact O-CB 3.25Å; L574-E578 VanDerWaalsContact O-CG 3.25Å; L574-E578 WeakPolarHBondContact O-CG 3.46Å; L574-E578 PolarHBondContact O-N 2.59Å; K575-E578 WeakPolarHBondContact CD-OE2 3.16Å; K575-E578 WeakPolarHBondContact CE-OE2 3.38Å; K575-E578 IonicContact NZ-OE2 2.69Å; K575-E578 PolarHBondContact NZ-OE2 3.31Å; E578-T580 VanDerWaalsContact C-N 3.29Å; E578-T580 PolarHBondContact O-N 3.4Å; E578-G581 PolarHBondContact O-N 3.44Å
579	S	90.3	Very high	79.9	Confident	16 Å²	16	46.2 Å²	46.2	11%	0.112	26%	0.261	C	S	.	.	H	α-helix	trans	-68.9	-25.1	179.5	80.3	0	0	0	0	113.7	P542 R543 K575 M576 V577	P542-S579 WeakPolarHBondContact CG-OG 3.43Å; R543-S579 PolarHBondContact N-O 2.89Å; R543-S579 VanDerWaalsContact N-O 3.15Å; K575-S579 WeakPolarHBondContact O-CB 3.34Å; K575-S579 PolarHBondContact O-N 2.73Å; M576-S579 PolarHBondContact O-N 3.34Å; M576-S579 PolarHBondContact O-OG 2.98Å; V577-S579 PolarHBondContact O-N 3.45Å
580	T	89.7	Confident	78.1	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.012	29%	0.294	C	S	.	.	H	α-helix	trans	-85.7	-23.5	176.5	71.2	0	0	0	0	112.6	P542 R543 L551 L554 V577 E578 W582	P542-T580 HydrophobicContact CB-CG2 4.46Å; R543-T580 WeakPolarHBondContact CB-O 3.34Å; L551-T580 HydrophobicContact CD1-CG2 3.99Å; L554-T580 HydrophobicContact CB-CG2 3.62Å; V577-T580 PolarHBondContact O-N 3.46Å; V577-T580 PolarHBondContact O-OG1 2.8Å; E578-T580 VanDerWaalsContact C-N 3.29Å; E578-T580 PolarHBondContact O-N 3.4Å; T580-W582 VanDerWaalsContact C-N 3.29Å; T580-W582 PolarHBondContact OG1-N 3.29Å
581	G	86.1	Confident	76.3	Confident	22 Å²	22	49.8 Å²	49.8	23%	0.227	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	6.8	-174.9	0	0	0	0	0	114.4	V577 E578	V577-G581 PolarHBondContact O-N 3.21Å; E578-G581 PolarHBondContact O-N 3.44Å
582	W	88.9	Confident	74.7	Confident	14 Å²	14	53.4 Å²	53.4	5%	0.053	32%	0.317	C	S	.	.			trans	-78.9	149.5	175.1	-72	53.8	0	0	0	110.8	A555 V577 T580 M602 R603 P604 V621	A555-W582 HydrophobicContact CB-CB 4.09Å; A555-W582 HydrophobicContact CB-CD2 3.68Å; A555-W582 HydrophobicContact CB-CE3 4Å; A555-W582 HydrophobicContact CB-CG 3.74Å; V577-W582 WeakPolarHBondContact CG1-O 3.42Å; T580-W582 VanDerWaalsContact C-N 3.29Å; T580-W582 PolarHBondContact OG1-N 3.29Å; W582-M602 HydrophobicContact CB-CE 4.04Å; W582-M602 HydrophobicContact CE3-CB 3.87Å; W582-M602 HydrophobicContact CZ3-CB 4.3Å; W582-M602 WeakPolarHBondContact CZ3-O 3.25Å; W582-R603 WeakPolarHBondContact CA-O 3.19Å; W582-P604 HydrophobicContact CD2-CB 4.26Å; W582-P604 HydrophobicContact CE3-CB 4.4Å; W582-P604 HydrophobicContact CH2-CB 4.19Å; W582-P604 HydrophobicContact CZ2-CB 4Å; W582-P604 HydrophobicContact CZ3-CB 4.38Å; W582-V621 HydrophobicContact CH2-CG2 4Å; W582-V621 HydrophobicContact CZ3-CB 4.35Å; W582-V621 HydrophobicContact CZ3-CG2 3.88Å
583	V	87.2	Confident	72.9	Confident	76 Å²	76	55.4 Å²	55.4	46%	0.461	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	135.5	-177.4	-177	0	0	0	0	110	R603	V583-R603 PolarHBondContact N-O 3.12Å; V583-R603 PolarHBondContact O-N 3.3Å
584	L	85.1	Confident	70.8	Confident	9 Å²	9	59.4 Å²	59.4	5%	0.047	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	127	175.4	176.3	65.4	0	0	0	110.5	L560 R562 E586 A600 M602	L560-L584 HydrophobicContact CB-CD2 4.12Å; R562-L584 WeakPolarHBondContact CD-O 3.49Å; R562-L584 PolarHBondContact NH1-O 2.7Å; L584-E586 HydrophobicContact CD1-CG 4.23Å; L584-E586 HydrophobicContact CD2-CG 4.41Å; L584-E586 HydrophobicContact CG-CG 4.18Å; L584-A600 HydrophobicContact CD1-CB 3.69Å; L584-M602 VanDerWaalsContact CA-SD 3.6Å; L584-M602 HydrophobicContact CB-CE 4.45Å; L584-M602 HydrophobicContact CB-SD 3.7Å; L584-M602 HydrophobicContact CD1-SD 3.55Å; L584-M602 VanDerWaalsContact CD1-SD 3.55Å; L584-M602 HydrophobicContact CG-SD 4.22Å
585	E	80.3	Confident	69	Low	60 Å²	60	61 Å²	61	28%	0.28	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.9	169.4	-77.4	179	-169	0	0	110.2	V601 R603	E585-V601 PolarHBondContact N-O 3.45Å; E585-V601 PolarHBondContact O-N 3.16Å; E585-R603 IonicContact OE1-NE 3.61Å; E585-R603 WeakPolarHBondContact OE2-CD 3.48Å; E585-R603 IonicContact OE2-CZ 3.71Å; E585-R603 IonicContact OE2-NE 3.54Å; E585-R603 PolarHBondContact OE2-NE 3.31Å; E585-R603 IonicContact OE2-NH2 3.95Å
586	E	69.3	Low	67.3	Low	36 Å²	36	60.4 Å²	60.4	17%	0.168	38%	0.384	C	S	.	.			trans	-125.5	58.9	178.7	-63.4	-174	154.4	0	0	108.5	R383 S561 R562 L584 A600	R383-E586 IonicContact CZ-OE2 2.61Å; R383-E586 VanDerWaalsContact CZ-OE2 3.26Å; R383-E586 IonicContact NH1-OE1 2.86Å; R383-E586 IonicContact NH1-OE2 3.28Å; R383-E586 PolarHBondContact NH1-OE2 3.19Å; R383-E586 IonicContact NH2-OE2 3.92Å; R383-E586 PolarHBondContact NH2-OE2 2.76Å; S561-E586 WeakPolarHBondContact CA-OE1 3.49Å; S561-E586 VanDerWaalsContact CB-OE1 3.32Å; S561-E586 WeakPolarHBondContact CB-OE1 3.46Å; S561-E586 PolarHBondContact OG-OE1 3.48Å; R562-E586 HydrophobicContact CB-CB 4.41Å; R562-E586 HydrophobicContact CB-CG 4.19Å; R562-E586 VanDerWaalsContact N-CD 3.29Å; R562-E586 PolarHBondContact N-OE2 2.97Å; L584-E586 HydrophobicContact CD1-CG 4.23Å; L584-E586 HydrophobicContact CD2-CG 4.41Å; L584-E586 HydrophobicContact CG-CG 4.18Å; E586-A600 HydrophobicContact CG-CB 4.4Å
587	E	57.4	Low	65.8	Low	154 Å²	154	67 Å²	67	72%	0.72	42%	0.415	S	S	*	.			trans	-96.4	146.2	171.9	-72.3	-158	167.8	0	0	111	A589	E587-A589 HydrophobicContact CB-CB 4.43Å; E587-A589 PolarHBondContact O-N 2.73Å
588	P	47.2	Very low	64.8	Low	135 Å²	135	68.5 Å²	68.5	88%	0.877	42%	0.424	S	S	*	.			trans	-76.1	42.6	171.1	35.3	-35	0	0	0	110.7	A590	P588-A590 PolarHBondContact O-N 3.01Å
589	A	38.7	Very low	64	Low	53 Å²	53	65.4 Å²	65.4	44%	0.438	41%	0.41	S	S	.	.			trans	-77.2	117.4	174.1	0	0	0	0	0	107.3	E587 D591	E587-A589 HydrophobicContact CB-CB 4.43Å; E587-A589 PolarHBondContact O-N 2.73Å; A589-D591 PolarHBondContact O-N 3.27Å
590	A	41.4	Very low	63.4	Low	99 Å²	99	64.8 Å²	64.8	82%	0.818	41%	0.406	S	S	*	.			trans	-59.9	81.9	162.3	0	0	0	0	0	108.3	P588 S592	P588-A590 PolarHBondContact O-N 3.01Å; A590-S592 PolarHBondContact O-N 3.35Å
591	D	42.5	Very low	63.2	Low	76 Å²	76	65.5 Å²	65.5	41%	0.406	41%	0.41	S	S	.	.			trans	-69.7	106.6	172.5	-99.3	-14.4	0	0	0	107.3	A589 A593 F594	A589-D591 PolarHBondContact O-N 3.27Å; D591-A593 PolarHBondContact O-N 2.86Å; D591-F594 PolarHBondContact O-N 3.41Å
592	S	44.3	Very low	63.2	Low	127 Å²	127	64.4 Å²	64.4	89%	0.888	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	4.1	-176.4	53.3	0	0	0	0	116.7	A590	A590-S592 PolarHBondContact O-N 3.35Å
593	A	47.4	Very low	63.1	Low	63 Å²	63	68.5 Å²	68.5	52%	0.521	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-25.3	179.8	0	0	0	0	0	114.5	D591 P643	D591-A593 PolarHBondContact O-N 2.86Å; A593-P643 HydrophobicContact CB-CG 4.25Å
594	F	43.8	Very low	63	Low	90 Å²	90	66.2 Å²	66.2	40%	0.395	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.5	-2	-176	-79.7	-82.9	0	0	0	115.6	D591 T596 A641	D591-F594 PolarHBondContact O-N 3.41Å; F594-T596 PolarHBondContact O-N 3.36Å; F594-T596 PolarHBondContact O-OG1 3.02Å; F594-A641 HydrophobicContact CZ-CB 4.23Å
595	G	48.9	Very low	62.8	Low	76 Å²	76	68.8 Å²	68.8	78%	0.784	42%	0.419	S	S	*	.	S	Bend	trans	58	14.5	174.6	0	0	0	0	0	115.8
596	T	52.5	Low	62.2	Low	67 Å²	67	74.3 Å²	74.3	41%	0.411	45%	0.449	S	S	.	.	S	Bend	trans	-140.3	150.3	-173	36.7	0	0	0	0	111	F594	F594-T596 PolarHBondContact O-N 3.36Å; F594-T596 PolarHBondContact O-OG1 3.02Å
597	Q	60.7	Low	61.7	Low	139 Å²	139	77.9 Å²	77.9	65%	0.65	46%	0.461	S	S	*	.			trans	-65.4	137.6	174.3	-73.5	-175.5	-11.3	0	0	110.2	L700	Q597-L700 HydrophobicContact CB-CD2 4.31Å; Q597-L700 WeakPolarHBondContact O-CD1 3.34Å; Q597-L700 VanDerWaalsContact O-CD2 3.24Å; Q597-L700 WeakPolarHBondContact O-CD2 3.5Å
598	V	70	Confident	61.6	Low	40 Å²	40	77.4 Å²	77.4	24%	0.242	46%	0.459	C	S	.	.			trans	-115.8	154.8	175.8	-66.2	0	0	0	0	109.9	V601 L624	V598-V601 HydrophobicContact CG2-CG2 3.86Å; V598-L624 HydrophobicContact CG1-CD2 4.09Å
599	L	71.5	Confident	61.7	Low	20 Å²	20	76.1 Å²	76.1	11%	0.105	45%	0.45	C	S	.	.	S	Bend	trans	-72	-39	-177.2	-67.8	174.3	0	0	0	112.3	Y385 V623 L624 R626	Y385-L599 HydrophobicContact CD1-CD2 3.91Å; Y385-L599 HydrophobicContact CD2-CD2 4.44Å; Y385-L599 HydrophobicContact CE1-CD2 3.71Å; Y385-L599 HydrophobicContact CE2-CD2 4.28Å; Y385-L599 HydrophobicContact CG-CD2 4.27Å; L599-V623 WeakPolarHBondContact CB-O 3.47Å; L599-V623 PolarHBondContact N-O 2.67Å; L599-L624 WeakPolarHBondContact CD1-O 3.47Å; L599-R626 HydrophobicContact CD1-CG 4.24Å
600	A	78.9	Confident	61.9	Low	3 Å²	3	82.9 Å²	82.9	3%	0.025	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	156.3	-179.2	0	0	0	0	0	111.1	L584 E586 V623	L584-A600 HydrophobicContact CD1-CB 3.69Å; E586-A600 HydrophobicContact CG-CB 4.4Å; A600-V623 HydrophobicContact CB-CB 4.31Å; A600-V623 HydrophobicContact CB-CG2 4.37Å; A600-V623 PolarHBondContact O-N 2.63Å
601	V	84.3	Confident	62.2	Low	16 Å²	16	84.5 Å²	84.5	10%	0.097	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.3	173.6	-177.7	0	0	0	0	109.8	E585 V598 R603 P620	E585-V601 PolarHBondContact N-O 3.45Å; E585-V601 PolarHBondContact O-N 3.16Å; V598-V601 HydrophobicContact CG2-CG2 3.86Å; V601-R603 HydrophobicContact CG1-CG 4.45Å; V601-P620 HydrophobicContact CG1-CB 3.98Å
602	M	87.7	Confident	62.6	Low	0 Å²	0	85.4 Å²	85.4	0%	0	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	115.6	173.1	-68.1	-58	-73.7	0	0	109.2	A555 T556 H558 V577 W582 L584 P620 V621	A555-M602 WeakPolarHBondContact O-CE 3.48Å; T556-M602 HydrophobicContact CG2-CB 4.27Å; T556-M602 HydrophobicContact CG2-CG 4.08Å; H558-M602 PolarHBondContact NE2-SD 2.99Å; H558-M602 VanDerWaalsContact NE2-SD 3.38Å; V577-M602 HydrophobicContact CG1-CE 3.64Å; W582-M602 HydrophobicContact CB-CE 4.04Å; W582-M602 HydrophobicContact CE3-CB 3.87Å; W582-M602 HydrophobicContact CZ3-CB 4.3Å; W582-M602 WeakPolarHBondContact CZ3-O 3.25Å; L584-M602 VanDerWaalsContact CA-SD 3.6Å; L584-M602 HydrophobicContact CB-CE 4.45Å; L584-M602 HydrophobicContact CB-SD 3.7Å; L584-M602 HydrophobicContact CD1-SD 3.55Å; L584-M602 VanDerWaalsContact CD1-SD 3.55Å; L584-M602 HydrophobicContact CG-SD 4.22Å; M602-P620 WeakPolarHBondContact O-CA 2.94Å; M602-V621 PolarHBondContact N-O 2.83Å; M602-V621 PolarHBondContact O-N 3.37Å
603	R	86.1	Confident	62.8	Low	100 Å²	100	84 Å²	84	38%	0.377	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	138.1	175.9	-67.4	-159.9	-175.5	-114.3	-4.3	111.2	W582 V583 E585 V601 P620	W582-R603 WeakPolarHBondContact CA-O 3.19Å; V583-R603 PolarHBondContact N-O 3.12Å; V583-R603 PolarHBondContact O-N 3.3Å; E585-R603 IonicContact OE1-NE 3.61Å; E585-R603 WeakPolarHBondContact OE2-CD 3.48Å; E585-R603 IonicContact OE2-CZ 3.71Å; E585-R603 IonicContact OE2-NE 3.54Å; E585-R603 PolarHBondContact OE2-NE 3.31Å; E585-R603 IonicContact OE2-NH2 3.95Å; V601-R603 HydrophobicContact CG1-CG 4.45Å; R603-P620 HydrophobicContact CG-CB 4.42Å
604	P	84.3	Confident	63	Low	27 Å²	27	83.6 Å²	83.6	18%	0.175	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-71.6	159.7	173	29.2	-32.6	0	0	0	111.7	W582 P618	W582-P604 HydrophobicContact CD2-CB 4.26Å; W582-P604 HydrophobicContact CE3-CB 4.4Å; W582-P604 HydrophobicContact CH2-CB 4.19Å; W582-P604 HydrophobicContact CZ2-CB 4Å; W582-P604 HydrophobicContact CZ3-CB 4.38Å; P604-P618 HydrophobicContact CB-CB 3.58Å; P604-P618 HydrophobicContact CB-CG 3.44Å; P604-P618 VanDerWaalsContact CB-CG 3.44Å; P604-P618 HydrophobicContact CG-CB 3.75Å; P604-P618 HydrophobicContact CG-CG 3.64Å; P604-P618 VanDerWaalsContact CG-O 3.31Å; P604-P618 WeakPolarHBondContact CG-O 3.38Å
605	P	81.2	Confident	63.2	Low	64 Å²	64	89 Å²	89	42%	0.416	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-61.6	156.3	175.5	25	-33	0	0	0	112.2	W607	P605-W607 PolarHBondContact O-N 2.91Å
606	L	68.9	Low	63.5	Low	175 Å²	175	92.9 Å²	92.9	92%	0.916	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-55.9	124.9	175.4	-71.5	167.4	0	0	0	110.1	E608	L606-E608 PolarHBondContact O-N 3.03Å
607	W	58.5	Low	63.9	Low	112 Å²	112	94 Å²	94	42%	0.424	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-68.8	116.4	-173.5	178.7	-80.3	0	0	0	111.4	P605 M614 E616 P617 P618	P605-W607 PolarHBondContact O-N 2.91Å; W607-M614 HydrophobicContact CH2-CB 3.72Å; W607-M614 HydrophobicContact CZ3-CB 4.37Å; W607-M614 HydrophobicContact CZ3-SD 4.26Å; W607-E616 VanDerWaalsContact CH2-O 3.24Å; W607-E616 WeakPolarHBondContact CH2-O 3.29Å; W607-E616 WeakPolarHBondContact CZ3-O 3.3Å; W607-P617 HydrophobicContact CE3-CB 4.26Å; W607-P617 VanDerWaalsContact CZ3-CA 3.43Å; W607-P617 HydrophobicContact CZ3-CB 4.32Å; W607-P618 HydrophobicContact CE3-CG 4.2Å; W607-P618 HydrophobicContact CZ3-CG 4.49Å
608	E	55.1	Low	64.3	Low	144 Å²	144	88.7 Å²	88.7	67%	0.673	47%	0.473	S	S	*	.			trans	-99.3	112.3	170.7	-76.2	-179.8	178.5	0	0	109.9	L606 Q610	L606-E608 PolarHBondContact O-N 3.03Å; E608-Q610 PolarHBondContact O-N 2.67Å
609	P	48.2	Very low	64.8	Low	107 Å²	107	89.7 Å²	89.7	70%	0.695	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-8.9	-171.2	-18.7	28.1	0	0	0	116.1
610	Q	43.9	Very low	65.5	Low	195 Å²	195	90.5 Å²	90.5	91%	0.911	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-8.6	-167.4	-73.8	-177	-19.4	0	0	115.2	E608	E608-Q610 PolarHBondContact O-N 2.67Å
611	L	47.8	Very low	65.9	Low	133 Å²	133	90.5 Å²	90.5	70%	0.696	49%	0.485	S	S	*	.	S	Bend	trans	-113.9	-14.2	-164	-103.1	144.1	0	0	0	116.6
612	Q	51.4	Low	65.9	Low	96 Å²	96	90.3 Å²	90.3	45%	0.449	48%	0.484	S	S	.	.			trans	-145.1	124	-170.9	-68	177.9	-11.2	0	0	111.5	M614	Q612-M614 HydrophobicContact CB-CG 4.44Å; Q612-M614 PolarHBondContact O-N 3.1Å
613	G	47.6	Very low	65.8	Low	98 Å²	98	90.3 Å²	90.3	100%	1.01	48%	0.484	S	S	*	.			trans	-70.7	65.9	173.4	0	0	0	0	0	112.7
614	M	50.7	Low	65.5	Low	53 Å²	53	86.6 Å²	86.6	26%	0.261	47%	0.472	S	S	.	.			trans	-109.3	137.1	178.2	-82.6	-178.1	159.9	0	0	111.3	V547 W607 Q612	V547-M614 HydrophobicContact CB-CE 3.85Å; V547-M614 HydrophobicContact CG2-CE 3.49Å; V547-M614 VanDerWaalsContact CG2-CE 3.49Å; V547-M614 HydrophobicContact CG2-SD 4.07Å; W607-M614 HydrophobicContact CH2-CB 3.72Å; W607-M614 HydrophobicContact CZ3-CB 4.37Å; W607-M614 HydrophobicContact CZ3-SD 4.26Å; Q612-M614 HydrophobicContact CB-CG 4.44Å; Q612-M614 PolarHBondContact O-N 3.1Å
615	E	48.1	Very low	65.3	Low	203 Å²	203	86 Å²	86	95%	0.949	47%	0.468	S	S	*	.	S	Bend	trans	-87.5	-14.3	179.2	-72.4	-178.4	155.5	0	0	114
616	E	55.5	Low	65.5	Low	159 Å²	159	84.7 Å²	84.7	74%	0.743	46%	0.455	S	S	*	.	S	Bend	trans	-139.6	142.8	-178.7	-69.6	-176.2	165.3	0	0	113.9	W607	W607-E616 VanDerWaalsContact CH2-O 3.24Å; W607-E616 WeakPolarHBondContact CH2-O 3.29Å; W607-E616 WeakPolarHBondContact CZ3-O 3.3Å
617	P	61.3	Low	66.3	Low	90 Å²	90	77.5 Å²	77.5	58%	0.584	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-68.4	141.6	176.3	27.8	-32.8	0	0	0	112.6	W607 V619	W607-P617 HydrophobicContact CE3-CB 4.26Å; W607-P617 VanDerWaalsContact CZ3-CA 3.43Å; W607-P617 HydrophobicContact CZ3-CB 4.32Å; P617-V619 PolarHBondContact O-N 3.21Å
618	P	69.3	Low	67.4	Low	27 Å²	27	73.8 Å²	73.8	18%	0.175	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-63.9	135.6	175.3	29.6	-35.4	0	0	0	109.5	V547 P604 W607	V547-P618 HydrophobicContact CG2-CB 4.08Å; P604-P618 HydrophobicContact CB-CB 3.58Å; P604-P618 HydrophobicContact CB-CG 3.44Å; P604-P618 VanDerWaalsContact CB-CG 3.44Å; P604-P618 HydrophobicContact CG-CB 3.75Å; P604-P618 HydrophobicContact CG-CG 3.64Å; P604-P618 VanDerWaalsContact CG-O 3.31Å; P604-P618 WeakPolarHBondContact CG-O 3.38Å; W607-P618 HydrophobicContact CE3-CG 4.2Å; W607-P618 HydrophobicContact CZ3-CG 4.49Å
619	V	80.8	Confident	68.7	Low	61 Å²	61	70.4 Å²	70.4	37%	0.37	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-96.3	144.9	-177.9	-171.9	0	0	0	0	109.3	P617 P643	P617-V619 PolarHBondContact O-N 3.21Å; V619-P643 HydrophobicContact CG1-CB 4.13Å; V619-P643 HydrophobicContact CG1-CG 3.98Å
620	P	85.4	Confident	70.1	Confident	37 Å²	37	66.7 Å²	66.7	24%	0.24	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-57.7	143	171	24.3	-35.8	0	0	0	112	V601 M602 R603 W642	V601-P620 HydrophobicContact CG1-CB 3.98Å; M602-P620 WeakPolarHBondContact O-CA 2.94Å; R603-P620 HydrophobicContact CG-CB 4.42Å; P620-W642 WeakPolarHBondContact O-CB 3.3Å
621	V	87.1	Confident	71.3	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.018	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.3	-178.6	-177.6	0	0	0	0	110.1	R552 T556 W582 M602 V640 W642	R552-V621 HydrophobicContact CG-CG2 4.45Å; T556-V621 HydrophobicContact CG2-CB 4.08Å; T556-V621 HydrophobicContact CG2-CG1 3.73Å; W582-V621 HydrophobicContact CH2-CG2 4Å; W582-V621 HydrophobicContact CZ3-CB 4.35Å; W582-V621 HydrophobicContact CZ3-CG2 3.88Å; M602-V621 PolarHBondContact N-O 2.83Å; M602-V621 PolarHBondContact O-N 3.37Å; V621-V640 HydrophobicContact CG1-CB 3.73Å; V621-V640 HydrophobicContact CG1-CG1 4.33Å; V621-V640 HydrophobicContact CG1-CG2 3.85Å; V621-W642 HydrophobicContact CG1-CE3 4.34Å; V621-W642 HydrophobicContact CG2-CB 4.3Å
622	S	85.8	Confident	72.4	Confident	13 Å²	13	59.8 Å²	59.8	9%	0.091	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	133.7	-179.2	-56.1	0	0	0	0	111.3	V640 A641	S622-V640 CarbonylContact O-C 3.59Å; S622-V640 WeakPolarHBondContact O-CA 3.48Å; S622-V640 WeakPolarHBondContact O-CB 3.41Å; S622-A641 WeakPolarHBondContact CA-O 3.42Å; S622-A641 PolarHBondContact N-O 3.34Å; S622-A641 PolarHBondContact O-N 2.92Å
623	V	85.3	Confident	73.7	Confident	0 Å²	0	58 Å²	58	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	118.2	175.1	-176.2	0	0	0	0	109.2	L599 A600 R626 V640	L599-V623 WeakPolarHBondContact CB-O 3.47Å; L599-V623 PolarHBondContact N-O 2.67Å; A600-V623 HydrophobicContact CB-CB 4.31Å; A600-V623 HydrophobicContact CB-CG2 4.37Å; A600-V623 PolarHBondContact O-N 2.63Å; V623-R626 HydrophobicContact CG1-CG 3.56Å; V623-V640 HydrophobicContact CG2-CG1 4.22Å
624	L	79.6	Confident	75.5	Confident	22 Å²	22	56.4 Å²	56.4	12%	0.115	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	-43	-178	-59.4	-179	0	0	0	112.2	V598 L599 V639 A641 P648 A703	V598-L624 HydrophobicContact CG1-CD2 4.09Å; L599-L624 WeakPolarHBondContact CD1-O 3.47Å; L624-V639 HydrophobicContact CB-CG1 4.49Å; L624-V639 HydrophobicContact CD1-CG1 4.44Å; L624-V639 PolarHBondContact N-O 3.45Å; L624-A641 HydrophobicContact CD1-CB 3.83Å; L624-A641 HydrophobicContact CG-CB 4.28Å; L624-P648 HydrophobicContact CD1-CB 4.24Å; L624-A703 HydrophobicContact CB-CB 4.21Å
625	C	80.3	Confident	77.4	Confident	13 Å²	13	55.2 Å²	55.2	9%	0.088	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	148.4	-177.2	-176.1	0	0	0	0	110	V638 V639	C625-V638 CarbonylContact O-C 3.43Å; C625-V638 WeakPolarHBondContact O-CA 3.21Å; C625-V639 HydrophobicContact CB-CB 4.11Å; C625-V639 HydrophobicContact CB-CG2 4.28Å; C625-V639 PolarHBondContact N-O 3.28Å; C625-V639 PolarHBondContact O-N 2.87Å
626	R	85	Confident	79.5	Confident	37 Å²	37	45.7 Å²	45.7	14%	0.14	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	125.8	178.5	-60.7	172.3	108.5	164.4	5.2	108.9	H558 L560 L599 V623 P628 V638	H558-R626 VanDerWaalsContact C-NH2 3.35Å; H558-R626 PolarHBondContact CE1-NH2 2.79Å; H558-R626 PolarHBondContact ND1-NH2 2.92Å; H558-R626 VanDerWaalsContact ND1-NH2 3.11Å; H558-R626 VanDerWaalsContact O-CZ 3.22Å; H558-R626 PolarHBondContact O-NE 3.05Å; H558-R626 PolarHBondContact O-NH2 2.87Å; L560-R626 PolarHBondContact O-NH1 3.06Å; L560-R626 PolarHBondContact O-NH2 2.67Å; L599-R626 HydrophobicContact CD1-CG 4.24Å; V623-R626 HydrophobicContact CG1-CG 3.56Å; R626-P628 WeakPolarHBondContact O-CD 3.33Å; R626-V638 HydrophobicContact CB-CG1 4.42Å; R626-V638 HydrophobicContact CG-CG1 4.05Å
627	F	85.9	Confident	81.3	Confident	24 Å²	24	38.1 Å²	38.1	11%	0.105	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	100.8	164.7	-59	-87.1	0	0	0	107.8	M636 S637 V639 L706 R708 V711	F627-M636 WeakPolarHBondContact O-CA 3.33Å; F627-M636 WeakPolarHBondContact O-CB 3.5Å; F627-S637 WeakPolarHBondContact CB-OG 3.5Å; F627-S637 VanDerWaalsContact CD2-OG 3.29Å; F627-S637 WeakPolarHBondContact CD2-OG 3.48Å; F627-S637 PolarHBondContact N-O 3.43Å; F627-S637 PolarHBondContact O-N 2.88Å; F627-V639 HydrophobicContact CE2-CG2 4.42Å; F627-L706 HydrophobicContact CZ-CB 4.21Å; F627-L706 VanDerWaalsContact CZ-O 3.29Å; F627-L706 WeakPolarHBondContact CZ-O 3.21Å; F627-R708 HydrophobicContact CB-CG 4.4Å; F627-R708 HydrophobicContact CD1-CB 3.77Å; F627-R708 HydrophobicContact CD1-CG 3.98Å; F627-R708 HydrophobicContact CE1-CB 3.98Å; F627-R708 HydrophobicContact CG-CB 4.46Å; F627-R708 HydrophobicContact CG-CG 4.24Å; F627-R708 PolarHBondContact O-NH2 3.28Å; F627-V711 HydrophobicContact CD2-CG1 4.42Å; F627-V711 HydrophobicContact CE2-CB 4.16Å; F627-V711 HydrophobicContact CE2-CG1 4.26Å; F627-V711 HydrophobicContact CE2-CG2 3.72Å; F627-V711 HydrophobicContact CZ-CG2 4.11Å
628	P	80.9	Confident	82.7	Confident	34 Å²	34	33.9 Å²	33.9	22%	0.221	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	162.5	-171.6	28.9	-36.6	0	0	0	111.5	R626 S630 R708	R626-P628 WeakPolarHBondContact O-CD 3.33Å; P628-S630 PolarHBondContact O-N 3.4Å; P628-R708 PolarHBondContact O-NH1 3.06Å; P628-R708 VanDerWaalsContact O-NH1 3.12Å; P628-R708 PolarHBondContact O-NH2 2.86Å
629	F	83.6	Confident	83.7	Confident	73 Å²	73	32.6 Å²	32.6	32%	0.32	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	136.8	179.8	-176.7	-94.1	0	0	0	111.9	R370 R635 M636	R370-F629 PolarHBondContact NE-O 2.75Å; R370-F629 VanDerWaalsContact NE-O 3.12Å; R370-F629 PolarHBondContact NH1-O 2.76Å; R370-F629 PolarHBondContact NH2-O 3.23Å; R370-F629 VanDerWaalsContact NH2-O 3.08Å; F629-R635 WeakPolarHBondContact CA-O 3.41Å; F629-M636 HydrophobicContact CB-CB 3.97Å; F629-M636 HydrophobicContact CB-SD 4.49Å
630	S	77.5	Confident	84	Confident	30 Å²	30	29.7 Å²	29.7	21%	0.21	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.5	171	165	0	0	0	0	108.8	P628 A632 L633 Q634 R635	P628-S630 PolarHBondContact O-N 3.4Å; S630-A632 PolarHBondContact O-N 3.47Å; S630-A632 PolarHBondContact OG-N 3.44Å; S630-L633 CarbonylContact O-C 3.45Å; S630-L633 PolarHBondContact O-N 3.07Å; S630-L633 PolarHBondContact OG-N 3.21Å; S630-Q634 VanDerWaalsContact O-CA 3.24Å; S630-Q634 WeakPolarHBondContact O-CA 3.33Å; S630-Q634 PolarHBondContact O-N 2.66Å; S630-R635 PolarHBondContact N-O 3.42Å; S630-R635 VanDerWaalsContact N-O 3.09Å
631	S	68.6	Low	84	Confident	92 Å²	92	28.3 Å²	28.3	64%	0.643	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-30.4	178.6	-54.2	0	0	0	0	112.3	Q634	S631-Q634 VanDerWaalsContact O-CG 3.31Å; S631-Q634 WeakPolarHBondContact O-CG 3.42Å
632	A	69.6	Low	83.9	Confident	91 Å²	91	30 Å²	30	75%	0.752	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-38.3	174.6	0	0	0	0	0	111.9	S630	S630-A632 PolarHBondContact O-N 3.47Å; S630-A632 PolarHBondContact OG-N 3.44Å
633	L	80.7	Confident	83.4	Confident	59 Å²	59	32.1 Å²	32.1	31%	0.309	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-13.5	-179.8	-57.2	177.8	0	0	0	114	S630 R635 L658	S630-L633 CarbonylContact O-C 3.45Å; S630-L633 PolarHBondContact O-N 3.07Å; S630-L633 PolarHBondContact OG-N 3.21Å; L633-R635 VanDerWaalsContact C-N 3.26Å; L633-R635 HydrophobicContact CB-CG 4.21Å; L633-R635 PolarHBondContact O-N 2.9Å; L633-R635 PolarHBondContact O-NH1 3.34Å; L633-L658 WeakPolarHBondContact O-CD1 3.24Å
634	Q	83.6	Confident	82.7	Confident	64 Å²	64	36.1 Å²	36.1	30%	0.299	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	35.6	-175.9	-44.9	173.9	3.9	0	0	115.4	S630 S631 G654 S655 L658	S630-Q634 VanDerWaalsContact O-CA 3.24Å; S630-Q634 WeakPolarHBondContact O-CA 3.33Å; S630-Q634 PolarHBondContact O-N 2.66Å; S631-Q634 VanDerWaalsContact O-CG 3.31Å; S631-Q634 WeakPolarHBondContact O-CG 3.42Å; Q634-G654 CarbonylContact O-C 3.54Å; Q634-G654 VanDerWaalsContact O-CA 3.26Å; Q634-G654 WeakPolarHBondContact O-CA 3.4Å; Q634-S655 PolarHBondContact O-N 3.06Å; Q634-L658 HydrophobicContact CB-CD1 3.75Å; Q634-L658 HydrophobicContact CG-CD1 4.02Å
635	R	91	Very high	82.4	Confident	28 Å²	28	36.4 Å²	36.4	11%	0.106	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	163.7	-178.9	67.8	-167.1	-179.1	-105.9	5	112.6	F629 S630 L633 K653 R708 E712	F629-R635 WeakPolarHBondContact CA-O 3.41Å; S630-R635 PolarHBondContact N-O 3.42Å; S630-R635 VanDerWaalsContact N-O 3.09Å; L633-R635 VanDerWaalsContact C-N 3.26Å; L633-R635 HydrophobicContact CB-CG 4.21Å; L633-R635 PolarHBondContact O-N 2.9Å; L633-R635 PolarHBondContact O-NH1 3.34Å; R635-K653 CarbonylContact C-O 3.6Å; R635-K653 VanDerWaalsContact CA-O 3.29Å; R635-K653 WeakPolarHBondContact CA-O 3.21Å; R635-K653 WeakPolarHBondContact CB-O 3.41Å; R635-R708 PolarHBondContact O-NH2 3.41Å; R635-R708 VanDerWaalsContact O-NH2 3.16Å; R635-E712 IonicContact CZ-OE2 3.08Å; R635-E712 IonicContact NE-OE1 3.62Å; R635-E712 IonicContact NE-OE2 3.01Å; R635-E712 PolarHBondContact NE-OE2 3.35Å; R635-E712 IonicContact NH2-OE2 2.56Å; R635-E712 PolarHBondContact NH2-OE2 3.21Å
636	M	92.6	Very high	81.9	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.015	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	159.7	169.7	75.9	174.4	-81.2	0	0	111	H558 A559 F627 F629 V638 V652 K653	H558-M636 WeakPolarHBondContact O-CE 3.34Å; A559-M636 HydrophobicContact CB-CE 4.32Å; F627-M636 WeakPolarHBondContact O-CA 3.33Å; F627-M636 WeakPolarHBondContact O-CB 3.5Å; F629-M636 HydrophobicContact CB-CB 3.97Å; F629-M636 HydrophobicContact CB-SD 4.49Å; M636-V638 HydrophobicContact CE-CG1 4.11Å; M636-V652 WeakPolarHBondContact O-CA 3.18Å; M636-V652 WeakPolarHBondContact O-CG1 3.47Å; M636-K653 HydrophobicContact CG-CD 4.19Å; M636-K653 VanDerWaalsContact CG-CE 3.47Å; M636-K653 HydrophobicContact CG-CG 3.59Å; M636-K653 PolarHBondContact N-O 3.11Å; M636-K653 PolarHBondContact O-N 3.2Å; M636-K653 HydrophobicContact SD-CD 4.44Å; M636-K653 WeakPolarHBondContact SD-CE 3.17Å; M636-K653 HydrophobicContact SD-CG 4.45Å
637	S	93.1	Very high	81.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	157.3	176.2	59.4	0	0	0	0	111.9	F627 Y651 E712	F627-S637 WeakPolarHBondContact CB-OG 3.5Å; F627-S637 VanDerWaalsContact CD2-OG 3.29Å; F627-S637 WeakPolarHBondContact CD2-OG 3.48Å; F627-S637 PolarHBondContact N-O 3.43Å; F627-S637 PolarHBondContact O-N 2.88Å; S637-Y651 CarbonylContact C-O 3.49Å; S637-Y651 WeakPolarHBondContact CA-O 3.39Å; S637-Y651 WeakPolarHBondContact CB-O 3.47Å; S637-E712 PolarHBondContact OG-OE1 3Å
638	V	91.5	Very high	81.7	Confident	0 Å²	0	43 Å²	43	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	150.3	176	-60.2	0	0	0	0	108.9	C557 C625 R626 M636 V640 A650 Y651	C557-V638 HydrophobicContact CB-CG2 3.87Å; C625-V638 CarbonylContact O-C 3.43Å; C625-V638 WeakPolarHBondContact O-CA 3.21Å; R626-V638 HydrophobicContact CB-CG1 4.42Å; R626-V638 HydrophobicContact CG-CG1 4.05Å; M636-V638 HydrophobicContact CE-CG1 4.11Å; V638-V640 HydrophobicContact CG2-CG1 4.03Å; V638-A650 CarbonylContact O-C 3.49Å; V638-A650 VanDerWaalsContact O-CA 3.27Å; V638-A650 WeakPolarHBondContact O-CA 3.44Å; V638-Y651 PolarHBondContact N-O 3.45Å; V638-Y651 PolarHBondContact O-N 3.48Å
639	V	89.3	Confident	82.1	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.6	172.1	-177.5	0	0	0	0	107.7	L624 C625 F627 P648 E649 A650 L694 L706 V711	L624-V639 HydrophobicContact CB-CG1 4.49Å; L624-V639 HydrophobicContact CD1-CG1 4.44Å; L624-V639 PolarHBondContact N-O 3.45Å; C625-V639 HydrophobicContact CB-CB 4.11Å; C625-V639 HydrophobicContact CB-CG2 4.28Å; C625-V639 PolarHBondContact N-O 3.28Å; C625-V639 PolarHBondContact O-N 2.87Å; F627-V639 HydrophobicContact CE2-CG2 4.42Å; V639-P648 HydrophobicContact CG1-CB 4.22Å; V639-E649 CarbonylContact C-O 3.51Å; V639-E649 WeakPolarHBondContact CA-O 3.49Å; V639-A650 HydrophobicContact CG2-CB 4.5Å; V639-L694 HydrophobicContact CG1-CD1 3.77Å; V639-L694 HydrophobicContact CG2-CD1 3.98Å; V639-L706 HydrophobicContact CG2-CD1 4.23Å; V639-V711 HydrophobicContact CG2-CG1 4.29Å; V639-V711 HydrophobicContact CG2-CG2 4.32Å
640	V	88.6	Confident	82.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	157	-174.2	-52.8	0	0	0	0	112.1	T556 V621 S622 V623 V638 W642 P648 E649 Y651	T556-V640 HydrophobicContact CG2-CG1 4.22Å; V621-V640 HydrophobicContact CG1-CB 3.73Å; V621-V640 HydrophobicContact CG1-CG1 4.33Å; V621-V640 HydrophobicContact CG1-CG2 3.85Å; S622-V640 CarbonylContact O-C 3.59Å; S622-V640 WeakPolarHBondContact O-CA 3.48Å; S622-V640 WeakPolarHBondContact O-CB 3.41Å; V623-V640 HydrophobicContact CG2-CG1 4.22Å; V638-V640 HydrophobicContact CG2-CG1 4.03Å; V640-W642 HydrophobicContact CG2-CZ3 4.38Å; V640-P648 WeakPolarHBondContact O-CA 3.44Å; V640-E649 PolarHBondContact N-O 3.26Å; V640-E649 PolarHBondContact O-N 3.28Å; V640-Y651 HydrophobicContact CG1-CD2 4.49Å; V640-Y651 HydrophobicContact CG2-CD2 3.7Å; V640-Y651 HydrophobicContact CG2-CE2 3.43Å; V640-Y651 VanDerWaalsContact CG2-CE2 3.43Å
641	A	85.2	Confident	83.4	Confident	7 Å²	7	37.9 Å²	37.9	6%	0.058	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	159.1	172.5	0	0	0	0	0	109.8	F594 S622 L624	F594-A641 HydrophobicContact CZ-CB 4.23Å; S622-A641 WeakPolarHBondContact CA-O 3.42Å; S622-A641 PolarHBondContact N-O 3.34Å; S622-A641 PolarHBondContact O-N 2.92Å; L624-A641 HydrophobicContact CD1-CB 3.83Å; L624-A641 HydrophobicContact CG-CB 4.28Å
642	W	84.2	Confident	84.7	Confident	40 Å²	40	33.5 Å²	33.5	15%	0.152	22%	0.218	C	C	.	.			trans	-143.6	160.3	176	59.8	90.1	0	0	0	110.5	P620 V621 V640 G644 A645 E649	P620-W642 WeakPolarHBondContact O-CB 3.3Å; V621-W642 HydrophobicContact CG1-CE3 4.34Å; V621-W642 HydrophobicContact CG2-CB 4.3Å; V640-W642 HydrophobicContact CG2-CZ3 4.38Å; W642-G644 PolarHBondContact O-N 2.84Å; W642-A645 HydrophobicContact CD2-CB 3.76Å; W642-A645 HydrophobicContact CE3-CB 4.3Å; W642-A645 HydrophobicContact CG-CB 4.05Å; W642-A645 HydrophobicContact CH2-CB 4.43Å; W642-A645 HydrophobicContact CZ2-CB 3.92Å; W642-A645 VanDerWaalsContact O-CB 3.29Å; W642-A645 WeakPolarHBondContact O-CB 3.47Å; W642-A645 PolarHBondContact O-N 3.11Å; W642-E649 VanDerWaalsContact CH2-CD 3.49Å; W642-E649 HydrophobicContact CH2-CG 4.05Å; W642-E649 HydrophobicContact CZ3-CB 4.39Å; W642-E649 HydrophobicContact CZ3-CG 4.3Å
643	P	75.9	Confident	85.9	Confident	56 Å²	56	29.3 Å²	29.3	36%	0.364	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	122.1	175.5	-25.8	33.5	0	0	0	111.7	A593 V619	A593-P643 HydrophobicContact CB-CG 4.25Å; V619-P643 HydrophobicContact CG1-CB 4.13Å; V619-P643 HydrophobicContact CG1-CG 3.98Å
644	G	70.2	Confident	86.5	Confident	84 Å²	84	26.8 Å²	26.8	87%	0.866	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.3	-1.4	-178.6	0	0	0	0	0	115.7	W642	W642-G644 PolarHBondContact O-N 2.84Å
645	A	73.1	Confident	86.8	Confident	28 Å²	28	24.6 Å²	24.6	23%	0.231	16%	0.163	C	C	.	.			trans	-69	128.4	171.6	0	0	0	0	0	111.1	W642 Q647	W642-A645 HydrophobicContact CD2-CB 3.76Å; W642-A645 HydrophobicContact CE3-CB 4.3Å; W642-A645 HydrophobicContact CG-CB 4.05Å; W642-A645 HydrophobicContact CH2-CB 4.43Å; W642-A645 HydrophobicContact CZ2-CB 3.92Å; W642-A645 VanDerWaalsContact O-CB 3.29Å; W642-A645 WeakPolarHBondContact O-CB 3.47Å; W642-A645 PolarHBondContact O-N 3.11Å; A645-Q647 VanDerWaalsContact C-N 3.33Å
646	S	69.5	Low	86.8	Confident	120 Å²	120	23.7 Å²	23.7	84%	0.839	16%	0.161	S	C	*	.	S	Bend	trans	-71.1	-28.7	175.8	56.3	0	0	0	0	113
647	Q	81.4	Confident	86.6	Confident	81 Å²	81	27.6 Å²	27.6	38%	0.379	18%	0.179	S	C	.	.	S	Bend	trans	-146.1	147.4	-179.2	-73.2	-176.4	-15.3	0	0	110.4	A645	A645-Q647 VanDerWaalsContact C-N 3.33Å
648	P	85.9	Confident	86.4	Confident	11 Å²	11	30.8 Å²	30.8	7%	0.071	20%	0.196	C	C	.	.			trans	-66.3	148	170.2	25.7	-29.5	0	0	0	111.1	L624 V639 V640 L694 V697	L624-P648 HydrophobicContact CD1-CB 4.24Å; V639-P648 HydrophobicContact CG1-CB 4.22Å; V640-P648 WeakPolarHBondContact O-CA 3.44Å; P648-L694 HydrophobicContact CG-CB 4.29Å; P648-L694 PolarHBondContact O-N 3.08Å; P648-V697 HydrophobicContact CG-CB 4.17Å; P648-V697 HydrophobicContact CG-CG2 4.33Å
649	E	90.3	Very high	86.4	Confident	30 Å²	30	30.8 Å²	30.8	14%	0.14	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	140.5	178.4	-73	-175	177.5	0	0	111	R552 V639 V640 W642 Y651	R552-E649 IonicContact NE-OE2 2.71Å; R552-E649 IonicContact NH2-OE2 2.87Å; V639-E649 CarbonylContact C-O 3.51Å; V639-E649 WeakPolarHBondContact CA-O 3.49Å; V640-E649 PolarHBondContact N-O 3.26Å; V640-E649 PolarHBondContact O-N 3.28Å; W642-E649 VanDerWaalsContact CH2-CD 3.49Å; W642-E649 HydrophobicContact CH2-CG 4.05Å; W642-E649 HydrophobicContact CZ3-CB 4.39Å; W642-E649 HydrophobicContact CZ3-CG 4.3Å; E649-Y651 HydrophobicContact CB-CE2 4.26Å; E649-Y651 VanDerWaalsContact OE2-CZ 3.27Å; E649-Y651 PolarHBondContact OE2-OH 3.49Å
650	A	92.4	Very high	86.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	133.2	169.7	0	0	0	0	0	110.4	V638 V639 S691 K692 L694 V711	V638-A650 CarbonylContact O-C 3.49Å; V638-A650 VanDerWaalsContact O-CA 3.27Å; V638-A650 WeakPolarHBondContact O-CA 3.44Å; V639-A650 HydrophobicContact CG2-CB 4.5Å; A650-S691 CarbonylContact O-C 3.55Å; A650-S691 WeakPolarHBondContact O-CA 3.39Å; A650-K692 HydrophobicContact CB-CB 4.48Å; A650-K692 PolarHBondContact N-O 2.98Å; A650-K692 PolarHBondContact O-N 2.84Å; A650-L694 HydrophobicContact CB-CD1 4.14Å; A650-L694 HydrophobicContact CB-CG 4.28Å; A650-V711 HydrophobicContact CB-CG1 3.62Å
651	Y	95.3	Very high	86.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	134.1	172.2	-66.9	-67.5	0	0	0	110.3	P549 R552 A553 C557 S637 V638 V640 E649 A690 L718	P549-Y651 HydrophobicContact CB-CE1 4.12Å; P549-Y651 WeakPolarHBondContact O-CE1 3.24Å; R552-Y651 HydrophobicContact CB-CE1 4.5Å; R552-Y651 HydrophobicContact CB-CE2 3.86Å; R552-Y651 WeakPolarHBondContact CB-OH 3.29Å; R552-Y651 PolarHBondContact NE-OH 2.99Å; A553-Y651 HydrophobicContact CB-CD1 3.49Å; A553-Y651 VanDerWaalsContact CB-CD1 3.49Å; A553-Y651 HydrophobicContact CB-CE1 4.04Å; A553-Y651 HydrophobicContact CB-CG 3.94Å; C557-Y651 PolarHBondContact SG-O 3.33Å; C557-Y651 VanDerWaalsContact SG-O 3.35Å; S637-Y651 CarbonylContact C-O 3.49Å; S637-Y651 WeakPolarHBondContact CA-O 3.39Å; S637-Y651 WeakPolarHBondContact CB-O 3.47Å; V638-Y651 PolarHBondContact N-O 3.45Å; V638-Y651 PolarHBondContact O-N 3.48Å; V640-Y651 HydrophobicContact CG1-CD2 4.49Å; V640-Y651 HydrophobicContact CG2-CD2 3.7Å; V640-Y651 HydrophobicContact CG2-CE2 3.43Å; V640-Y651 VanDerWaalsContact CG2-CE2 3.43Å; E649-Y651 HydrophobicContact CB-CE2 4.26Å; E649-Y651 VanDerWaalsContact OE2-CZ 3.27Å; E649-Y651 PolarHBondContact OE2-OH 3.49Å; Y651-A690 WeakPolarHBondContact CA-O 3.3Å; Y651-L718 HydrophobicContact CD1-CD1 4.17Å; Y651-L718 HydrophobicContact CE1-CD1 4.14Å
652	V	95.3	Very high	87	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.8	-178.9	-172.7	0	0	0	0	109.3	M636 L689 A690 L715	M636-V652 WeakPolarHBondContact O-CA 3.18Å; M636-V652 WeakPolarHBondContact O-CG1 3.47Å; V652-L689 CarbonylContact O-C 3.58Å; V652-L689 WeakPolarHBondContact O-CA 3.22Å; V652-A690 PolarHBondContact N-O 2.92Å; V652-A690 PolarHBondContact O-N 3.46Å; V652-L715 HydrophobicContact CB-CD1 3.97Å; V652-L715 HydrophobicContact CG1-CD1 4.23Å; V652-L715 HydrophobicContact CG2-CD1 3.6Å; V652-L715 HydrophobicContact CG2-CD2 3.78Å; V652-L715 HydrophobicContact CG2-CG 4.36Å
653	K	95.1	Very high	87.4	Confident	4 Å²	4	34.8 Å²	34.8	2%	0.017	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	146	168	77.9	177	175.4	-170	0	111.5	C557 M572 D573 M576 R635 M636 V687 A688 L689	C557-K653 WeakPolarHBondContact O-CD 3.49Å; C557-K653 WeakPolarHBondContact O-CE 3.31Å; C557-K653 PolarHBondContact O-NZ 3.3Å; M572-K653 HydrophobicContact CE-CD 4.5Å; D573-K653 IonicContact OD1-NZ 3.66Å; D573-K653 PolarHBondContact OD1-NZ 3.22Å; D573-K653 IonicContact OD2-NZ 3.31Å; D573-K653 PolarHBondContact OD2-NZ 3.44Å; M576-K653 HydrophobicContact CE-CD 4.34Å; M576-K653 HydrophobicContact SD-CD 4.22Å; R635-K653 CarbonylContact C-O 3.6Å; R635-K653 VanDerWaalsContact CA-O 3.29Å; R635-K653 WeakPolarHBondContact CA-O 3.21Å; R635-K653 WeakPolarHBondContact CB-O 3.41Å; M636-K653 HydrophobicContact CG-CD 4.19Å; M636-K653 VanDerWaalsContact CG-CE 3.47Å; M636-K653 HydrophobicContact CG-CG 3.59Å; M636-K653 PolarHBondContact N-O 3.11Å; M636-K653 PolarHBondContact O-N 3.2Å; M636-K653 HydrophobicContact SD-CD 4.44Å; M636-K653 WeakPolarHBondContact SD-CE 3.17Å; M636-K653 HydrophobicContact SD-CG 4.45Å; K653-V687 HydrophobicContact CB-CG1 4.12Å; K653-A688 VanDerWaalsContact CA-O 3.28Å; K653-A688 WeakPolarHBondContact CA-O 3.45Å; K653-L689 HydrophobicContact CB-CD2 3.62Å
654	G	92.6	Very high	88.2	Confident	6 Å²	6	35.2 Å²	35.2	6%	0.062	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.7	-166.2	179.8	0	0	0	0	0	114.7	Q634 V687 A688	Q634-G654 CarbonylContact O-C 3.54Å; Q634-G654 VanDerWaalsContact O-CA 3.26Å; Q634-G654 WeakPolarHBondContact O-CA 3.4Å; G654-V687 WeakPolarHBondContact O-CG1 3.41Å; G654-A688 PolarHBondContact N-O 3.02Å; G654-A688 VanDerWaalsContact N-O 3.13Å; G654-A688 PolarHBondContact O-N 2.86Å
655	S	90.3	Very high	89	Confident	18 Å²	18	36.6 Å²	36.6	13%	0.126	23%	0.23	C	C	.	.			trans	-56.1	129.9	173.9	58.7	0	0	0	0	109.8	Q634 E657 L658 V659	Q634-S655 PolarHBondContact O-N 3.06Å; S655-E657 VanDerWaalsContact C-N 3.3Å; S655-E657 PolarHBondContact O-N 3.13Å; S655-L658 PolarHBondContact O-N 2.78Å; S655-L658 VanDerWaalsContact OG-CB 3.23Å; S655-L658 WeakPolarHBondContact OG-CB 3.4Å; S655-L658 VanDerWaalsContact OG-CD1 3.32Å; S655-L658 WeakPolarHBondContact OG-CD1 3.44Å; S655-L658 WeakPolarHBondContact OG-CG 3.3Å; S655-V659 WeakPolarHBondContact O-CG2 3.41Å; S655-V659 PolarHBondContact O-N 3.03Å
656	P	90.9	Very high	89.6	Confident	8 Å²	8	42.8 Å²	42.8	5%	0.052	25%	0.254	C	S	.	.	H	α-helix	trans	-54.1	-42.2	-174	-30.2	37.9	0	0	0	114.4	A660 F672 L676 V686 A688	P656-A660 WeakPolarHBondContact O-CB 3.44Å; P656-A660 PolarHBondContact O-N 3Å; P656-F672 HydrophobicContact CB-CE1 4.44Å; P656-F672 HydrophobicContact CB-CZ 3.8Å; P656-F672 WeakPolarHBondContact O-CZ 3.49Å; P656-L676 HydrophobicContact CB-CD1 3.69Å; P656-L676 HydrophobicContact CB-CD2 3.75Å; P656-L676 HydrophobicContact CB-CG 4.33Å; P656-L676 HydrophobicContact CG-CD1 3.62Å; P656-L676 HydrophobicContact CG-CD2 4.47Å; P656-V686 WeakPolarHBondContact CD-O 3.43Å; P656-V686 HydrophobicContact CG-CB 4.16Å; P656-V686 HydrophobicContact CG-CG1 3.97Å; P656-V686 WeakPolarHBondContact CG-O 3.26Å; P656-A688 HydrophobicContact CB-CB 4.1Å; P656-A688 HydrophobicContact CG-CB 4.36Å
657	E	88.3	Confident	90.4	Very high	85 Å²	85	38.3 Å²	38.3	40%	0.397	22%	0.222	S	C	.	.	H	α-helix	trans	-68	-42	-176.9	-48.8	90.8	161.4	0	0	112	S655 G661 L676	S655-E657 VanDerWaalsContact C-N 3.3Å; S655-E657 PolarHBondContact O-N 3.13Å; E657-G661 PolarHBondContact O-N 3.21Å; E657-G661 VanDerWaalsContact O-N 3.07Å; E657-L676 HydrophobicContact CG-CD2 3.96Å
658	L	89.6	Confident	90.8	Very high	68 Å²	68	35.8 Å²	35.8	36%	0.356	21%	0.212	S	C	.	.	H	α-helix	trans	-72.3	-39.9	178.7	-60	-179.5	0	0	0	112.2	L633 Q634 S655 G661 L662	L633-L658 WeakPolarHBondContact O-CD1 3.24Å; Q634-L658 HydrophobicContact CB-CD1 3.75Å; Q634-L658 HydrophobicContact CG-CD1 4.02Å; S655-L658 PolarHBondContact O-N 2.78Å; S655-L658 VanDerWaalsContact OG-CB 3.23Å; S655-L658 WeakPolarHBondContact OG-CB 3.4Å; S655-L658 VanDerWaalsContact OG-CD1 3.32Å; S655-L658 WeakPolarHBondContact OG-CD1 3.44Å; S655-L658 WeakPolarHBondContact OG-CG 3.3Å; L658-G661 PolarHBondContact O-N 3.22Å; L658-L662 WeakPolarHBondContact O-CG 3.46Å; L658-L662 PolarHBondContact O-N 2.76Å
659	V	92.1	Very high	91	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.9	-43.4	177.8	174.3	0	0	0	0	110.1	S655 G661 L662 C663 A688 A690	S655-V659 WeakPolarHBondContact O-CG2 3.41Å; S655-V659 PolarHBondContact O-N 3.03Å; V659-G661 VanDerWaalsContact C-N 3.27Å; V659-G661 PolarHBondContact O-N 3.49Å; V659-L662 PolarHBondContact O-N 3.07Å; V659-C663 PolarHBondContact O-N 3.17Å; V659-C663 PolarHBondContact O-SG 2.66Å; V659-A688 HydrophobicContact CB-CB 3.97Å; V659-A688 HydrophobicContact CG1-CB 4.03Å; V659-A688 HydrophobicContact CG2-CB 4.48Å; V659-A690 HydrophobicContact CG1-CB 3.75Å
660	A	91.2	Very high	90.9	Very high	15 Å²	15	40.8 Å²	40.8	12%	0.124	25%	0.245	C	C	.	.	H	α-helix	trans	-59.2	-38.6	174.5	0	0	0	0	0	112.1	P656 L662 C663 V668 F672	P656-A660 WeakPolarHBondContact O-CB 3.44Å; P656-A660 PolarHBondContact O-N 3Å; A660-L662 PolarHBondContact O-N 3.48Å; A660-C663 PolarHBondContact O-N 2.85Å; A660-C663 VanDerWaalsContact O-N 3.12Å; A660-V668 HydrophobicContact CB-CG1 4.44Å; A660-F672 HydrophobicContact CB-CD1 4.39Å; A660-F672 HydrophobicContact CB-CE1 3.76Å; A660-F672 HydrophobicContact CB-CE2 4.21Å; A660-F672 HydrophobicContact CB-CZ 3.67Å
661	G	91.2	Very high	90.6	Very high	66 Å²	66	43.3 Å²	43.3	68%	0.68	26%	0.258	S	S	*	.	H	α-helix	trans	-66	-15	175	0	0	0	0	0	115.3	E657 L658 V659	E657-G661 PolarHBondContact O-N 3.21Å; E657-G661 VanDerWaalsContact O-N 3.07Å; L658-G661 PolarHBondContact O-N 3.22Å; V659-G661 VanDerWaalsContact C-N 3.27Å; V659-G661 PolarHBondContact O-N 3.49Å
662	L	92.2	Very high	90.4	Very high	40 Å²	40	44.1 Å²	44.1	21%	0.209	26%	0.262	C	S	.	.	H	α-helix	trans	-99.7	-9	174.8	-59.6	171.3	0	0	0	112.7	L658 V659 A660 E712 E714 L715	L658-L662 WeakPolarHBondContact O-CG 3.46Å; L658-L662 PolarHBondContact O-N 2.76Å; V659-L662 PolarHBondContact O-N 3.07Å; A660-L662 PolarHBondContact O-N 3.48Å; L662-E712 HydrophobicContact CD1-CB 4.39Å; L662-E712 WeakPolarHBondContact CD2-O 3.39Å; L662-E714 PolarHBondContact O-N 3.23Å; L662-L715 HydrophobicContact CB-CD1 3.88Å; L662-L715 PolarHBondContact O-N 2.93Å; L662-L715 VanDerWaalsContact O-N 3.1Å
663	C	92.9	Very high	90.1	Very high	10 Å²	10	47.4 Å²	47.4	7%	0.068	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-83.5	154.4	178.2	-63.7	0	0	0	0	111.1	V659 A660 V668 L715	V659-C663 PolarHBondContact O-N 3.17Å; V659-C663 PolarHBondContact O-SG 2.66Å; A660-C663 PolarHBondContact O-N 2.85Å; A660-C663 VanDerWaalsContact O-N 3.12Å; C663-V668 HydrophobicContact CB-CG2 3.71Å; C663-L715 CarbonylContact C-O 3.51Å; C663-L715 WeakPolarHBondContact CA-O 3.17Å; C663-L715 WeakPolarHBondContact CB-O 3.34Å
664	N	92	Very high	89.7	Confident	66 Å²	66	54.2 Å²	54.2	35%	0.353	32%	0.321	S	S	.	.			trans	-61.5	129.6	169.2	-71.9	-27.7	0	0	0	108.8	E666 T667 E714 L715	N664-E666 PolarHBondContact O-N 2.84Å; N664-T667 HydrophobicContact CB-CG2 4.11Å; N664-T667 PolarHBondContact O-N 3.02Å; N664-T667 PolarHBondContact O-OG1 2.69Å; N664-E714 PolarHBondContact ND2-O 2.9Å; N664-E714 VanDerWaalsContact OD1-CA 3.29Å; N664-E714 WeakPolarHBondContact OD1-CA 3.42Å; N664-E714 WeakPolarHBondContact OD1-CB 3.34Å; N664-L715 PolarHBondContact N-O 3.41Å
665	P	86.9	Confident	89.5	Confident	112 Å²	112	56 Å²	56	73%	0.727	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-54.7	-31.4	-176.4	-27.4	34	0	0	0	113.5	T667 V668	P665-T667 PolarHBondContact O-N 2.98Å; P665-V668 PolarHBondContact O-N 2.88Å
666	E	85.8	Confident	89.4	Confident	159 Å²	159	55.7 Å²	55.7	74%	0.743	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-67.3	-19.1	178	-60	-176.3	174.9	0	0	114	Q533 N664	Q533-E666 WeakPolarHBondContact CG-O 3.24Å; Q533-E666 PolarHBondContact NE2-O 2.89Å; N664-E666 PolarHBondContact O-N 2.84Å
667	T	87.2	Confident	89.1	Confident	25 Å²	25	61.3 Å²	61.3	15%	0.153	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-95.2	-10.8	179.2	68.7	0	0	0	0	112.7	L530 N664 P665 S716 L717	L530-T667 WeakPolarHBondContact CD2-O 3.47Å; N664-T667 HydrophobicContact CB-CG2 4.11Å; N664-T667 PolarHBondContact O-N 3.02Å; N664-T667 PolarHBondContact O-OG1 2.69Å; P665-T667 PolarHBondContact O-N 2.98Å; T667-S716 WeakPolarHBondContact CG2-OG 3.46Å; T667-L717 PolarHBondContact OG1-N 3.48Å
668	V	90	Very high	89	Confident	29 Å²	29	60.6 Å²	60.6	18%	0.176	36%	0.355	C	S	.	.	S	Bend	trans	-96.2	121.3	-179	-177.1	0	0	0	0	109.2	A660 C663 P665 F672	A660-V668 HydrophobicContact CB-CG1 4.44Å; C663-V668 HydrophobicContact CB-CG2 3.71Å; P665-V668 PolarHBondContact O-N 2.88Å; V668-F672 HydrophobicContact CG1-CB 3.95Å; V668-F672 HydrophobicContact CG1-CD2 4.17Å; V668-F672 HydrophobicContact CG1-CG 3.99Å
669	P	89.6	Confident	88.9	Confident	4 Å²	4	59.4 Å²	59.4	3%	0.026	35%	0.346	C	S	.	.			trans	-61	147.9	177.4	-27.4	37.9	0	0	0	113.3	L530 Q533 F535 D671 F672	L530-P669 HydrophobicContact CD1-CG 3.27Å; L530-P669 HydrophobicContact CD2-CG 4.18Å; L530-P669 HydrophobicContact CG-CG 4.35Å; Q533-P669 VanDerWaalsContact O-CB 3.3Å; Q533-P669 WeakPolarHBondContact O-CB 3.07Å; F535-P669 HydrophobicContact CD2-CB 4.19Å; F535-P669 HydrophobicContact CD2-CG 4Å; F535-P669 HydrophobicContact CE2-CB 3.9Å; F535-P669 HydrophobicContact CE2-CG 3.63Å; F535-P669 HydrophobicContact CZ-CG 4.05Å; P669-D671 WeakPolarHBondContact CB-OD1 3.42Å; P669-D671 PolarHBondContact O-N 3.34Å; P669-F672 WeakPolarHBondContact O-CB 3.36Å; P669-F672 PolarHBondContact O-N 2.94Å; P669-F672 VanDerWaalsContact O-N 3.17Å
670	T	87.3	Confident	88.4	Confident	141 Å²	141	60.2 Å²	60.2	87%	0.865	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-27.3	175.3	54.5	0	0	0	0	112.7
671	D	87.9	Confident	87.6	Confident	53 Å²	53	62.2 Å²	62.2	28%	0.283	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	5.3	177.3	70.6	-29	0	0	0	113.9	P669 A673 Q674 M675	P669-D671 WeakPolarHBondContact CB-OD1 3.42Å; P669-D671 PolarHBondContact O-N 3.34Å; D671-A673 PolarHBondContact O-N 2.9Å; D671-Q674 PolarHBondContact O-N 3.15Å; D671-Q674 VanDerWaalsContact O-N 3.08Å; D671-M675 PolarHBondContact O-N 3.46Å
672	F	90.6	Very high	86.9	Confident	18 Å²	18	61.8 Å²	61.8	8%	0.079	36%	0.358	C	S	.	.	H	α-helix	trans	-51.2	-49.4	-178.2	178.2	-88.7	0	0	0	113.6	F535 P656 A660 V668 P669 Q674 M675 L676 L717 L720	F535-F672 HydrophobicContact CE2-CB 4.39Å; F535-F672 HydrophobicContact CE2-CD2 4.23Å; F535-F672 AromaticContact CZ-CD2 3.8Å; F535-F672 HydrophobicContact CZ-CD2 3.8Å; F535-F672 HydrophobicContact CZ-CE2 4.43Å; P656-F672 HydrophobicContact CB-CE1 4.44Å; P656-F672 HydrophobicContact CB-CZ 3.8Å; P656-F672 WeakPolarHBondContact O-CZ 3.49Å; A660-F672 HydrophobicContact CB-CD1 4.39Å; A660-F672 HydrophobicContact CB-CE1 3.76Å; A660-F672 HydrophobicContact CB-CE2 4.21Å; A660-F672 HydrophobicContact CB-CZ 3.67Å; V668-F672 HydrophobicContact CG1-CB 3.95Å; V668-F672 HydrophobicContact CG1-CD2 4.17Å; V668-F672 HydrophobicContact CG1-CG 3.99Å; P669-F672 WeakPolarHBondContact O-CB 3.36Å; P669-F672 PolarHBondContact O-N 2.94Å; P669-F672 VanDerWaalsContact O-N 3.17Å; F672-Q674 VanDerWaalsContact C-N 3.33Å; F672-Q674 PolarHBondContact O-N 2.72Å; F672-M675 PolarHBondContact O-N 3.2Å; F672-L676 HydrophobicContact CE1-CD2 4.19Å; F672-L676 WeakPolarHBondContact O-CB 3.15Å; F672-L676 PolarHBondContact O-N 3.21Å; F672-L717 HydrophobicContact CD2-CD2 3.79Å; F672-L717 HydrophobicContact CE2-CD2 3.82Å; F672-L720 HydrophobicContact CE2-CD2 4.07Å
673	A	87.8	Confident	86	Confident	69 Å²	69	60.5 Å²	60.5	57%	0.57	35%	0.354	S	S	*	.	H	α-helix	trans	-63.8	-39.8	-179	0	0	0	0	0	111.8	D671 Q677	D671-A673 PolarHBondContact O-N 2.9Å; A673-Q677 VanDerWaalsContact O-CB 3.25Å; A673-Q677 WeakPolarHBondContact O-CB 3.44Å; A673-Q677 PolarHBondContact O-N 3.49Å
674	Q	87.4	Confident	85.6	Confident	146 Å²	146	63.5 Å²	63.5	68%	0.682	36%	0.364	S	S	*	.	H	α-helix	trans	-67.7	-43.2	179.2	-172.9	179	3.9	0	0	111.4	D671 F672 Q677 S678	D671-Q674 PolarHBondContact O-N 3.15Å; D671-Q674 VanDerWaalsContact O-N 3.08Å; F672-Q674 VanDerWaalsContact C-N 3.33Å; F672-Q674 PolarHBondContact O-N 2.72Å; Q674-Q677 PolarHBondContact O-N 2.61Å; Q674-S678 PolarHBondContact O-N 3.04Å
675	M	88.3	Confident	85.2	Confident	43 Å²	43	64.3 Å²	64.3	21%	0.212	36%	0.363	C	S	.	.	H	α-helix	trans	-69.1	-39.7	178.6	-169.5	156.8	-61.1	0	0	112.5	V528 F535 D671 F672 Q677 S678 Y679	V528-M675 HydrophobicContact CG1-SD 3.98Å; F535-M675 HydrophobicContact CB-CE 3.73Å; F535-M675 HydrophobicContact CB-SD 3.41Å; F535-M675 WeakPolarHBondContact CB-SD 3.38Å; F535-M675 HydrophobicContact CD1-SD 4.06Å; F535-M675 HydrophobicContact CD2-CB 4.32Å; F535-M675 HydrophobicContact CD2-CE 3.98Å; F535-M675 HydrophobicContact CD2-CG 4.41Å; F535-M675 HydrophobicContact CD2-SD 3.45Å; F535-M675 WeakPolarHBondContact CD2-SD 3.45Å; F535-M675 HydrophobicContact CE2-CB 4.35Å; F535-M675 HydrophobicContact CE2-SD 4.18Å; F535-M675 HydrophobicContact CG-CE 4.12Å; F535-M675 HydrophobicContact CG-SD 3.36Å; F535-M675 WeakPolarHBondContact CG-SD 3.4Å; D671-M675 PolarHBondContact O-N 3.46Å; F672-M675 PolarHBondContact O-N 3.2Å; M675-Q677 VanDerWaalsContact C-N 3.29Å; M675-Q677 PolarHBondContact O-N 2.72Å; M675-S678 PolarHBondContact O-N 3.4Å; M675-S678 PolarHBondContact O-OG 3.43Å; M675-Y679 HydrophobicContact CG-CD2 4.24Å; M675-Y679 HydrophobicContact CG-CE2 3.95Å; M675-Y679 VanDerWaalsContact O-CD2 3.31Å; M675-Y679 WeakPolarHBondContact O-CD2 3.44Å; M675-Y679 PolarHBondContact O-N 2.76Å
676	L	88.4	Confident	85.3	Confident	13 Å²	13	59.6 Å²	59.6	7%	0.068	33%	0.332	C	S	.	.	H	α-helix	trans	-60.5	-43.2	171.5	177.7	61.2	0	0	0	110.9	P656 E657 F672 S678 Y679 T680 V686	P656-L676 HydrophobicContact CB-CD1 3.69Å; P656-L676 HydrophobicContact CB-CD2 3.75Å; P656-L676 HydrophobicContact CB-CG 4.33Å; P656-L676 HydrophobicContact CG-CD1 3.62Å; P656-L676 HydrophobicContact CG-CD2 4.47Å; E657-L676 HydrophobicContact CG-CD2 3.96Å; F672-L676 HydrophobicContact CE1-CD2 4.19Å; F672-L676 WeakPolarHBondContact O-CB 3.15Å; F672-L676 PolarHBondContact O-N 3.21Å; L676-S678 PolarHBondContact O-N 3.22Å; L676-Y679 PolarHBondContact O-N 3.14Å; L676-T680 HydrophobicContact CD1-CG2 3.82Å; L676-T680 HydrophobicContact CG-CG2 4.29Å; L676-T680 WeakPolarHBondContact O-CB 3.49Å; L676-T680 VanDerWaalsContact O-CG2 3.31Å; L676-T680 WeakPolarHBondContact O-CG2 3.32Å; L676-T680 PolarHBondContact O-N 3.1Å; L676-T680 PolarHBondContact O-OG1 3.35Å; L676-V686 HydrophobicContact CD1-CB 3.89Å; L676-V686 HydrophobicContact CD1-CG1 3.91Å; L676-V686 HydrophobicContact CD1-CG2 4.28Å
677	Q	84.1	Confident	85.7	Confident	126 Å²	126	52.5 Å²	52.5	59%	0.589	30%	0.299	S	S	*	.	H	α-helix	trans	-63.5	-39.3	178.5	-171.3	173.4	4	0	0	112	A673 Q674 M675 Y679 T680 A681	A673-Q677 VanDerWaalsContact O-CB 3.25Å; A673-Q677 WeakPolarHBondContact O-CB 3.44Å; A673-Q677 PolarHBondContact O-N 3.49Å; Q674-Q677 PolarHBondContact O-N 2.61Å; M675-Q677 VanDerWaalsContact C-N 3.29Å; M675-Q677 PolarHBondContact O-N 2.72Å; Q677-Y679 PolarHBondContact O-N 3.26Å; Q677-T680 WeakPolarHBondContact CA-OG1 3.41Å; Q677-T680 PolarHBondContact O-N 3.45Å; Q677-T680 PolarHBondContact O-OG1 2.93Å; Q677-A681 WeakPolarHBondContact O-CB 3.44Å; Q677-A681 PolarHBondContact O-N 3.44Å
678	S	87.4	Confident	86	Confident	69 Å²	69	51.3 Å²	51.3	48%	0.483	29%	0.292	S	S	.	.	H	α-helix	trans	-62.7	-42.3	179.6	62.7	0	0	0	0	112.6	Q674 M675 L676 A682	Q674-S678 PolarHBondContact O-N 3.04Å; M675-S678 PolarHBondContact O-N 3.4Å; M675-S678 PolarHBondContact O-OG 3.43Å; L676-S678 PolarHBondContact O-N 3.22Å; S678-A682 WeakPolarHBondContact O-CB 3.41Å; S678-A682 PolarHBondContact O-N 3.49Å
679	Y	86.9	Confident	86.3	Confident	43 Å²	43	50 Å²	50	17%	0.169	28%	0.283	C	S	.	.	H	α-helix	trans	-74.7	-42.1	177.7	-73.3	-66.6	0	0	0	112.8	M525 V528 L538 M675 L676 Q677 A682 G683 Y684 V686 V722	M525-Y679 HydrophobicContact CE-CD1 4.32Å; M525-Y679 HydrophobicContact CE-CE1 3.85Å; V528-Y679 HydrophobicContact CG2-CE2 3.81Å; L538-Y679 HydrophobicContact CD1-CE1 4.35Å; M675-Y679 HydrophobicContact CG-CD2 4.24Å; M675-Y679 HydrophobicContact CG-CE2 3.95Å; M675-Y679 VanDerWaalsContact O-CD2 3.31Å; M675-Y679 WeakPolarHBondContact O-CD2 3.44Å; M675-Y679 PolarHBondContact O-N 2.76Å; L676-Y679 PolarHBondContact O-N 3.14Å; Q677-Y679 PolarHBondContact O-N 3.26Å; Y679-A682 PolarHBondContact O-N 3.27Å; Y679-G683 PolarHBondContact O-N 3.02Å; Y679-Y684 AromaticContact CD1-CD2 3.94Å; Y679-Y684 HydrophobicContact CD1-CD2 3.94Å; Y679-Y684 HydrophobicContact CD1-CE2 4.47Å; Y679-Y684 WeakPolarHBondContact O-CB 3.48Å; Y679-Y684 WeakPolarHBondContact O-CD2 3.28Å; Y679-Y684 PolarHBondContact O-N 2.75Å; Y679-V686 HydrophobicContact CG-CG2 4.49Å; Y679-V722 HydrophobicContact CD1-CG1 3.82Å; Y679-V722 HydrophobicContact CD1-CG2 4.22Å; Y679-V722 HydrophobicContact CD2-CG2 4.35Å; Y679-V722 HydrophobicContact CE1-CG1 4.28Å; Y679-V722 HydrophobicContact CE1-CG2 4.27Å; Y679-V722 HydrophobicContact CE2-CG2 4.39Å; Y679-V722 HydrophobicContact CG-CG1 4.3Å; Y679-V722 HydrophobicContact CG-CG2 4.26Å
680	T	80.7	Confident	86.6	Confident	17 Å²	17	49.8 Å²	49.8	10%	0.104	28%	0.282	C	S	.	.	H	α-helix	trans	-69.6	-35.9	-179.7	53.8	0	0	0	0	112.2	L676 Q677 A682 G683 V686	L676-T680 HydrophobicContact CD1-CG2 3.82Å; L676-T680 HydrophobicContact CG-CG2 4.29Å; L676-T680 WeakPolarHBondContact O-CB 3.49Å; L676-T680 VanDerWaalsContact O-CG2 3.31Å; L676-T680 WeakPolarHBondContact O-CG2 3.32Å; L676-T680 PolarHBondContact O-N 3.1Å; L676-T680 PolarHBondContact O-OG1 3.35Å; Q677-T680 WeakPolarHBondContact CA-OG1 3.41Å; Q677-T680 PolarHBondContact O-N 3.45Å; Q677-T680 PolarHBondContact O-OG1 2.93Å; T680-A682 VanDerWaalsContact C-N 3.3Å; T680-A682 PolarHBondContact O-N 2.89Å; T680-G683 PolarHBondContact O-N 3.02Å; T680-V686 HydrophobicContact CG2-CG2 4.09Å
681	A	75.3	Confident	86.9	Confident	57 Å²	57	43.8 Å²	43.8	47%	0.471	25%	0.246	S	C	.	.	H	α-helix	trans	-64.7	-34.7	172.8	0	0	0	0	0	112	Q677 G683 T758	Q677-A681 WeakPolarHBondContact O-CB 3.44Å; Q677-A681 PolarHBondContact O-N 3.44Å; A681-G683 PolarHBondContact O-N 2.97Å; A681-T758 PolarHBondContact O-OG1 3.19Å
682	A	77.1	Confident	87.2	Confident	58 Å²	58	43.2 Å²	43.2	48%	0.479	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-2.4	172	0	0	0	0	0	113.7	S678 Y679 T680 Y684	S678-A682 WeakPolarHBondContact O-CB 3.41Å; S678-A682 PolarHBondContact O-N 3.49Å; Y679-A682 PolarHBondContact O-N 3.27Å; T680-A682 VanDerWaalsContact C-N 3.3Å; T680-A682 PolarHBondContact O-N 2.89Å; A682-Y684 HydrophobicContact CB-CD2 3.67Å; A682-Y684 HydrophobicContact CB-CE2 3.58Å
683	G	73.3	Confident	87.1	Confident	13 Å²	13	45.6 Å²	45.6	13%	0.134	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	9	175.1	0	0	0	0	0	115	Y679 T680 A681	Y679-G683 PolarHBondContact O-N 3.02Å; T680-G683 PolarHBondContact O-N 3.02Å; A681-G683 PolarHBondContact O-N 2.97Å
684	Y	84.1	Confident	86.9	Confident	72 Å²	72	42.8 Å²	42.8	28%	0.282	24%	0.235	S	C	.	.			trans	-76.3	147.8	175.1	-59.5	-71.4	0	0	0	111.4	M525 Y679 A682 V722 M723 R724	M525-Y684 HydrophobicContact CG-CE1 4.27Å; Y679-Y684 AromaticContact CD1-CD2 3.94Å; Y679-Y684 HydrophobicContact CD1-CD2 3.94Å; Y679-Y684 HydrophobicContact CD1-CE2 4.47Å; Y679-Y684 WeakPolarHBondContact O-CB 3.48Å; Y679-Y684 WeakPolarHBondContact O-CD2 3.28Å; Y679-Y684 PolarHBondContact O-N 2.75Å; A682-Y684 HydrophobicContact CB-CD2 3.67Å; A682-Y684 HydrophobicContact CB-CE2 3.58Å; Y684-V722 HydrophobicContact CD1-CG1 4.15Å; Y684-V722 HydrophobicContact CD2-CG1 4.36Å; Y684-V722 HydrophobicContact CG-CG1 3.78Å; Y684-M723 CarbonylContact C-O 3.54Å; Y684-M723 WeakPolarHBondContact CA-O 3.24Å; Y684-M723 WeakPolarHBondContact CB-O 3.32Å; Y684-R724 HydrophobicContact CD1-CB 3.95Å; Y684-R724 HydrophobicContact CE1-CB 4.06Å
685	R	84.1	Confident	86.3	Confident	84 Å²	84	40.5 Å²	40.5	32%	0.317	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	123	167.1	-177.6	178	-177.7	113.1	-7	107.6	L522 M723 D751	L522-R685 HydrophobicContact CD2-CB 4.36Å; R685-M723 HydrophobicContact CB-CB 4.38Å; R685-M723 PolarHBondContact N-O 3.48Å; R685-M723 PolarHBondContact O-N 3Å; R685-D751 IonicContact NH1-OD1 3.81Å; R685-D751 PolarHBondContact NH1-OD1 3.38Å
686	V	89.2	Confident	85.1	Confident	13 Å²	13	44 Å²	44	8%	0.079	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.1	-176.9	-172.4	0	0	0	0	109.3	P656 L676 Y679 T680 L720 L721	P656-V686 WeakPolarHBondContact CD-O 3.43Å; P656-V686 HydrophobicContact CG-CB 4.16Å; P656-V686 HydrophobicContact CG-CG1 3.97Å; P656-V686 WeakPolarHBondContact CG-O 3.26Å; L676-V686 HydrophobicContact CD1-CB 3.89Å; L676-V686 HydrophobicContact CD1-CG1 3.91Å; L676-V686 HydrophobicContact CD1-CG2 4.28Å; Y679-V686 HydrophobicContact CG-CG2 4.49Å; T680-V686 HydrophobicContact CG2-CG2 4.09Å; V686-L720 HydrophobicContact CG1-CB 3.91Å; V686-L720 HydrophobicContact CG1-CD1 4.17Å; V686-L720 HydrophobicContact CG1-CD2 4.13Å; V686-L720 HydrophobicContact CG1-CG 4.3Å; V686-L721 CarbonylContact C-O 3.43Å; V686-L721 WeakPolarHBondContact CA-O 3.27Å
687	V	92.6	Very high	83.7	Confident	10 Å²	10	44.8 Å²	44.8	6%	0.061	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	128.5	176.8	179.1	0	0	0	0	108	M572 K653 G654 L720 L721	M572-V687 HydrophobicContact SD-CG2 4.05Å; K653-V687 HydrophobicContact CB-CG1 4.12Å; G654-V687 WeakPolarHBondContact O-CG1 3.41Å; V687-L720 CarbonylContact O-C 3.55Å; V687-L720 WeakPolarHBondContact O-CA 3.49Å; V687-L721 HydrophobicContact CB-CB 4.28Å; V687-L721 PolarHBondContact N-O 2.89Å; V687-L721 PolarHBondContact O-N 3.34Å
688	A	94.9	Very high	82.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	146.9	175.2	0	0	0	0	0	111.1	K653 G654 P656 V659 L717 L720	K653-A688 VanDerWaalsContact CA-O 3.28Å; K653-A688 WeakPolarHBondContact CA-O 3.45Å; G654-A688 PolarHBondContact N-O 3.02Å; G654-A688 VanDerWaalsContact N-O 3.13Å; G654-A688 PolarHBondContact O-N 2.86Å; P656-A688 HydrophobicContact CB-CB 4.1Å; P656-A688 HydrophobicContact CG-CB 4.36Å; V659-A688 HydrophobicContact CB-CB 3.97Å; V659-A688 HydrophobicContact CG1-CB 4.03Å; V659-A688 HydrophobicContact CG2-CB 4.48Å; A688-L717 HydrophobicContact CB-CD1 4.26Å; A688-L720 HydrophobicContact CB-CD2 3.82Å
689	L	95.8	Very high	81.1	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.4	177.1	-68.7	154.4	0	0	0	109.1	L550 A553 L554 V652 K653 L718 G719 L721	L550-L689 HydrophobicContact CD1-CB 4.28Å; L550-L689 HydrophobicContact CD1-CD1 3.81Å; A553-L689 HydrophobicContact CB-CD2 4.04Å; L554-L689 HydrophobicContact CD2-CD1 3.55Å; L554-L689 HydrophobicContact CG-CD1 3.89Å; V652-L689 CarbonylContact O-C 3.58Å; V652-L689 WeakPolarHBondContact O-CA 3.22Å; K653-L689 HydrophobicContact CB-CD2 3.62Å; L689-L718 HydrophobicContact CB-CB 4.42Å; L689-L718 WeakPolarHBondContact O-CB 3.43Å; L689-L718 PolarHBondContact O-N 2.79Å; L689-G719 PolarHBondContact N-O 3.46Å; L689-G719 PolarHBondContact O-N 3.23Å; L689-L721 HydrophobicContact CD1-CB 4.34Å
690	A	95.4	Very high	79.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	160.4	178.6	0	0	0	0	0	111	Y651 V652 V659 L715 S716	Y651-A690 WeakPolarHBondContact CA-O 3.3Å; V652-A690 PolarHBondContact N-O 2.92Å; V652-A690 PolarHBondContact O-N 3.46Å; V659-A690 HydrophobicContact CG1-CB 3.75Å; A690-L715 HydrophobicContact CB-CB 3.98Å; A690-L715 HydrophobicContact CB-CD1 4.23Å; A690-S716 CarbonylContact C-O 3.54Å; A690-S716 WeakPolarHBondContact CA-O 3.39Å; A690-S716 WeakPolarHBondContact CB-O 3.4Å
691	S	94.8	Very high	79.1	Confident	15 Å²	15	48.1 Å²	48.1	11%	0.105	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	159.4	179	60.5	0	0	0	0	114.1	A650 S716 L718	A650-S691 CarbonylContact O-C 3.55Å; A650-S691 WeakPolarHBondContact O-CA 3.39Å; S691-S716 PolarHBondContact N-O 2.96Å; S691-S716 PolarHBondContact O-N 2.85Å; S691-L718 WeakPolarHBondContact OG-CD2 3.43Å
692	K	92.6	Very high	78.7	Confident	42 Å²	42	47 Å²	47	18%	0.183	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	136.3	172.8	171.4	177.4	-173.7	176.7	0	110.8	A650 L694 T710 R713 L715	A650-K692 HydrophobicContact CB-CB 4.48Å; A650-K692 PolarHBondContact N-O 2.98Å; A650-K692 PolarHBondContact O-N 2.84Å; K692-L694 HydrophobicContact CD-CD2 4.43Å; K692-T710 PolarHBondContact NZ-O 2.89Å; K692-R713 VanDerWaalsContact CD-O 3.22Å; K692-R713 WeakPolarHBondContact CD-O 3.46Å; K692-R713 WeakPolarHBondContact CE-O 3.41Å; K692-R713 PolarHBondContact NZ-O 3.48Å; K692-L715 HydrophobicContact CB-CD2 3.71Å; K692-L715 HydrophobicContact CD-CD2 4.35Å
693	S	88.7	Confident	78.3	Confident	68 Å²	68	44.3 Å²	44.3	48%	0.476	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	133.9	169	-52.3	0	0	0	0	109.9
694	L	83.8	Confident	77.9	Confident	9 Å²	9	47.2 Å²	47.2	5%	0.047	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-102	138.2	-178.3	-68.1	173	0	0	0	111	V639 P648 A650 K692 L706	V639-L694 HydrophobicContact CG1-CD1 3.77Å; V639-L694 HydrophobicContact CG2-CD1 3.98Å; P648-L694 HydrophobicContact CG-CB 4.29Å; P648-L694 PolarHBondContact O-N 3.08Å; A650-L694 HydrophobicContact CB-CD1 4.14Å; A650-L694 HydrophobicContact CB-CG 4.28Å; K692-L694 HydrophobicContact CD-CD2 4.43Å; L694-L706 HydrophobicContact CD1-CD1 4.09Å
695	P	74.7	Confident	77.3	Confident	99 Å²	99	51.6 Å²	51.6	64%	0.643	29%	0.29	S	S	*	.	S	Bend	trans	-62.8	152.4	171.5	25.4	-31.1	0	0	0	111.1	V697	P695-V697 PolarHBondContact O-N 3.47Å; P695-V697 VanDerWaalsContact O-N 3.07Å
696	T	63.4	Low	77	Confident	115 Å²	115	49.3 Å²	49.3	71%	0.706	28%	0.284	S	S	*	.			trans	-46.1	104.5	-158.6	-24.9	0	0	0	0	114.5
697	V	58.5	Low	76.6	Confident	31 Å²	31	52.5 Å²	52.5	19%	0.188	30%	0.304	C	S	.	.			trans	-92.9	108.8	165.4	-177	0	0	0	0	107	P648 P695 S699 A702 A703 L706	P648-V697 HydrophobicContact CG-CB 4.17Å; P648-V697 HydrophobicContact CG-CG2 4.33Å; P695-V697 PolarHBondContact O-N 3.47Å; P695-V697 VanDerWaalsContact O-N 3.07Å; V697-S699 WeakPolarHBondContact CG1-O 3.34Å; V697-A702 HydrophobicContact CG1-CB 3.75Å; V697-A703 HydrophobicContact CG1-CB 3.8Å; V697-A703 VanDerWaalsContact CG1-N 3.34Å; V697-L706 HydrophobicContact CG2-CD1 4.32Å
698	S	55.9	Low	76.3	Confident	113 Å²	113	54.5 Å²	54.5	79%	0.79	31%	0.311	S	S	*	.			trans	-88.9	-10.3	-171.8	46.2	0	0	0	0	114.8
699	S	61.9	Low	75.8	Confident	44 Å²	44	58.9 Å²	58.9	31%	0.308	33%	0.334	S	S	.	.	S	Bend	trans	-146.7	159.7	-179.8	71.5	0	0	0	0	113.7	V697 E701 A702 A703	V697-S699 WeakPolarHBondContact CG1-O 3.34Å; S699-E701 VanDerWaalsContact C-N 3.31Å; S699-E701 PolarHBondContact O-N 3.16Å; S699-A702 PolarHBondContact O-N 3.45Å; S699-A702 PolarHBondContact OG-N 3.46Å; S699-A703 PolarHBondContact O-N 2.81Å
700	L	61.2	Low	75.3	Confident	24 Å²	24	62 Å²	62	13%	0.126	35%	0.353	C	S	.	.	H	α-helix	trans	-58.2	-41.1	174.5	-177.1	73.9	0	0	0	112.2	Q597 A702 A703 Q704	Q597-L700 HydrophobicContact CB-CD2 4.31Å; Q597-L700 WeakPolarHBondContact O-CD1 3.34Å; Q597-L700 VanDerWaalsContact O-CD2 3.24Å; Q597-L700 WeakPolarHBondContact O-CD2 3.5Å; L700-A702 VanDerWaalsContact C-N 3.32Å; L700-A702 PolarHBondContact O-N 2.58Å; L700-A703 WeakPolarHBondContact O-CB 3.36Å; L700-A703 PolarHBondContact O-N 3.1Å; L700-A703 VanDerWaalsContact O-N 3.09Å; L700-Q704 WeakPolarHBondContact O-CG 3.49Å; L700-Q704 PolarHBondContact O-N 2.66Å
701	E	63.6	Low	74.9	Confident	143 Å²	143	62 Å²	62	67%	0.668	35%	0.353	S	S	*	.	H	α-helix	trans	-61.8	-41.2	178.6	-66.2	171.5	169.5	0	0	111.2	S699 A703 Q704 Q705	S699-E701 VanDerWaalsContact C-N 3.31Å; S699-E701 PolarHBondContact O-N 3.16Å; E701-A703 VanDerWaalsContact C-N 3.32Å; E701-A703 PolarHBondContact O-N 3.12Å; E701-Q704 PolarHBondContact O-N 3.26Å; E701-Q705 WeakPolarHBondContact O-CG 3.29Å; E701-Q705 PolarHBondContact O-N 3.32Å; E701-Q705 VanDerWaalsContact O-N 3.13Å
702	A	67.6	Low	74.7	Confident	35 Å²	35	61.4 Å²	61.4	29%	0.289	35%	0.349	S	S	.	.	H	α-helix	trans	-67	-33.9	174.4	0	0	0	0	0	112	V697 S699 L700 Q705	V697-A702 HydrophobicContact CG1-CB 3.75Å; S699-A702 PolarHBondContact O-N 3.45Å; S699-A702 PolarHBondContact OG-N 3.46Å; L700-A702 VanDerWaalsContact C-N 3.32Å; L700-A702 PolarHBondContact O-N 2.58Å; A702-Q705 PolarHBondContact O-N 2.78Å
703	A	67.7	Low	74.6	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-69	-33.8	175.1	0	0	0	0	0	112.6	L624 V697 S699 L700 E701 L706	L624-A703 HydrophobicContact CB-CB 4.21Å; V697-A703 HydrophobicContact CG1-CB 3.8Å; V697-A703 VanDerWaalsContact CG1-N 3.34Å; S699-A703 PolarHBondContact O-N 2.81Å; L700-A703 WeakPolarHBondContact O-CB 3.36Å; L700-A703 PolarHBondContact O-N 3.1Å; L700-A703 VanDerWaalsContact O-N 3.09Å; E701-A703 VanDerWaalsContact C-N 3.32Å; E701-A703 PolarHBondContact O-N 3.12Å; A703-L706 WeakPolarHBondContact O-CB 3.16Å; A703-L706 PolarHBondContact O-N 3.41Å
704	Q	65.4	Low	74.7	Confident	75 Å²	75	69.4 Å²	69.4	35%	0.35	37%	0.373	S	S	.	.	H	α-helix	trans	-75.6	-25.8	176.9	-73.2	-179.9	-14.9	0	0	113.1	L700 E701 L706	L700-Q704 WeakPolarHBondContact O-CG 3.49Å; L700-Q704 PolarHBondContact O-N 2.66Å; E701-Q704 PolarHBondContact O-N 3.26Å; Q704-L706 VanDerWaalsContact C-N 3.25Å; Q704-L706 PolarHBondContact O-N 2.93Å
705	Q	71.4	Confident	75.1	Confident	163 Å²	163	69 Å²	69	76%	0.762	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-7.6	173.5	-71.4	-176.8	5.6	0	0	113.6	E701 A702 T707	E701-Q705 WeakPolarHBondContact O-CG 3.29Å; E701-Q705 PolarHBondContact O-N 3.32Å; E701-Q705 VanDerWaalsContact O-N 3.13Å; A702-Q705 PolarHBondContact O-N 2.78Å; Q705-T707 PolarHBondContact O-N 3.24Å
706	L	78.4	Confident	76	Confident	36 Å²	36	66.5 Å²	66.5	19%	0.188	36%	0.355	C	S	.	.			trans	-60.3	129.4	174.3	-71	172.2	0	0	0	110	F627 V639 L694 V697 A703 Q704 V711	F627-L706 HydrophobicContact CZ-CB 4.21Å; F627-L706 VanDerWaalsContact CZ-O 3.29Å; F627-L706 WeakPolarHBondContact CZ-O 3.21Å; V639-L706 HydrophobicContact CG2-CD1 4.23Å; L694-L706 HydrophobicContact CD1-CD1 4.09Å; V697-L706 HydrophobicContact CG2-CD1 4.32Å; A703-L706 WeakPolarHBondContact O-CB 3.16Å; A703-L706 PolarHBondContact O-N 3.41Å; Q704-L706 VanDerWaalsContact C-N 3.25Å; Q704-L706 PolarHBondContact O-N 2.93Å; L706-V711 HydrophobicContact CB-CG2 4.21Å; L706-V711 HydrophobicContact CD1-CG2 4.3Å
707	T	81.6	Confident	77.5	Confident	81 Å²	81	61.2 Å²	61.2	50%	0.497	32%	0.323	S	S	.	.			trans	-84	150.6	172.1	59.6	0	0	0	0	110.1	Q705 D709 T710	Q705-T707 PolarHBondContact O-N 3.24Å; T707-D709 PolarHBondContact O-N 3.29Å; T707-T710 PolarHBondContact O-N 2.97Å; T707-T710 VanDerWaalsContact O-N 3.15Å; T707-T710 PolarHBondContact O-OG1 3.35Å; T707-T710 WeakPolarHBondContact OG1-CG2 3.24Å
708	R	85.8	Confident	79.2	Confident	52 Å²	52	60.7 Å²	60.7	20%	0.196	32%	0.319	C	S	.	.	H	α-helix	trans	-55.9	-37.2	179.2	-169.2	171.3	-160.5	142	17.7	112.4	F627 P628 R635 T710 V711 E712	F627-R708 HydrophobicContact CB-CG 4.4Å; F627-R708 HydrophobicContact CD1-CB 3.77Å; F627-R708 HydrophobicContact CD1-CG 3.98Å; F627-R708 HydrophobicContact CE1-CB 3.98Å; F627-R708 HydrophobicContact CG-CB 4.46Å; F627-R708 HydrophobicContact CG-CG 4.24Å; F627-R708 PolarHBondContact O-NH2 3.28Å; P628-R708 PolarHBondContact O-NH1 3.06Å; P628-R708 VanDerWaalsContact O-NH1 3.12Å; P628-R708 PolarHBondContact O-NH2 2.86Å; R635-R708 PolarHBondContact O-NH2 3.41Å; R635-R708 VanDerWaalsContact O-NH2 3.16Å; R708-T710 VanDerWaalsContact C-N 3.34Å; R708-T710 PolarHBondContact O-N 3.42Å; R708-V711 PolarHBondContact O-N 3.44Å; R708-E712 HydrophobicContact CG-CG 4.07Å; R708-E712 WeakPolarHBondContact CG-OE1 3.31Å; R708-E712 WeakPolarHBondContact CG-OE2 3.4Å; R708-E712 IonicContact CZ-OE1 3.82Å; R708-E712 IonicContact NE-OE1 2.84Å; R708-E712 PolarHBondContact NE-OE1 3.28Å; R708-E712 IonicContact NE-OE2 3.77Å; R708-E712 PolarHBondContact NE-OE2 3.09Å; R708-E712 IonicContact NH2-OE1 2.8Å; R708-E712 PolarHBondContact NH2-OE1 3.32Å; R708-E712 WeakPolarHBondContact O-CB 3.23Å; R708-E712 WeakPolarHBondContact O-CG 3.36Å; R708-E712 PolarHBondContact O-N 3.33Å
709	D	84.6	Confident	81	Confident	91 Å²	91	55.3 Å²	55.3	49%	0.487	28%	0.281	S	S	.	.	H	α-helix	trans	-67.8	-28.3	-178.4	-74	-12.8	0	0	0	113.9	T707 R713	T707-D709 PolarHBondContact O-N 3.29Å; D709-R713 VanDerWaalsContact O-CD 3.22Å; D709-R713 WeakPolarHBondContact O-CD 3.49Å; D709-R713 WeakPolarHBondContact O-CG 3.44Å
710	T	85.4	Confident	82.6	Confident	66 Å²	66	53.2 Å²	53.2	41%	0.405	27%	0.267	S	S	.	.	H	α-helix	trans	-76.4	-34.9	177.5	57.6	0	0	0	0	111.6	K692 T707 R708	K692-T710 PolarHBondContact NZ-O 2.89Å; T707-T710 PolarHBondContact O-N 2.97Å; T707-T710 VanDerWaalsContact O-N 3.15Å; T707-T710 PolarHBondContact O-OG1 3.35Å; T707-T710 WeakPolarHBondContact OG1-CG2 3.24Å; R708-T710 VanDerWaalsContact C-N 3.34Å; R708-T710 PolarHBondContact O-N 3.42Å
711	V	87.3	Confident	84.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-76	-40.2	179.4	179.3	0	0	0	0	111.4	F627 V639 A650 L706 R708 R713 L715	F627-V711 HydrophobicContact CD2-CG1 4.42Å; F627-V711 HydrophobicContact CE2-CB 4.16Å; F627-V711 HydrophobicContact CE2-CG1 4.26Å; F627-V711 HydrophobicContact CE2-CG2 3.72Å; F627-V711 HydrophobicContact CZ-CG2 4.11Å; V639-V711 HydrophobicContact CG2-CG1 4.29Å; V639-V711 HydrophobicContact CG2-CG2 4.32Å; A650-V711 HydrophobicContact CB-CG1 3.62Å; L706-V711 HydrophobicContact CB-CG2 4.21Å; L706-V711 HydrophobicContact CD1-CG2 4.3Å; R708-V711 PolarHBondContact O-N 3.44Å; V711-R713 PolarHBondContact O-N 3.49Å; V711-L715 WeakPolarHBondContact O-CD2 3.24Å
712	E	90.6	Very high	85.5	Confident	3 Å²	3	45.3 Å²	45.3	1%	0.014	23%	0.229	C	C	.	.	S	Bend	trans	-95.3	37.7	-172.8	-61.9	-178.3	170.8	0	0	114	R635 S637 L662 R708	R635-E712 IonicContact CZ-OE2 3.08Å; R635-E712 IonicContact NE-OE1 3.62Å; R635-E712 IonicContact NE-OE2 3.01Å; R635-E712 PolarHBondContact NE-OE2 3.35Å; R635-E712 IonicContact NH2-OE2 2.56Å; R635-E712 PolarHBondContact NH2-OE2 3.21Å; S637-E712 PolarHBondContact OG-OE1 3Å; L662-E712 HydrophobicContact CD1-CB 4.39Å; L662-E712 WeakPolarHBondContact CD2-O 3.39Å; R708-E712 HydrophobicContact CG-CG 4.07Å; R708-E712 WeakPolarHBondContact CG-OE1 3.31Å; R708-E712 WeakPolarHBondContact CG-OE2 3.4Å; R708-E712 IonicContact CZ-OE1 3.82Å; R708-E712 IonicContact NE-OE1 2.84Å; R708-E712 PolarHBondContact NE-OE1 3.28Å; R708-E712 IonicContact NE-OE2 3.77Å; R708-E712 PolarHBondContact NE-OE2 3.09Å; R708-E712 IonicContact NH2-OE1 2.8Å; R708-E712 PolarHBondContact NH2-OE1 3.32Å; R708-E712 WeakPolarHBondContact O-CB 3.23Å; R708-E712 WeakPolarHBondContact O-CG 3.36Å; R708-E712 PolarHBondContact O-N 3.33Å
713	R	88.7	Confident	86.5	Confident	146 Å²	146	43.6 Å²	43.6	55%	0.551	22%	0.215	S	C	*	.	S	Bend	trans	-134.8	147.8	175.6	-75.7	179.6	-175.1	178.6	4.9	111.4	K692 D709 V711 L715	K692-R713 VanDerWaalsContact CD-O 3.22Å; K692-R713 WeakPolarHBondContact CD-O 3.46Å; K692-R713 WeakPolarHBondContact CE-O 3.41Å; K692-R713 PolarHBondContact NZ-O 3.48Å; D709-R713 VanDerWaalsContact O-CD 3.22Å; D709-R713 WeakPolarHBondContact O-CD 3.49Å; D709-R713 WeakPolarHBondContact O-CG 3.44Å; V711-R713 PolarHBondContact O-N 3.49Å; R713-L715 VanDerWaalsContact C-N 3.34Å; R713-L715 PolarHBondContact O-N 3.13Å
714	E	90.6	Very high	87.1	Confident	132 Å²	132	48.5 Å²	48.5	62%	0.617	23%	0.234	S	C	*	.	S	Bend	trans	58.2	44.5	176.1	-57.9	171.4	169.2	0	0	112.5	L662 N664	L662-E714 PolarHBondContact O-N 3.23Å; N664-E714 PolarHBondContact ND2-O 2.9Å; N664-E714 VanDerWaalsContact OD1-CA 3.29Å; N664-E714 WeakPolarHBondContact OD1-CA 3.42Å; N664-E714 WeakPolarHBondContact OD1-CB 3.34Å
715	L	93.4	Very high	87.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-79.1	159.6	-178.2	-56.7	169.8	0	0	0	111.4	V652 L662 C663 N664 A690 K692 V711 R713	V652-L715 HydrophobicContact CB-CD1 3.97Å; V652-L715 HydrophobicContact CG1-CD1 4.23Å; V652-L715 HydrophobicContact CG2-CD1 3.6Å; V652-L715 HydrophobicContact CG2-CD2 3.78Å; V652-L715 HydrophobicContact CG2-CG 4.36Å; L662-L715 HydrophobicContact CB-CD1 3.88Å; L662-L715 PolarHBondContact O-N 2.93Å; L662-L715 VanDerWaalsContact O-N 3.1Å; C663-L715 CarbonylContact C-O 3.51Å; C663-L715 WeakPolarHBondContact CA-O 3.17Å; C663-L715 WeakPolarHBondContact CB-O 3.34Å; N664-L715 PolarHBondContact N-O 3.41Å; A690-L715 HydrophobicContact CB-CB 3.98Å; A690-L715 HydrophobicContact CB-CD1 4.23Å; K692-L715 HydrophobicContact CB-CD2 3.71Å; K692-L715 HydrophobicContact CD-CD2 4.35Å; V711-L715 WeakPolarHBondContact O-CD2 3.24Å; R713-L715 VanDerWaalsContact C-N 3.34Å; R713-L715 PolarHBondContact O-N 3.13Å
716	S	94.1	Very high	88.2	Confident	46 Å²	46	42.1 Å²	42.1	32%	0.322	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.3	167.6	-173.9	0	0	0	0	109.9	T667 A690 S691	T667-S716 WeakPolarHBondContact CG2-OG 3.46Å; A690-S716 CarbonylContact C-O 3.54Å; A690-S716 WeakPolarHBondContact CA-O 3.39Å; A690-S716 WeakPolarHBondContact CB-O 3.4Å; S691-S716 PolarHBondContact N-O 2.96Å; S691-S716 PolarHBondContact O-N 2.85Å
717	L	94.8	Very high	88.6	Confident	5 Å²	5	42.7 Å²	42.7	3%	0.026	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	133.9	178.8	-171.4	69.7	0	0	0	110.5	L530 F535 T667 F672 A688	L530-L717 HydrophobicContact CD2-CB 4.04Å; L530-L717 HydrophobicContact CD2-CD2 4.12Å; L530-L717 HydrophobicContact CD2-CG 4.16Å; L530-L717 WeakPolarHBondContact CD2-O 3.45Å; F535-L717 HydrophobicContact CZ-CD2 4.45Å; T667-L717 PolarHBondContact OG1-N 3.48Å; F672-L717 HydrophobicContact CD2-CD2 3.79Å; F672-L717 HydrophobicContact CE2-CD2 3.82Å; A688-L717 HydrophobicContact CB-CD1 4.26Å
718	L	93.9	Very high	89	Confident	20 Å²	20	39.7 Å²	39.7	11%	0.105	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-33.6	-178.1	-66	179.7	0	0	0	113.8	L530 P549 L550 A553 Y651 L689 S691	L530-L718 VanDerWaalsContact CB-O 3.23Å; L530-L718 WeakPolarHBondContact CB-O 3.35Å; L530-L718 PolarHBondContact N-O 3Å; P549-L718 HydrophobicContact CB-CD1 3.93Å; P549-L718 HydrophobicContact CB-CD2 3.71Å; P549-L718 HydrophobicContact CB-CG 4.49Å; L550-L718 HydrophobicContact CB-CB 4.46Å; L550-L718 HydrophobicContact CD1-CB 3.96Å; A553-L718 HydrophobicContact CB-CD1 4Å; Y651-L718 HydrophobicContact CD1-CD1 4.17Å; Y651-L718 HydrophobicContact CE1-CD1 4.14Å; L689-L718 HydrophobicContact CB-CB 4.42Å; L689-L718 WeakPolarHBondContact O-CB 3.43Å; L689-L718 PolarHBondContact O-N 2.79Å; S691-L718 WeakPolarHBondContact OG-CD2 3.43Å
719	G	94.1	Very high	89.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.5	-173.2	-176.3	0	0	0	0	0	113.5	V528 L689	V528-G719 CarbonylContact O-C 3.05Å; V528-G719 WeakPolarHBondContact O-CA 3.22Å; L689-G719 PolarHBondContact N-O 3.46Å; L689-G719 PolarHBondContact O-N 3.23Å
720	L	94.7	Very high	89.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.9	-178.3	-55.7	174.7	0	0	0	110.8	V527 V528 F535 F672 V686 V687 A688	V527-L720 CarbonylContact C-O 3.52Å; V527-L720 WeakPolarHBondContact CA-O 3.49Å; V528-L720 HydrophobicContact CB-CB 4.2Å; V528-L720 PolarHBondContact N-O 2.84Å; V528-L720 PolarHBondContact O-N 2.89Å; F535-L720 HydrophobicContact CE1-CD1 4.01Å; F535-L720 HydrophobicContact CE1-CG 3.96Å; F535-L720 HydrophobicContact CZ-CD1 4.05Å; F535-L720 HydrophobicContact CZ-CG 4.3Å; F672-L720 HydrophobicContact CE2-CD2 4.07Å; V686-L720 HydrophobicContact CG1-CB 3.91Å; V686-L720 HydrophobicContact CG1-CD1 4.17Å; V686-L720 HydrophobicContact CG1-CD2 4.13Å; V686-L720 HydrophobicContact CG1-CG 4.3Å; V687-L720 CarbonylContact O-C 3.55Å; V687-L720 WeakPolarHBondContact O-CA 3.49Å; A688-L720 HydrophobicContact CB-CD2 3.82Å
721	L	93.8	Very high	89.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.7	166.3	173	67.4	0	0	0	108.9	V524 V527 L554 M576 V686 V687 L689 M723	V524-L721 HydrophobicContact CG1-CD1 3.93Å; V527-L721 HydrophobicContact CG2-CD1 3.8Å; L554-L721 HydrophobicContact CD2-CD1 4.19Å; L554-L721 HydrophobicContact CD2-CD2 4.4Å; M576-L721 HydrophobicContact CB-CD2 4.3Å; M576-L721 HydrophobicContact CG-CD2 3.9Å; M576-L721 HydrophobicContact SD-CD2 3.99Å; V686-L721 CarbonylContact C-O 3.43Å; V686-L721 WeakPolarHBondContact CA-O 3.27Å; V687-L721 HydrophobicContact CB-CB 4.28Å; V687-L721 PolarHBondContact N-O 2.89Å; V687-L721 PolarHBondContact O-N 3.34Å; L689-L721 HydrophobicContact CD1-CB 4.34Å; L721-M723 HydrophobicContact CD2-CG 4.35Å; L721-M723 HydrophobicContact CD2-SD 4.07Å; L721-M723 HydrophobicContact CG-CG 4.05Å; L721-M723 HydrophobicContact CG-SD 4.42Å
722	V	92.1	Very high	90.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.3	-178.3	-171.7	0	0	0	0	109.8	M525 G526 V528 L538 Y679 Y684	M525-V722 HydrophobicContact CB-CG1 4.43Å; M525-V722 WeakPolarHBondContact CB-O 3.49Å; M525-V722 HydrophobicContact CE-CB 4.05Å; M525-V722 HydrophobicContact CE-CG1 3.59Å; M525-V722 PolarHBondContact N-O 3.37Å; G526-V722 PolarHBondContact N-O 2.95Å; G526-V722 PolarHBondContact O-N 2.89Å; V528-V722 HydrophobicContact CG2-CG2 3.91Å; L538-V722 HydrophobicContact CD1-CB 4.11Å; L538-V722 HydrophobicContact CD1-CG2 4.02Å; Y679-V722 HydrophobicContact CD1-CG1 3.82Å; Y679-V722 HydrophobicContact CD1-CG2 4.22Å; Y679-V722 HydrophobicContact CD2-CG2 4.35Å; Y679-V722 HydrophobicContact CE1-CG1 4.28Å; Y679-V722 HydrophobicContact CE1-CG2 4.27Å; Y679-V722 HydrophobicContact CE2-CG2 4.39Å; Y679-V722 HydrophobicContact CG-CG1 4.3Å; Y679-V722 HydrophobicContact CG-CG2 4.26Å; Y684-V722 HydrophobicContact CD1-CG1 4.15Å; Y684-V722 HydrophobicContact CD2-CG1 4.36Å; Y684-V722 HydrophobicContact CG-CG1 3.78Å
723	M	87.4	Confident	90.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	153	-176.8	-52.2	180	90.8	0	0	111.1	L522 D523 V524 M572 K575 Y684 R685 L721	L522-M723 HydrophobicContact CB-CE 3.58Å; L522-M723 HydrophobicContact CB-SD 4.31Å; L522-M723 HydrophobicContact CD1-CE 4.35Å; L522-M723 HydrophobicContact CD1-SD 4.32Å; L522-M723 HydrophobicContact CD2-CB 4.17Å; L522-M723 HydrophobicContact CG-CE 4.5Å; D523-M723 CarbonylContact O-C 3.59Å; D523-M723 WeakPolarHBondContact O-CA 3.43Å; V524-M723 HydrophobicContact CG2-CE 3.82Å; M572-M723 HydrophobicContact CG-CE 3.78Å; M572-M723 HydrophobicContact CG-SD 3.49Å; M572-M723 WeakPolarHBondContact CG-SD 3.26Å; M572-M723 HydrophobicContact SD-SD 4.31Å; K575-M723 HydrophobicContact CB-CE 4.3Å; Y684-M723 CarbonylContact C-O 3.54Å; Y684-M723 WeakPolarHBondContact CA-O 3.24Å; Y684-M723 WeakPolarHBondContact CB-O 3.32Å; R685-M723 HydrophobicContact CB-CB 4.38Å; R685-M723 PolarHBondContact N-O 3.48Å; R685-M723 PolarHBondContact O-N 3Å; L721-M723 HydrophobicContact CD2-CG 4.35Å; L721-M723 HydrophobicContact CD2-SD 4.07Å; L721-M723 HydrophobicContact CG-CG 4.05Å; L721-M723 HydrophobicContact CG-SD 4.42Å
724	R	81.7	Confident	90.8	Very high	103 Å²	103	35.8 Å²	35.8	39%	0.389	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139	178	59	-177.9	163.9	-163.5	-7.6	112.1	D523 Y684	D523-R724 HydrophobicContact CB-CG 3.82Å; D523-R724 PolarHBondContact N-O 3.28Å; D523-R724 PolarHBondContact O-N 3.45Å; D523-R724 IonicContact OD2-CZ 2.68Å; D523-R724 IonicContact OD2-NE 3.17Å; D523-R724 PolarHBondContact OD2-NE 3.4Å; D523-R724 IonicContact OD2-NH2 3.63Å; D523-R724 PolarHBondContact OD2-NH2 3.21Å; Y684-R724 HydrophobicContact CD1-CB 3.95Å; Y684-R724 HydrophobicContact CE1-CB 4.06Å
725	N	77.1	Confident	91	Very high	24 Å²	24	29.6 Å²	29.6	13%	0.128	16%	0.161	C	C	.	.			trans	-100.4	112.2	169.1	-85.2	-39.6	0	0	0	108.6	K513 T518 L522	K513-N725 PolarHBondContact NZ-ND2 3.46Å; K513-N725 VanDerWaalsContact NZ-ND2 3.12Å; T518-N725 HydrophobicContact CG2-CB 4.3Å; L522-N725 WeakPolarHBondContact CD2-OD1 3.43Å
726	L	81.6	Confident	91	Very high	79 Å²	79	33.3 Å²	33.3	41%	0.414	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-85.8	136.5	180	-66.4	170.7	0	0	0	110.8	T518 E519	T518-L726 CarbonylContact C-O 3.55Å; T518-L726 WeakPolarHBondContact CA-O 3.28Å; T518-L726 WeakPolarHBondContact CB-O 3.41Å; E519-L726 PolarHBondContact N-O 2.81Å
727	L	87.4	Confident	90.9	Very high	49 Å²	49	32.7 Å²	32.7	26%	0.257	18%	0.176	S	C	.	.	B	Isolated β-bridge	trans	-70.8	138.8	171.4	-76.6	173	0	0	0	109.6	T518 T731 V759 C763	T518-L727 HydrophobicContact CG2-CD2 4.31Å; L727-T731 HydrophobicContact CD2-CG2 4.08Å; L727-V759 HydrophobicContact CD2-CG1 3.75Å; L727-C763 HydrophobicContact CD1-CB 4.13Å; L727-C763 HydrophobicContact CD2-CB 4.18Å
728	K	89.5	Confident	90.9	Very high	18 Å²	18	32.4 Å²	32.4	8%	0.078	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-61.2	139.4	168.4	-68.5	179	172.8	177	0	109.2	G515 L517 T518 E519 D520 Q730 T731 A910	G515-K728 PolarHBondContact O-NZ 3.23Å; L517-K728 PolarHBondContact O-N 3.49Å; T518-K728 WeakPolarHBondContact O-CE 3.42Å; E519-K728 HydrophobicContact CG-CG 3.98Å; D520-K728 IonicContact OD1-NZ 3.26Å; K728-Q730 PolarHBondContact O-N 2.57Å; K728-Q730 VanDerWaalsContact O-N 3.09Å; K728-T731 VanDerWaalsContact O-CB 3.27Å; K728-T731 WeakPolarHBondContact O-CB 3.36Å; K728-T731 PolarHBondContact O-N 2.95Å; K728-T731 PolarHBondContact O-OG1 2.9Å; K728-A910 PolarHBondContact NZ-O 3Å
729	P	90.4	Very high	90.7	Very high	95 Å²	95	36.1 Å²	36.1	62%	0.617	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.7	-175.5	19.6	-29.3	0	0	0	112.9	P733	P729-P733 WeakPolarHBondContact O-CD 3.34Å
730	Q	91.8	Very high	90.5	Very high	62 Å²	62	45.1 Å²	45.1	29%	0.29	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-12	177.6	-51.3	81.1	5.1	0	0	113.7	K728 P733 V734 E913	K728-Q730 PolarHBondContact O-N 2.57Å; K728-Q730 VanDerWaalsContact O-N 3.09Å; Q730-P733 WeakPolarHBondContact O-CD 3.25Å; Q730-P733 VanDerWaalsContact O-CG 3.3Å; Q730-P733 WeakPolarHBondContact O-CG 3.29Å; Q730-V734 VanDerWaalsContact O-CG2 3.29Å; Q730-V734 WeakPolarHBondContact O-CG2 3.17Å; Q730-V734 PolarHBondContact O-N 3.45Å; Q730-E913 HydrophobicContact CB-CG 3.85Å; Q730-E913 HydrophobicContact CG-CG 4.15Å; Q730-E913 WeakPolarHBondContact CG-OE1 3.41Å
731	T	94	Very high	90.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.6	-55.8	-172.7	-69.4	0	0	0	0	112.2	L517 L727 K728 V734 I735 C763 I912	L517-T731 HydrophobicContact CB-CG2 4.07Å; L517-T731 HydrophobicContact CD2-CG2 3.66Å; L517-T731 HydrophobicContact CG-CG2 4.45Å; L517-T731 PolarHBondContact O-OG1 2.92Å; L727-T731 HydrophobicContact CD2-CG2 4.08Å; K728-T731 VanDerWaalsContact O-CB 3.27Å; K728-T731 WeakPolarHBondContact O-CB 3.36Å; K728-T731 PolarHBondContact O-N 2.95Å; K728-T731 PolarHBondContact O-OG1 2.9Å; T731-V734 PolarHBondContact O-N 3.48Å; T731-I735 HydrophobicContact CG2-CG1 4.33Å; T731-I735 WeakPolarHBondContact O-CG1 3.48Å; T731-I735 PolarHBondContact O-N 2.92Å; T731-C763 HydrophobicContact CG2-CB 3.76Å; T731-I912 HydrophobicContact CG2-CD1 4.13Å
732	T	94.1	Very high	90	Very high	41 Å²	41	53.8 Å²	53.8	25%	0.252	26%	0.255	S	S	.	.	H	α-helix	trans	-56.2	-49.9	-179.1	-54.4	0	0	0	0	113.6	V734 I735 Q736	T732-V734 VanDerWaalsContact C-N 3.32Å; T732-V734 PolarHBondContact O-N 3Å; T732-I735 PolarHBondContact O-N 3.06Å; T732-Q736 VanDerWaalsContact O-CG 3.31Å; T732-Q736 WeakPolarHBondContact O-CG 2.99Å; T732-Q736 PolarHBondContact O-N 2.87Å
733	P	95	Very high	90	Very high	69 Å²	69	54 Å²	54	45%	0.448	26%	0.257	S	S	.	.	H	α-helix	trans	-63.7	-35.4	-179.7	22.4	-32.3	0	0	0	113.1	P729 Q730 A737	P729-P733 WeakPolarHBondContact O-CD 3.34Å; Q730-P733 WeakPolarHBondContact O-CD 3.25Å; Q730-P733 VanDerWaalsContact O-CG 3.3Å; Q730-P733 WeakPolarHBondContact O-CG 3.29Å; P733-A737 WeakPolarHBondContact O-CB 3.43Å; P733-A737 PolarHBondContact O-N 3.46Å
734	V	95.4	Very high	90.3	Very high	9 Å²	9	56.3 Å²	56.3	6%	0.055	27%	0.265	C	S	.	.	H	α-helix	trans	-68.7	-46.6	177.9	170.4	0	0	0	0	111.5	Q730 T731 T732 Q736 A737 L738 I912 E913 P916	Q730-V734 VanDerWaalsContact O-CG2 3.29Å; Q730-V734 WeakPolarHBondContact O-CG2 3.17Å; Q730-V734 PolarHBondContact O-N 3.45Å; T731-V734 PolarHBondContact O-N 3.48Å; T732-V734 VanDerWaalsContact C-N 3.32Å; T732-V734 PolarHBondContact O-N 3Å; V734-Q736 VanDerWaalsContact C-N 3.31Å; V734-Q736 PolarHBondContact O-N 2.68Å; V734-A737 WeakPolarHBondContact O-CB 3.29Å; V734-A737 PolarHBondContact O-N 3.33Å; V734-A737 VanDerWaalsContact O-N 3.13Å; V734-L738 HydrophobicContact CG1-CD1 4.36Å; V734-L738 WeakPolarHBondContact O-CG 3.47Å; V734-L738 PolarHBondContact O-N 3.25Å; V734-I912 HydrophobicContact CB-CD1 3.83Å; V734-I912 HydrophobicContact CB-CG1 4Å; V734-I912 HydrophobicContact CG1-CD1 3.75Å; V734-I912 HydrophobicContact CG1-CG1 3.94Å; V734-I912 HydrophobicContact CG2-CG1 4.21Å; V734-E913 HydrophobicContact CG2-CB 4.48Å; V734-E913 HydrophobicContact CG2-CG 3.82Å; V734-P916 HydrophobicContact CG1-CG 4.13Å; V734-P916 HydrophobicContact CG2-CG 4.41Å
735	I	95.4	Very high	91	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-42.7	177.5	-65.6	-52.4	0	0	0	111	F511 L517 T731 T732 A737 L738 R739 A745 M765 I912	F511-I735 HydrophobicContact CD2-CD1 4.28Å; F511-I735 HydrophobicContact CE2-CD1 3.94Å; F511-I735 HydrophobicContact CZ-CD1 4.16Å; L517-I735 HydrophobicContact CD2-CD1 4.38Å; T731-I735 HydrophobicContact CG2-CG1 4.33Å; T731-I735 WeakPolarHBondContact O-CG1 3.48Å; T731-I735 PolarHBondContact O-N 2.92Å; T732-I735 PolarHBondContact O-N 3.06Å; I735-A737 VanDerWaalsContact C-N 3.35Å; I735-A737 PolarHBondContact O-N 3.41Å; I735-L738 PolarHBondContact O-N 3.03Å; I735-R739 WeakPolarHBondContact O-CB 3.3Å; I735-R739 PolarHBondContact O-N 3.35Å; I735-A745 HydrophobicContact CD1-CB 4.16Å; I735-M765 HydrophobicContact CD1-CE 3.51Å; I735-M765 HydrophobicContact CD1-CG 4.34Å; I735-M765 HydrophobicContact CG1-CE 4.11Å; I735-M765 HydrophobicContact CG1-CG 4.33Å; I735-M765 HydrophobicContact CG2-CB 4.31Å; I735-M765 HydrophobicContact CG2-CG 3.57Å; I735-I912 HydrophobicContact CD1-CD1 4.3Å; I735-I912 HydrophobicContact CG1-CD1 4.44Å
736	Q	93	Very high	91.9	Very high	77 Å²	77	51 Å²	51	36%	0.36	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-41	174.7	-70.9	-178.5	7.7	0	0	112.4	T732 V734 R739 R740	T732-Q736 VanDerWaalsContact O-CG 3.31Å; T732-Q736 WeakPolarHBondContact O-CG 2.99Å; T732-Q736 PolarHBondContact O-N 2.87Å; V734-Q736 VanDerWaalsContact C-N 3.31Å; V734-Q736 PolarHBondContact O-N 2.68Å; Q736-R739 PolarHBondContact O-N 3.14Å; Q736-R740 WeakPolarHBondContact O-CB 3.25Å; Q736-R740 VanDerWaalsContact O-CG 3.25Å; Q736-R740 WeakPolarHBondContact O-CG 3.45Å; Q736-R740 PolarHBondContact O-N 2.92Å
737	A	92.3	Very high	92.6	Very high	33 Å²	33	47.2 Å²	47.2	27%	0.273	23%	0.227	S	C	.	.	H	α-helix	trans	-62.9	-41.7	176.4	0	0	0	0	0	112.3	P733 V734 I735 T741	P733-A737 WeakPolarHBondContact O-CB 3.43Å; P733-A737 PolarHBondContact O-N 3.46Å; V734-A737 WeakPolarHBondContact O-CB 3.29Å; V734-A737 PolarHBondContact O-N 3.33Å; V734-A737 VanDerWaalsContact O-N 3.13Å; I735-A737 VanDerWaalsContact C-N 3.35Å; I735-A737 PolarHBondContact O-N 3.41Å; A737-T741 WeakPolarHBondContact O-CG2 3.4Å; A737-T741 PolarHBondContact O-N 3.07Å; A737-T741 PolarHBondContact O-OG1 3.4Å; A737-T741 VanDerWaalsContact O-OG1 3.1Å
738	L	93.9	Very high	92.9	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-44.3	175.1	-65.5	177.7	0	0	0	111.4	F511 V734 I735 T741 R742 I743 V915 I919 L986	F511-L738 HydrophobicContact CE2-CD1 3.9Å; F511-L738 HydrophobicContact CZ-CD1 3.62Å; V734-L738 HydrophobicContact CG1-CD1 4.36Å; V734-L738 WeakPolarHBondContact O-CG 3.47Å; V734-L738 PolarHBondContact O-N 3.25Å; I735-L738 PolarHBondContact O-N 3.03Å; L738-T741 CarbonylContact O-C 3.46Å; L738-T741 PolarHBondContact O-N 3.42Å; L738-T741 VanDerWaalsContact O-N 3.14Å; L738-T741 PolarHBondContact O-OG1 2.86Å; L738-R742 PolarHBondContact O-N 2.93Å; L738-I743 CarbonylContact C-O 3.49Å; L738-I743 HydrophobicContact CB-CB 4.28Å; L738-I743 HydrophobicContact CD2-CB 4.24Å; L738-I743 HydrophobicContact CD2-CD1 4.03Å; L738-I743 HydrophobicContact CD2-CG2 4.24Å; L738-I743 PolarHBondContact O-N 3.32Å; L738-V915 HydrophobicContact CD1-CG1 4.38Å; L738-I919 HydrophobicContact CD2-CD1 3.8Å; L738-L986 HydrophobicContact CD2-CD2 4.15Å
739	R	89.8	Confident	92.9	Very high	97 Å²	97	44.1 Å²	44.1	37%	0.366	21%	0.212	S	C	.	.	H	α-helix	trans	-61.5	-47.7	177.6	-173.9	176.3	168.9	135.7	7.8	112.3	I735 Q736 T741 R742 G764 E770	I735-R739 WeakPolarHBondContact O-CB 3.3Å; I735-R739 PolarHBondContact O-N 3.35Å; Q736-R739 PolarHBondContact O-N 3.14Å; R739-T741 PolarHBondContact O-N 3.38Å; R739-T741 VanDerWaalsContact O-N 3.15Å; R739-R742 PolarHBondContact O-N 3.47Å; R739-G764 PolarHBondContact NH1-O 3.21Å; R739-E770 IonicContact CZ-OE1 2.58Å; R739-E770 IonicContact CZ-OE2 3.42Å; R739-E770 VanDerWaalsContact CZ-OE2 3.28Å; R739-E770 IonicContact NH1-OE1 2.8Å; R739-E770 IonicContact NH1-OE2 3.25Å; R739-E770 PolarHBondContact NH1-OE2 2.85Å; R739-E770 IonicContact NH2-OE1 2.65Å; R739-E770 PolarHBondContact NH2-OE1 2.97Å; R739-E770 IonicContact NH2-OE2 2.74Å; R739-E770 PolarHBondContact NH2-OE2 3.47Å
740	R	90.1	Very high	92.5	Very high	189 Å²	189	41.8 Å²	41.8	71%	0.713	21%	0.205	S	C	*	.	H	α-helix	trans	-56.5	-31.3	175.3	-72.7	173	-170.6	173.1	6.8	112.2	Q736	Q736-R740 WeakPolarHBondContact O-CB 3.25Å; Q736-R740 VanDerWaalsContact O-CG 3.25Å; Q736-R740 WeakPolarHBondContact O-CG 3.45Å; Q736-R740 PolarHBondContact O-N 2.92Å
741	T	89	Confident	91.9	Very high	11 Å²	11	39.8 Å²	39.8	7%	0.067	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	5.6	179.3	62.6	0	0	0	0	115	A737 L738 R739 I743 L986 G987	A737-T741 WeakPolarHBondContact O-CG2 3.4Å; A737-T741 PolarHBondContact O-N 3.07Å; A737-T741 PolarHBondContact O-OG1 3.4Å; A737-T741 VanDerWaalsContact O-OG1 3.1Å; L738-T741 CarbonylContact O-C 3.46Å; L738-T741 PolarHBondContact O-N 3.42Å; L738-T741 VanDerWaalsContact O-N 3.14Å; L738-T741 PolarHBondContact O-OG1 2.86Å; R739-T741 PolarHBondContact O-N 3.38Å; R739-T741 VanDerWaalsContact O-N 3.15Å; T741-I743 VanDerWaalsContact C-N 3.26Å; T741-I743 PolarHBondContact O-N 3.22Å; T741-L986 HydrophobicContact CG2-CB 3.99Å; T741-L986 HydrophobicContact CG2-CD2 3.81Å; T741-L986 HydrophobicContact CG2-CG 3.67Å; T741-L986 WeakPolarHBondContact CG2-O 3.24Å; T741-L986 WeakPolarHBondContact OG1-CD2 3.26Å; T741-G987 WeakPolarHBondContact CG2-O 3.37Å
742	R	88.9	Confident	91.2	Very high	172 Å²	172	41.9 Å²	41.9	65%	0.649	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	36.6	-176.4	-58.2	-171.2	172.9	-169.2	-5	113.3	L738 R739 R988	L738-R742 PolarHBondContact O-N 2.93Å; R739-R742 PolarHBondContact O-N 3.47Å; R742-R988 HydrophobicContact CG-CG 4.44Å
743	I	92.6	Very high	90.8	Very high	5 Å²	5	41 Å²	41	3%	0.026	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-96.6	119.5	165	-57.2	179.8	0	0	0	106.2	V509 L738 T741 A745 I919 L986	V509-I743 HydrophobicContact CG2-CG2 4.09Å; L738-I743 CarbonylContact C-O 3.49Å; L738-I743 HydrophobicContact CB-CB 4.28Å; L738-I743 HydrophobicContact CD2-CB 4.24Å; L738-I743 HydrophobicContact CD2-CD1 4.03Å; L738-I743 HydrophobicContact CD2-CG2 4.24Å; L738-I743 PolarHBondContact O-N 3.32Å; T741-I743 VanDerWaalsContact C-N 3.26Å; T741-I743 PolarHBondContact O-N 3.22Å; I743-A745 PolarHBondContact O-N 3.43Å; I743-I919 HydrophobicContact CD1-CD1 3.81Å; I743-I919 HydrophobicContact CD1-CG2 4.09Å; I743-L986 HydrophobicContact CD1-CD2 4.06Å
744	R	93.3	Very high	90.1	Very high	47 Å²	47	40.3 Å²	40.3	18%	0.177	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	127.4	-176.5	-179.1	168.3	164.4	-143.2	3.2	109.6	Q507 L508 V509 V746 L844 V845 G847	Q507-R744 PolarHBondContact O-N 2.86Å; L508-R744 CarbonylContact C-O 3.59Å; L508-R744 VanDerWaalsContact CA-O 3.22Å; L508-R744 WeakPolarHBondContact CA-O 3.22Å; L508-R744 HydrophobicContact CB-CB 4.29Å; L508-R744 HydrophobicContact CD1-CB 4.3Å; L508-R744 HydrophobicContact CD1-CG 4.11Å; L508-R744 HydrophobicContact CG-CB 4.16Å; L508-R744 HydrophobicContact CG-CG 4.3Å; V509-R744 PolarHBondContact N-O 2.84Å; R744-V746 HydrophobicContact CG-CG2 4.07Å; R744-L844 VanDerWaalsContact CZ-O 3.29Å; R744-L844 PolarHBondContact NH1-O 2.96Å; R744-L844 PolarHBondContact NH2-O 3.46Å; R744-V845 PolarHBondContact NH1-O 3.21Å; R744-V845 VanDerWaalsContact NH1-O 3.14Å; R744-V845 PolarHBondContact NH2-O 2.84Å; R744-V845 VanDerWaalsContact NH2-O 3.15Å; R744-G847 PolarHBondContact NH2-O 2.88Å
745	A	95.5	Very high	89.4	Confident	15 Å²	15	40.2 Å²	40.2	12%	0.124	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	131.7	169.6	0	0	0	0	0	108.6	V509 F511 I735 I743 M765	V509-A745 WeakPolarHBondContact O-CA 3.44Å; F511-A745 HydrophobicContact CD2-CB 4.27Å; F511-A745 HydrophobicContact CE2-CB 4.04Å; I735-A745 HydrophobicContact CD1-CB 4.16Å; I743-A745 PolarHBondContact O-N 3.43Å; A745-M765 HydrophobicContact CB-CE 4.19Å; A745-M765 HydrophobicContact CB-CG 4.08Å; A745-M765 HydrophobicContact CB-SD 4.33Å
746	V	96.4	Very high	89	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.3	175.7	177.4	0	0	0	0	107.8	L508 V509 C510 F511 R744 V748 F850	L508-V746 HydrophobicContact CD1-CG2 3.81Å; L508-V746 HydrophobicContact CD2-CB 4.47Å; L508-V746 HydrophobicContact CD2-CG2 4.08Å; L508-V746 HydrophobicContact CG-CG2 3.96Å; V509-V746 PolarHBondContact O-N 2.9Å; C510-V746 CarbonylContact C-O 3.56Å; C510-V746 VanDerWaalsContact CA-O 3.27Å; C510-V746 WeakPolarHBondContact CA-O 3.23Å; F511-V746 PolarHBondContact N-O 2.87Å; R744-V746 HydrophobicContact CG-CG2 4.07Å; V746-V748 HydrophobicContact CG1-CG2 4.07Å; V746-F850 HydrophobicContact CG1-CD2 3.56Å; V746-F850 HydrophobicContact CG1-CE2 3.58Å
747	M	96	Very high	88.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.6	173.1	-174	-175.2	-67.6	0	0	109.6	F511 K513 L517 T749 A756 V759 A760 M765 T848 V849 F850	F511-M747 WeakPolarHBondContact O-CA 3.05Å; K513-M747 HydrophobicContact CB-CG 4.36Å; K513-M747 HydrophobicContact CB-SD 4.21Å; K513-M747 HydrophobicContact CG-CE 4.48Å; K513-M747 HydrophobicContact CG-SD 4.13Å; L517-M747 HydrophobicContact CD1-CE 3.74Å; L517-M747 HydrophobicContact CD1-CG 4.34Å; M747-T749 HydrophobicContact CG-CG2 4.46Å; M747-T749 HydrophobicContact SD-CG2 4.38Å; M747-A756 HydrophobicContact SD-CB 3.87Å; M747-V759 HydrophobicContact CE-CB 4.01Å; M747-V759 HydrophobicContact CE-CG1 3.63Å; M747-A760 HydrophobicContact CE-CB 3.82Å; M747-M765 HydrophobicContact CB-SD 3.96Å; M747-M765 HydrophobicContact CE-SD 4.18Å; M747-T848 PolarHBondContact N-O 3.23Å; M747-V849 HydrophobicContact SD-CG1 4.49Å; M747-F850 PolarHBondContact O-N 3.27Å
748	V	94.4	Very high	88.4	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.012	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	110.6	177.2	-170.2	0	0	0	0	107.9	C510 F511 D512 V746 F850 M853 K858 L861	C510-V748 HydrophobicContact CB-CG2 4.03Å; F511-V748 PolarHBondContact O-N 3.15Å; D512-V748 WeakPolarHBondContact CA-O 3.48Å; V746-V748 HydrophobicContact CG1-CG2 4.07Å; V748-F850 CarbonylContact C-O 3.52Å; V748-F850 WeakPolarHBondContact CA-O 3.41Å; V748-F850 HydrophobicContact CG1-CB 4.42Å; V748-M853 HydrophobicContact CG1-CB 4.31Å; V748-M853 HydrophobicContact CG1-CG 4.13Å; V748-K858 HydrophobicContact CG1-CB 4.16Å; V748-K858 HydrophobicContact CG1-CD 4.14Å; V748-K858 HydrophobicContact CG1-CG 3.75Å; V748-L861 HydrophobicContact CB-CD2 4.36Å; V748-L861 HydrophobicContact CG1-CD2 3.91Å; V748-L861 HydrophobicContact CG2-CD2 3.48Å; V748-L861 VanDerWaalsContact CG2-CD2 3.48Å
749	T	89	Confident	88.2	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.006	18%	0.175	C	C	.	.			trans	-143.1	157.2	-172	-173.7	0	0	0	0	113	K513 M747 D751 A756 F850 A851 R852 M853	K513-T749 HydrophobicContact CB-CG2 4.19Å; K513-T749 WeakPolarHBondContact CB-OG1 3.44Å; M747-T749 HydrophobicContact CG-CG2 4.46Å; M747-T749 HydrophobicContact SD-CG2 4.38Å; T749-D751 VanDerWaalsContact C-N 3.34Å; T749-D751 HydrophobicContact CG2-CB 4.12Å; T749-D751 PolarHBondContact OG1-N 3.43Å; T749-A756 HydrophobicContact CG2-CB 3.76Å; T749-F850 PolarHBondContact N-O 3.36Å; T749-A851 HydrophobicContact CG2-CB 4.26Å; T749-A851 CarbonylContact O-C 2.97Å; T749-A851 VanDerWaalsContact O-C 3.25Å; T749-A851 WeakPolarHBondContact O-CA 3.35Å; T749-R852 PolarHBondContact O-N 3.12Å; T749-M853 PolarHBondContact O-N 3.15Å
750	G	81.6	Confident	88.2	Confident	46 Å²	46	32.8 Å²	32.8	47%	0.474	16%	0.158	S	C	.	.	S	Bend	trans	-81.2	-9.8	169.7	0	0	0	0	0	114.3	R852	G750-R852 WeakPolarHBondContact O-CA 3.32Å
751	D	79.1	Confident	88.1	Confident	19 Å²	19	26 Å²	26	10%	0.102	13%	0.133	C	C	.	.	S	Bend	trans	-71.2	169.5	-177.2	-92.3	4.9	0	0	0	113.7	K513 R685 T749 A851 R852	K513-D751 HydrophobicContact CD-CB 4.46Å; K513-D751 WeakPolarHBondContact CD-OD2 3.44Å; K513-D751 WeakPolarHBondContact CE-OD2 3.4Å; K513-D751 IonicContact NZ-OD2 3.15Å; K513-D751 PolarHBondContact NZ-OD2 2.72Å; R685-D751 IonicContact NH1-OD1 3.81Å; R685-D751 PolarHBondContact NH1-OD1 3.38Å; T749-D751 VanDerWaalsContact C-N 3.34Å; T749-D751 HydrophobicContact CG2-CB 4.12Å; T749-D751 PolarHBondContact OG1-N 3.43Å; D751-A851 WeakPolarHBondContact O-CB 3.46Å; D751-R852 WeakPolarHBondContact O-CG 3.38Å; D751-R852 PolarHBondContact O-N 3.33Å
752	N	80.3	Confident	88.1	Confident	44 Å²	44	27.8 Å²	27.8	24%	0.235	15%	0.153	C	C	.	.			trans	-59.8	142.5	174.1	-167.6	-20.5	0	0	0	111.1	Q754 T755 A756 R852	N752-Q754 VanDerWaalsContact C-N 3.34Å; N752-Q754 PolarHBondContact O-N 3.49Å; N752-Q754 PolarHBondContact OD1-N 3.4Å; N752-T755 PolarHBondContact O-N 3.46Å; N752-A756 WeakPolarHBondContact O-CB 3.45Å; N752-A756 PolarHBondContact O-N 3.02Å; N752-R852 PolarHBondContact ND2-NH2 2.93Å
753	L	84.8	Confident	88.1	Confident	22 Å²	22	19.6 Å²	19.6	12%	0.115	12%	0.122	C	C	.	.	H	α-helix	trans	-54.3	-45.4	179.2	-173.5	65.6	0	0	0	112.7	A756 V757 I774 A823 V849 A851	L753-A756 PolarHBondContact O-N 3.48Å; L753-V757 HydrophobicContact CD1-CG2 4.48Å; L753-V757 WeakPolarHBondContact O-CB 3.43Å; L753-V757 VanDerWaalsContact O-CG2 3.27Å; L753-V757 WeakPolarHBondContact O-CG2 3.26Å; L753-V757 PolarHBondContact O-N 3.18Å; L753-I774 HydrophobicContact CD2-CD1 4.4Å; L753-I774 HydrophobicContact CD2-CG1 4.34Å; L753-I774 HydrophobicContact CD2-CG2 3.67Å; L753-A823 HydrophobicContact CD1-CB 3.97Å; L753-V849 HydrophobicContact CD1-CG1 4.39Å; L753-A851 VanDerWaalsContact CA-CB 3.47Å; L753-A851 HydrophobicContact CB-CB 4.02Å; L753-A851 HydrophobicContact CD1-CB 3.67Å; L753-A851 HydrophobicContact CG-CB 4.48Å
754	Q	82.2	Confident	88	Confident	56 Å²	56	20.1 Å²	20.1	26%	0.262	13%	0.129	S	C	.	.	H	α-helix	trans	-62.7	-47.6	-179	-68.4	-66.6	1.7	0	0	111.7	N752 A756 V757 T758	N752-Q754 VanDerWaalsContact C-N 3.34Å; N752-Q754 PolarHBondContact O-N 3.49Å; N752-Q754 PolarHBondContact OD1-N 3.4Å; Q754-A756 VanDerWaalsContact C-N 3.35Å; Q754-A756 PolarHBondContact O-N 3.03Å; Q754-V757 PolarHBondContact O-N 3.22Å; Q754-T758 PolarHBondContact O-N 3.34Å; Q754-T758 PolarHBondContact O-OG1 2.93Å
755	T	80.7	Confident	87.9	Confident	7 Å²	7	18.4 Å²	18.4	4%	0.043	12%	0.124	C	C	.	.	H	α-helix	trans	-59.5	-45.3	175.7	-48.9	0	0	0	0	111.4	N752 V757 T758 V759	N752-T755 PolarHBondContact O-N 3.46Å; T755-V757 VanDerWaalsContact C-N 3.31Å; T755-V757 PolarHBondContact O-N 3.35Å; T755-T758 PolarHBondContact O-N 2.67Å; T755-V759 VanDerWaalsContact O-CG2 3.29Å; T755-V759 WeakPolarHBondContact O-CG2 3.38Å; T755-V759 PolarHBondContact O-N 3.25Å
756	A	86.6	Confident	87.7	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-40.3	177.8	0	0	0	0	0	112	M747 T749 N752 L753 Q754 V759 A760 V849 A851	M747-A756 HydrophobicContact SD-CB 3.87Å; T749-A756 HydrophobicContact CG2-CB 3.76Å; N752-A756 WeakPolarHBondContact O-CB 3.45Å; N752-A756 PolarHBondContact O-N 3.02Å; L753-A756 PolarHBondContact O-N 3.48Å; Q754-A756 VanDerWaalsContact C-N 3.35Å; Q754-A756 PolarHBondContact O-N 3.03Å; A756-V759 PolarHBondContact O-N 3.03Å; A756-A760 VanDerWaalsContact O-CB 3.28Å; A756-A760 WeakPolarHBondContact O-CB 3.47Å; A756-A760 PolarHBondContact O-N 3.01Å; A756-V849 HydrophobicContact CB-CG1 3.63Å; A756-A851 HydrophobicContact CB-CB 3.91Å
757	V	87.9	Confident	87.1	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.7	-44.8	175.2	166	0	0	0	0	111.7	L753 Q754 T755 V759 A760 R761 L772 M793 A823 V849	L753-V757 HydrophobicContact CD1-CG2 4.48Å; L753-V757 WeakPolarHBondContact O-CB 3.43Å; L753-V757 VanDerWaalsContact O-CG2 3.27Å; L753-V757 WeakPolarHBondContact O-CG2 3.26Å; L753-V757 PolarHBondContact O-N 3.18Å; Q754-V757 PolarHBondContact O-N 3.22Å; T755-V757 VanDerWaalsContact C-N 3.31Å; T755-V757 PolarHBondContact O-N 3.35Å; V757-V759 VanDerWaalsContact C-N 3.35Å; V757-V759 PolarHBondContact O-N 2.91Å; V757-A760 PolarHBondContact O-N 2.92Å; V757-R761 PolarHBondContact O-N 3.06Å; V757-L772 HydrophobicContact CB-CD2 4.13Å; V757-L772 HydrophobicContact CG1-CD2 3.26Å; V757-L772 HydrophobicContact CG2-CD2 3.78Å; V757-M793 HydrophobicContact CG1-CE 3.65Å; V757-M793 HydrophobicContact CG1-SD 3.66Å; V757-A823 HydrophobicContact CG2-CB 3.85Å; V757-V849 HydrophobicContact CG2-CG1 4.34Å
758	T	85.1	Confident	86.2	Confident	39 Å²	39	23.6 Å²	23.6	24%	0.239	16%	0.158	C	C	.	.	H	α-helix	trans	-63.2	-42	177.5	-57.3	0	0	0	0	111.4	A681 Q754 T755 R761 G762	A681-T758 PolarHBondContact O-OG1 3.19Å; Q754-T758 PolarHBondContact O-N 3.34Å; Q754-T758 PolarHBondContact O-OG1 2.93Å; T755-T758 PolarHBondContact O-N 2.67Å; T758-R761 PolarHBondContact O-N 3.32Å; T758-G762 PolarHBondContact O-N 3.3Å
759	V	87.9	Confident	85.3	Confident	12 Å²	12	30.6 Å²	30.6	7%	0.073	19%	0.19	C	C	.	.	H	α-helix	trans	-63.2	-42.7	174	175.3	0	0	0	0	111	K513 T518 L727 M747 T755 A756 V757 R761 G762 C763	K513-V759 HydrophobicContact CD-CG2 4.32Å; K513-V759 HydrophobicContact CG-CG1 4Å; T518-V759 HydrophobicContact CG2-CG1 4.22Å; T518-V759 HydrophobicContact CG2-CG2 4.49Å; L727-V759 HydrophobicContact CD2-CG1 3.75Å; M747-V759 HydrophobicContact CE-CB 4.01Å; M747-V759 HydrophobicContact CE-CG1 3.63Å; T755-V759 VanDerWaalsContact O-CG2 3.29Å; T755-V759 WeakPolarHBondContact O-CG2 3.38Å; T755-V759 PolarHBondContact O-N 3.25Å; A756-V759 PolarHBondContact O-N 3.03Å; V757-V759 VanDerWaalsContact C-N 3.35Å; V757-V759 PolarHBondContact O-N 2.91Å; V759-R761 VanDerWaalsContact C-N 3.33Å; V759-R761 PolarHBondContact O-N 2.89Å; V759-G762 PolarHBondContact O-N 2.94Å; V759-C763 PolarHBondContact O-N 3.32Å; V759-C763 PolarHBondContact O-SG 3.08Å
760	A	90.9	Very high	84.9	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-36.2	178.6	0	0	0	0	0	112.7	M747 A756 V757 G764 M765 V766 V849	M747-A760 HydrophobicContact CE-CB 3.82Å; A756-A760 VanDerWaalsContact O-CB 3.28Å; A756-A760 WeakPolarHBondContact O-CB 3.47Å; A756-A760 PolarHBondContact O-N 3.01Å; V757-A760 PolarHBondContact O-N 2.92Å; A760-G764 PolarHBondContact O-N 3.45Å; A760-M765 HydrophobicContact CB-CB 4.26Å; A760-M765 WeakPolarHBondContact O-CB 3.28Å; A760-M765 PolarHBondContact O-N 3.44Å; A760-V766 HydrophobicContact CB-CG2 4.39Å; A760-V766 PolarHBondContact O-N 3.49Å; A760-V766 VanDerWaalsContact O-N 3.14Å; A760-V849 HydrophobicContact CB-CG2 3.66Å
761	R	88.8	Confident	84.9	Confident	47 Å²	47	35.1 Å²	35.1	18%	0.177	20%	0.199	C	C	.	.	H	α-helix	trans	-70	-45	170.9	-75.3	179.7	169.2	173.7	-3.8	111.5	V757 T758 V759 C763 G764 V766 M793	V757-R761 PolarHBondContact O-N 3.06Å; T758-R761 PolarHBondContact O-N 3.32Å; V759-R761 VanDerWaalsContact C-N 3.33Å; V759-R761 PolarHBondContact O-N 2.89Å; R761-C763 PolarHBondContact O-N 2.91Å; R761-G764 PolarHBondContact O-N 3.23Å; R761-G764 VanDerWaalsContact O-N 3.09Å; R761-V766 HydrophobicContact CG-CB 4.3Å; R761-M793 PolarHBondContact NH1-SD 3.39Å; R761-M793 PolarHBondContact NH2-SD 2.88Å
762	G	87.1	Confident	85.2	Confident	48 Å²	48	34.3 Å²	34.3	50%	0.495	20%	0.195	S	C	.	.	H	α-helix	trans	-60.9	-37.4	-179.1	0	0	0	0	0	114.1	T758 V759	T758-G762 PolarHBondContact O-N 3.3Å; V759-G762 PolarHBondContact O-N 2.94Å
763	C	90.3	Very high	85.6	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-2.7	175.9	68.4	0	0	0	0	114.5	L727 T731 V759 R761	L727-C763 HydrophobicContact CD1-CB 4.13Å; L727-C763 HydrophobicContact CD2-CB 4.18Å; T731-C763 HydrophobicContact CG2-CB 3.76Å; V759-C763 PolarHBondContact O-N 3.32Å; V759-C763 PolarHBondContact O-SG 3.08Å; R761-C763 PolarHBondContact O-N 2.91Å
764	G	89.4	Confident	85.8	Confident	17 Å²	17	32.5 Å²	32.5	18%	0.175	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	78	16.5	179.3	0	0	0	0	0	115.5	R739 A760 R761 V766	R739-G764 PolarHBondContact NH1-O 3.21Å; A760-G764 PolarHBondContact O-N 3.45Å; R761-G764 PolarHBondContact O-N 3.23Å; R761-G764 VanDerWaalsContact O-N 3.09Å; G764-V766 PolarHBondContact O-N 3.08Å
765	M	91.8	Very high	86.1	Confident	11 Å²	11	29.9 Å²	29.9	5%	0.054	17%	0.172	C	C	.	.	S	Bend	trans	-61.1	-37.4	167.8	-78	-173.4	-173.1	0	0	110.8	F511 L517 I735 A745 M747 A760	F511-M765 HydrophobicContact CB-CE 4.15Å; F511-M765 HydrophobicContact CD2-CE 3.89Å; F511-M765 HydrophobicContact CG-CE 4.2Å; L517-M765 HydrophobicContact CD1-CE 3.57Å; L517-M765 HydrophobicContact CD2-CE 3.95Å; L517-M765 HydrophobicContact CG-CE 4.44Å; I735-M765 HydrophobicContact CD1-CE 3.51Å; I735-M765 HydrophobicContact CD1-CG 4.34Å; I735-M765 HydrophobicContact CG1-CE 4.11Å; I735-M765 HydrophobicContact CG1-CG 4.33Å; I735-M765 HydrophobicContact CG2-CB 4.31Å; I735-M765 HydrophobicContact CG2-CG 3.57Å; A745-M765 HydrophobicContact CB-CE 4.19Å; A745-M765 HydrophobicContact CB-CG 4.08Å; A745-M765 HydrophobicContact CB-SD 4.33Å; M747-M765 HydrophobicContact CB-SD 3.96Å; M747-M765 HydrophobicContact CE-SD 4.18Å; A760-M765 HydrophobicContact CB-CB 4.26Å; A760-M765 WeakPolarHBondContact O-CB 3.28Å; A760-M765 PolarHBondContact O-N 3.44Å
766	V	90.5	Very high	86.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-117.9	120.8	169.4	-176.7	0	0	0	0	107.2	A760 R761 G764 E770 L772 H821 T848	A760-V766 HydrophobicContact CB-CG2 4.39Å; A760-V766 PolarHBondContact O-N 3.49Å; A760-V766 VanDerWaalsContact O-N 3.14Å; R761-V766 HydrophobicContact CG-CB 4.3Å; G764-V766 PolarHBondContact O-N 3.08Å; V766-E770 HydrophobicContact CG1-CB 4.23Å; V766-L772 HydrophobicContact CG1-CB 4.44Å; V766-L772 HydrophobicContact CG2-CD1 4.24Å; V766-H821 HydrophobicContact CG2-CB 4.28Å; V766-T848 HydrophobicContact CG2-CG2 3.88Å
767	A	85.3	Confident	86.3	Confident	23 Å²	23	33.7 Å²	33.7	19%	0.19	19%	0.191	C	C	.	.			trans	-73.9	153.2	178.8	0	0	0	0	0	110.5	Q769 E770	A767-Q769 PolarHBondContact O-N 3.31Å; A767-Q769 VanDerWaalsContact O-N 3.08Å; A767-E770 HydrophobicContact CB-CG 3.99Å; A767-E770 WeakPolarHBondContact CB-OE2 3.37Å; A767-E770 PolarHBondContact N-OE2 3.3Å; A767-E770 PolarHBondContact O-N 3.02Å
768	P	76.8	Confident	86.1	Confident	101 Å²	101	36.2 Å²	36.2	66%	0.656	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.2	180	-25.4	34.2	0	0	0	114.6
769	Q	75.2	Confident	85.8	Confident	148 Å²	148	40 Å²	40	69%	0.692	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-6.6	-179.4	-55.4	-176	8.9	0	0	113.2	A767	A767-Q769 PolarHBondContact O-N 3.31Å; A767-Q769 VanDerWaalsContact O-N 3.08Å
770	E	81.4	Confident	85.2	Confident	15 Å²	15	42.3 Å²	42.3	7%	0.07	24%	0.236	C	C	.	.	S	Bend	trans	-90.1	139.7	-178.1	-71	178	142.7	0	0	111.8	R739 V766 A767 L772 S819 H821	R739-E770 IonicContact CZ-OE1 2.58Å; R739-E770 IonicContact CZ-OE2 3.42Å; R739-E770 VanDerWaalsContact CZ-OE2 3.28Å; R739-E770 IonicContact NH1-OE1 2.8Å; R739-E770 IonicContact NH1-OE2 3.25Å; R739-E770 PolarHBondContact NH1-OE2 2.85Å; R739-E770 IonicContact NH2-OE1 2.65Å; R739-E770 PolarHBondContact NH2-OE1 2.97Å; R739-E770 IonicContact NH2-OE2 2.74Å; R739-E770 PolarHBondContact NH2-OE2 3.47Å; V766-E770 HydrophobicContact CG1-CB 4.23Å; A767-E770 HydrophobicContact CB-CG 3.99Å; A767-E770 WeakPolarHBondContact CB-OE2 3.37Å; A767-E770 PolarHBondContact N-OE2 3.3Å; A767-E770 PolarHBondContact O-N 3.02Å; E770-L772 PolarHBondContact O-N 3.08Å; E770-S819 WeakPolarHBondContact CG-OG 3.38Å; E770-S819 WeakPolarHBondContact OE1-CB 3.38Å; E770-S819 PolarHBondContact OE1-OG 2.9Å; E770-H821 VanDerWaalsContact CD-NE2 3.27Å; E770-H821 IonicContact OE1-NE2 3.96Å; E770-H821 PolarHBondContact OE1-NE2 3.28Å; E770-H821 IonicContact OE2-CD2 2.7Å; E770-H821 IonicContact OE2-NE2 3.98Å; E770-H821 PolarHBondContact OE2-NE2 2.79Å
771	H	81.1	Confident	84.4	Confident	128 Å²	128	49.5 Å²	49.5	59%	0.593	27%	0.269	S	S	*	.			trans	-76.2	120	178.7	-65.4	-70.3	0	0	0	110.8	H821	H771-H821 PolarHBondContact O-N 2.79Å
772	L	86.1	Confident	82.7	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.3	172.6	-173.3	71.6	0	0	0	109.6	V757 V766 E770 M793 H821 A823	V757-L772 HydrophobicContact CB-CD2 4.13Å; V757-L772 HydrophobicContact CG1-CD2 3.26Å; V757-L772 HydrophobicContact CG2-CD2 3.78Å; V766-L772 HydrophobicContact CG1-CB 4.44Å; V766-L772 HydrophobicContact CG2-CD1 4.24Å; E770-L772 PolarHBondContact O-N 3.08Å; L772-M793 HydrophobicContact CD2-SD 4.09Å; L772-M793 PolarHBondContact O-N 3.11Å; L772-H821 WeakPolarHBondContact CA-O 3.19Å; L772-H821 HydrophobicContact CD1-CB 3.52Å; L772-A823 HydrophobicContact CD1-CB 4.1Å; L772-A823 HydrophobicContact CD2-CB 4.46Å; L772-A823 HydrophobicContact CG-CB 4.36Å
773	I	88.3	Confident	81.5	Confident	3 Å²	3	61.5 Å²	61.5	2%	0.015	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.2	179.4	-56.5	170.2	0	0	0	108.2	F790 H821 L822 A823 P1171 L1173	I773-F790 HydrophobicContact CG2-CB 3.84Å; I773-F790 HydrophobicContact CG2-CD1 4.2Å; I773-H821 PolarHBondContact N-O 3.4Å; I773-L822 HydrophobicContact CB-CD2 3.84Å; I773-L822 HydrophobicContact CD1-CD2 4.45Å; I773-L822 HydrophobicContact CG2-CD2 4.31Å; I773-L822 CarbonylContact O-C 3.54Å; I773-L822 WeakPolarHBondContact O-CA 3.37Å; I773-A823 PolarHBondContact O-N 2.92Å; I773-P1171 HydrophobicContact CD1-CG 3.84Å; I773-P1171 HydrophobicContact CG2-CG 4.45Å; I773-L1173 HydrophobicContact CD1-CD1 4.33Å; I773-L1173 HydrophobicContact CD1-CD2 4.37Å; I773-L1173 HydrophobicContact CD1-CG 4.49Å
774	I	87.9	Confident	80.5	Confident	24 Å²	24	68.3 Å²	68.3	12%	0.123	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.2	171.9	-65.5	172.2	0	0	0	108	L753 L791 A823	L753-I774 HydrophobicContact CD2-CD1 4.4Å; L753-I774 HydrophobicContact CD2-CG1 4.34Å; L753-I774 HydrophobicContact CD2-CG2 3.67Å; I774-L791 HydrophobicContact CB-CB 4.32Å; I774-L791 PolarHBondContact N-O 2.86Å; I774-L791 PolarHBondContact O-N 3.39Å; I774-A823 CarbonylContact C-O 3.58Å; I774-A823 WeakPolarHBondContact CA-O 2.95Å; I774-A823 HydrophobicContact CG1-CB 4.37Å
775	V	88	Confident	80	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.006	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.6	173.7	-171.5	0	0	0	0	107.8	L788 F790 L822 A823 L824 T828 I832	V775-L788 HydrophobicContact CG1-CD2 3.4Å; V775-F790 HydrophobicContact CB-CD1 4.5Å; V775-F790 HydrophobicContact CB-CE1 4.46Å; V775-F790 HydrophobicContact CG1-CD1 4.26Å; V775-F790 HydrophobicContact CG1-CE1 3.89Å; V775-F790 HydrophobicContact CG2-CD1 3.93Å; V775-F790 HydrophobicContact CG2-CE1 3.89Å; V775-L822 HydrophobicContact CG2-CB 4.08Å; V775-L822 HydrophobicContact CG2-CD1 4.19Å; V775-L822 HydrophobicContact CG2-CD2 4.03Å; V775-L822 HydrophobicContact CG2-CG 4.31Å; V775-A823 PolarHBondContact N-O 3.35Å; V775-L824 HydrophobicContact CB-CB 4.23Å; V775-T828 HydrophobicContact CG1-CG2 4.23Å; V775-I832 HydrophobicContact CG1-CD1 4.08Å
776	H	87.6	Confident	79.5	Confident	83 Å²	83	73.1 Å²	73.1	38%	0.384	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	137.6	172.3	-168.3	67.5	0	0	0	109	L788 E789	H776-L788 WeakPolarHBondContact O-CA 3.27Å; H776-E789 HydrophobicContact CB-CB 4.48Å; H776-E789 PolarHBondContact N-O 3.48Å; H776-E789 PolarHBondContact O-N 2.92Å
777	A	84.9	Confident	79	Confident	5 Å²	5	76.1 Å²	76.1	4%	0.041	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134.9	173	0	0	0	0	0	108.7	S787 L788 T828 I831 I832	A777-S787 VanDerWaalsContact CA-O 3.27Å; A777-S787 WeakPolarHBondContact CA-O 3.31Å; A777-L788 HydrophobicContact CB-CD2 4.32Å; A777-L788 HydrophobicContact CB-CG 4.19Å; A777-T828 HydrophobicContact CB-CG2 3.73Å; A777-I831 HydrophobicContact CB-CB 4.14Å; A777-I831 HydrophobicContact CB-CD1 4.29Å; A777-I831 HydrophobicContact CB-CG2 3.88Å; A777-I831 VanDerWaalsContact O-CD1 3.32Å; A777-I831 WeakPolarHBondContact O-CD1 3.42Å; A777-I832 HydrophobicContact CB-CG1 4.48Å
778	T	83.4	Confident	78.9	Confident	53 Å²	53	76.9 Å²	76.9	33%	0.325	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	145.9	179.5	56.6	0	0	0	0	109.8	S787	T778-S787 PolarHBondContact N-O 3.02Å; T778-S787 PolarHBondContact OG1-N 3.5Å; T778-S787 PolarHBondContact OG1-OG 3.4Å
779	H	78.9	Confident	79.2	Confident	119 Å²	119	77.1 Å²	77.1	55%	0.551	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-69.4	150.8	174.2	-89.5	-73.6	0	0	0	110.6	E781	H779-E781 PolarHBondContact O-N 3.36Å
780	P	75.9	Confident	79.6	Confident	59 Å²	59	72.3 Å²	72.3	38%	0.383	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-66.4	116.7	172.8	25.9	-29.4	0	0	0	109.8	Q784	P780-Q784 WeakPolarHBondContact CA-O 3.38Å; P780-Q784 WeakPolarHBondContact CB-O 3.31Å
781	E	73.4	Confident	79.6	Confident	153 Å²	153	75.1 Å²	75.1	72%	0.715	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-89.6	163.1	169.2	-66.8	-171.3	176.8	0	0	110.5	H779 G783 Q784	H779-E781 PolarHBondContact O-N 3.36Å; E781-G783 PolarHBondContact O-N 3.47Å; E781-Q784 PolarHBondContact O-N 2.7Å
782	R	54.1	Low	79.3	Confident	262 Å²	262	73 Å²	73	99%	0.989	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	106.3	-175.4	-80	-175.4	179.4	-176.6	1.7	111
783	G	61.8	Low	78.3	Confident	84 Å²	84	75 Å²	75	87%	0.866	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.1	-7.8	178	0	0	0	0	0	116	E781	E781-G783 PolarHBondContact O-N 3.47Å
784	Q	69.1	Low	76.8	Confident	143 Å²	143	83.3 Å²	83.3	67%	0.668	44%	0.44	S	S	*	.			trans	-117.5	132.4	176.6	-66	-169.6	1.8	0	0	111.8	P780 E781	P780-Q784 WeakPolarHBondContact CA-O 3.38Å; P780-Q784 WeakPolarHBondContact CB-O 3.31Å; E781-Q784 PolarHBondContact O-N 2.7Å
785	P	78	Confident	74.8	Confident	113 Å²	113	85.3 Å²	85.3	73%	0.734	46%	0.456	S	S	*	.			trans	-67.9	158.3	173.4	30.4	-34	0	0	0	110.5	S787	P785-S787 PolarHBondContact O-N 2.89Å
786	A	80.9	Confident	72.6	Confident	17 Å²	17	89.9 Å²	89.9	14%	0.14	49%	0.486	C	S	.	.			trans	-52.9	138.4	172.2	0	0	0	0	0	109.6	I831 H835 F836	A786-I831 HydrophobicContact CB-CG2 4.44Å; A786-H835 HydrophobicContact CB-CB 4.22Å; A786-F836 HydrophobicContact CB-CE2 3.77Å; A786-F836 HydrophobicContact CB-CZ 3.94Å; A786-F836 WeakPolarHBondContact O-CZ 3.46Å
787	S	81.2	Confident	69.8	Low	62 Å²	62	91.8 Å²	91.8	43%	0.434	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	158.5	178.7	79.3	0	0	0	0	111.8	A777 T778 P785	A777-S787 VanDerWaalsContact CA-O 3.27Å; A777-S787 WeakPolarHBondContact CA-O 3.31Å; T778-S787 PolarHBondContact N-O 3.02Å; T778-S787 PolarHBondContact OG1-N 3.5Å; T778-S787 PolarHBondContact OG1-OG 3.4Å; P785-S787 PolarHBondContact O-N 2.89Å
788	L	83.2	Confident	67.4	Low	40 Å²	40	98.3 Å²	98.3	21%	0.209	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	122.4	-175.4	-109.2	154.9	0	0	0	108.3	V775 H776 A777 F790 I832 F836 L839	V775-L788 HydrophobicContact CG1-CD2 3.4Å; H776-L788 WeakPolarHBondContact O-CA 3.27Å; A777-L788 HydrophobicContact CB-CD2 4.32Å; A777-L788 HydrophobicContact CB-CG 4.19Å; L788-F790 HydrophobicContact CD2-CZ 4.12Å; L788-I832 HydrophobicContact CD1-CG1 4.43Å; L788-I832 HydrophobicContact CD2-CD1 4.17Å; L788-I832 HydrophobicContact CD2-CG1 4.27Å; L788-F836 HydrophobicContact CD1-CB 4.14Å; L788-F836 HydrophobicContact CD1-CD1 3.78Å; L788-F836 HydrophobicContact CD1-CD2 3.48Å; L788-F836 VanDerWaalsContact CD1-CD2 3.48Å; L788-F836 HydrophobicContact CD1-CE1 3.93Å; L788-F836 HydrophobicContact CD1-CE2 3.64Å; L788-F836 HydrophobicContact CD1-CG 3.52Å; L788-F836 HydrophobicContact CD1-CZ 3.84Å; L788-F836 HydrophobicContact CG-CD2 4.35Å; L788-F836 HydrophobicContact CG-CE2 4.15Å; L788-F836 HydrophobicContact CG-CZ 4.41Å; L788-L839 HydrophobicContact CD1-CD1 3.85Å
789	E	83.9	Confident	64.9	Low	105 Å²	105	101.2 Å²	101.2	49%	0.491	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.6	143.4	-179.5	-169	175.8	-170.6	0	0	110.4	H776 L791	H776-E789 HydrophobicContact CB-CB 4.48Å; H776-E789 PolarHBondContact N-O 3.48Å; H776-E789 PolarHBondContact O-N 2.92Å; E789-L791 HydrophobicContact CG-CD2 4.15Å; E789-L791 HydrophobicContact CG-CG 4.31Å
790	F	83.4	Confident	62.5	Low	47 Å²	47	102.3 Å²	102.3	21%	0.206	57%	0.57	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.4	105.8	-177.4	-63.9	-79.5	0	0	0	109.4	I773 V775 L788 P792 W1170 P1171	I773-F790 HydrophobicContact CG2-CB 3.84Å; I773-F790 HydrophobicContact CG2-CD1 4.2Å; V775-F790 HydrophobicContact CB-CD1 4.5Å; V775-F790 HydrophobicContact CB-CE1 4.46Å; V775-F790 HydrophobicContact CG1-CD1 4.26Å; V775-F790 HydrophobicContact CG1-CE1 3.89Å; V775-F790 HydrophobicContact CG2-CD1 3.93Å; V775-F790 HydrophobicContact CG2-CE1 3.89Å; L788-F790 HydrophobicContact CD2-CZ 4.12Å; F790-P792 WeakPolarHBondContact O-CD 3.22Å; F790-W1170 AromaticContact CE1-CH2 3.84Å; F790-W1170 HydrophobicContact CE1-CH2 3.84Å; F790-W1170 HydrophobicContact CE1-CZ2 4.07Å; F790-W1170 HydrophobicContact CE1-CZ3 4.42Å; F790-W1170 HydrophobicContact CE2-CZ2 4.3Å; F790-W1170 AromaticContact CZ-CH2 3.65Å; F790-W1170 HydrophobicContact CZ-CH2 3.65Å; F790-W1170 AromaticContact CZ-CZ2 3.44Å; F790-W1170 HydrophobicContact CZ-CZ2 3.44Å; F790-W1170 VanDerWaalsContact CZ-CZ2 3.44Å; F790-P1171 HydrophobicContact CB-CB 4.28Å; F790-P1171 HydrophobicContact CB-CG 4.07Å; F790-P1171 HydrophobicContact CD1-CB 3.69Å; F790-P1171 HydrophobicContact CD1-CG 3.47Å; F790-P1171 VanDerWaalsContact CD1-CG 3.47Å; F790-P1171 HydrophobicContact CD2-CB 3.7Å; F790-P1171 HydrophobicContact CD2-CG 4.31Å; F790-P1171 HydrophobicContact CE1-CB 3.85Å; F790-P1171 HydrophobicContact CE1-CG 3.91Å; F790-P1171 HydrophobicContact CE2-CB 3.88Å; F790-P1171 HydrophobicContact CG-CB 3.6Å; F790-P1171 HydrophobicContact CG-CG 3.68Å; F790-P1171 HydrophobicContact CZ-CB 3.95Å
791	L	80.3	Confident	60.5	Low	75 Å²	75	103.1 Å²	103.1	39%	0.393	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.1	110	-175.8	-62.6	170.3	0	0	0	109.6	I774 E789	I774-L791 HydrophobicContact CB-CB 4.32Å; I774-L791 PolarHBondContact N-O 2.86Å; I774-L791 PolarHBondContact O-N 3.39Å; E789-L791 HydrophobicContact CG-CD2 4.15Å; E789-L791 HydrophobicContact CG-CG 4.31Å
792	P	74.6	Confident	58.5	Low	83 Å²	83	103.5 Å²	103.5	54%	0.539	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.4	136.1	173.9	27.5	-31.1	0	0	0	110.2	F790 L1173	F790-P792 WeakPolarHBondContact O-CD 3.22Å; P792-L1173 HydrophobicContact CB-CD2 4.36Å; P792-L1173 HydrophobicContact CG-CD2 4.24Å
793	M	66.4	Low	57.3	Low	43 Å²	43	100.5 Å²	100.5	21%	0.212	59%	0.588	C	S	.	*	P	Polyproline II helix	trans	-92.5	121	174.7	-165	-168	-140.5	0	0	109.7	V757 R761 L772	V757-M793 HydrophobicContact CG1-CE 3.65Å; V757-M793 HydrophobicContact CG1-SD 3.66Å; R761-M793 PolarHBondContact NH1-SD 3.39Å; R761-M793 PolarHBondContact NH2-SD 2.88Å; L772-M793 HydrophobicContact CD2-SD 4.09Å; L772-M793 PolarHBondContact O-N 3.11Å
794	E	56.3	Low	55.8	Low	179 Å²	179	103.7 Å²	103.7	84%	0.836	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-62.2	138.7	174	-65.3	-174.4	167.8	0	0	110.5
795	S	46.1	Very low	53.9	Low	66 Å²	66	101.7 Å²	101.7	46%	0.462	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-67.9	128.4	175.2	-61.1	0	0	0	0	108.6	T797	S795-T797 PolarHBondContact O-N 3.46Å
796	P	41.9	Very low	51.7	Low	97 Å²	97	103.7 Å²	103.7	63%	0.63	59%	0.59	S	S	*	*			trans	-63.3	111.5	175.4	24.8	-31.1	0	0	0	108.2	V798	P796-V798 PolarHBondContact O-N 2.99Å
797	T	29.3	Very low	49.4	Very low	122 Å²	122	112.2 Å²	112.2	75%	0.748	63%	0.626	S	S	*	*			trans	-56	124.4	164.2	39.9	0	0	0	0	107.6	S795 V799	S795-T797 PolarHBondContact O-N 3.46Å; T797-V799 VanDerWaalsContact C-N 3.35Å; T797-V799 PolarHBondContact O-N 3.07Å
798	V	32.6	Very low	46.9	Very low	142 Å²	142	113.8 Å²	113.8	86%	0.861	64%	0.644	S	S	*	*			trans	-58.3	96.1	177.4	179	0	0	0	0	108.7	P796	P796-V798 PolarHBondContact O-N 2.99Å
799	V	31.5	Very low	44.4	Very low	115 Å²	115	116.4 Å²	116.4	70%	0.697	67%	0.671	S	S	*	*			trans	-104.4	89.6	165.6	-178.1	0	0	0	0	105.9	T797	T797-V799 VanDerWaalsContact C-N 3.35Å; T797-V799 PolarHBondContact O-N 3.07Å
800	N	29.3	Very low	42	Very low	141 Å²	141	116 Å²	116	75%	0.754	68%	0.68	S	S	*	*			trans	168.9	116.5	140.2	-84.1	-18.8	0	0	0	109.1	I802	N800-I802 PolarHBondContact O-N 3.22Å
801	G	34.3	Very low	39.6	Very low	76 Å²	76	124.4 Å²	124.4	78%	0.784	71%	0.711	S	S	*	*			trans	-78.5	117.6	179.4	0	0	0	0	0	111.5
802	I	29.6	Very low	37	Very low	161 Å²	161	127 Å²	127	83%	0.826	73%	0.731	S	S	*	*			trans	-141.1	107.2	140.7	-58.1	-176.6	0	0	0	105	N800 D804	N800-I802 PolarHBondContact O-N 3.22Å; I802-D804 PolarHBondContact O-N 2.84Å
803	K	30.3	Very low	35.1	Very low	199 Å²	199	129.2 Å²	129.2	87%	0.865	74%	0.742	S	S	*	*			trans	-81.7	106.9	173.1	-74.8	-179.5	176.9	178.9	0	107.5
804	D	30.4	Very low	33.2	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	77%	0.77	S	S	*	*			trans	-87.8	113.9	155.6	-109.5	-27.5	0	0	0	107.8	I802 D806	I802-D804 PolarHBondContact O-N 2.84Å; D804-D806 PolarHBondContact O-N 2.75Å
805	P	29.4	Very low	32.2	Very low	102 Å²	102	129.9 Å²	129.9	66%	0.662	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-75.8	-9.8	-170.4	-16.4	31.3	0	0	0	116.3
806	D	30.6	Very low	32	Very low	155 Å²	155	131.7 Å²	131.7	83%	0.829	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-106.1	16	-157.6	-75.9	-13.2	0	0	0	117.4	D804	D804-D806 PolarHBondContact O-N 2.75Å
807	Q	33.4	Very low	31.7	Very low	195 Å²	195	133.1 Å²	133.1	91%	0.911	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-122.2	6.7	174.4	-71.6	-172.7	12.1	0	0	115.6	A809	Q807-A809 VanDerWaalsContact C-N 3.32Å; Q807-A809 PolarHBondContact O-N 3.21Å; Q807-A809 VanDerWaalsContact O-N 3.11Å
808	A	29.3	Very low	32.7	Very low	96 Å²	96	135.4 Å²	135.4	79%	0.793	76%	0.759	S	S	*	*			trans	-88.3	54.3	-178.3	0	0	0	0	0	113.7
809	A	29.7	Very low	34.1	Very low	94 Å²	94	130.4 Å²	130.4	78%	0.777	73%	0.73	S	S	*	*			trans	-107	65.9	162.8	0	0	0	0	0	109.2	Q807	Q807-A809 VanDerWaalsContact C-N 3.32Å; Q807-A809 PolarHBondContact O-N 3.21Å; Q807-A809 VanDerWaalsContact O-N 3.11Å
810	S	32.6	Very low	36.2	Very low	97 Å²	97	128.3 Å²	128.3	68%	0.678	71%	0.71	S	S	*	*			trans	-96.1	126	179.1	69.8	0	0	0	0	111.2	T812	S810-T812 PolarHBondContact O-N 3Å; S810-T812 VanDerWaalsContact O-N 3.13Å
811	Y	33	Very low	39.1	Very low	223 Å²	223	122.8 Å²	122.8	88%	0.875	68%	0.68	S	S	*	*			trans	-57	109.8	165.3	-68.5	-98.6	0	0	0	109.1	V813	Y811-V813 PolarHBondContact O-N 2.9Å
812	T	27.3	Very low	41.8	Very low	131 Å²	131	119.2 Å²	119.2	80%	0.804	64%	0.642	S	S	*	*			trans	-69.6	93.9	171.9	33.5	0	0	0	0	109.7	S810 E814	S810-T812 PolarHBondContact O-N 3Å; S810-T812 VanDerWaalsContact O-N 3.13Å; T812-E814 PolarHBondContact O-N 3.44Å
813	V	34.3	Very low	44.8	Very low	128 Å²	128	111.5 Å²	111.5	78%	0.776	60%	0.603	S	S	*	*			trans	-82.4	105	155.6	179.3	0	0	0	0	105.8	Y811	Y811-V813 PolarHBondContact O-N 2.9Å
814	E	26.1	Very low	47.8	Very low	172 Å²	172	102 Å²	102	80%	0.804	56%	0.562	S	S	*	*			trans	-44.4	119.8	168.4	-73	-96.2	141	0	0	109.8	T812	T812-E814 PolarHBondContact O-N 3.44Å
815	P	34.5	Very low	50.7	Low	64 Å²	64	95.8 Å²	95.8	42%	0.416	53%	0.53	S	S	.	.			trans	-68.7	134.5	177.4	23.4	-26.3	0	0	0	110.1	P817	P815-P817 VanDerWaalsContact O-CD 3.29Å; P815-P817 WeakPolarHBondContact O-CD 3.34Å
816	D	42.2	Very low	53.5	Low	104 Å²	104	91 Å²	91	56%	0.556	50%	0.499	S	S	*	.			trans	-65.7	117.8	172.3	-168.9	-8.4	0	0	0	107.6	R818 S819	D816-R818 PolarHBondContact O-N 3.05Å; D816-S819 PolarHBondContact O-N 3.09Å; D816-S819 PolarHBondContact O-OG 3.25Å
817	P	36.9	Very low	56.2	Low	128 Å²	128	87.2 Å²	87.2	83%	0.831	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	16.1	-176.5	24.8	-33.1	0	0	0	114.4	P815	P815-P817 VanDerWaalsContact O-CD 3.29Å; P815-P817 WeakPolarHBondContact O-CD 3.34Å
818	R	49.4	Very low	58.9	Low	170 Å²	170	78 Å²	78	64%	0.642	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	-4.5	-173.8	-63.1	178.5	172.4	-177.4	-3.9	113.9	D816 R820	D816-R818 PolarHBondContact O-N 3.05Å; R818-R820 PolarHBondContact O-N 3.24Å
819	S	60.9	Low	61.9	Low	36 Å²	36	73.5 Å²	73.5	25%	0.252	40%	0.402	S	S	.	.			trans	-81	85.4	179	52	0	0	0	0	112.2	E770 D816 H821	E770-S819 WeakPolarHBondContact CG-OG 3.38Å; E770-S819 WeakPolarHBondContact OE1-CB 3.38Å; E770-S819 PolarHBondContact OE1-OG 2.9Å; D816-S819 PolarHBondContact O-N 3.09Å; D816-S819 PolarHBondContact O-OG 3.25Å; S819-H821 PolarHBondContact O-CD2 3.09Å
820	R	77.2	Confident	64.6	Low	72 Å²	72	70.3 Å²	70.3	27%	0.272	38%	0.379	S	S	.	.			trans	-86.2	127.8	167.4	-63.4	179.3	-177.2	176.2	-1.8	109.6	R818 P1171	R818-R820 PolarHBondContact O-N 3.24Å; R820-P1171 PolarHBondContact NH1-O 2.74Å
821	H	88.8	Confident	67.3	Low	25 Å²	25	65.9 Å²	65.9	12%	0.116	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	138.9	175.5	-65.8	-96.1	0	0	0	109.3	V766 E770 H771 L772 I773 S819 T848	V766-H821 HydrophobicContact CG2-CB 4.28Å; E770-H821 VanDerWaalsContact CD-NE2 3.27Å; E770-H821 IonicContact OE1-NE2 3.96Å; E770-H821 PolarHBondContact OE1-NE2 3.28Å; E770-H821 IonicContact OE2-CD2 2.7Å; E770-H821 IonicContact OE2-NE2 3.98Å; E770-H821 PolarHBondContact OE2-NE2 2.79Å; H771-H821 PolarHBondContact O-N 2.79Å; L772-H821 WeakPolarHBondContact CA-O 3.19Å; L772-H821 HydrophobicContact CD1-CB 3.52Å; I773-H821 PolarHBondContact N-O 3.4Å; S819-H821 PolarHBondContact O-CD2 3.09Å; H821-T848 PolarHBondContact ND1-OG1 2.92Å
822	L	91.9	Very high	69.9	Low	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	139.6	172.3	-55.4	177.6	0	0	0	110.5	I773 V775 L824 V843 Q846 G847 T848 V849 W1170	I773-L822 HydrophobicContact CB-CD2 3.84Å; I773-L822 HydrophobicContact CD1-CD2 4.45Å; I773-L822 HydrophobicContact CG2-CD2 4.31Å; I773-L822 CarbonylContact O-C 3.54Å; I773-L822 WeakPolarHBondContact O-CA 3.37Å; V775-L822 HydrophobicContact CG2-CB 4.08Å; V775-L822 HydrophobicContact CG2-CD1 4.19Å; V775-L822 HydrophobicContact CG2-CD2 4.03Å; V775-L822 HydrophobicContact CG2-CG 4.31Å; L822-L824 HydrophobicContact CB-CD2 4.42Å; L822-V843 HydrophobicContact CD1-CG1 4.39Å; L822-Q846 HydrophobicContact CD1-CB 3.79Å; L822-Q846 HydrophobicContact CG-CB 3.75Å; L822-Q846 PolarHBondContact N-O 3.41Å; L822-G847 CarbonylContact O-C 3.56Å; L822-T848 PolarHBondContact O-N 3.35Å; L822-V849 PolarHBondContact O-N 3.44Å; L822-W1170 HydrophobicContact CD1-CZ3 4.05Å
823	A	92.9	Very high	72.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.1	170.2	0	0	0	0	0	108.9	L753 V757 L772 I773 I774 V775 V849	L753-A823 HydrophobicContact CD1-CB 3.97Å; V757-A823 HydrophobicContact CG2-CB 3.85Å; L772-A823 HydrophobicContact CD1-CB 4.1Å; L772-A823 HydrophobicContact CD2-CB 4.46Å; L772-A823 HydrophobicContact CG-CB 4.36Å; I773-A823 PolarHBondContact O-N 2.92Å; I774-A823 CarbonylContact C-O 3.58Å; I774-A823 WeakPolarHBondContact CA-O 2.95Å; I774-A823 HydrophobicContact CG1-CB 4.37Å; V775-A823 PolarHBondContact N-O 3.35Å; A823-V849 CarbonylContact C-O 3.45Å; A823-V849 VanDerWaalsContact CA-O 3.31Å; A823-V849 WeakPolarHBondContact CA-O 3.48Å; A823-V849 HydrophobicContact CB-CB 3.97Å
824	L	93.7	Very high	75.2	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	155.8	-179	53.5	137.5	0	0	0	112.6	V775 L822 T828 F829 V843 V849 F850 A851	V775-L824 HydrophobicContact CB-CB 4.23Å; L822-L824 HydrophobicContact CB-CD2 4.42Å; L824-T828 HydrophobicContact CB-CG2 4.33Å; L824-F829 HydrophobicContact CD1-CB 3.84Å; L824-F829 HydrophobicContact CD1-CD2 3.93Å; L824-F829 HydrophobicContact CD1-CG 4.37Å; L824-V843 HydrophobicContact CD1-CG1 4.36Å; L824-V843 HydrophobicContact CD2-CG1 3.76Å; L824-V849 PolarHBondContact N-O 2.86Å; L824-F850 HydrophobicContact CD1-CD1 3.62Å; L824-F850 HydrophobicContact CD1-CE1 3.65Å; L824-F850 HydrophobicContact CD2-CD1 4.07Å; L824-F850 HydrophobicContact CD2-CE1 3.76Å; L824-F850 HydrophobicContact CD2-CZ 4.22Å; L824-F850 HydrophobicContact CG-CD1 3.72Å; L824-F850 HydrophobicContact CG-CE1 3.88Å; L824-F850 WeakPolarHBondContact O-CA 3.17Å; L824-A851 PolarHBondContact O-N 3.14Å
825	S	91.2	Very high	78	Confident	20 Å²	20	49 Å²	49	14%	0.14	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	157.2	177.1	75.7	0	0	0	0	112.2	T828 F829 A851	S825-T828 WeakPolarHBondContact O-CB 3.4Å; S825-T828 PolarHBondContact O-N 3.09Å; S825-T828 VanDerWaalsContact O-N 3.16Å; S825-T828 PolarHBondContact OG-N 3.06Å; S825-T828 PolarHBondContact OG-OG1 3.11Å; S825-F829 PolarHBondContact O-N 3.07Å; S825-A851 CarbonylContact C-O 3.58Å; S825-A851 VanDerWaalsContact CA-O 3.25Å; S825-A851 WeakPolarHBondContact CA-O 3.49Å
826	G	87.2	Confident	80.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-54.4	-44.6	174.6	0	0	0	0	0	114.7	T828 F829 G830 A851 R852 M853 Q857	G826-T828 PolarHBondContact O-N 2.9Å; G826-F829 WeakPolarHBondContact O-CB 3.36Å; G826-F829 PolarHBondContact O-N 3.36Å; G826-G830 PolarHBondContact O-N 2.87Å; G826-A851 PolarHBondContact N-O 3.04Å; G826-R852 WeakPolarHBondContact CA-O 3.43Å; G826-M853 VanDerWaalsContact CA-SD 3.55Å; G826-Q857 PolarHBondContact O-NE2 3.33Å
827	P	87.3	Confident	82.6	Confident	76 Å²	76	47 Å²	47	49%	0.494	25%	0.245	S	C	.	.	H	α-helix	trans	-58.5	-45.9	172.9	-27.4	35.7	0	0	0	112.7	F829 G830 I831	P827-F829 VanDerWaalsContact C-N 3.33Å; P827-F829 PolarHBondContact O-N 3Å; P827-G830 PolarHBondContact O-N 3.34Å; P827-I831 WeakPolarHBondContact O-CG1 3.37Å; P827-I831 PolarHBondContact O-N 3.14Å
828	T	89.6	Confident	84.9	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-42.1	175.8	-58.4	0	0	0	0	111.8	V775 A777 L824 S825 G826 G830 I831 I832	V775-T828 HydrophobicContact CG1-CG2 4.23Å; A777-T828 HydrophobicContact CB-CG2 3.73Å; L824-T828 HydrophobicContact CB-CG2 4.33Å; S825-T828 WeakPolarHBondContact O-CB 3.4Å; S825-T828 PolarHBondContact O-N 3.09Å; S825-T828 VanDerWaalsContact O-N 3.16Å; S825-T828 PolarHBondContact OG-N 3.06Å; S825-T828 PolarHBondContact OG-OG1 3.11Å; G826-T828 PolarHBondContact O-N 2.9Å; T828-G830 PolarHBondContact O-N 3Å; T828-I831 PolarHBondContact O-N 3Å; T828-I832 HydrophobicContact CG2-CD1 3.74Å; T828-I832 HydrophobicContact CG2-CG1 4.39Å; T828-I832 VanDerWaalsContact O-CG1 3.26Å; T828-I832 WeakPolarHBondContact O-CG1 3.31Å; T828-I832 PolarHBondContact O-N 3.41Å
829	F	92.2	Very high	86.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.5	-47.3	175.9	-178	-108.7	0	0	0	111.8	L824 S825 G826 P827 I831 I832 M833 L840 L844 F850 M853 E860 L861	L824-F829 HydrophobicContact CD1-CB 3.84Å; L824-F829 HydrophobicContact CD1-CD2 3.93Å; L824-F829 HydrophobicContact CD1-CG 4.37Å; S825-F829 PolarHBondContact O-N 3.07Å; G826-F829 WeakPolarHBondContact O-CB 3.36Å; G826-F829 PolarHBondContact O-N 3.36Å; P827-F829 VanDerWaalsContact C-N 3.33Å; P827-F829 PolarHBondContact O-N 3Å; F829-I831 PolarHBondContact O-N 2.72Å; F829-I832 PolarHBondContact O-N 3.47Å; F829-M833 HydrophobicContact CE1-SD 4.27Å; F829-M833 WeakPolarHBondContact O-CB 3.3Å; F829-M833 PolarHBondContact O-N 3.13Å; F829-L840 HydrophobicContact CD2-CD1 4.41Å; F829-L840 HydrophobicContact CE2-CD1 3.83Å; F829-L844 HydrophobicContact CE2-CD2 4.08Å; F829-F850 HydrophobicContact CD2-CD1 4.28Å; F829-F850 HydrophobicContact CD2-CE1 4.11Å; F829-F850 HydrophobicContact CE2-CE1 4.3Å; F829-M853 HydrophobicContact CB-SD 4.27Å; F829-M853 HydrophobicContact CD1-CE 3.87Å; F829-M853 HydrophobicContact CD1-SD 4.43Å; F829-M853 HydrophobicContact CE1-CE 4.19Å; F829-M853 HydrophobicContact CG-CE 4.23Å; F829-M853 HydrophobicContact CG-SD 4.44Å; F829-E860 HydrophobicContact CE1-CB 4.48Å; F829-L861 HydrophobicContact CE2-CD1 4.17Å; F829-L861 HydrophobicContact CZ-CB 4.27Å; F829-L861 HydrophobicContact CZ-CD1 4.31Å
830	G	87.1	Confident	87.9	Confident	28 Å²	28	43.1 Å²	43.1	29%	0.289	22%	0.218	S	C	.	.	H	α-helix	trans	-61.3	-42.4	177.9	0	0	0	0	0	113.1	G826 P827 T828 M833 K834	G826-G830 PolarHBondContact O-N 2.87Å; P827-G830 PolarHBondContact O-N 3.34Å; T828-G830 PolarHBondContact O-N 3Å; G830-M833 PolarHBondContact O-N 3.3Å; G830-K834 WeakPolarHBondContact O-CB 3.42Å; G830-K834 PolarHBondContact O-N 3.48Å
831	I	88.6	Confident	88.5	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-46.1	175.6	-64.1	164.1	0	0	0	110.7	A777 A786 P827 T828 F829 M833 K834 H835 F836	A777-I831 HydrophobicContact CB-CB 4.14Å; A777-I831 HydrophobicContact CB-CD1 4.29Å; A777-I831 HydrophobicContact CB-CG2 3.88Å; A777-I831 VanDerWaalsContact O-CD1 3.32Å; A777-I831 WeakPolarHBondContact O-CD1 3.42Å; A786-I831 HydrophobicContact CB-CG2 4.44Å; P827-I831 WeakPolarHBondContact O-CG1 3.37Å; P827-I831 PolarHBondContact O-N 3.14Å; T828-I831 PolarHBondContact O-N 3Å; F829-I831 PolarHBondContact O-N 2.72Å; I831-M833 VanDerWaalsContact C-N 3.32Å; I831-M833 PolarHBondContact O-N 2.96Å; I831-K834 PolarHBondContact O-N 3.39Å; I831-H835 WeakPolarHBondContact O-CB 3.09Å; I831-H835 PolarHBondContact O-N 3.32Å; I831-F836 HydrophobicContact CG2-CE2 4.33Å
832	I	88.6	Confident	88.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.2	-43.2	178.7	-68.8	167.4	0	0	0	110.8	V775 A777 L788 T828 F829 K834 F836 L840 V843	V775-I832 HydrophobicContact CG1-CD1 4.08Å; A777-I832 HydrophobicContact CB-CG1 4.48Å; L788-I832 HydrophobicContact CD1-CG1 4.43Å; L788-I832 HydrophobicContact CD2-CD1 4.17Å; L788-I832 HydrophobicContact CD2-CG1 4.27Å; T828-I832 HydrophobicContact CG2-CD1 3.74Å; T828-I832 HydrophobicContact CG2-CG1 4.39Å; T828-I832 VanDerWaalsContact O-CG1 3.26Å; T828-I832 WeakPolarHBondContact O-CG1 3.31Å; T828-I832 PolarHBondContact O-N 3.41Å; F829-I832 PolarHBondContact O-N 3.47Å; I832-K834 VanDerWaalsContact C-N 3.34Å; I832-K834 PolarHBondContact O-N 3.18Å; I832-F836 HydrophobicContact CG2-CB 4.33Å; I832-F836 CarbonylContact O-C 3.49Å; I832-F836 WeakPolarHBondContact O-CA 3.3Å; I832-F836 PolarHBondContact O-N 3.27Å; I832-L840 HydrophobicContact CG2-CB 4.1Å; I832-L840 HydrophobicContact CG2-CD1 4.05Å; I832-V843 HydrophobicContact CD1-CG2 4.48Å
833	M	86.8	Confident	88.4	Confident	57 Å²	57	41.2 Å²	41.2	28%	0.281	21%	0.213	S	C	.	.	H	α-helix	trans	-63.6	-39.8	179.8	-170.3	170.3	174.9	0	0	112.1	F829 G830 I831 L840	F829-M833 HydrophobicContact CE1-SD 4.27Å; F829-M833 WeakPolarHBondContact O-CB 3.3Å; F829-M833 PolarHBondContact O-N 3.13Å; G830-M833 PolarHBondContact O-N 3.3Å; I831-M833 VanDerWaalsContact C-N 3.32Å; I831-M833 PolarHBondContact O-N 2.96Å; M833-L840 HydrophobicContact CB-CD2 4.45Å; M833-L840 HydrophobicContact CG-CD2 4.15Å
834	K	86.4	Confident	88.3	Confident	166 Å²	166	41.3 Å²	41.3	72%	0.722	21%	0.213	S	C	*	.	H	α-helix	trans	-82	-46.4	-177.7	-171.9	175.1	-179.3	179.5	0	113.7	G830 I831 I832	G830-K834 WeakPolarHBondContact O-CB 3.42Å; G830-K834 PolarHBondContact O-N 3.48Å; I831-K834 PolarHBondContact O-N 3.39Å; I832-K834 VanDerWaalsContact C-N 3.34Å; I832-K834 PolarHBondContact O-N 3.18Å
835	H	85.6	Confident	88.2	Confident	77 Å²	77	42 Å²	42	36%	0.356	22%	0.217	S	C	.	.	H	α-helix	trans	-102.8	-22.9	-170.5	-64.1	-78.2	0	0	0	113.5	A786 I831	A786-H835 HydrophobicContact CB-CB 4.22Å; I831-H835 WeakPolarHBondContact O-CB 3.09Å; I831-H835 PolarHBondContact O-N 3.32Å
836	F	86.8	Confident	88.1	Confident	47 Å²	47	42 Å²	42	21%	0.206	22%	0.215	C	C	.	.			trans	-126.7	49.5	-177.8	-57.3	-81.1	0	0	0	114.1	A786 L788 I831 I832 K838 L839 L840	A786-F836 HydrophobicContact CB-CE2 3.77Å; A786-F836 HydrophobicContact CB-CZ 3.94Å; A786-F836 WeakPolarHBondContact O-CZ 3.46Å; L788-F836 HydrophobicContact CD1-CB 4.14Å; L788-F836 HydrophobicContact CD1-CD1 3.78Å; L788-F836 HydrophobicContact CD1-CD2 3.48Å; L788-F836 VanDerWaalsContact CD1-CD2 3.48Å; L788-F836 HydrophobicContact CD1-CE1 3.93Å; L788-F836 HydrophobicContact CD1-CE2 3.64Å; L788-F836 HydrophobicContact CD1-CG 3.52Å; L788-F836 HydrophobicContact CD1-CZ 3.84Å; L788-F836 HydrophobicContact CG-CD2 4.35Å; L788-F836 HydrophobicContact CG-CE2 4.15Å; L788-F836 HydrophobicContact CG-CZ 4.41Å; I831-F836 HydrophobicContact CG2-CE2 4.33Å; I832-F836 HydrophobicContact CG2-CB 4.33Å; I832-F836 CarbonylContact O-C 3.49Å; I832-F836 WeakPolarHBondContact O-CA 3.3Å; I832-F836 PolarHBondContact O-N 3.27Å; F836-K838 PolarHBondContact O-N 2.87Å; F836-L839 HydrophobicContact CB-CB 4.32Å; F836-L839 HydrophobicContact CB-CD1 4.24Å; F836-L839 HydrophobicContact CD1-CD1 4.15Å; F836-L839 HydrophobicContact CG-CD1 4.47Å; F836-L839 PolarHBondContact O-N 3.42Å; F836-L840 PolarHBondContact O-N 3.25Å
837	P	85.5	Confident	88.3	Confident	79 Å²	79	42 Å²	42	51%	0.513	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.3	-173.8	26.4	-36.3	0	0	0	113.8	P841	P837-P841 WeakPolarHBondContact O-CD 3.4Å
838	K	85.3	Confident	88.7	Confident	193 Å²	193	38.6 Å²	38.6	84%	0.839	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-30	175.4	-66.5	-177.8	-179.1	176	0	113	F836	F836-K838 PolarHBondContact O-N 2.87Å
839	L	85.7	Confident	88.9	Confident	50 Å²	50	38.4 Å²	38.4	26%	0.262	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-26.5	-179.7	-65.5	177.9	0	0	0	112.3	L788 F836 P841 K842 V843 W1170	L788-L839 HydrophobicContact CD1-CD1 3.85Å; F836-L839 HydrophobicContact CB-CB 4.32Å; F836-L839 HydrophobicContact CB-CD1 4.24Å; F836-L839 HydrophobicContact CD1-CD1 4.15Å; F836-L839 HydrophobicContact CG-CD1 4.47Å; F836-L839 PolarHBondContact O-N 3.42Å; L839-P841 VanDerWaalsContact C-N 3.33Å; L839-K842 WeakPolarHBondContact O-CB 3.42Å; L839-K842 PolarHBondContact O-N 3.48Å; L839-V843 PolarHBondContact O-N 2.89Å; L839-V843 VanDerWaalsContact O-N 3.08Å; L839-W1170 HydrophobicContact CD1-CZ2 4.34Å; L839-W1170 HydrophobicContact CD2-CZ2 3.99Å
840	L	88.3	Confident	89.1	Confident	8 Å²	8	38.5 Å²	38.5	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-47	-46.8	-179.2	179.3	67.1	0	0	0	113.4	F829 I832 M833 F836 K842 V843 L844 E864	F829-L840 HydrophobicContact CD2-CD1 4.41Å; F829-L840 HydrophobicContact CE2-CD1 3.83Å; I832-L840 HydrophobicContact CG2-CB 4.1Å; I832-L840 HydrophobicContact CG2-CD1 4.05Å; M833-L840 HydrophobicContact CB-CD2 4.45Å; M833-L840 HydrophobicContact CG-CD2 4.15Å; F836-L840 PolarHBondContact O-N 3.25Å; L840-K842 VanDerWaalsContact C-N 3.31Å; L840-K842 PolarHBondContact O-N 3.23Å; L840-V843 PolarHBondContact O-N 3.32Å; L840-L844 HydrophobicContact CD1-CD1 4.02Å; L840-L844 HydrophobicContact CD1-CD2 4.32Å; L840-L844 HydrophobicContact CD1-CG 3.93Å; L840-L844 HydrophobicContact CD2-CD1 4.43Å; L840-L844 HydrophobicContact CG-CD1 3.79Å; L840-L844 HydrophobicContact CG-CG 4.16Å; L840-L844 WeakPolarHBondContact O-CB 3.34Å; L840-L844 VanDerWaalsContact O-CG 3.22Å; L840-L844 WeakPolarHBondContact O-CG 3.3Å; L840-L844 PolarHBondContact O-N 3.45Å; L840-E864 HydrophobicContact CD2-CG 4.29Å
841	P	89.7	Confident	89.2	Confident	15 Å²	15	37.1 Å²	37.1	10%	0.097	18%	0.178	C	C	.	.	H	α-helix	trans	-58.3	-36.6	176.6	-27.3	36.8	0	0	0	114.8	P837 L839 V845 L868 L1161	P837-P841 WeakPolarHBondContact O-CD 3.4Å; L839-P841 VanDerWaalsContact C-N 3.33Å; P841-V845 VanDerWaalsContact O-CG2 3.3Å; P841-V845 WeakPolarHBondContact O-CG2 3.42Å; P841-V845 PolarHBondContact O-N 2.93Å; P841-L868 HydrophobicContact CB-CD2 3.86Å; P841-L868 HydrophobicContact CG-CD2 4.39Å; P841-L1161 HydrophobicContact CB-CD1 3.61Å; P841-L1161 HydrophobicContact CB-CD2 4.31Å
842	K	87.9	Confident	89.1	Confident	42 Å²	42	41.5 Å²	41.5	18%	0.183	19%	0.194	C	C	.	.	H	α-helix	trans	-70.2	-45.7	177.6	-65.5	-173.7	177.6	-167.3	0	110.3	L839 L840 L844 V845 Q846 L1161 E1164 L1165 W1170	L839-K842 WeakPolarHBondContact O-CB 3.42Å; L839-K842 PolarHBondContact O-N 3.48Å; L840-K842 VanDerWaalsContact C-N 3.31Å; L840-K842 PolarHBondContact O-N 3.23Å; K842-L844 VanDerWaalsContact C-N 3.32Å; K842-L844 PolarHBondContact O-N 2.91Å; K842-V845 PolarHBondContact O-N 3.28Å; K842-V845 VanDerWaalsContact O-N 3.17Å; K842-Q846 PolarHBondContact O-N 3.21Å; K842-L1161 HydrophobicContact CG-CD2 4.11Å; K842-E1164 WeakPolarHBondContact CE-OE1 3.19Å; K842-E1164 IonicContact NZ-OE1 2.7Å; K842-E1164 PolarHBondContact NZ-OE1 3.35Å; K842-L1165 HydrophobicContact CB-CD2 4.36Å; K842-L1165 HydrophobicContact CD-CD2 4.29Å; K842-L1165 HydrophobicContact CG-CD2 4.34Å; K842-W1170 HydrophobicContact CB-CE3 3.97Å; K842-W1170 HydrophobicContact CB-CZ3 3.99Å; K842-W1170 HydrophobicContact CD-CD2 4.42Å
843	V	89.8	Confident	88.9	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-57.1	-45.8	175.2	177.4	0	0	0	0	110.9	L822 L824 I832 L839 L840 V845 Q846 G847 W1170	L822-V843 HydrophobicContact CD1-CG1 4.39Å; L824-V843 HydrophobicContact CD1-CG1 4.36Å; L824-V843 HydrophobicContact CD2-CG1 3.76Å; I832-V843 HydrophobicContact CD1-CG2 4.48Å; L839-V843 PolarHBondContact O-N 2.89Å; L839-V843 VanDerWaalsContact O-N 3.08Å; L840-V843 PolarHBondContact O-N 3.32Å; V843-V845 VanDerWaalsContact C-N 3.32Å; V843-V845 PolarHBondContact O-N 3.3Å; V843-Q846 PolarHBondContact O-N 3.44Å; V843-G847 WeakPolarHBondContact O-CA 3.29Å; V843-G847 PolarHBondContact O-N 3.07Å; V843-W1170 HydrophobicContact CG2-CH2 3.65Å; V843-W1170 HydrophobicContact CG2-CZ3 3.9Å
844	L	91.8	Very high	88.6	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-66.5	-28.7	179.8	-70.7	174.3	0	0	0	113.8	R744 F829 L840 K842 F850 L861 E864 L865 L868	R744-L844 VanDerWaalsContact CZ-O 3.29Å; R744-L844 PolarHBondContact NH1-O 2.96Å; R744-L844 PolarHBondContact NH2-O 3.46Å; F829-L844 HydrophobicContact CE2-CD2 4.08Å; L840-L844 HydrophobicContact CD1-CD1 4.02Å; L840-L844 HydrophobicContact CD1-CD2 4.32Å; L840-L844 HydrophobicContact CD1-CG 3.93Å; L840-L844 HydrophobicContact CD2-CD1 4.43Å; L840-L844 HydrophobicContact CG-CD1 3.79Å; L840-L844 HydrophobicContact CG-CG 4.16Å; L840-L844 WeakPolarHBondContact O-CB 3.34Å; L840-L844 VanDerWaalsContact O-CG 3.22Å; L840-L844 WeakPolarHBondContact O-CG 3.3Å; L840-L844 PolarHBondContact O-N 3.45Å; K842-L844 VanDerWaalsContact C-N 3.32Å; K842-L844 PolarHBondContact O-N 2.91Å; L844-F850 HydrophobicContact CD2-CE1 4.37Å; L844-F850 HydrophobicContact CD2-CZ 4.2Å; L844-L861 HydrophobicContact CD2-CD1 3.35Å; L844-E864 HydrophobicContact CD1-CB 3.61Å; L844-L865 HydrophobicContact CB-CD2 4.21Å; L844-L865 HydrophobicContact CD2-CD2 4.43Å; L844-L868 HydrophobicContact CB-CD1 3.74Å; L844-L868 HydrophobicContact CD1-CD1 4.06Å
845	V	90.6	Very high	88.2	Confident	14 Å²	14	35.3 Å²	35.3	9%	0.085	18%	0.178	C	C	.	.	H	α-helix	trans	-75.8	-31.4	177.5	170.2	0	0	0	0	112	R744 P841 K842 V843 L868 F1158 L1161 E1162 L1165	R744-V845 PolarHBondContact NH1-O 3.21Å; R744-V845 VanDerWaalsContact NH1-O 3.14Å; R744-V845 PolarHBondContact NH2-O 2.84Å; R744-V845 VanDerWaalsContact NH2-O 3.15Å; P841-V845 VanDerWaalsContact O-CG2 3.3Å; P841-V845 WeakPolarHBondContact O-CG2 3.42Å; P841-V845 PolarHBondContact O-N 2.93Å; K842-V845 PolarHBondContact O-N 3.28Å; K842-V845 VanDerWaalsContact O-N 3.17Å; V843-V845 VanDerWaalsContact C-N 3.32Å; V843-V845 PolarHBondContact O-N 3.3Å; V845-L868 HydrophobicContact CG2-CD1 4.18Å; V845-F1158 HydrophobicContact CG2-CB 4.44Å; V845-L1161 HydrophobicContact CG2-CB 3.97Å; V845-L1161 HydrophobicContact CG2-CD1 4.15Å; V845-E1162 HydrophobicContact CG1-CG 3.73Å; V845-L1165 HydrophobicContact CB-CD1 4.04Å; V845-L1165 HydrophobicContact CG1-CD1 3.74Å
846	Q	89.4	Confident	87.8	Confident	21 Å²	21	35.4 Å²	35.4	10%	0.098	18%	0.179	C	C	.	.	H	α-helix	trans	-101.6	-16.6	179.7	-64.9	172.4	-51.2	0	0	114.1	L822 K842 V843 T848 L1165 W1170	L822-Q846 HydrophobicContact CD1-CB 3.79Å; L822-Q846 HydrophobicContact CG-CB 3.75Å; L822-Q846 PolarHBondContact N-O 3.41Å; K842-Q846 PolarHBondContact O-N 3.21Å; V843-Q846 PolarHBondContact O-N 3.44Å; Q846-T848 PolarHBondContact O-N 3.07Å; Q846-T848 PolarHBondContact O-OG1 2.89Å; Q846-L1165 HydrophobicContact CG-CD1 3.9Å; Q846-W1170 PolarHBondContact NE2-O 3.37Å; Q846-W1170 PolarHBondContact OE1-O 2.9Å
847	G	91.9	Very high	87.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	113.9	-176.6	0	0	0	0	0	113.7	R744 L822 V843 F850	R744-G847 PolarHBondContact NH2-O 2.88Å; L822-G847 CarbonylContact O-C 3.56Å; V843-G847 WeakPolarHBondContact O-CA 3.29Å; V843-G847 PolarHBondContact O-N 3.07Å; G847-F850 WeakPolarHBondContact O-CE2 3.38Å
848	T	94.6	Very high	87.9	Confident	4 Å²	4	31.6 Å²	31.6	3%	0.025	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	-30.2	-177.7	-56.1	0	0	0	0	111.9	M747 V766 H821 L822 Q846	M747-T848 PolarHBondContact N-O 3.23Å; V766-T848 HydrophobicContact CG2-CG2 3.88Å; H821-T848 PolarHBondContact ND1-OG1 2.92Å; L822-T848 PolarHBondContact O-N 3.35Å; Q846-T848 PolarHBondContact O-N 3.07Å; Q846-T848 PolarHBondContact O-OG1 2.89Å
849	V	95.4	Very high	88	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	119.4	-179.6	-176.8	0	0	0	0	109.2	M747 L753 A756 V757 A760 L822 A823 L824	M747-V849 HydrophobicContact SD-CG1 4.49Å; L753-V849 HydrophobicContact CD1-CG1 4.39Å; A756-V849 HydrophobicContact CB-CG1 3.63Å; V757-V849 HydrophobicContact CG2-CG1 4.34Å; A760-V849 HydrophobicContact CB-CG2 3.66Å; L822-V849 PolarHBondContact O-N 3.44Å; A823-V849 CarbonylContact C-O 3.45Å; A823-V849 VanDerWaalsContact CA-O 3.31Å; A823-V849 WeakPolarHBondContact CA-O 3.48Å; A823-V849 HydrophobicContact CB-CB 3.97Å; L824-V849 PolarHBondContact N-O 2.86Å
850	F	95.4	Very high	88.1	Confident	1 Å²	1	23.1 Å²	23.1	0%	0.004	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	105.8	171.8	-62.4	-99.9	0	0	0	107.4	V746 M747 V748 T749 L824 F829 L844 G847 M853 L861	V746-F850 HydrophobicContact CG1-CD2 3.56Å; V746-F850 HydrophobicContact CG1-CE2 3.58Å; M747-F850 PolarHBondContact O-N 3.27Å; V748-F850 CarbonylContact C-O 3.52Å; V748-F850 WeakPolarHBondContact CA-O 3.41Å; V748-F850 HydrophobicContact CG1-CB 4.42Å; T749-F850 PolarHBondContact N-O 3.36Å; L824-F850 HydrophobicContact CD1-CD1 3.62Å; L824-F850 HydrophobicContact CD1-CE1 3.65Å; L824-F850 HydrophobicContact CD2-CD1 4.07Å; L824-F850 HydrophobicContact CD2-CE1 3.76Å; L824-F850 HydrophobicContact CD2-CZ 4.22Å; L824-F850 HydrophobicContact CG-CD1 3.72Å; L824-F850 HydrophobicContact CG-CE1 3.88Å; L824-F850 WeakPolarHBondContact O-CA 3.17Å; F829-F850 HydrophobicContact CD2-CD1 4.28Å; F829-F850 HydrophobicContact CD2-CE1 4.11Å; F829-F850 HydrophobicContact CE2-CE1 4.3Å; L844-F850 HydrophobicContact CD2-CE1 4.37Å; L844-F850 HydrophobicContact CD2-CZ 4.2Å; G847-F850 WeakPolarHBondContact O-CE2 3.38Å; F850-M853 HydrophobicContact CB-CE 4.35Å; F850-M853 HydrophobicContact CB-CG 3.85Å; F850-M853 HydrophobicContact CB-SD 4.07Å; F850-L861 HydrophobicContact CB-CD2 4.08Å; F850-L861 HydrophobicContact CD1-CD1 4.2Å; F850-L861 HydrophobicContact CD1-CD2 3.97Å; F850-L861 HydrophobicContact CD2-CD2 3.73Å; F850-L861 HydrophobicContact CE1-CD1 3.75Å; F850-L861 HydrophobicContact CE1-CD2 4.31Å; F850-L861 HydrophobicContact CE2-CD1 4.16Å; F850-L861 HydrophobicContact CE2-CD2 4.11Å; F850-L861 HydrophobicContact CG-CD2 3.67Å; F850-L861 HydrophobicContact CZ-CD1 3.75Å; F850-L861 HydrophobicContact CZ-CD2 4.39Å
851	A	89.7	Confident	88.3	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	165.9	-174.2	0	0	0	0	0	111.3	T749 D751 L753 A756 L824 S825 G826 M853	T749-A851 HydrophobicContact CG2-CB 4.26Å; T749-A851 CarbonylContact O-C 2.97Å; T749-A851 VanDerWaalsContact O-C 3.25Å; T749-A851 WeakPolarHBondContact O-CA 3.35Å; D751-A851 WeakPolarHBondContact O-CB 3.46Å; L753-A851 VanDerWaalsContact CA-CB 3.47Å; L753-A851 HydrophobicContact CB-CB 4.02Å; L753-A851 HydrophobicContact CD1-CB 3.67Å; L753-A851 HydrophobicContact CG-CB 4.48Å; A756-A851 HydrophobicContact CB-CB 3.91Å; L824-A851 PolarHBondContact O-N 3.14Å; S825-A851 CarbonylContact C-O 3.58Å; S825-A851 VanDerWaalsContact CA-O 3.25Å; S825-A851 WeakPolarHBondContact CA-O 3.49Å; G826-A851 PolarHBondContact N-O 3.04Å; A851-M853 PolarHBondContact O-N 3.45Å; A851-M853 VanDerWaalsContact O-N 3.16Å
852	R	85.5	Confident	88.4	Confident	95 Å²	95	22.1 Å²	22.1	36%	0.358	11%	0.112	S	C	.	.	S	Bend	trans	49	36.4	-174.2	-59.5	-172.2	176.6	-174.6	-1	113.3	T749 G750 D751 N752 G826	T749-R852 PolarHBondContact O-N 3.12Å; G750-R852 WeakPolarHBondContact O-CA 3.32Å; D751-R852 WeakPolarHBondContact O-CG 3.38Å; D751-R852 PolarHBondContact O-N 3.33Å; N752-R852 PolarHBondContact ND2-NH2 2.93Å; G826-R852 WeakPolarHBondContact CA-O 3.43Å
853	M	85.1	Confident	88.4	Confident	7 Å²	7	20.4 Å²	20.4	3%	0.034	11%	0.105	C	C	.	.			trans	-85.5	128.9	-179.3	-65.2	-71.6	-77.5	0	0	110.6	V748 T749 G826 F829 F850 A851 Q857 K858 L861	V748-M853 HydrophobicContact CG1-CB 4.31Å; V748-M853 HydrophobicContact CG1-CG 4.13Å; T749-M853 PolarHBondContact O-N 3.15Å; G826-M853 VanDerWaalsContact CA-SD 3.55Å; F829-M853 HydrophobicContact CB-SD 4.27Å; F829-M853 HydrophobicContact CD1-CE 3.87Å; F829-M853 HydrophobicContact CD1-SD 4.43Å; F829-M853 HydrophobicContact CE1-CE 4.19Å; F829-M853 HydrophobicContact CG-CE 4.23Å; F829-M853 HydrophobicContact CG-SD 4.44Å; F850-M853 HydrophobicContact CB-CE 4.35Å; F850-M853 HydrophobicContact CB-CG 3.85Å; F850-M853 HydrophobicContact CB-SD 4.07Å; A851-M853 PolarHBondContact O-N 3.45Å; A851-M853 VanDerWaalsContact O-N 3.16Å; M853-Q857 HydrophobicContact CE-CB 3.61Å; M853-Q857 WeakPolarHBondContact CE-O 3.4Å; M853-Q857 HydrophobicContact SD-CB 4.24Å; M853-K858 HydrophobicContact CB-CG 4.16Å; M853-L861 HydrophobicContact CE-CB 4.22Å; M853-L861 HydrophobicContact CE-CD2 4.22Å
854	A	80.4	Confident	88.3	Confident	38 Å²	38	21.8 Å²	21.8	31%	0.314	11%	0.111	S	C	.	.			trans	-71.2	155	167.8	0	0	0	0	0	111.2	E856 Q857 K858	A854-E856 PolarHBondContact O-N 2.97Å; A854-Q857 HydrophobicContact CB-CG 4.13Å; A854-Q857 WeakPolarHBondContact O-CA 3.42Å; A854-Q857 WeakPolarHBondContact O-CB 3.31Å; A854-Q857 PolarHBondContact O-N 3.11Å; A854-K858 WeakPolarHBondContact O-CG 3.38Å; A854-K858 PolarHBondContact O-N 2.86Å
855	P	77.9	Confident	88.3	Confident	49 Å²	49	21.8 Å²	21.8	32%	0.318	11%	0.111	S	C	.	.	H	α-helix	trans	-51	-39.6	179	-29.6	37.4	0	0	0	114.6	K858 T859 N880	P855-K858 WeakPolarHBondContact O-CB 3.29Å; P855-K858 PolarHBondContact O-N 3.03Å; P855-T859 PolarHBondContact O-N 2.79Å; P855-T859 PolarHBondContact O-OG1 3.08Å; P855-N880 WeakPolarHBondContact CB-O 3.4Å; P855-N880 HydrophobicContact CG-CB 4.32Å
856	E	76.9	Confident	88.3	Confident	79 Å²	79	22 Å²	22	37%	0.369	11%	0.111	S	C	.	.	H	α-helix	trans	-65.4	-43	177.9	-58.8	70.4	-149.9	0	0	110.4	A854 K858 T859 E860	A854-E856 PolarHBondContact O-N 2.97Å; E856-K858 VanDerWaalsContact C-N 3.29Å; E856-K858 PolarHBondContact O-N 3.4Å; E856-T859 WeakPolarHBondContact O-CA 3.44Å; E856-T859 WeakPolarHBondContact O-CB 3.39Å; E856-T859 PolarHBondContact O-N 3.18Å; E856-T859 VanDerWaalsContact O-N 3.08Å; E856-E860 WeakPolarHBondContact O-CG 3.27Å; E856-E860 PolarHBondContact O-N 3.35Å
857	Q	86.4	Confident	88	Confident	35 Å²	35	24.4 Å²	24.4	16%	0.164	12%	0.121	C	C	.	.	H	α-helix	trans	-65.4	-32.7	177.9	-59.4	-176.8	-51.5	0	0	112	G826 M853 A854 T859 E860 L861	G826-Q857 PolarHBondContact O-NE2 3.33Å; M853-Q857 HydrophobicContact CE-CB 3.61Å; M853-Q857 WeakPolarHBondContact CE-O 3.4Å; M853-Q857 HydrophobicContact SD-CB 4.24Å; A854-Q857 HydrophobicContact CB-CG 4.13Å; A854-Q857 WeakPolarHBondContact O-CA 3.42Å; A854-Q857 WeakPolarHBondContact O-CB 3.31Å; A854-Q857 PolarHBondContact O-N 3.11Å; Q857-T859 VanDerWaalsContact C-N 3.3Å; Q857-E860 PolarHBondContact O-N 3.33Å; Q857-L861 WeakPolarHBondContact O-CB 3.48Å; Q857-L861 PolarHBondContact O-N 3Å
858	K	88.7	Confident	87.8	Confident	10 Å²	10	24.6 Å²	24.6	4%	0.043	12%	0.122	C	C	.	.	H	α-helix	trans	-61.3	-43.4	172.1	-56.3	-164.7	-174.8	-176.6	0	110.7	D512 V748 M853 A854 P855 E856 L861 V862 D881 A884	D512-K858 IonicContact OD1-NZ 3.56Å; D512-K858 PolarHBondContact OD1-NZ 3.48Å; V748-K858 HydrophobicContact CG1-CB 4.16Å; V748-K858 HydrophobicContact CG1-CD 4.14Å; V748-K858 HydrophobicContact CG1-CG 3.75Å; M853-K858 HydrophobicContact CB-CG 4.16Å; A854-K858 WeakPolarHBondContact O-CG 3.38Å; A854-K858 PolarHBondContact O-N 2.86Å; P855-K858 WeakPolarHBondContact O-CB 3.29Å; P855-K858 PolarHBondContact O-N 3.03Å; E856-K858 VanDerWaalsContact C-N 3.29Å; E856-K858 PolarHBondContact O-N 3.4Å; K858-L861 PolarHBondContact O-N 3.38Å; K858-V862 WeakPolarHBondContact O-CG2 3.41Å; K858-V862 PolarHBondContact O-N 2.78Å; K858-D881 WeakPolarHBondContact CD-OD1 3.31Å; K858-D881 WeakPolarHBondContact CE-OD1 3.42Å; K858-D881 IonicContact NZ-OD1 2.7Å; K858-D881 PolarHBondContact NZ-OD1 2.94Å; K858-D881 IonicContact NZ-OD2 3.12Å; K858-A884 HydrophobicContact CB-CB 4.04Å
859	T	87.3	Confident	87.5	Confident	11 Å²	11	29 Å²	29	7%	0.067	14%	0.143	C	C	.	.	H	α-helix	trans	-65	-45.3	177.3	-54.3	0	0	0	0	111.3	P855 E856 Q857 L861 V862 C863 G883 A884 A887	P855-T859 PolarHBondContact O-N 2.79Å; P855-T859 PolarHBondContact O-OG1 3.08Å; E856-T859 WeakPolarHBondContact O-CA 3.44Å; E856-T859 WeakPolarHBondContact O-CB 3.39Å; E856-T859 PolarHBondContact O-N 3.18Å; E856-T859 VanDerWaalsContact O-N 3.08Å; Q857-T859 VanDerWaalsContact C-N 3.3Å; T859-L861 PolarHBondContact O-N 3.05Å; T859-V862 PolarHBondContact O-N 2.87Å; T859-C863 PolarHBondContact O-N 3.34Å; T859-C863 PolarHBondContact O-SG 3.45Å; T859-G883 VanDerWaalsContact OG1-C 3.22Å; T859-G883 WeakPolarHBondContact OG1-CA 3.43Å; T859-A884 PolarHBondContact OG1-N 2.9Å; T859-A887 HydrophobicContact CG2-CB 3.92Å
860	E	87.3	Confident	87.2	Confident	55 Å²	55	29.7 Å²	29.7	26%	0.257	15%	0.145	S	C	.	.	H	α-helix	trans	-59.9	-43.5	176.1	-71.8	178.1	167.4	0	0	112.3	F829 E856 Q857 V862 C863 E864	F829-E860 HydrophobicContact CE1-CB 4.48Å; E856-E860 WeakPolarHBondContact O-CG 3.27Å; E856-E860 PolarHBondContact O-N 3.35Å; Q857-E860 PolarHBondContact O-N 3.33Å; E860-V862 PolarHBondContact O-N 3.48Å; E860-C863 WeakPolarHBondContact O-CB 3.46Å; E860-C863 PolarHBondContact O-N 2.89Å; E860-E864 WeakPolarHBondContact O-CG 3.16Å; E860-E864 PolarHBondContact O-N 3.3Å
861	L	92.6	Very high	86.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.5	-46.3	176.8	175.4	61.1	0	0	0	111.8	V748 F829 L844 F850 M853 Q857 K858 T859 C863 E864 L865	V748-L861 HydrophobicContact CB-CD2 4.36Å; V748-L861 HydrophobicContact CG1-CD2 3.91Å; V748-L861 HydrophobicContact CG2-CD2 3.48Å; V748-L861 VanDerWaalsContact CG2-CD2 3.48Å; F829-L861 HydrophobicContact CE2-CD1 4.17Å; F829-L861 HydrophobicContact CZ-CB 4.27Å; F829-L861 HydrophobicContact CZ-CD1 4.31Å; L844-L861 HydrophobicContact CD2-CD1 3.35Å; F850-L861 HydrophobicContact CB-CD2 4.08Å; F850-L861 HydrophobicContact CD1-CD1 4.2Å; F850-L861 HydrophobicContact CD1-CD2 3.97Å; F850-L861 HydrophobicContact CD2-CD2 3.73Å; F850-L861 HydrophobicContact CE1-CD1 3.75Å; F850-L861 HydrophobicContact CE1-CD2 4.31Å; F850-L861 HydrophobicContact CE2-CD1 4.16Å; F850-L861 HydrophobicContact CE2-CD2 4.11Å; F850-L861 HydrophobicContact CG-CD2 3.67Å; F850-L861 HydrophobicContact CZ-CD1 3.75Å; F850-L861 HydrophobicContact CZ-CD2 4.39Å; M853-L861 HydrophobicContact CE-CB 4.22Å; M853-L861 HydrophobicContact CE-CD2 4.22Å; Q857-L861 WeakPolarHBondContact O-CB 3.48Å; Q857-L861 PolarHBondContact O-N 3Å; K858-L861 PolarHBondContact O-N 3.38Å; T859-L861 PolarHBondContact O-N 3.05Å; L861-C863 PolarHBondContact O-N 3.4Å; L861-E864 PolarHBondContact O-N 3.31Å; L861-L865 HydrophobicContact CD1-CD1 4.13Å; L861-L865 HydrophobicContact CD1-CG 4.29Å; L861-L865 HydrophobicContact CG-CD1 4.16Å; L861-L865 VanDerWaalsContact O-CG 3.29Å; L861-L865 WeakPolarHBondContact O-CG 3.36Å; L861-L865 PolarHBondContact O-N 3.47Å
862	V	91.6	Very high	87.1	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-59.4	-46.9	176	170	0	0	0	0	110.8	K858 T859 E860 E864 L865 Q866 V872 A884 A887 A888	K858-V862 WeakPolarHBondContact O-CG2 3.41Å; K858-V862 PolarHBondContact O-N 2.78Å; T859-V862 PolarHBondContact O-N 2.87Å; E860-V862 PolarHBondContact O-N 3.48Å; V862-E864 PolarHBondContact O-N 3.18Å; V862-L865 PolarHBondContact O-N 2.93Å; V862-Q866 WeakPolarHBondContact O-CG 3.2Å; V862-Q866 PolarHBondContact O-N 2.82Å; V862-V872 HydrophobicContact CG1-CG1 4.02Å; V862-V872 HydrophobicContact CG2-CG1 4.5Å; V862-A884 HydrophobicContact CG2-CB 4.1Å; V862-A887 HydrophobicContact CG1-CB 4.16Å; V862-A888 HydrophobicContact CG1-CB 4.02Å
863	C	87.7	Confident	87.6	Confident	5 Å²	5	26 Å²	26	3%	0.034	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-42.4	177.8	-73.7	0	0	0	0	112.6	T859 E860 L861 Q866 K867	T859-C863 PolarHBondContact O-N 3.34Å; T859-C863 PolarHBondContact O-SG 3.45Å; E860-C863 WeakPolarHBondContact O-CB 3.46Å; E860-C863 PolarHBondContact O-N 2.89Å; L861-C863 PolarHBondContact O-N 3.4Å; C863-Q866 WeakPolarHBondContact O-CB 3.23Å; C863-Q866 PolarHBondContact O-N 2.85Å; C863-K867 WeakPolarHBondContact O-CG 3.29Å; C863-K867 PolarHBondContact O-N 3.29Å
864	E	89	Confident	88.1	Confident	30 Å²	30	25.8 Å²	25.8	14%	0.14	13%	0.133	C	C	.	.	H	α-helix	trans	-67.1	-36.3	177.6	-71.5	-59.1	143	0	0	112.3	L840 L844 E860 L861 V862 K867 L868	L840-E864 HydrophobicContact CD2-CG 4.29Å; L844-E864 HydrophobicContact CD1-CB 3.61Å; E860-E864 WeakPolarHBondContact O-CG 3.16Å; E860-E864 PolarHBondContact O-N 3.3Å; L861-E864 PolarHBondContact O-N 3.31Å; V862-E864 PolarHBondContact O-N 3.18Å; E864-K867 WeakPolarHBondContact O-CB 3.34Å; E864-K867 PolarHBondContact O-N 3.45Å; E864-K867 IonicContact OE1-NZ 3.67Å; E864-K867 PolarHBondContact OE1-NZ 2.93Å; E864-K867 WeakPolarHBondContact OE2-CD 3.32Å; E864-K867 IonicContact OE2-NZ 3.83Å; E864-L868 PolarHBondContact O-N 3.05Å
865	L	91.9	Very high	88.7	Confident	1 Å²	1	24 Å²	24	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-64.9	-39.8	172.7	-70.7	168.3	0	0	0	111.7	L508 L844 L861 V862 L868 Y870 V872	L508-L865 HydrophobicContact CD1-CD1 4.26Å; L508-L865 HydrophobicContact CD1-CD2 4.09Å; L508-L865 HydrophobicContact CD2-CD1 3.9Å; L844-L865 HydrophobicContact CB-CD2 4.21Å; L844-L865 HydrophobicContact CD2-CD2 4.43Å; L861-L865 HydrophobicContact CD1-CD1 4.13Å; L861-L865 HydrophobicContact CD1-CG 4.29Å; L861-L865 HydrophobicContact CG-CD1 4.16Å; L861-L865 VanDerWaalsContact O-CG 3.29Å; L861-L865 WeakPolarHBondContact O-CG 3.36Å; L861-L865 PolarHBondContact O-N 3.47Å; V862-L865 PolarHBondContact O-N 2.93Å; L865-L868 PolarHBondContact O-N 3.41Å; L865-Y870 HydrophobicContact CD2-CD2 4.35Å; L865-Y870 WeakPolarHBondContact O-CB 3.27Å; L865-Y870 PolarHBondContact O-N 2.96Å; L865-V872 HydrophobicContact CB-CG2 3.7Å
866	Q	89	Confident	89.3	Confident	20 Å²	20	21.6 Å²	21.6	9%	0.093	10%	0.103	C	C	.	.	H	α-helix	trans	-61.8	-42	172.6	-74	169.4	-40	0	0	111.7	V862 C863 L868 Q869 V872 A887 D889	V862-Q866 WeakPolarHBondContact O-CG 3.2Å; V862-Q866 PolarHBondContact O-N 2.82Å; C863-Q866 WeakPolarHBondContact O-CB 3.23Å; C863-Q866 PolarHBondContact O-N 2.85Å; Q866-L868 PolarHBondContact O-N 3.27Å; Q866-L868 VanDerWaalsContact O-N 3.15Å; Q866-Q869 VanDerWaalsContact O-CA 3.24Å; Q866-Q869 WeakPolarHBondContact O-CA 3.4Å; Q866-Q869 PolarHBondContact O-N 2.84Å; Q866-V872 HydrophobicContact CG-CB 4.13Å; Q866-V872 HydrophobicContact CG-CG2 3.84Å; Q866-A887 PolarHBondContact NE2-O 2.91Å; Q866-A887 PolarHBondContact OE1-O 3.35Å; Q866-D889 PolarHBondContact NE2-OD1 3.03Å
867	K	84.6	Confident	89.4	Confident	70 Å²	70	19.9 Å²	19.9	30%	0.304	10%	0.096	S	C	.	.	H	α-helix	trans	-58.8	-27.2	175.1	-71.3	171.2	-169	170.4	0	113.5	C863 E864 Q869	C863-K867 WeakPolarHBondContact O-CG 3.29Å; C863-K867 PolarHBondContact O-N 3.29Å; E864-K867 WeakPolarHBondContact O-CB 3.34Å; E864-K867 PolarHBondContact O-N 3.45Å; E864-K867 IonicContact OE1-NZ 3.67Å; E864-K867 PolarHBondContact OE1-NZ 2.93Å; E864-K867 WeakPolarHBondContact OE2-CD 3.32Å; E864-K867 IonicContact OE2-NZ 3.83Å; K867-Q869 PolarHBondContact O-N 2.89Å
868	L	86.9	Confident	88.4	Confident	5 Å²	5	18.8 Å²	18.8	3%	0.026	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	0.3	172	-60.6	-179.4	0	0	0	113.8	P841 L844 V845 E864 L865 Q866 Y870 R1157 F1158 L1161	P841-L868 HydrophobicContact CB-CD2 3.86Å; P841-L868 HydrophobicContact CG-CD2 4.39Å; L844-L868 HydrophobicContact CB-CD1 3.74Å; L844-L868 HydrophobicContact CD1-CD1 4.06Å; V845-L868 HydrophobicContact CG2-CD1 4.18Å; E864-L868 PolarHBondContact O-N 3.05Å; L865-L868 PolarHBondContact O-N 3.41Å; Q866-L868 PolarHBondContact O-N 3.27Å; Q866-L868 VanDerWaalsContact O-N 3.15Å; L868-Y870 HydrophobicContact CB-CD2 4Å; L868-Y870 HydrophobicContact CB-CE2 4.27Å; L868-Y870 HydrophobicContact CD1-CE2 4.42Å; L868-R1157 HydrophobicContact CD2-CG 4.3Å; L868-F1158 HydrophobicContact CB-CB 4.15Å; L868-F1158 WeakPolarHBondContact O-CD1 3.47Å; L868-F1158 PolarHBondContact O-N 2.9Å; L868-L1161 HydrophobicContact CD2-CD1 4.04Å
869	Q	87.4	Confident	86.9	Confident	97 Å²	97	19.2 Å²	19.2	45%	0.453	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	28.8	-178.9	-52.6	176.3	-45.5	0	0	114.4	Q866 K867 K1156 R1157 F1158	Q866-Q869 VanDerWaalsContact O-CA 3.24Å; Q866-Q869 WeakPolarHBondContact O-CA 3.4Å; Q866-Q869 PolarHBondContact O-N 2.84Å; K867-Q869 PolarHBondContact O-N 2.89Å; Q869-K1156 PolarHBondContact O-NZ 3.49Å; Q869-K1156 VanDerWaalsContact OE1-CA 3.25Å; Q869-R1157 VanDerWaalsContact OE1-N 3.14Å; Q869-F1158 WeakPolarHBondContact O-CE1 3.38Å
870	Y	89.1	Confident	86	Confident	14 Å²	14	22.7 Å²	22.7	6%	0.055	12%	0.118	C	C	.	.			trans	-72.3	148.1	161.9	-76.2	-75.1	0	0	0	110.3	Q507 L508 L865 L868 F1158	Q507-Y870 HydrophobicContact CB-CD1 3.99Å; L508-Y870 HydrophobicContact CB-CD1 4.32Å; L865-Y870 HydrophobicContact CD2-CD2 4.35Å; L865-Y870 WeakPolarHBondContact O-CB 3.27Å; L865-Y870 PolarHBondContact O-N 2.96Å; L868-Y870 HydrophobicContact CB-CD2 4Å; L868-Y870 HydrophobicContact CB-CE2 4.27Å; L868-Y870 HydrophobicContact CD1-CE2 4.42Å; Y870-F1158 HydrophobicContact CD1-CD1 4.02Å; Y870-F1158 HydrophobicContact CD1-CD2 4.17Å; Y870-F1158 HydrophobicContact CD1-CE1 4.16Å; Y870-F1158 HydrophobicContact CD1-CE2 4.34Å; Y870-F1158 HydrophobicContact CD1-CG 4.06Å; Y870-F1158 HydrophobicContact CD1-CZ 4.39Å; Y870-F1158 HydrophobicContact CD2-CB 3.9Å; Y870-F1158 HydrophobicContact CD2-CD1 4.21Å; Y870-F1158 HydrophobicContact CD2-CG 4.07Å; Y870-F1158 HydrophobicContact CE1-CB 4.18Å; Y870-F1158 HydrophobicContact CE1-CD1 4.04Å; Y870-F1158 AromaticContact CE1-CD2 3.39Å; Y870-F1158 HydrophobicContact CE1-CD2 3.39Å; Y870-F1158 HydrophobicContact CE1-CE1 4.3Å; Y870-F1158 AromaticContact CE1-CE2 3.72Å; Y870-F1158 HydrophobicContact CE1-CE2 3.72Å; Y870-F1158 AromaticContact CE1-CG 3.61Å; Y870-F1158 HydrophobicContact CE1-CG 3.61Å; Y870-F1158 HydrophobicContact CE1-CZ 4.21Å; Y870-F1158 HydrophobicContact CE2-CB 3.26Å; Y870-F1158 HydrophobicContact CE2-CD1 4.24Å; Y870-F1158 HydrophobicContact CE2-CD2 4.1Å; Y870-F1158 AromaticContact CE2-CG 3.64Å; Y870-F1158 HydrophobicContact CE2-CG 3.64Å; Y870-F1158 HydrophobicContact CG-CD1 4.1Å; Y870-F1158 HydrophobicContact CG-CG 4.27Å; Y870-F1158 VanDerWaalsContact CZ-CB 3.43Å; Y870-F1158 AromaticContact CZ-CD2 3.34Å; Y870-F1158 AromaticContact CZ-CG 3.38Å; Y870-F1158 WeakPolarHBondContact OH-CD2 3.31Å
871	C	90.3	Very high	85.6	Confident	15 Å²	15	20.1 Å²	20.1	10%	0.101	11%	0.106	C	C	.	.			trans	-91.9	113	158.9	-174.5	0	0	0	0	107.1	K505 Q507 L508 D889	K505-C871 HydrophobicContact CB-CB 4.36Å; K505-C871 WeakPolarHBondContact O-CB 3.36Å; Q507-C871 HydrophobicContact CG-CB 4.13Å; Q507-C871 PolarHBondContact N-O 3.26Å; L508-C871 PolarHBondContact N-O 3.39Å; C871-D889 WeakPolarHBondContact CA-OD2 3.48Å; C871-D889 PolarHBondContact SG-OD2 2.91Å; C871-D889 VanDerWaalsContact SG-OD2 3.34Å
872	V	94	Very high	84.8	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126	-165.4	-176.9	0	0	0	0	109.9	L508 V862 L865 Q866 D889 V890	L508-V872 HydrophobicContact CD2-CG1 4.12Å; V862-V872 HydrophobicContact CG1-CG1 4.02Å; V862-V872 HydrophobicContact CG2-CG1 4.5Å; L865-V872 HydrophobicContact CB-CG2 3.7Å; Q866-V872 HydrophobicContact CG-CB 4.13Å; Q866-V872 HydrophobicContact CG-CG2 3.84Å; V872-D889 PolarHBondContact N-OD2 2.66Å; V872-D889 WeakPolarHBondContact O-CB 3.46Å; V872-D889 PolarHBondContact O-N 3.25Å; V872-V890 PolarHBondContact O-N 2.79Å
873	G	95.3	Very high	84.1	Confident	2 Å²	2	22 Å²	22	2%	0.021	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	151.2	167.3	0	0	0	0	0	110.6	L508 V509 C510 V890	L508-G873 PolarHBondContact O-N 3.08Å; V509-G873 CarbonylContact C-O 3.54Å; V509-G873 WeakPolarHBondContact CA-O 3.27Å; C510-G873 PolarHBondContact N-O 2.91Å; G873-V890 CarbonylContact C-O 3.55Å; G873-V890 WeakPolarHBondContact CA-O 3.31Å
874	M	94.9	Very high	84	Confident	3 Å²	3	21.8 Å²	21.8	2%	0.015	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133.8	169.6	177.5	63.2	-173.9	0	0	108.1	C510 D512 D881 A884 L885 A888 V890 G891 I892	C510-M874 HydrophobicContact CB-SD 3.48Å; C510-M874 WeakPolarHBondContact CB-SD 3.11Å; C510-M874 CarbonylContact O-C 3.44Å; C510-M874 WeakPolarHBondContact O-CA 3.14Å; D512-M874 HydrophobicContact CB-CE 4.4Å; M874-D881 HydrophobicContact CE-CB 3.8Å; M874-D881 WeakPolarHBondContact CE-OD1 3.48Å; M874-A884 HydrophobicContact CE-CB 4.33Å; M874-A884 HydrophobicContact CG-CB 4.06Å; M874-A884 HydrophobicContact SD-CB 4.36Å; M874-L885 HydrophobicContact CB-CD2 4.1Å; M874-L885 HydrophobicContact CG-CD2 3.72Å; M874-L885 HydrophobicContact CG-CG 3.98Å; M874-L885 WeakPolarHBondContact O-CD2 3.49Å; M874-A888 HydrophobicContact CB-CB 3.73Å; M874-V890 PolarHBondContact N-O 2.91Å; M874-G891 CarbonylContact O-C 3.59Å; M874-G891 WeakPolarHBondContact O-CA 3.36Å; M874-I892 PolarHBondContact O-N 3.22Å
875	C	94.4	Very high	83.9	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	125.6	173.1	-172	0	0	0	0	108.8	V509 C510 F511 D512 I892 V915	V509-C875 HydrophobicContact CG1-CB 4.42Å; C510-C875 PolarHBondContact O-N 3.24Å; F511-C875 WeakPolarHBondContact CA-O 3.42Å; F511-C875 HydrophobicContact CD1-CB 3.85Å; F511-C875 HydrophobicContact CE1-CB 3.97Å; D512-C875 PolarHBondContact N-O 2.79Å; C875-I892 WeakPolarHBondContact CA-O 3.49Å; C875-V915 HydrophobicContact CB-CG2 3.99Å
876	G	89.9	Confident	83.3	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	161.4	-176.7	0	0	0	0	0	110.3	T516 I892 S893 L894	T516-G876 WeakPolarHBondContact OG1-CA 3.34Å; G876-I892 PolarHBondContact N-O 3.31Å; G876-S893 CarbonylContact O-C 3.45Å; G876-S893 VanDerWaalsContact O-CA 3.28Å; G876-S893 WeakPolarHBondContact O-CA 3.25Å; G876-L894 PolarHBondContact O-N 2.98Å
877	D	79.2	Confident	83	Confident	42 Å²	42	22 Å²	22	23%	0.225	12%	0.122	C	C	.	.	S	Bend	trans	-104	-25.8	-177.4	60.9	-30.3	0	0	0	112.6	G515 T516 L894 S895	G515-D877 VanDerWaalsContact C-OD2 3.28Å; G515-D877 WeakPolarHBondContact CA-OD2 3.06Å; T516-D877 PolarHBondContact OG1-N 3.47Å; T516-D877 PolarHBondContact OG1-OD1 3.38Å; D877-L894 HydrophobicContact CB-CB 4.26Å; D877-S895 WeakPolarHBondContact O-CB 3.21Å
878	G	65.7	Low	83.2	Confident	12 Å²	12	18.7 Å²	18.7	12%	0.124	11%	0.107	C	C	.	.	S	Bend	trans	-119.1	177.4	-166.1	0	0	0	0	0	118.4	N880 D881	G878-N880 VanDerWaalsContact C-N 3.27Å; G878-N880 PolarHBondContact O-N 2.79Å; G878-D881 PolarHBondContact O-N 2.85Å
879	A	57.1	Low	83.3	Confident	19 Å²	19	20.3 Å²	20.3	16%	0.157	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-55.6	-39.8	173.7	0	0	0	0	0	113.3	T345 D881 C882	T345-A879 HydrophobicContact CG2-CB 3.84Å; T345-A879 WeakPolarHBondContact O-CA 3.45Å; T345-A879 VanDerWaalsContact O-CB 3.32Å; T345-A879 WeakPolarHBondContact O-CB 3.21Å; T345-A879 PolarHBondContact O-N 2.8Å; A879-D881 PolarHBondContact O-N 3.46Å; A879-D881 VanDerWaalsContact O-N 3.09Å; A879-C882 WeakPolarHBondContact O-CB 3.49Å; A879-C882 PolarHBondContact O-N 3.03Å
880	N	69.3	Low	83.5	Confident	84 Å²	84	15.7 Å²	15.7	45%	0.449	10%	0.095	S	C	.	.	G	3₁₀ helix	trans	-62.3	-19.5	-176.1	-63.5	-36.3	0	0	0	112	P855 G878	P855-N880 WeakPolarHBondContact CB-O 3.4Å; P855-N880 HydrophobicContact CG-CB 4.32Å; G878-N880 VanDerWaalsContact C-N 3.27Å; G878-N880 PolarHBondContact O-N 2.79Å
881	D	77.8	Confident	83.7	Confident	2 Å²	2	15 Å²	15	1%	0.011	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-102.7	-3.5	177.5	-59.9	-43.3	0	0	0	113.1	D512 K858 M874 G878 A879 G883 A884 L885	D512-D881 VanDerWaalsContact CB-OD2 3.23Å; D512-D881 WeakPolarHBondContact CB-OD2 3.4Å; K858-D881 WeakPolarHBondContact CD-OD1 3.31Å; K858-D881 WeakPolarHBondContact CE-OD1 3.42Å; K858-D881 IonicContact NZ-OD1 2.7Å; K858-D881 PolarHBondContact NZ-OD1 2.94Å; K858-D881 IonicContact NZ-OD2 3.12Å; M874-D881 HydrophobicContact CE-CB 3.8Å; M874-D881 WeakPolarHBondContact CE-OD1 3.48Å; G878-D881 PolarHBondContact O-N 2.85Å; A879-D881 PolarHBondContact O-N 3.46Å; A879-D881 VanDerWaalsContact O-N 3.09Å; D881-G883 VanDerWaalsContact C-N 3.28Å; D881-G883 PolarHBondContact O-N 3.15Å; D881-A884 CarbonylContact O-C 3.52Å; D881-A884 PolarHBondContact O-N 3.32Å; D881-L885 HydrophobicContact CB-CD1 3.98Å; D881-L885 HydrophobicContact CB-CG 4.11Å; D881-L885 WeakPolarHBondContact O-CB 3.18Å; D881-L885 VanDerWaalsContact O-CG 3.28Å; D881-L885 WeakPolarHBondContact O-CG 3.32Å; D881-L885 PolarHBondContact O-N 3.42Å
882	C	75.2	Confident	83.8	Confident	23 Å²	23	14.5 Å²	14.5	16%	0.155	9%	0.088	C	C	.	.	H	α-helix	trans	-56.3	-42.4	-174.6	-179.4	0	0	0	0	112	A879 K886	A879-C882 WeakPolarHBondContact O-CB 3.49Å; A879-C882 PolarHBondContact O-N 3.03Å; C882-K886 WeakPolarHBondContact O-CB 3.37Å; C882-K886 PolarHBondContact O-N 2.98Å
883	G	77	Confident	83.6	Confident	18 Å²	18	14.7 Å²	14.7	19%	0.186	9%	0.089	C	C	.	.	H	α-helix	trans	-60.8	-46.5	174.9	0	0	0	0	0	112.6	T859 D881 K886 A887	T859-G883 VanDerWaalsContact OG1-C 3.22Å; T859-G883 WeakPolarHBondContact OG1-CA 3.43Å; D881-G883 VanDerWaalsContact C-N 3.28Å; D881-G883 PolarHBondContact O-N 3.15Å; G883-K886 PolarHBondContact O-N 3.29Å; G883-A887 VanDerWaalsContact O-CB 3.32Å; G883-A887 WeakPolarHBondContact O-CB 3.49Å; G883-A887 PolarHBondContact O-N 2.91Å
884	A	85.4	Confident	83.2	Confident	0 Å²	0	15 Å²	15	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-69.7	-42.3	-179.9	0	0	0	0	0	112.6	K858 T859 V862 M874 D881 K886 A887 A888	K858-A884 HydrophobicContact CB-CB 4.04Å; T859-A884 PolarHBondContact OG1-N 2.9Å; V862-A884 HydrophobicContact CG2-CB 4.1Å; M874-A884 HydrophobicContact CE-CB 4.33Å; M874-A884 HydrophobicContact CG-CB 4.06Å; M874-A884 HydrophobicContact SD-CB 4.36Å; D881-A884 CarbonylContact O-C 3.52Å; D881-A884 PolarHBondContact O-N 3.32Å; A884-K886 VanDerWaalsContact C-N 3.29Å; A884-K886 PolarHBondContact O-N 3.47Å; A884-A887 PolarHBondContact O-N 3.33Å; A884-A888 WeakPolarHBondContact O-CB 3.17Å; A884-A888 PolarHBondContact O-N 3.41Å
885	L	87.3	Confident	82.3	Confident	5 Å²	5	16.2 Å²	16.2	3%	0.026	10%	0.099	C	C	.	.	H	α-helix	trans	-59.1	-41.2	174.7	-74.8	168.8	0	0	0	111.4	M874 D881 G891 I892	M874-L885 HydrophobicContact CB-CD2 4.1Å; M874-L885 HydrophobicContact CG-CD2 3.72Å; M874-L885 HydrophobicContact CG-CG 3.98Å; M874-L885 WeakPolarHBondContact O-CD2 3.49Å; D881-L885 HydrophobicContact CB-CD1 3.98Å; D881-L885 HydrophobicContact CB-CG 4.11Å; D881-L885 WeakPolarHBondContact O-CB 3.18Å; D881-L885 VanDerWaalsContact O-CG 3.28Å; D881-L885 WeakPolarHBondContact O-CG 3.32Å; D881-L885 PolarHBondContact O-N 3.42Å; L885-G891 WeakPolarHBondContact O-CA 3.43Å; L885-I892 WeakPolarHBondContact CD2-O 3.23Å
886	K	80.2	Confident	80.8	Confident	43 Å²	43	22.2 Å²	22.2	19%	0.187	13%	0.127	C	C	.	.	H	α-helix	trans	-70.5	-42	176.6	-177.5	-173.9	176	-174.9	0	112.5	S409 C882 G883 A884 V902	S409-K886 PolarHBondContact OG-NZ 3.13Å; C882-K886 WeakPolarHBondContact O-CB 3.37Å; C882-K886 PolarHBondContact O-N 2.98Å; G883-K886 PolarHBondContact O-N 3.29Å; A884-K886 VanDerWaalsContact C-N 3.29Å; A884-K886 PolarHBondContact O-N 3.47Å; K886-V902 HydrophobicContact CB-CG1 4.02Å; K886-V902 HydrophobicContact CD-CG1 3.86Å; K886-V902 HydrophobicContact CG-CG1 4Å
887	A	82	Confident	79.5	Confident	7 Å²	7	23.2 Å²	23.2	6%	0.058	14%	0.136	C	C	.	.	H	α-helix	trans	-69.7	-33.1	-178.7	0	0	0	0	0	112.5	T859 V862 Q866 G883 A884	T859-A887 HydrophobicContact CG2-CB 3.92Å; V862-A887 HydrophobicContact CG1-CB 4.16Å; Q866-A887 PolarHBondContact NE2-O 2.91Å; Q866-A887 PolarHBondContact OE1-O 3.35Å; G883-A887 VanDerWaalsContact O-CB 3.32Å; G883-A887 WeakPolarHBondContact O-CB 3.49Å; G883-A887 PolarHBondContact O-N 2.91Å; A884-A887 PolarHBondContact O-N 3.33Å
888	A	89	Confident	78.4	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.008	15%	0.146	C	C	.	.	S	Bend	trans	-60.1	150.9	179	0	0	0	0	0	112.6	R499 V862 M874 A884 V890	R499-A888 PolarHBondContact NH1-O 2.92Å; V862-A888 HydrophobicContact CG1-CB 4.02Å; M874-A888 HydrophobicContact CB-CB 3.73Å; A884-A888 WeakPolarHBondContact O-CB 3.17Å; A884-A888 PolarHBondContact O-N 3.41Å; A888-V890 PolarHBondContact O-N 2.86Å
889	D	88.9	Confident	77.8	Confident	40 Å²	40	25.4 Å²	25.4	21%	0.214	14%	0.143	C	C	.	.	S	Bend	trans	-61.3	-38.3	173.6	-57.3	-41.6	0	0	0	110	R499 Q866 C871 V872	R499-D889 PolarHBondContact NH1-O 3.34Å; Q866-D889 PolarHBondContact NE2-OD1 3.03Å; C871-D889 WeakPolarHBondContact CA-OD2 3.48Å; C871-D889 PolarHBondContact SG-OD2 2.91Å; C871-D889 VanDerWaalsContact SG-OD2 3.34Å; V872-D889 PolarHBondContact N-OD2 2.66Å; V872-D889 WeakPolarHBondContact O-CB 3.46Å; V872-D889 PolarHBondContact O-N 3.25Å
890	V	91.9	Very high	77.8	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	95.5	177.5	-179.4	0	0	0	0	109.2	L502 L506 V872 G873 M874 A888 I892 F905 V918	L502-V890 HydrophobicContact CB-CG2 3.93Å; L506-V890 HydrophobicContact CD1-CB 4.05Å; L506-V890 HydrophobicContact CD1-CG1 4.04Å; L506-V890 HydrophobicContact CD1-CG2 4.28Å; L506-V890 HydrophobicContact CD2-CB 4.07Å; L506-V890 HydrophobicContact CD2-CG2 4.14Å; L506-V890 HydrophobicContact CG-CB 4.36Å; L506-V890 HydrophobicContact CG-CG2 4.21Å; V872-V890 PolarHBondContact O-N 2.79Å; G873-V890 CarbonylContact C-O 3.55Å; G873-V890 WeakPolarHBondContact CA-O 3.31Å; M874-V890 PolarHBondContact N-O 2.91Å; A888-V890 PolarHBondContact O-N 2.86Å; V890-I892 HydrophobicContact CG1-CD1 4.38Å; V890-I892 HydrophobicContact CG1-CG1 4.19Å; V890-F905 HydrophobicContact CG1-CD2 3.76Å; V890-F905 HydrophobicContact CG1-CE2 3.67Å; V890-V918 HydrophobicContact CG1-CG1 4.21Å
891	G	91.9	Very high	77.3	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	133.6	168.9	0	0	0	0	0	111.5	M874 L885 P904 F905	M874-G891 CarbonylContact O-C 3.59Å; M874-G891 WeakPolarHBondContact O-CA 3.36Å; L885-G891 WeakPolarHBondContact O-CA 3.43Å; G891-P904 WeakPolarHBondContact O-CD 3.4Å; G891-F905 PolarHBondContact O-N 3.38Å; G891-F905 VanDerWaalsContact O-N 3.15Å
892	I	92.5	Very high	76.7	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.015	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	110.4	178	-55.3	169.8	0	0	0	108.8	M874 C875 G876 L885 V890 F905 V915 V918	M874-I892 PolarHBondContact O-N 3.22Å; C875-I892 WeakPolarHBondContact CA-O 3.49Å; G876-I892 PolarHBondContact N-O 3.31Å; L885-I892 WeakPolarHBondContact CD2-O 3.23Å; V890-I892 HydrophobicContact CG1-CD1 4.38Å; V890-I892 HydrophobicContact CG1-CG1 4.19Å; I892-F905 CarbonylContact C-O 3.48Å; I892-F905 WeakPolarHBondContact CA-O 3.47Å; I892-F905 HydrophobicContact CB-CB 4.44Å; I892-F905 HydrophobicContact CG1-CB 4.07Å; I892-F905 HydrophobicContact CG1-CD2 4.45Å; I892-F905 HydrophobicContact CG2-CB 4.42Å; I892-V915 HydrophobicContact CD1-CB 4.44Å; I892-V915 HydrophobicContact CD1-CG2 3.99Å; I892-V918 HydrophobicContact CD1-CB 4.17Å; I892-V918 HydrophobicContact CD1-CG1 4.25Å; I892-V918 HydrophobicContact CD1-CG2 4.18Å
893	S	90.3	Very high	76.8	Confident	4 Å²	4	22.9 Å²	22.9	3%	0.028	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	138.6	172.7	-176.5	0	0	0	0	111.3	G876 S895 S900 S903 F905 S907	G876-S893 CarbonylContact O-C 3.45Å; G876-S893 VanDerWaalsContact O-CA 3.28Å; G876-S893 WeakPolarHBondContact O-CA 3.25Å; S893-S895 PolarHBondContact OG-N 3.45Å; S893-S895 PolarHBondContact OG-O 2.83Å; S893-S900 VanDerWaalsContact OG-CB 3.27Å; S893-S900 WeakPolarHBondContact OG-CB 3.42Å; S893-S903 VanDerWaalsContact CB-OG 3.22Å; S893-S903 WeakPolarHBondContact CB-OG 3.45Å; S893-F905 PolarHBondContact N-O 2.87Å; S893-S907 PolarHBondContact O-N 3.12Å
894	L	87.5	Confident	77	Confident	9 Å²	9	22.4 Å²	22.4	5%	0.047	12%	0.122	C	C	.	.	S	Bend	trans	-94.6	1.3	176.9	-59.8	-178.3	0	0	0	113.9	T516 G876 D877 S911 I912 C914	T516-L894 HydrophobicContact CG2-CD1 3.97Å; G876-L894 PolarHBondContact O-N 2.98Å; D877-L894 HydrophobicContact CB-CB 4.26Å; L894-S911 WeakPolarHBondContact CD2-O 3.17Å; L894-I912 HydrophobicContact CD1-CG2 4.14Å; L894-C914 WeakPolarHBondContact CD2-SG 3.18Å
895	S	75.1	Confident	77.1	Confident	28 Å²	28	22.4 Å²	22.4	20%	0.196	12%	0.122	C	C	.	.			trans	-113.1	147.5	178	174.3	0	0	0	0	110.5	G346 D877 S893 A897 S900 T906	G346-S895 PolarHBondContact O-OG 3.42Å; D877-S895 WeakPolarHBondContact O-CB 3.21Å; S893-S895 PolarHBondContact OG-N 3.45Å; S893-S895 PolarHBondContact OG-O 2.83Å; S895-A897 PolarHBondContact OG-N 3.26Å; S895-S900 WeakPolarHBondContact O-CB 3.37Å; S895-S900 PolarHBondContact O-OG 2.66Å; S895-T906 WeakPolarHBondContact O-CG2 3.25Å
896	Q	64.4	Low	77.2	Confident	126 Å²	126	22.8 Å²	22.8	59%	0.589	13%	0.125	S	C	*	.			trans	-90.2	-1.1	176.6	-69.7	-161.1	-34.7	0	0	114.5
897	A	61.3	Low	77.7	Confident	22 Å²	22	20.8 Å²	20.8	18%	0.182	12%	0.116	C	C	.	.	S	Bend	trans	-67.3	161.9	-172.1	0	0	0	0	0	113.3	S342 S895 A899 S900	S342-A897 WeakPolarHBondContact O-CB 3.45Å; S895-A897 PolarHBondContact OG-N 3.26Å; A897-A899 PolarHBondContact O-N 2.95Å; A897-A899 VanDerWaalsContact O-N 3.08Å; A897-S900 WeakPolarHBondContact O-CA 3.48Å; A897-S900 WeakPolarHBondContact O-CB 3.3Å; A897-S900 PolarHBondContact O-N 2.96Å; A897-S900 PolarHBondContact O-OG 3.41Å
898	E	57.4	Low	77.8	Confident	91 Å²	91	23.1 Å²	23.1	43%	0.425	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-56.7	-32.7	-172.3	-63.2	-175.9	166.8	0	0	113.4	S343 K403 S900 V901	S343-E898 VanDerWaalsContact CB-OE2 3.3Å; S343-E898 WeakPolarHBondContact CB-OE2 3.2Å; S343-E898 VanDerWaalsContact O-CB 3.31Å; S343-E898 WeakPolarHBondContact O-CB 3.31Å; K403-E898 IonicContact NZ-OE2 2.81Å; E898-S900 PolarHBondContact O-N 3.45Å; E898-V901 VanDerWaalsContact O-CB 3.23Å; E898-V901 WeakPolarHBondContact O-CB 3.43Å; E898-V901 WeakPolarHBondContact O-CG2 3.39Å; E898-V901 PolarHBondContact O-N 3.38Å; E898-V901 VanDerWaalsContact O-N 3.15Å
899	A	52.3	Low	77.6	Confident	8 Å²	8	26.4 Å²	26.4	7%	0.066	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-58.9	-32.9	173.6	0	0	0	0	0	113.8	S343 L344 A897 V901 V902	S343-A899 PolarHBondContact O-N 3.04Å; S343-A899 VanDerWaalsContact O-N 3.12Å; L344-A899 WeakPolarHBondContact O-CB 3.41Å; A897-A899 PolarHBondContact O-N 2.95Å; A897-A899 VanDerWaalsContact O-N 3.08Å; A899-V901 PolarHBondContact O-N 3.49Å; A899-V902 WeakPolarHBondContact O-CG2 3.38Å; A899-V902 PolarHBondContact O-N 3.41Å
900	S	56.8	Low	77.4	Confident	9 Å²	9	27.1 Å²	27.1	6%	0.063	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-68.9	-17.1	179.7	76.3	0	0	0	0	113.3	S893 S895 A897 E898 V902 S903 T906	S893-S900 VanDerWaalsContact OG-CB 3.27Å; S893-S900 WeakPolarHBondContact OG-CB 3.42Å; S895-S900 WeakPolarHBondContact O-CB 3.37Å; S895-S900 PolarHBondContact O-OG 2.66Å; A897-S900 WeakPolarHBondContact O-CA 3.48Å; A897-S900 WeakPolarHBondContact O-CB 3.3Å; A897-S900 PolarHBondContact O-N 2.96Å; A897-S900 PolarHBondContact O-OG 3.41Å; E898-S900 PolarHBondContact O-N 3.45Å; S900-V902 PolarHBondContact O-N 3.44Å; S900-V902 VanDerWaalsContact O-N 3.14Å; S900-S903 WeakPolarHBondContact O-CB 3.38Å; S900-S903 PolarHBondContact O-N 2.97Å; S900-S903 PolarHBondContact O-OG 3.34Å; S900-T906 PolarHBondContact O-OG1 3.45Å; S900-T906 WeakPolarHBondContact OG-CG2 3.34Å
901	V	59	Low	77.2	Confident	45 Å²	45	27.7 Å²	27.7	27%	0.273	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-63.8	-18.4	179.2	-178.5	0	0	0	0	111.7	I410 I495 E898 A899 S903	I410-V901 HydrophobicContact CD1-CG1 3.9Å; I495-V901 HydrophobicContact CD1-CB 4.48Å; I495-V901 HydrophobicContact CD1-CG1 3.82Å; I495-V901 WeakPolarHBondContact CD1-O 3.34Å; E898-V901 VanDerWaalsContact O-CB 3.23Å; E898-V901 WeakPolarHBondContact O-CB 3.43Å; E898-V901 WeakPolarHBondContact O-CG2 3.39Å; E898-V901 PolarHBondContact O-N 3.38Å; E898-V901 VanDerWaalsContact O-N 3.15Å; A899-V901 PolarHBondContact O-N 3.49Å; V901-S903 VanDerWaalsContact C-N 3.26Å; V901-S903 PolarHBondContact O-N 2.92Å
902	V	64.6	Low	77.3	Confident	19 Å²	19	27.8 Å²	27.8	12%	0.115	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-72.9	-25.1	176.2	-171.8	0	0	0	0	111.2	L406 K886 A899 S900	L406-V902 HydrophobicContact CB-CG2 4.05Å; L406-V902 HydrophobicContact CD1-CG2 4.21Å; L406-V902 HydrophobicContact CD2-CG1 4.48Å; L406-V902 HydrophobicContact CD2-CG2 3.61Å; L406-V902 HydrophobicContact CG-CG2 4.14Å; K886-V902 HydrophobicContact CB-CG1 4.02Å; K886-V902 HydrophobicContact CD-CG1 3.86Å; K886-V902 HydrophobicContact CG-CG1 4Å; A899-V902 WeakPolarHBondContact O-CG2 3.38Å; A899-V902 PolarHBondContact O-N 3.41Å; S900-V902 PolarHBondContact O-N 3.44Å; S900-V902 VanDerWaalsContact O-N 3.14Å
903	S	76.7	Confident	77.4	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.021	18%	0.18	C	C	.	.	S	Bend	trans	-77	140.8	177.4	75.3	0	0	0	0	111.2	S893 S900 V901 F905	S893-S903 VanDerWaalsContact CB-OG 3.22Å; S893-S903 WeakPolarHBondContact CB-OG 3.45Å; S900-S903 WeakPolarHBondContact O-CB 3.38Å; S900-S903 PolarHBondContact O-N 2.97Å; S900-S903 PolarHBondContact O-OG 3.34Å; V901-S903 VanDerWaalsContact C-N 3.26Å; V901-S903 PolarHBondContact O-N 2.92Å; S903-F905 PolarHBondContact O-N 3.43Å; S903-F905 PolarHBondContact OG-O 3.31Å
904	P	81.3	Confident	77.5	Confident	8 Å²	8	31 Å²	31	5%	0.052	18%	0.178	C	C	.	.	S	Bend	trans	-56.7	-32.8	175.8	-31.9	38.1	0	0	0	115.5	C494 I495 R499 G891	C494-P904 WeakPolarHBondContact CA-O 3.36Å; I495-P904 PolarHBondContact N-O 3.07Å; I495-P904 VanDerWaalsContact N-O 3.15Å; R499-P904 HydrophobicContact CB-CB 4.47Å; R499-P904 VanDerWaalsContact CD-CB 3.42Å; G891-P904 WeakPolarHBondContact O-CD 3.4Å
905	F	89.3	Confident	77.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.9	-178	-63.8	-87.2	0	0	0	110	L487 I492 F493 C494 R499 I500 V890 G891 I892 S893 S903 V918	L487-F905 HydrophobicContact CD1-CE1 4.11Å; I492-F905 HydrophobicContact CG2-CD1 4.22Å; F493-F905 CarbonylContact O-C 3.54Å; F493-F905 VanDerWaalsContact O-CA 3.26Å; F493-F905 WeakPolarHBondContact O-CA 3.45Å; C494-F905 HydrophobicContact CB-CD1 3.72Å; C494-F905 HydrophobicContact CB-CE1 3.61Å; C494-F905 HydrophobicContact CB-CZ 4.47Å; C494-F905 WeakPolarHBondContact SG-CE1 3.27Å; R499-F905 HydrophobicContact CB-CE2 4.08Å; R499-F905 HydrophobicContact CB-CZ 4.35Å; I500-F905 HydrophobicContact CB-CZ 4.48Å; I500-F905 HydrophobicContact CG1-CE1 3.85Å; I500-F905 HydrophobicContact CG1-CZ 3.89Å; V890-F905 HydrophobicContact CG1-CD2 3.76Å; V890-F905 HydrophobicContact CG1-CE2 3.67Å; G891-F905 PolarHBondContact O-N 3.38Å; G891-F905 VanDerWaalsContact O-N 3.15Å; I892-F905 CarbonylContact C-O 3.48Å; I892-F905 WeakPolarHBondContact CA-O 3.47Å; I892-F905 HydrophobicContact CB-CB 4.44Å; I892-F905 HydrophobicContact CG1-CB 4.07Å; I892-F905 HydrophobicContact CG1-CD2 4.45Å; I892-F905 HydrophobicContact CG2-CB 4.42Å; S893-F905 PolarHBondContact N-O 2.87Å; S903-F905 PolarHBondContact O-N 3.43Å; S903-F905 PolarHBondContact OG-O 3.31Å; F905-V918 HydrophobicContact CD1-CG2 4.29Å; F905-V918 HydrophobicContact CE1-CG1 4.32Å; F905-V918 HydrophobicContact CE2-CG1 4.43Å; F905-V918 HydrophobicContact CZ-CG1 4.28Å
906	T	89.4	Confident	78.8	Confident	13 Å²	13	30.1 Å²	30.1	8%	0.08	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.7	175.8	-49.8	0	0	0	0	108.4	I492 F493 S895 S900	I492-T906 CarbonylContact C-O 3.59Å; I492-T906 WeakPolarHBondContact CA-O 3.48Å; F493-T906 PolarHBondContact N-O 3.01Å; F493-T906 PolarHBondContact O-N 3.01Å; S895-T906 WeakPolarHBondContact O-CG2 3.25Å; S900-T906 PolarHBondContact O-OG1 3.45Å; S900-T906 WeakPolarHBondContact OG-CG2 3.34Å
907	S	89.2	Confident	80.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	138.1	173.4	-164.3	0	0	0	0	110.4	G491 S893 M909	G491-S907 CarbonylContact O-C 3.57Å; G491-S907 WeakPolarHBondContact O-CA 3.42Å; S893-S907 PolarHBondContact O-N 3.12Å; S907-M909 PolarHBondContact OG-N 2.98Å; S907-M909 PolarHBondContact OG-O 3.28Å
908	S	84.8	Confident	81.9	Confident	57 Å²	57	25.3 Å²	25.3	40%	0.399	15%	0.147	S	C	.	.	S	Bend	trans	-76.8	-12.4	167.4	64.6	0	0	0	0	113	G491	G491-S908 WeakPolarHBondContact CA-OG 3.46Å; G491-S908 PolarHBondContact O-N 3.48Å; G491-S908 PolarHBondContact O-OG 2.77Å
909	M	84.8	Confident	83.7	Confident	69 Å²	69	21 Å²	21	34%	0.34	13%	0.127	S	C	.	.	S	Bend	trans	-102.6	126.6	-179.8	-61	178.6	-63.9	0	0	108.4	Q490 S907 S911	Q490-M909 VanDerWaalsContact O-CE 3.24Å; Q490-M909 WeakPolarHBondContact O-CE 3.35Å; S907-M909 PolarHBondContact OG-N 2.98Å; S907-M909 PolarHBondContact OG-O 3.28Å; M909-S911 PolarHBondContact O-N 2.93Å
910	A	84.3	Confident	85.7	Confident	55 Å²	55	23.8 Å²	23.8	46%	0.455	14%	0.136	S	C	.	.	S	Bend	trans	-76.1	49.4	175.6	0	0	0	0	0	112.1	K728	K728-A910 PolarHBondContact NZ-O 3Å
911	S	88.9	Confident	87.5	Confident	13 Å²	13	23.5 Å²	23.5	9%	0.091	13%	0.134	C	C	.	.	S	Bend	trans	-139	138.2	-174.7	172.3	0	0	0	0	111.7	L894 M909 E913 C914	L894-S911 WeakPolarHBondContact CD2-O 3.17Å; M909-S911 PolarHBondContact O-N 2.93Å; S911-E913 PolarHBondContact O-N 2.89Å; S911-E913 VanDerWaalsContact O-N 3.12Å; S911-E913 WeakPolarHBondContact OG-CG 3.45Å; S911-E913 PolarHBondContact OG-N 2.93Å; S911-C914 PolarHBondContact O-SG 3.27Å
912	I	93.5	Very high	89.1	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-2	179	65.1	165.6	0	0	0	113.8	F511 T516 L517 T731 V734 I735 L894 C914 V915 P916	F511-I912 HydrophobicContact CD1-CG2 4.18Å; F511-I912 HydrophobicContact CE1-CB 4.2Å; F511-I912 HydrophobicContact CE1-CD1 4.35Å; F511-I912 HydrophobicContact CE1-CG2 4.15Å; T516-I912 HydrophobicContact CG2-CG2 3.84Å; T516-I912 WeakPolarHBondContact O-CG2 3.47Å; L517-I912 HydrophobicContact CD2-CD1 3.92Å; T731-I912 HydrophobicContact CG2-CD1 4.13Å; V734-I912 HydrophobicContact CB-CD1 3.83Å; V734-I912 HydrophobicContact CB-CG1 4Å; V734-I912 HydrophobicContact CG1-CD1 3.75Å; V734-I912 HydrophobicContact CG1-CG1 3.94Å; V734-I912 HydrophobicContact CG2-CG1 4.21Å; I735-I912 HydrophobicContact CD1-CD1 4.3Å; I735-I912 HydrophobicContact CG1-CD1 4.44Å; L894-I912 HydrophobicContact CD1-CG2 4.14Å; I912-C914 PolarHBondContact O-N 2.94Å; I912-C914 VanDerWaalsContact O-N 3.16Å; I912-V915 WeakPolarHBondContact O-CB 3.47Å; I912-V915 WeakPolarHBondContact O-CG2 3.14Å; I912-V915 PolarHBondContact O-N 3.43Å; I912-P916 WeakPolarHBondContact O-CD 3.44Å
913	E	93.8	Very high	90.5	Very high	74 Å²	74	20.8 Å²	20.8	35%	0.346	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.2	173	-71.6	-176.5	153.7	0	0	113	Q730 V734 S911 V915 P916 M917	Q730-E913 HydrophobicContact CB-CG 3.85Å; Q730-E913 HydrophobicContact CG-CG 4.15Å; Q730-E913 WeakPolarHBondContact CG-OE1 3.41Å; V734-E913 HydrophobicContact CG2-CB 4.48Å; V734-E913 HydrophobicContact CG2-CG 3.82Å; S911-E913 PolarHBondContact O-N 2.89Å; S911-E913 VanDerWaalsContact O-N 3.12Å; S911-E913 WeakPolarHBondContact OG-CG 3.45Å; S911-E913 PolarHBondContact OG-N 2.93Å; E913-V915 PolarHBondContact O-N 3.1Å; E913-P916 WeakPolarHBondContact O-CD 3.34Å; E913-P916 VanDerWaalsContact O-CG 3.28Å; E913-P916 WeakPolarHBondContact O-CG 3.45Å; E913-M917 HydrophobicContact CB-CE 4.13Å; E913-M917 WeakPolarHBondContact O-CG 3.17Å; E913-M917 PolarHBondContact O-N 3.27Å
914	C	93.2	Very high	91.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.7	-29.5	173.5	64	0	0	0	0	112.6	I492 L894 S911 I912 M917 V918	I492-C914 HydrophobicContact CD1-CB 3.66Å; I492-C914 HydrophobicContact CG1-CB 4.1Å; L894-C914 WeakPolarHBondContact CD2-SG 3.18Å; S911-C914 PolarHBondContact O-SG 3.27Å; I912-C914 PolarHBondContact O-N 2.94Å; I912-C914 VanDerWaalsContact O-N 3.16Å; C914-M917 WeakPolarHBondContact O-CB 3.47Å; C914-M917 PolarHBondContact O-N 2.89Å; C914-V918 VanDerWaalsContact O-CG2 3.3Å; C914-V918 WeakPolarHBondContact O-CG2 3.33Å; C914-V918 PolarHBondContact O-N 3.11Å
915	V	95.3	Very high	91.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.6	-57.4	-177.9	178.8	0	0	0	0	112.2	V509 F511 L738 C875 I892 I912 E913 M917 V918 I919	V509-V915 HydrophobicContact CG1-CG1 4.22Å; V509-V915 HydrophobicContact CG2-CG1 4.14Å; F511-V915 HydrophobicContact CE1-CG2 3.94Å; F511-V915 HydrophobicContact CZ-CG1 4.26Å; F511-V915 HydrophobicContact CZ-CG2 4.33Å; L738-V915 HydrophobicContact CD1-CG1 4.38Å; C875-V915 HydrophobicContact CB-CG2 3.99Å; I892-V915 HydrophobicContact CD1-CB 4.44Å; I892-V915 HydrophobicContact CD1-CG2 3.99Å; I912-V915 WeakPolarHBondContact O-CB 3.47Å; I912-V915 WeakPolarHBondContact O-CG2 3.14Å; I912-V915 PolarHBondContact O-N 3.43Å; E913-V915 PolarHBondContact O-N 3.1Å; V915-M917 PolarHBondContact O-N 3.4Å; V915-V918 PolarHBondContact O-N 3.15Å; V915-I919 HydrophobicContact CG1-CD1 3.85Å; V915-I919 WeakPolarHBondContact O-CD1 3.44Å; V915-I919 VanDerWaalsContact O-CG1 3.3Å; V915-I919 WeakPolarHBondContact O-CG1 3.35Å; V915-I919 PolarHBondContact O-N 2.86Å
916	P	94.9	Very high	91.9	Very high	20 Å²	20	20.3 Å²	20.3	13%	0.13	11%	0.113	C	C	.	.	H	α-helix	trans	-62.8	-29.7	175.6	24	-33.7	0	0	0	112.9	V734 I912 E913 I919 R920 L986	V734-P916 HydrophobicContact CG1-CG 4.13Å; V734-P916 HydrophobicContact CG2-CG 4.41Å; I912-P916 WeakPolarHBondContact O-CD 3.44Å; E913-P916 WeakPolarHBondContact O-CD 3.34Å; E913-P916 VanDerWaalsContact O-CG 3.28Å; E913-P916 WeakPolarHBondContact O-CG 3.45Å; P916-I919 PolarHBondContact O-N 3.1Å; P916-R920 WeakPolarHBondContact O-CB 3.49Å; P916-R920 WeakPolarHBondContact O-CD 3.47Å; P916-R920 WeakPolarHBondContact O-CG 3.47Å; P916-R920 PolarHBondContact O-N 3.26Å; P916-L986 HydrophobicContact CB-CD2 4.5Å
917	M	94.4	Very high	92	Very high	47 Å²	47	20.8 Å²	20.8	23%	0.232	12%	0.115	C	C	.	.	H	α-helix	trans	-63.8	-49.4	174	-65.8	177.2	-167.1	0	0	111.6	I492 E913 C914 V915 I919 R920 E921	I492-M917 HydrophobicContact CD1-CB 4.06Å; I492-M917 HydrophobicContact CD1-SD 4.21Å; E913-M917 HydrophobicContact CB-CE 4.13Å; E913-M917 WeakPolarHBondContact O-CG 3.17Å; E913-M917 PolarHBondContact O-N 3.27Å; C914-M917 WeakPolarHBondContact O-CB 3.47Å; C914-M917 PolarHBondContact O-N 2.89Å; V915-M917 PolarHBondContact O-N 3.4Å; M917-I919 VanDerWaalsContact C-N 3.32Å; M917-I919 PolarHBondContact O-N 2.82Å; M917-R920 PolarHBondContact O-N 2.87Å; M917-E921 PolarHBondContact O-N 3.33Å
918	V	95.3	Very high	92.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.7	-41.7	176.1	169.9	0	0	0	0	111.1	L487 I492 V890 I892 F905 C914 V915 G922	L487-V918 HydrophobicContact CD2-CG2 4.32Å; I492-V918 HydrophobicContact CD1-CG2 4.23Å; I492-V918 HydrophobicContact CG2-CG2 4.03Å; V890-V918 HydrophobicContact CG1-CG1 4.21Å; I892-V918 HydrophobicContact CD1-CB 4.17Å; I892-V918 HydrophobicContact CD1-CG1 4.25Å; I892-V918 HydrophobicContact CD1-CG2 4.18Å; F905-V918 HydrophobicContact CD1-CG2 4.29Å; F905-V918 HydrophobicContact CE1-CG1 4.32Å; F905-V918 HydrophobicContact CE2-CG1 4.43Å; F905-V918 HydrophobicContact CZ-CG1 4.28Å; C914-V918 VanDerWaalsContact O-CG2 3.3Å; C914-V918 WeakPolarHBondContact O-CG2 3.33Å; C914-V918 PolarHBondContact O-N 3.11Å; V915-V918 PolarHBondContact O-N 3.15Å; V918-G922 PolarHBondContact O-N 3.31Å
919	I	95.3	Very high	92.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-65.9	-44	177.9	-62.5	159.7	0	0	0	110.8	L506 L738 I743 V915 P916 M917 G922 R923 L986	L506-I919 HydrophobicContact CB-CG1 4.36Å; L506-I919 HydrophobicContact CD1-CD1 4.39Å; L506-I919 HydrophobicContact CD1-CG1 3.79Å; L738-I919 HydrophobicContact CD2-CD1 3.8Å; I743-I919 HydrophobicContact CD1-CD1 3.81Å; I743-I919 HydrophobicContact CD1-CG2 4.09Å; V915-I919 HydrophobicContact CG1-CD1 3.85Å; V915-I919 WeakPolarHBondContact O-CD1 3.44Å; V915-I919 VanDerWaalsContact O-CG1 3.3Å; V915-I919 WeakPolarHBondContact O-CG1 3.35Å; V915-I919 PolarHBondContact O-N 2.86Å; P916-I919 PolarHBondContact O-N 3.1Å; M917-I919 VanDerWaalsContact C-N 3.32Å; M917-I919 PolarHBondContact O-N 2.82Å; I919-G922 PolarHBondContact O-N 2.82Å; I919-R923 HydrophobicContact CG2-CG 4.49Å; I919-R923 VanDerWaalsContact O-CG 3.28Å; I919-R923 WeakPolarHBondContact O-CG 3.47Å; I919-R923 PolarHBondContact O-N 3.45Å; I919-L986 HydrophobicContact CB-CD1 4.11Å; I919-L986 HydrophobicContact CG2-CD1 3.55Å
920	R	94.4	Very high	92.5	Very high	66 Å²	66	15.2 Å²	15.2	25%	0.249	8%	0.082	C	C	.	.	H	α-helix	trans	-62.8	-48.1	178.8	-76.4	168.8	61.9	-162.3	-7.6	111.6	P916 M917 R923 C924 P982 A983 L984 L986	P916-R920 WeakPolarHBondContact O-CB 3.49Å; P916-R920 WeakPolarHBondContact O-CD 3.47Å; P916-R920 WeakPolarHBondContact O-CG 3.47Å; P916-R920 PolarHBondContact O-N 3.26Å; M917-R920 PolarHBondContact O-N 2.87Å; R920-R923 PolarHBondContact O-N 3Å; R920-C924 WeakPolarHBondContact O-CB 3.43Å; R920-C924 PolarHBondContact O-N 3.11Å; R920-P982 HydrophobicContact CB-CB 4.4Å; R920-A983 VanDerWaalsContact CZ-O 3.23Å; R920-A983 PolarHBondContact NE-O 3.29Å; R920-A983 PolarHBondContact NH2-O 2.92Å; R920-L984 PolarHBondContact NH1-O 3.28Å; R920-L984 VanDerWaalsContact NH2-C 3.28Å; R920-L984 VanDerWaalsContact NH2-CA 3.28Å; R920-L984 PolarHBondContact NH2-O 3Å; R920-L986 HydrophobicContact CG-CB 4.22Å; R920-L986 HydrophobicContact CG-CD1 3.74Å
921	E	94.6	Very high	92.8	Very high	4 Å²	4	13 Å²	13	2%	0.019	6%	0.063	C	C	.	.	H	α-helix	trans	-63.7	-41.4	176	-81.6	-67.8	175.3	0	0	111.7	R486 L487 M917 R923 C924 S925 P982	R486-E921 IonicContact CZ-OE1 2.66Å; R486-E921 IonicContact CZ-OE2 3.57Å; R486-E921 IonicContact NE-OE1 2.78Å; R486-E921 PolarHBondContact NE-OE1 3.44Å; R486-E921 IonicContact NE-OE2 3.98Å; R486-E921 PolarHBondContact NE-OE2 3.47Å; R486-E921 IonicContact NH2-OE1 3.22Å; R486-E921 IonicContact NH2-OE2 2.74Å; R486-E921 PolarHBondContact NH2-OE2 3.35Å; L487-E921 HydrophobicContact CD1-CB 4.36Å; L487-E921 HydrophobicContact CD2-CB 3.99Å; L487-E921 HydrophobicContact CD2-CG 3.84Å; L487-E921 HydrophobicContact CG-CB 4.17Å; L487-E921 HydrophobicContact CG-CG 4.08Å; M917-E921 PolarHBondContact O-N 3.33Å; E921-R923 VanDerWaalsContact C-N 3.34Å; E921-R923 PolarHBondContact O-N 3.13Å; E921-C924 PolarHBondContact O-N 3.49Å; E921-S925 VanDerWaalsContact O-CB 3.24Å; E921-S925 WeakPolarHBondContact O-CB 3.27Å; E921-S925 PolarHBondContact O-N 2.86Å; E921-P982 HydrophobicContact CG-CG 4.27Å; E921-P982 WeakPolarHBondContact OE1-CD 3.09Å; E921-P982 VanDerWaalsContact OE1-CG 3.23Å; E921-P982 WeakPolarHBondContact OE1-CG 3.42Å
922	G	94	Very high	92.9	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-62.6	-38	175.8	0	0	0	0	0	113.5	I500 G504 V918 I919 L926	I500-G922 WeakPolarHBondContact O-CA 3.47Å; G504-G922 VanDerWaalsContact CA-C 3.43Å; V918-G922 PolarHBondContact O-N 3.31Å; I919-G922 PolarHBondContact O-N 2.82Å; G922-L926 VanDerWaalsContact O-CB 3.24Å; G922-L926 WeakPolarHBondContact O-CB 3.41Å; G922-L926 PolarHBondContact O-N 2.66Å
923	R	93.5	Very high	92.7	Very high	7 Å²	7	12.4 Å²	12.4	3%	0.026	6%	0.059	C	C	.	.	H	α-helix	trans	-67.1	-44	174	-71.5	177.7	-176.1	178.4	0.4	111.8	I919 R920 E921 D927 L986 G987 V989 P991 F1070	I919-R923 HydrophobicContact CG2-CG 4.49Å; I919-R923 VanDerWaalsContact O-CG 3.28Å; I919-R923 WeakPolarHBondContact O-CG 3.47Å; I919-R923 PolarHBondContact O-N 3.45Å; R920-R923 PolarHBondContact O-N 3Å; E921-R923 VanDerWaalsContact C-N 3.34Å; E921-R923 PolarHBondContact O-N 3.13Å; R923-D927 VanDerWaalsContact O-CB 3.29Å; R923-D927 WeakPolarHBondContact O-CB 3.45Å; R923-D927 PolarHBondContact O-N 3.34Å; R923-L986 VanDerWaalsContact NH1-CD1 3.27Å; R923-G987 PolarHBondContact NH1-O 3.44Å; R923-V989 PolarHBondContact NH1-O 2.92Å; R923-P991 HydrophobicContact CB-CG 3.98Å; R923-P991 HydrophobicContact CG-CG 4.13Å; R923-F1070 HydrophobicContact CB-CD1 4.16Å
924	C	93.6	Very high	92.5	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-62.1	-50.8	177	177	0	0	0	0	111.8	R920 E921 L926 D927 T928 T980 P982 R1071	R920-C924 WeakPolarHBondContact O-CB 3.43Å; R920-C924 PolarHBondContact O-N 3.11Å; E921-C924 PolarHBondContact O-N 3.49Å; C924-L926 VanDerWaalsContact C-N 3.35Å; C924-L926 PolarHBondContact O-N 3.27Å; C924-D927 PolarHBondContact O-N 2.7Å; C924-T928 VanDerWaalsContact O-CB 3.32Å; C924-T928 WeakPolarHBondContact O-CB 3.46Å; C924-T928 PolarHBondContact O-N 3.03Å; C924-T928 PolarHBondContact O-OG1 2.73Å; C924-T980 PolarHBondContact SG-O 2.85Å; C924-P982 HydrophobicContact CB-CB 3.65Å; C924-P982 VanDerWaalsContact SG-CA 3.57Å; C924-P982 VanDerWaalsContact SG-N 3.44Å; C924-R1071 HydrophobicContact CB-CG 4.48Å
925	S	92.7	Very high	92.5	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.007	5%	0.048	C	C	.	.	H	α-helix	trans	-58.2	-47.2	178.7	-178.2	0	0	0	0	111	N501 E921 T928 S929	N501-S925 VanDerWaalsContact OD1-CB 3.28Å; N501-S925 WeakPolarHBondContact OD1-CB 3.32Å; N501-S925 PolarHBondContact OD1-OG 3.13Å; E921-S925 VanDerWaalsContact O-CB 3.24Å; E921-S925 WeakPolarHBondContact O-CB 3.27Å; E921-S925 PolarHBondContact O-N 2.86Å; S925-T928 WeakPolarHBondContact O-CB 3.32Å; S925-T928 PolarHBondContact O-N 2.95Å; S925-S929 PolarHBondContact O-N 3Å; S925-S929 PolarHBondContact O-OG 3Å; S925-S929 VanDerWaalsContact O-OG 3.05Å
926	L	90.6	Very high	92.3	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-63.8	-47.7	179.1	-176.4	60.5	0	0	0	111.9	F418 F420 N501 K505 G922 C924 T928 S929 F930 P991	F418-L926 HydrophobicContact CE1-CD1 3.7Å; F418-L926 HydrophobicContact CZ-CD1 3.65Å; F418-L926 HydrophobicContact CZ-CD2 4.07Å; F420-L926 HydrophobicContact CD2-CD1 4.41Å; N501-L926 HydrophobicContact CB-CD1 4.27Å; N501-L926 PolarHBondContact OD1-N 2.86Å; K505-L926 HydrophobicContact CD-CD2 4.13Å; K505-L926 HydrophobicContact CG-CD2 4.31Å; G922-L926 VanDerWaalsContact O-CB 3.24Å; G922-L926 WeakPolarHBondContact O-CB 3.41Å; G922-L926 PolarHBondContact O-N 2.66Å; C924-L926 VanDerWaalsContact C-N 3.35Å; C924-L926 PolarHBondContact O-N 3.27Å; L926-T928 VanDerWaalsContact C-N 3.28Å; L926-T928 PolarHBondContact O-N 3.09Å; L926-S929 WeakPolarHBondContact O-CB 3.36Å; L926-S929 PolarHBondContact O-N 3.24Å; L926-S929 VanDerWaalsContact O-N 3.16Å; L926-F930 HydrophobicContact CD1-CD2 4.09Å; L926-F930 HydrophobicContact CD1-CE2 3.82Å; L926-F930 HydrophobicContact CG-CD2 4.14Å; L926-F930 HydrophobicContact CG-CE2 4.02Å; L926-F930 WeakPolarHBondContact O-CD2 3.41Å; L926-F930 PolarHBondContact O-N 2.97Å; L926-P991 HydrophobicContact CD2-CB 4.06Å; L926-P991 HydrophobicContact CD2-CG 4.45Å; L926-P991 HydrophobicContact CG-CB 4.34Å
927	D	90.6	Very high	92.1	Very high	23 Å²	23	9.6 Å²	9.6	12%	0.123	4%	0.044	C	C	.	.	H	α-helix	trans	-62.5	-37.5	178.8	-164.9	49.9	0	0	0	111.9	R923 C924 F930 S931 F1070 R1071	R923-D927 VanDerWaalsContact O-CB 3.29Å; R923-D927 WeakPolarHBondContact O-CB 3.45Å; R923-D927 PolarHBondContact O-N 3.34Å; C924-D927 PolarHBondContact O-N 2.7Å; D927-F930 WeakPolarHBondContact O-CB 3.47Å; D927-F930 PolarHBondContact O-N 3.43Å; D927-S931 PolarHBondContact O-N 3.32Å; D927-F1070 HydrophobicContact CB-CB 4.01Å; D927-F1070 HydrophobicContact CB-CD2 4.04Å; D927-F1070 HydrophobicContact CB-CG 4.35Å; D927-R1071 PolarHBondContact O-NH2 2.86Å; D927-R1071 IonicContact OD1-NH2 3.45Å; D927-R1071 IonicContact OD2-CZ 3.25Å; D927-R1071 IonicContact OD2-NE 2.74Å; D927-R1071 PolarHBondContact OD2-NE 3.15Å; D927-R1071 IonicContact OD2-NH2 3.39Å; D927-R1071 PolarHBondContact OD2-NH2 3.05Å
928	T	91.9	Very high	92	Very high	2 Å²	2	7.3 Å²	7.3	1%	0.012	3%	0.033	C	C	.	.	H	α-helix	trans	-62.1	-46	171.9	-53.2	0	0	0	0	111.4	C479 C924 S925 L926 F930 S931 V932 R1071	C479-T928 HydrophobicContact CB-CG2 4.41Å; C924-T928 VanDerWaalsContact O-CB 3.32Å; C924-T928 WeakPolarHBondContact O-CB 3.46Å; C924-T928 PolarHBondContact O-N 3.03Å; C924-T928 PolarHBondContact O-OG1 2.73Å; S925-T928 WeakPolarHBondContact O-CB 3.32Å; S925-T928 PolarHBondContact O-N 2.95Å; L926-T928 VanDerWaalsContact C-N 3.28Å; L926-T928 PolarHBondContact O-N 3.09Å; T928-F930 VanDerWaalsContact C-N 3.27Å; T928-F930 PolarHBondContact O-N 2.74Å; T928-S931 PolarHBondContact O-N 2.72Å; T928-S931 VanDerWaalsContact O-N 3.14Å; T928-V932 HydrophobicContact CG2-CG2 4.28Å; T928-V932 WeakPolarHBondContact O-CG2 3.42Å; T928-V932 PolarHBondContact O-N 3.37Å; T928-R1071 WeakPolarHBondContact OG1-CD 3.43Å
929	S	89.8	Confident	91.9	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-59.4	-37	175.6	-60.6	0	0	0	0	112.3	S925 L926 F933	S925-S929 PolarHBondContact O-N 3Å; S925-S929 PolarHBondContact O-OG 3Å; S925-S929 VanDerWaalsContact O-OG 3.05Å; L926-S929 WeakPolarHBondContact O-CB 3.36Å; L926-S929 PolarHBondContact O-N 3.24Å; L926-S929 VanDerWaalsContact O-N 3.16Å; S929-F933 WeakPolarHBondContact O-CB 3.42Å; S929-F933 PolarHBondContact O-N 2.91Å
930	F	88.6	Confident	91.7	Very high	6 Å²	6	7.7 Å²	7.7	3%	0.026	3%	0.034	C	C	.	.	H	α-helix	trans	-65.6	-44.9	173.3	-89.5	-94.1	0	0	0	112.1	F420 L926 D927 T928 F933 K934 P992 L995 V1000	F420-F930 AromaticContact CD2-CD2 3.93Å; F420-F930 HydrophobicContact CD2-CD2 3.93Å; F420-F930 HydrophobicContact CD2-CE1 4.23Å; F420-F930 AromaticContact CD2-CE2 3.41Å; F420-F930 HydrophobicContact CD2-CE2 3.41Å; F420-F930 VanDerWaalsContact CD2-CE2 3.41Å; F420-F930 AromaticContact CD2-CZ 3.57Å; F420-F930 HydrophobicContact CD2-CZ 3.57Å; F420-F930 HydrophobicContact CE2-CD1 4.13Å; F420-F930 AromaticContact CE2-CD2 3.55Å; F420-F930 HydrophobicContact CE2-CD2 3.55Å; F420-F930 HydrophobicContact CE2-CE1 4.15Å; F420-F930 AromaticContact CE2-CE2 3.54Å; F420-F930 HydrophobicContact CE2-CE2 3.54Å; F420-F930 AromaticContact CE2-CG 3.84Å; F420-F930 HydrophobicContact CE2-CG 3.84Å; F420-F930 AromaticContact CE2-CZ 3.85Å; F420-F930 HydrophobicContact CE2-CZ 3.85Å; L926-F930 HydrophobicContact CD1-CD2 4.09Å; L926-F930 HydrophobicContact CD1-CE2 3.82Å; L926-F930 HydrophobicContact CG-CD2 4.14Å; L926-F930 HydrophobicContact CG-CE2 4.02Å; L926-F930 WeakPolarHBondContact O-CD2 3.41Å; L926-F930 PolarHBondContact O-N 2.97Å; D927-F930 WeakPolarHBondContact O-CB 3.47Å; D927-F930 PolarHBondContact O-N 3.43Å; T928-F930 VanDerWaalsContact C-N 3.27Å; T928-F930 PolarHBondContact O-N 2.74Å; F930-F933 PolarHBondContact O-N 2.98Å; F930-K934 WeakPolarHBondContact O-CG 3.41Å; F930-K934 PolarHBondContact O-N 2.77Å; F930-P992 HydrophobicContact CD1-CG 4.26Å; F930-P992 HydrophobicContact CE1-CB 4.35Å; F930-P992 HydrophobicContact CE1-CG 4Å; F930-P992 HydrophobicContact CE2-CG 4.37Å; F930-P992 WeakPolarHBondContact CE2-O 3.37Å; F930-P992 HydrophobicContact CZ-CB 4.26Å; F930-P992 HydrophobicContact CZ-CG 4.09Å; F930-P992 VanDerWaalsContact CZ-O 3.23Å; F930-P992 WeakPolarHBondContact CZ-O 3.47Å; F930-L995 HydrophobicContact CD1-CD2 3.58Å; F930-L995 HydrophobicContact CE1-CD2 3.57Å; F930-L995 HydrophobicContact CE1-CG 4.04Å; F930-L995 HydrophobicContact CG-CD2 4.34Å; F930-L995 HydrophobicContact CZ-CD2 4.28Å; F930-L995 HydrophobicContact CZ-CG 4.42Å; F930-V1000 HydrophobicContact CD1-CG2 4.49Å
931	S	90.1	Very high	91.6	Very high	8 Å²	8	5.2 Å²	5.2	6%	0.056	3%	0.026	C	C	.	.	H	α-helix	trans	-63.8	-44.4	177.1	-74.8	0	0	0	0	112.6	D927 T928 F933 K934 Y935 V1064 R1071	D927-S931 PolarHBondContact O-N 3.32Å; T928-S931 PolarHBondContact O-N 2.72Å; T928-S931 VanDerWaalsContact O-N 3.14Å; S931-F933 VanDerWaalsContact C-N 3.34Å; S931-K934 PolarHBondContact O-N 3.46Å; S931-Y935 WeakPolarHBondContact O-CB 3.33Å; S931-Y935 PolarHBondContact O-N 3.44Å; S931-V1064 WeakPolarHBondContact CB-O 3.3Å; S931-V1064 PolarHBondContact OG-O 3.34Å; S931-R1071 VanDerWaalsContact CB-NH1 3.35Å; S931-R1071 VanDerWaalsContact OG-CZ 3.31Å; S931-R1071 PolarHBondContact OG-NH1 2.67Å; S931-R1071 PolarHBondContact OG-NH2 2.91Å
932	V	91.1	Very high	91.6	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-65.2	-40.7	178.2	171.1	0	0	0	0	110.6	A475 T928 Y935 M936 M977 S978	A475-V932 HydrophobicContact CB-CG1 3.7Å; T928-V932 HydrophobicContact CG2-CG2 4.28Å; T928-V932 WeakPolarHBondContact O-CG2 3.42Å; T928-V932 PolarHBondContact O-N 3.37Å; V932-Y935 PolarHBondContact O-N 2.91Å; V932-M936 HydrophobicContact CG1-CG 4.46Å; V932-M936 WeakPolarHBondContact O-CB 3.41Å; V932-M936 VanDerWaalsContact O-CG 3.31Å; V932-M936 WeakPolarHBondContact O-CG 3.46Å; V932-M936 PolarHBondContact O-N 3.41Å; V932-M977 HydrophobicContact CG2-CE 4.06Å; V932-M977 HydrophobicContact CG2-CG 4.01Å; V932-M977 HydrophobicContact CG2-SD 3.97Å; V932-S978 WeakPolarHBondContact CG2-OG 3.42Å
933	F	89.4	Confident	91.6	Very high	2 Å²	2	5.4 Å²	5.4	1%	0.009	3%	0.027	C	C	.	.	H	α-helix	trans	-61	-47.6	173.3	177.9	-86.6	0	0	0	112.1	F420 S424 F427 L472 M476 S929 F930 S931 Y935 M936 A937 L995	F420-F933 HydrophobicContact CZ-CB 4.33Å; S424-F933 WeakPolarHBondContact OG-CE2 3.47Å; F427-F933 HydrophobicContact CB-CZ 3.85Å; F427-F933 AromaticContact CD1-CE1 3.95Å; F427-F933 HydrophobicContact CD1-CE1 3.95Å; F427-F933 HydrophobicContact CD1-CE2 4.1Å; F427-F933 AromaticContact CD1-CZ 3.26Å; F427-F933 HydrophobicContact CD1-CZ 3.26Å; F427-F933 HydrophobicContact CD2-CZ 4.34Å; F427-F933 HydrophobicContact CE1-CE1 4.1Å; F427-F933 AromaticContact CE1-CZ 3.8Å; F427-F933 HydrophobicContact CE1-CZ 3.8Å; F427-F933 HydrophobicContact CG-CE1 4.15Å; F427-F933 AromaticContact CG-CZ 3.56Å; F427-F933 HydrophobicContact CG-CZ 3.56Å; F427-F933 HydrophobicContact CZ-CE1 4.48Å; L472-F933 HydrophobicContact CD1-CD2 3.93Å; L472-F933 HydrophobicContact CD1-CE2 4.42Å; L472-F933 HydrophobicContact CD2-CE2 4.39Å; M476-F933 HydrophobicContact SD-CD2 4.36Å; S929-F933 WeakPolarHBondContact O-CB 3.42Å; S929-F933 PolarHBondContact O-N 2.91Å; F930-F933 PolarHBondContact O-N 2.98Å; S931-F933 VanDerWaalsContact C-N 3.34Å; F933-Y935 VanDerWaalsContact C-N 3.31Å; F933-Y935 PolarHBondContact O-N 2.92Å; F933-M936 PolarHBondContact O-N 3.48Å; F933-A937 PolarHBondContact O-N 2.8Å; F933-L995 HydrophobicContact CB-CD2 4.36Å; F933-L995 HydrophobicContact CD1-CD1 4.39Å; F933-L995 HydrophobicContact CD1-CD2 3.49Å; F933-L995 VanDerWaalsContact CD1-CD2 3.49Å; F933-L995 HydrophobicContact CD2-CD1 4.12Å; F933-L995 HydrophobicContact CD2-CD2 4.46Å; F933-L995 HydrophobicContact CE1-CD1 4.21Å; F933-L995 HydrophobicContact CE1-CD2 3.79Å; F933-L995 HydrophobicContact CE1-CG 4.44Å; F933-L995 HydrophobicContact CE2-CD1 3.94Å; F933-L995 HydrophobicContact CG-CD1 4.32Å; F933-L995 HydrophobicContact CG-CD2 3.84Å; F933-L995 HydrophobicContact CZ-CD1 3.95Å; F933-L995 HydrophobicContact CZ-CD2 4.37Å
934	K	90.2	Very high	91.6	Very high	29 Å²	29	5.6 Å²	5.6	13%	0.126	3%	0.028	C	C	.	.	H	α-helix	trans	-58.4	-46.3	176.1	-78.6	-173.1	177.4	-167.3	0	110.9	F930 S931 A937 L938 V1000 S1003 L1004 V1064	F930-K934 WeakPolarHBondContact O-CG 3.41Å; F930-K934 PolarHBondContact O-N 2.77Å; S931-K934 PolarHBondContact O-N 3.46Å; K934-A937 PolarHBondContact O-N 2.82Å; K934-L938 WeakPolarHBondContact O-CB 3.46Å; K934-L938 WeakPolarHBondContact O-CD1 3.45Å; K934-L938 WeakPolarHBondContact O-CG 3.26Å; K934-L938 PolarHBondContact O-N 2.87Å; K934-V1000 HydrophobicContact CG-CG1 4.36Å; K934-S1003 PolarHBondContact NZ-OG 3Å; K934-L1004 HydrophobicContact CB-CD2 4.12Å; K934-L1004 HydrophobicContact CG-CD2 4.12Å; K934-V1064 HydrophobicContact CB-CG1 4.4Å
935	Y	92.8	Very high	91.7	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-57.4	-50.5	177.5	175.8	-115.3	0	0	0	111.4	S931 V932 F933 A937 L938 Y939 T970 V973 A974 M977 Y1057 A1061	S931-Y935 WeakPolarHBondContact O-CB 3.33Å; S931-Y935 PolarHBondContact O-N 3.44Å; V932-Y935 PolarHBondContact O-N 2.91Å; F933-Y935 VanDerWaalsContact C-N 3.31Å; F933-Y935 PolarHBondContact O-N 2.92Å; Y935-A937 VanDerWaalsContact C-N 3.3Å; Y935-A937 PolarHBondContact O-N 3.23Å; Y935-L938 PolarHBondContact O-N 2.97Å; Y935-Y939 WeakPolarHBondContact O-CB 3.32Å; Y935-Y939 PolarHBondContact O-N 3.49Å; Y935-T970 HydrophobicContact CE1-CG2 3.84Å; Y935-T970 WeakPolarHBondContact OH-CA 3.31Å; Y935-V973 HydrophobicContact CE1-CG1 4.36Å; Y935-A974 HydrophobicContact CD1-CB 4.33Å; Y935-A974 HydrophobicContact CE1-CB 4.1Å; Y935-M977 HydrophobicContact CD1-SD 4Å; Y935-M977 HydrophobicContact CG-SD 4.14Å; Y935-Y1057 WeakPolarHBondContact CE2-O 3.48Å; Y935-A1061 HydrophobicContact CD2-CB 3.9Å; Y935-A1061 HydrophobicContact CE2-CB 3.64Å
936	M	91.1	Very high	91.8	Very high	3 Å²	3	6.4 Å²	6.4	2%	0.015	3%	0.032	C	C	.	.	H	α-helix	trans	-61	-38.1	179.4	-73	-61.4	172.9	0	0	112.9	A471 L472 A475 V932 F933 S940 T970 A974	A471-M936 HydrophobicContact CB-CE 4.36Å; L472-M936 HydrophobicContact CD1-CB 3.6Å; L472-M936 HydrophobicContact CD1-CG 4Å; A475-M936 HydrophobicContact CB-CE 3.53Å; A475-M936 HydrophobicContact CB-CG 4.44Å; V932-M936 HydrophobicContact CG1-CG 4.46Å; V932-M936 WeakPolarHBondContact O-CB 3.41Å; V932-M936 VanDerWaalsContact O-CG 3.31Å; V932-M936 WeakPolarHBondContact O-CG 3.46Å; V932-M936 PolarHBondContact O-N 3.41Å; F933-M936 PolarHBondContact O-N 3.48Å; M936-S940 WeakPolarHBondContact O-CB 3.27Å; M936-S940 PolarHBondContact O-N 3.01Å; M936-S940 VanDerWaalsContact O-N 3.13Å; M936-T970 HydrophobicContact CE-CG2 4.45Å; M936-T970 HydrophobicContact SD-CG2 4.43Å; M936-A974 HydrophobicContact CE-CB 3.41Å; M936-A974 VanDerWaalsContact CE-CB 3.41Å
937	A	90.2	Very high	91.8	Very high	3 Å²	3	6.4 Å²	6.4	3%	0.025	3%	0.032	C	C	.	.	H	α-helix	trans	-66.4	-47.5	174.1	0	0	0	0	0	112.1	F427 F933 K934 Y935 S940 L941 L1004	F427-A937 HydrophobicContact CE1-CB 3.61Å; F427-A937 HydrophobicContact CZ-CB 3.65Å; F933-A937 PolarHBondContact O-N 2.8Å; K934-A937 PolarHBondContact O-N 2.82Å; Y935-A937 VanDerWaalsContact C-N 3.3Å; Y935-A937 PolarHBondContact O-N 3.23Å; A937-S940 PolarHBondContact O-N 2.95Å; A937-L941 WeakPolarHBondContact O-CB 3.25Å; A937-L941 WeakPolarHBondContact O-CG 3.45Å; A937-L941 PolarHBondContact O-N 3.3Å; A937-L1004 HydrophobicContact CB-CD2 4.21Å
938	L	92.8	Very high	91.9	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-64.8	-41.4	-179.7	-71.5	164.2	0	0	0	111.8	K934 Y935 L941 T942 L1004 Q1007 V1008 L1060 V1064	K934-L938 WeakPolarHBondContact O-CB 3.46Å; K934-L938 WeakPolarHBondContact O-CD1 3.45Å; K934-L938 WeakPolarHBondContact O-CG 3.26Å; K934-L938 PolarHBondContact O-N 2.87Å; Y935-L938 PolarHBondContact O-N 2.97Å; L938-L941 PolarHBondContact O-N 2.98Å; L938-T942 VanDerWaalsContact O-CB 3.27Å; L938-T942 WeakPolarHBondContact O-CB 3.32Å; L938-T942 PolarHBondContact O-N 3.04Å; L938-T942 PolarHBondContact O-OG1 3.48Å; L938-L1004 HydrophobicContact CD1-CD2 4.04Å; L938-L1004 HydrophobicContact CD2-CD2 3.88Å; L938-L1004 HydrophobicContact CG-CD2 3.61Å; L938-Q1007 HydrophobicContact CD2-CB 3.59Å; L938-V1008 HydrophobicContact CD2-CG2 3.93Å; L938-L1060 HydrophobicContact CB-CD1 3.99Å; L938-L1060 HydrophobicContact CB-CD2 4.45Å; L938-L1060 HydrophobicContact CD1-CD2 4.17Å; L938-L1060 HydrophobicContact CD2-CD2 4.49Å; L938-V1064 HydrophobicContact CD1-CG1 3.78Å
939	Y	92.6	Very high	91.9	Very high	7 Å²	7	7.8 Å²	7.8	3%	0.027	4%	0.039	C	C	.	.	H	α-helix	trans	-54.7	-58.3	173.2	158.2	-107.4	0	0	0	111.1	Y935 L941 T942 Q943 I965 D966 T970 Y1057	Y935-Y939 WeakPolarHBondContact O-CB 3.32Å; Y935-Y939 PolarHBondContact O-N 3.49Å; Y939-L941 VanDerWaalsContact C-N 3.31Å; Y939-L941 PolarHBondContact O-N 2.78Å; Y939-T942 WeakPolarHBondContact O-CB 3.06Å; Y939-T942 PolarHBondContact O-N 3.18Å; Y939-T942 VanDerWaalsContact O-N 3.11Å; Y939-Q943 PolarHBondContact O-N 2.93Å; Y939-Q943 PolarHBondContact OH-NE2 2.97Å; Y939-Q943 PolarHBondContact OH-OE1 2.85Å; Y939-I965 HydrophobicContact CE2-CG2 3.6Å; Y939-D966 PolarHBondContact OH-OD1 3.43Å; Y939-D966 PolarHBondContact OH-OD2 3.31Å; Y939-T970 HydrophobicContact CD1-CG2 3.95Å; Y939-T970 HydrophobicContact CD2-CG2 3.87Å; Y939-T970 WeakPolarHBondContact CD2-OG1 3.49Å; Y939-T970 HydrophobicContact CE1-CG2 4.09Å; Y939-T970 HydrophobicContact CE2-CG2 4.03Å; Y939-T970 WeakPolarHBondContact CE2-OG1 3.47Å; Y939-T970 HydrophobicContact CG-CG2 3.84Å; Y939-Y1057 AromaticContact CD2-CD1 3.54Å; Y939-Y1057 HydrophobicContact CD2-CD1 3.54Å; Y939-Y1057 AromaticContact CD2-CE1 3.45Å; Y939-Y1057 HydrophobicContact CD2-CE1 3.45Å; Y939-Y1057 VanDerWaalsContact CD2-CE1 3.45Å; Y939-Y1057 HydrophobicContact CD2-CG 4.32Å; Y939-Y1057 HydrophobicContact CE2-CD1 4.23Å; Y939-Y1057 AromaticContact CE2-CE1 3.85Å; Y939-Y1057 HydrophobicContact CE2-CE1 3.85Å
940	S	91.9	Very high	91.9	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-63.1	-38	-177.5	172.1	0	0	0	0	112.1	V466 V467 M936 A937 Q943 F944	V466-S940 PolarHBondContact O-OG 2.75Å; V467-S940 VanDerWaalsContact CA-OG 3.3Å; V467-S940 WeakPolarHBondContact CA-OG 3.28Å; V467-S940 PolarHBondContact O-OG 2.71Å; M936-S940 WeakPolarHBondContact O-CB 3.27Å; M936-S940 PolarHBondContact O-N 3.01Å; M936-S940 VanDerWaalsContact O-N 3.13Å; A937-S940 PolarHBondContact O-N 2.95Å; S940-Q943 PolarHBondContact O-N 3.3Å; S940-F944 VanDerWaalsContact O-CB 3.27Å; S940-F944 WeakPolarHBondContact O-CB 3.49Å; S940-F944 PolarHBondContact O-N 2.58Å
941	L	92.6	Very high	91.9	Very high	14 Å²	14	7.8 Å²	7.8	7%	0.073	4%	0.039	C	C	.	.	H	α-helix	trans	-66.9	-39	174.9	-69.4	171.9	0	0	0	112.3	L431 L434 A937 L938 Y939 F944 I945 V1008	L431-L941 HydrophobicContact CD2-CD1 4.41Å; L431-L941 HydrophobicContact CD2-CD2 3.91Å; L431-L941 HydrophobicContact CD2-CG 4.31Å; L434-L941 HydrophobicContact CD2-CD2 3.3Å; A937-L941 WeakPolarHBondContact O-CB 3.25Å; A937-L941 WeakPolarHBondContact O-CG 3.45Å; A937-L941 PolarHBondContact O-N 3.3Å; L938-L941 PolarHBondContact O-N 2.98Å; Y939-L941 VanDerWaalsContact C-N 3.31Å; Y939-L941 PolarHBondContact O-N 2.78Å; L941-F944 PolarHBondContact O-N 2.69Å; L941-I945 VanDerWaalsContact O-CD1 3.32Å; L941-I945 WeakPolarHBondContact O-CD1 3.2Å; L941-I945 VanDerWaalsContact O-CG1 3.22Å; L941-I945 WeakPolarHBondContact O-CG1 3.44Å; L941-I945 PolarHBondContact O-N 2.89Å; L941-V1008 HydrophobicContact CB-CG2 4.03Å; L941-V1008 HydrophobicContact CD1-CG2 3.62Å; L941-V1008 HydrophobicContact CG-CG2 4.45Å
942	T	94.4	Very high	91.7	Very high	1 Å²	1	9.9 Å²	9.9	1%	0.006	5%	0.051	C	C	.	.	H	α-helix	trans	-63.2	-44	175.6	-59.2	0	0	0	0	110.9	L938 Y939 I945 S946 V1011 Q1056 Y1057	L938-T942 VanDerWaalsContact O-CB 3.27Å; L938-T942 WeakPolarHBondContact O-CB 3.32Å; L938-T942 PolarHBondContact O-N 3.04Å; L938-T942 PolarHBondContact O-OG1 3.48Å; Y939-T942 WeakPolarHBondContact O-CB 3.06Å; Y939-T942 PolarHBondContact O-N 3.18Å; Y939-T942 VanDerWaalsContact O-N 3.11Å; T942-I945 PolarHBondContact O-N 3.31Å; T942-S946 PolarHBondContact O-N 3.21Å; T942-S946 PolarHBondContact O-OG 3.03Å; T942-V1011 HydrophobicContact CG2-CG1 3.68Å; T942-Q1056 HydrophobicContact CG2-CB 4.17Å; T942-Y1057 HydrophobicContact CG2-CD1 4.19Å; T942-Y1057 HydrophobicContact CG2-CE1 3.59Å
943	Q	93.8	Very high	91.4	Very high	7 Å²	7	11 Å²	11	3%	0.033	6%	0.057	C	C	.	.	H	α-helix	trans	-65.7	-43.8	176.7	-165.8	175.2	30.1	0	0	111.3	V466 Y939 S940 I945 S946 V947 F962 D966 Y1057	V466-Q943 HydrophobicContact CG1-CB 4.09Å; V466-Q943 HydrophobicContact CG1-CG 3.81Å; Y939-Q943 PolarHBondContact O-N 2.93Å; Y939-Q943 PolarHBondContact OH-NE2 2.97Å; Y939-Q943 PolarHBondContact OH-OE1 2.85Å; S940-Q943 PolarHBondContact O-N 3.3Å; Q943-I945 PolarHBondContact O-N 3.32Å; Q943-S946 WeakPolarHBondContact O-CB 3.43Å; Q943-S946 PolarHBondContact O-N 3.47Å; Q943-S946 VanDerWaalsContact O-N 3.17Å; Q943-V947 WeakPolarHBondContact O-CG2 3.25Å; Q943-V947 PolarHBondContact O-N 3.38Å; Q943-F962 HydrophobicContact CG-CE1 4.37Å; Q943-F962 VanDerWaalsContact NE2-CD1 3.32Å; Q943-D966 PolarHBondContact NE2-OD1 2.84Å; Q943-Y1057 WeakPolarHBondContact CA-OH 3.49Å; Q943-Y1057 WeakPolarHBondContact CB-OH 3.41Å
944	F	93.5	Very high	91	Very high	11 Å²	11	11.3 Å²	11.3	5%	0.048	6%	0.059	C	C	.	.	H	α-helix	trans	-57.7	-45	174.5	169.8	-102.6	0	0	0	112.6	L434 L463 V466 V467 S940 L941 S946 V947 L948	L434-F944 HydrophobicContact CD2-CE1 4.35Å; L434-F944 HydrophobicContact CG-CE1 4.19Å; L434-F944 HydrophobicContact CG-CZ 4.47Å; L463-F944 HydrophobicContact CD1-CD2 3.46Å; L463-F944 VanDerWaalsContact CD1-CD2 3.46Å; L463-F944 HydrophobicContact CD1-CE2 3.62Å; L463-F944 HydrophobicContact CD2-CD2 4.49Å; L463-F944 HydrophobicContact CD2-CE2 3.79Å; L463-F944 HydrophobicContact CG-CD2 3.88Å; L463-F944 HydrophobicContact CG-CE2 3.62Å; V466-F944 HydrophobicContact CG1-CB 4.33Å; V467-F944 HydrophobicContact CG2-CB 3.93Å; V467-F944 HydrophobicContact CG2-CD1 4.49Å; V467-F944 HydrophobicContact CG2-CD2 3.07Å; V467-F944 HydrophobicContact CG2-CE2 3.55Å; V467-F944 HydrophobicContact CG2-CG 3.6Å; V467-F944 HydrophobicContact CG2-CZ 4.44Å; S940-F944 VanDerWaalsContact O-CB 3.27Å; S940-F944 WeakPolarHBondContact O-CB 3.49Å; S940-F944 PolarHBondContact O-N 2.58Å; L941-F944 PolarHBondContact O-N 2.69Å; F944-S946 VanDerWaalsContact C-N 3.34Å; F944-V947 PolarHBondContact O-N 3.12Å; F944-L948 HydrophobicContact CE1-CD2 4.42Å; F944-L948 VanDerWaalsContact O-CB 3.31Å; F944-L948 WeakPolarHBondContact O-CB 2.91Å; F944-L948 PolarHBondContact O-N 3.3Å
945	I	94.3	Very high	90.9	Very high	18 Å²	18	9.9 Å²	9.9	9%	0.092	5%	0.053	C	C	.	.	H	α-helix	trans	-63.3	-42.7	176.1	-67.9	157.1	0	0	0	110.7	L941 T942 Q943 V947 L948 I949 V1008 T1012	L941-I945 VanDerWaalsContact O-CD1 3.32Å; L941-I945 WeakPolarHBondContact O-CD1 3.2Å; L941-I945 VanDerWaalsContact O-CG1 3.22Å; L941-I945 WeakPolarHBondContact O-CG1 3.44Å; L941-I945 PolarHBondContact O-N 2.89Å; T942-I945 PolarHBondContact O-N 3.31Å; Q943-I945 PolarHBondContact O-N 3.32Å; I945-V947 PolarHBondContact O-N 3.09Å; I945-L948 PolarHBondContact O-N 3.47Å; I945-I949 HydrophobicContact CG2-CD1 3.82Å; I945-I949 HydrophobicContact CG2-CG1 4.37Å; I945-I949 WeakPolarHBondContact O-CG1 3.22Å; I945-I949 PolarHBondContact O-N 3Å; I945-V1008 HydrophobicContact CD1-CG1 3.73Å; I945-T1012 WeakPolarHBondContact CD1-OG1 3.37Å; I945-T1012 HydrophobicContact CG2-CG2 4.2Å
946	S	94.9	Very high	90.6	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-58.4	-49.4	178.4	-51.6	0	0	0	0	110.8	T942 Q943 F944 L948 I949 L950 Q1015	T942-S946 PolarHBondContact O-N 3.21Å; T942-S946 PolarHBondContact O-OG 3.03Å; Q943-S946 WeakPolarHBondContact O-CB 3.43Å; Q943-S946 PolarHBondContact O-N 3.47Å; Q943-S946 VanDerWaalsContact O-N 3.17Å; F944-S946 VanDerWaalsContact C-N 3.34Å; S946-L948 PolarHBondContact O-N 2.98Å; S946-I949 PolarHBondContact O-N 3.06Å; S946-L950 WeakPolarHBondContact O-CG 3.45Å; S946-L950 PolarHBondContact O-N 3.35Å; S946-L950 VanDerWaalsContact O-N 3.16Å; S946-Q1015 PolarHBondContact OG-NE2 3.04Å; S946-Q1015 PolarHBondContact OG-OE1 3.38Å
947	V	92.4	Very high	90.5	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-63.7	-41.1	177.4	174.1	0	0	0	0	111.3	L463 V466 Q943 F944 I945 I949 L950 Y951 L957 F962	L463-V947 HydrophobicContact CD1-CB 4.49Å; L463-V947 HydrophobicContact CD1-CG1 3.98Å; V466-V947 HydrophobicContact CG1-CG2 4.49Å; Q943-V947 WeakPolarHBondContact O-CG2 3.25Å; Q943-V947 PolarHBondContact O-N 3.38Å; F944-V947 PolarHBondContact O-N 3.12Å; I945-V947 PolarHBondContact O-N 3.09Å; V947-I949 PolarHBondContact O-N 3.49Å; V947-L950 PolarHBondContact O-N 2.87Å; V947-Y951 HydrophobicContact CG1-CD1 4Å; V947-Y951 HydrophobicContact CG1-CD2 3.99Å; V947-Y951 HydrophobicContact CG1-CE1 3.68Å; V947-Y951 HydrophobicContact CG1-CE2 3.65Å; V947-Y951 HydrophobicContact CG1-CG 4.16Å; V947-Y951 VanDerWaalsContact CG1-CZ 3.47Å; V947-Y951 WeakPolarHBondContact O-CB 3.28Å; V947-Y951 PolarHBondContact O-N 3.47Å; V947-L957 HydrophobicContact CG2-CD1 4.1Å; V947-F962 HydrophobicContact CG2-CE1 4.34Å; V947-F962 HydrophobicContact CG2-CZ 4.05Å
948	L	91.9	Very high	90.4	Very high	39 Å²	39	10.1 Å²	10.1	20%	0.204	6%	0.055	C	C	.	.	H	α-helix	trans	-63.1	-41	179	-165.1	67.8	0	0	0	112.7	Y441 F944 I945 S946 T952	Y441-L948 HydrophobicContact CD1-CD1 3.48Å; Y441-L948 VanDerWaalsContact CD1-CD1 3.48Å; Y441-L948 HydrophobicContact CD1-CD2 4.45Å; Y441-L948 HydrophobicContact CD1-CG 4.09Å; Y441-L948 HydrophobicContact CE1-CD1 3.88Å; Y441-L948 HydrophobicContact CE1-CG 4.06Å; F944-L948 HydrophobicContact CE1-CD2 4.42Å; F944-L948 VanDerWaalsContact O-CB 3.31Å; F944-L948 WeakPolarHBondContact O-CB 2.91Å; F944-L948 PolarHBondContact O-N 3.3Å; I945-L948 PolarHBondContact O-N 3.47Å; S946-L948 PolarHBondContact O-N 2.98Å; L948-T952 PolarHBondContact O-N 2.84Å; L948-T952 PolarHBondContact O-OG1 2.94Å
949	I	92.1	Very high	90.1	Very high	16 Å²	16	11.4 Å²	11.4	8%	0.082	6%	0.062	C	C	.	.	H	α-helix	trans	-61.7	-46.7	175	-69.3	168.2	0	0	0	109.8	I945 S946 V947 T952 Q1015 L1016 Y1019 V1049	I945-I949 HydrophobicContact CG2-CD1 3.82Å; I945-I949 HydrophobicContact CG2-CG1 4.37Å; I945-I949 WeakPolarHBondContact O-CG1 3.22Å; I945-I949 PolarHBondContact O-N 3Å; S946-I949 PolarHBondContact O-N 3.06Å; V947-I949 PolarHBondContact O-N 3.49Å; I949-T952 VanDerWaalsContact O-CB 3.29Å; I949-T952 WeakPolarHBondContact O-CB 3.22Å; I949-T952 PolarHBondContact O-N 3.36Å; I949-Q1015 HydrophobicContact CD1-CB 3.87Å; I949-L1016 HydrophobicContact CD1-CD2 3.93Å; I949-L1016 HydrophobicContact CD1-CG 4.33Å; I949-L1016 HydrophobicContact CG1-CD2 4.07Å; I949-Y1019 HydrophobicContact CG2-CD2 4.13Å; I949-Y1019 HydrophobicContact CG2-CG 4.2Å; I949-V1049 HydrophobicContact CG2-CG2 4.24Å
950	L	90.3	Very high	89.9	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-69.4	-37.7	-178.6	-63.5	175.7	0	0	0	112.6	S946 V947 T952 I953 N954 T955 L957 E1045 N1046 V1049	S946-L950 WeakPolarHBondContact O-CG 3.45Å; S946-L950 PolarHBondContact O-N 3.35Å; S946-L950 VanDerWaalsContact O-N 3.16Å; V947-L950 PolarHBondContact O-N 2.87Å; L950-T952 PolarHBondContact O-N 3.39Å; L950-I953 HydrophobicContact CD2-CD1 4.33Å; L950-I953 CarbonylContact O-C 3.57Å; L950-I953 WeakPolarHBondContact O-CG1 3.46Å; L950-I953 PolarHBondContact O-N 3.32Å; L950-I953 VanDerWaalsContact O-N 3.09Å; L950-N954 PolarHBondContact O-N 3.49Å; L950-T955 CarbonylContact C-O 3.17Å; L950-T955 HydrophobicContact CB-CG2 3.8Å; L950-T955 WeakPolarHBondContact CB-O 3.45Å; L950-T955 HydrophobicContact CD2-CG2 3.73Å; L950-T955 HydrophobicContact CG-CG2 4.26Å; L950-T955 PolarHBondContact O-N 3.43Å; L950-L957 HydrophobicContact CD1-CD2 3.98Å; L950-L957 HydrophobicContact CD1-CG 3.88Å; L950-E1045 HydrophobicContact CD2-CB 4.47Å; L950-N1046 HydrophobicContact CD2-CB 4.37Å; L950-V1049 HydrophobicContact CD1-CG1 4.44Å; L950-V1049 HydrophobicContact CD2-CB 4.24Å; L950-V1049 HydrophobicContact CD2-CG2 4.19Å; L950-V1049 HydrophobicContact CG-CG1 4.41Å
951	Y	87.3	Confident	89.9	Confident	6 Å²	6	14 Å²	14	2%	0.024	8%	0.076	C	C	.	.	H	α-helix	trans	-62.2	-29.7	174	-78	3.2	0	0	0	112.6	S442 R459 D462 L463 V947 I953 N954 T955 N956	S442-Y951 WeakPolarHBondContact OG-CD2 3.22Å; R459-Y951 HydrophobicContact CB-CE2 4.17Å; R459-Y951 VanDerWaalsContact CD-OH 3.27Å; R459-Y951 WeakPolarHBondContact CD-OH 3.49Å; D462-Y951 PolarHBondContact OD2-OH 3.31Å; L463-Y951 HydrophobicContact CD1-CE2 4.48Å; V947-Y951 HydrophobicContact CG1-CD1 4Å; V947-Y951 HydrophobicContact CG1-CD2 3.99Å; V947-Y951 HydrophobicContact CG1-CE1 3.68Å; V947-Y951 HydrophobicContact CG1-CE2 3.65Å; V947-Y951 HydrophobicContact CG1-CG 4.16Å; V947-Y951 VanDerWaalsContact CG1-CZ 3.47Å; V947-Y951 WeakPolarHBondContact O-CB 3.28Å; V947-Y951 PolarHBondContact O-N 3.47Å; Y951-I953 PolarHBondContact O-N 3.49Å; Y951-N954 PolarHBondContact O-N 3.18Å; Y951-N954 VanDerWaalsContact O-N 3.16Å; Y951-T955 WeakPolarHBondContact CD1-O 3.47Å; Y951-T955 PolarHBondContact N-O 3.44Å; Y951-N956 HydrophobicContact CD1-CB 4.43Å; Y951-N956 HydrophobicContact CE1-CB 3.88Å; Y951-N956 VanDerWaalsContact CE1-CG 3.43Å; Y951-N956 WeakPolarHBondContact CE1-ND2 3.39Å; Y951-N956 PolarHBondContact OH-ND2 3.24Å
952	T	86.8	Confident	89.8	Confident	51 Å²	51	13.7 Å²	13.7	31%	0.313	8%	0.075	S	C	.	.	H	α-helix	trans	-60.4	-29.4	176.7	-55.9	0	0	0	0	112.3	Y441 L948 I949 L950	Y441-T952 PolarHBondContact OH-OG1 2.67Å; L948-T952 PolarHBondContact O-N 2.84Å; L948-T952 PolarHBondContact O-OG1 2.94Å; I949-T952 VanDerWaalsContact O-CB 3.29Å; I949-T952 WeakPolarHBondContact O-CB 3.22Å; I949-T952 PolarHBondContact O-N 3.36Å; L950-T952 PolarHBondContact O-N 3.39Å
953	I	83.8	Confident	89.5	Confident	25 Å²	25	15 Å²	15	13%	0.128	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	15.7	-179.8	57.5	171.6	0	0	0	113.4	L950 Y951 T955 Y1019 L1031 E1045	L950-I953 HydrophobicContact CD2-CD1 4.33Å; L950-I953 CarbonylContact O-C 3.57Å; L950-I953 WeakPolarHBondContact O-CG1 3.46Å; L950-I953 PolarHBondContact O-N 3.32Å; L950-I953 VanDerWaalsContact O-N 3.09Å; Y951-I953 PolarHBondContact O-N 3.49Å; I953-T955 HydrophobicContact CD1-CG2 3.76Å; I953-T955 HydrophobicContact CG1-CG2 3.81Å; I953-Y1019 HydrophobicContact CD1-CE2 4.1Å; I953-Y1019 HydrophobicContact CG2-CE2 4.32Å; I953-Y1019 WeakPolarHBondContact CG2-OH 3.39Å; I953-L1031 HydrophobicContact CB-CD1 4.24Å; I953-L1031 HydrophobicContact CD1-CD1 3.75Å; I953-L1031 HydrophobicContact CG1-CD1 4.13Å; I953-E1045 HydrophobicContact CD1-CB 3.41Å; I953-E1045 VanDerWaalsContact CD1-CB 3.41Å; I953-E1045 HydrophobicContact CD1-CG 3.62Å
954	N	82.1	Confident	89.4	Confident	7 Å²	7	15.7 Å²	15.7	4%	0.037	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	44.1	-179.8	-166.3	31.3	0	0	0	114.1	L451 L950 Y951 V1035 A1037 N1040	L451-N954 WeakPolarHBondContact CD1-OD1 3.45Å; L950-N954 PolarHBondContact O-N 3.49Å; Y951-N954 PolarHBondContact O-N 3.18Å; Y951-N954 VanDerWaalsContact O-N 3.16Å; N954-V1035 PolarHBondContact ND2-O 2.92Å; N954-V1035 VanDerWaalsContact ND2-O 3.14Å; N954-A1037 WeakPolarHBondContact O-CA 3.4Å; N954-N1040 PolarHBondContact O-ND2 3.33Å; N954-N1040 VanDerWaalsContact O-ND2 3.08Å
955	T	86.6	Confident	89.3	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.086	C	C	.	.			trans	-136.8	172.7	169.4	-162.4	0	0	0	0	110.6	L950 Y951 I953 L1031 N1043	L950-T955 CarbonylContact C-O 3.17Å; L950-T955 HydrophobicContact CB-CG2 3.8Å; L950-T955 WeakPolarHBondContact CB-O 3.45Å; L950-T955 HydrophobicContact CD2-CG2 3.73Å; L950-T955 HydrophobicContact CG-CG2 4.26Å; L950-T955 PolarHBondContact O-N 3.43Å; Y951-T955 WeakPolarHBondContact CD1-O 3.47Å; Y951-T955 PolarHBondContact N-O 3.44Å; I953-T955 HydrophobicContact CD1-CG2 3.76Å; I953-T955 HydrophobicContact CG1-CG2 3.81Å; T955-L1031 HydrophobicContact CG2-CD1 4.24Å; T955-N1043 PolarHBondContact OG1-ND2 3.2Å
956	N	87.2	Confident	89.1	Confident	2 Å²	2	15.2 Å²	15.2	1%	0.011	9%	0.086	C	C	.	.			trans	-146	171.4	175.8	-158.6	4.3	0	0	0	111.2	Y255 R459 Y951	Y255-N956 PolarHBondContact OH-ND2 2.91Å; R459-N956 PolarHBondContact NH1-ND2 3.17Å; Y951-N956 HydrophobicContact CD1-CB 4.43Å; Y951-N956 HydrophobicContact CE1-CB 3.88Å; Y951-N956 VanDerWaalsContact CE1-CG 3.43Å; Y951-N956 WeakPolarHBondContact CE1-ND2 3.39Å; Y951-N956 PolarHBondContact OH-ND2 3.24Å
957	L	89	Confident	88.7	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.101	C	C	.	.			trans	-63.4	147.2	166.5	-66.3	168.7	0	0	0	110.4	V947 L950 F962 I965 N1046 F1050	V947-L957 HydrophobicContact CG2-CD1 4.1Å; L950-L957 HydrophobicContact CD1-CD2 3.98Å; L950-L957 HydrophobicContact CD1-CG 3.88Å; L957-F962 HydrophobicContact CB-CD2 4.01Å; L957-F962 HydrophobicContact CB-CE1 4.37Å; L957-F962 HydrophobicContact CB-CE2 3.58Å; L957-F962 HydrophobicContact CB-CZ 3.78Å; L957-F962 HydrophobicContact CD1-CD1 4.42Å; L957-F962 HydrophobicContact CD1-CE1 3.88Å; L957-F962 HydrophobicContact CD1-CZ 3.96Å; L957-F962 HydrophobicContact CG-CZ 4.42Å; L957-I965 HydrophobicContact CD1-CD1 4.28Å; L957-N1046 WeakPolarHBondContact CD2-OD1 2.73Å; L957-F1050 HydrophobicContact CD2-CB 4.11Å; L957-F1050 HydrophobicContact CD2-CD2 4.17Å
958	G	87.8	Confident	88.6	Confident	8 Å²	8	21.5 Å²	21.5	8%	0.082	12%	0.122	C	C	.	.			trans	-78.4	160.3	177.3	0	0	0	0	0	113.7	L960 Q961 F962	G958-L960 PolarHBondContact O-N 3.49Å; G958-Q961 WeakPolarHBondContact O-CA 3.07Å; G958-Q961 WeakPolarHBondContact O-CB 3.5Å; G958-Q961 PolarHBondContact O-N 3.33Å; G958-F962 WeakPolarHBondContact O-CD2 3.06Å; G958-F962 PolarHBondContact O-N 3.28Å
959	D	87.4	Confident	88.7	Confident	27 Å²	27	20 Å²	20	14%	0.144	11%	0.114	C	C	.	.	H	α-helix	trans	-53.9	-51.5	-179.8	-169.3	9.6	0	0	0	112.2	Y255 Y256 W257 Y258 Q961 F962 L963	Y255-D959 HydrophobicContact CD1-CB 4.06Å; Y256-D959 PolarHBondContact N-OD2 3.41Å; W257-D959 WeakPolarHBondContact CB-OD2 3.32Å; W257-D959 PolarHBondContact N-OD2 2.82Å; Y258-D959 WeakPolarHBondContact CB-OD1 3.48Å; Y258-D959 PolarHBondContact N-OD1 2.9Å; D959-Q961 VanDerWaalsContact C-N 3.28Å; D959-Q961 PolarHBondContact O-N 2.93Å; D959-F962 PolarHBondContact O-N 2.9Å; D959-L963 PolarHBondContact O-N 3.17Å; D959-L963 VanDerWaalsContact O-N 3.1Å
960	L	88.7	Confident	88.7	Confident	62 Å²	62	19.5 Å²	19.5	33%	0.325	11%	0.112	S	C	.	.	H	α-helix	trans	-70.8	-21.5	177.4	-73	175.4	0	0	0	113.7	G958 L963 A964 P1104 L1105	G958-L960 PolarHBondContact O-N 3.49Å; L960-L963 HydrophobicContact CD2-CD2 3.98Å; L960-A964 VanDerWaalsContact O-CB 3.32Å; L960-A964 WeakPolarHBondContact O-CB 3.37Å; L960-A964 PolarHBondContact O-N 2.91Å; L960-P1104 WeakPolarHBondContact CB-O 3.44Å; L960-P1104 HydrophobicContact CD1-CB 3.82Å; L960-P1104 WeakPolarHBondContact CD1-O 3.27Å; L960-L1105 HydrophobicContact CB-CD2 4.36Å
961	Q	91.8	Very high	88.6	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-72.3	-44.9	174.1	-66.5	179.3	-17.7	0	0	110.7	G958 D959 L963 A964 I965 N1046 F1050 L1105	G958-Q961 WeakPolarHBondContact O-CA 3.07Å; G958-Q961 WeakPolarHBondContact O-CB 3.5Å; G958-Q961 PolarHBondContact O-N 3.33Å; D959-Q961 VanDerWaalsContact C-N 3.28Å; D959-Q961 PolarHBondContact O-N 2.93Å; Q961-L963 VanDerWaalsContact C-N 3.33Å; Q961-L963 PolarHBondContact O-N 3.49Å; Q961-A964 PolarHBondContact O-N 3.49Å; Q961-I965 WeakPolarHBondContact O-CB 3.48Å; Q961-I965 WeakPolarHBondContact O-CD1 3.36Å; Q961-I965 VanDerWaalsContact O-CG1 3.22Å; Q961-I965 WeakPolarHBondContact O-CG1 3.23Å; Q961-I965 PolarHBondContact O-N 2.98Å; Q961-N1046 PolarHBondContact NE2-ND2 3.42Å; Q961-N1046 PolarHBondContact OE1-ND2 3.5Å; Q961-N1046 PolarHBondContact OE1-OD1 2.86Å; Q961-F1050 HydrophobicContact CB-CD2 3.7Å; Q961-F1050 HydrophobicContact CB-CE2 3.52Å; Q961-F1050 HydrophobicContact CB-CZ 4.29Å; Q961-F1050 HydrophobicContact CG-CD2 3.81Å; Q961-F1050 HydrophobicContact CG-CE2 3.73Å; Q961-F1050 HydrophobicContact CG-CG 4.24Å; Q961-F1050 HydrophobicContact CG-CZ 4.09Å; Q961-L1105 HydrophobicContact CG-CD2 4.27Å; Q961-L1105 WeakPolarHBondContact CG-O 3.2Å; Q961-L1105 PolarHBondContact NE2-O 2.88Å
962	F	89.2	Confident	88.9	Confident	8 Å²	8	24.4 Å²	24.4	4%	0.035	14%	0.143	C	C	.	.	H	α-helix	trans	-57.1	-47.1	170.9	-81.3	-67.3	0	0	0	111.2	Y255 Y258 Q943 V947 L957 G958 D959 A964 I965 D966	Y255-F962 HydrophobicContact CE2-CE2 4.34Å; Y258-F962 HydrophobicContact CD2-CB 4.23Å; Y258-F962 HydrophobicContact CE2-CB 4.4Å; Y258-F962 HydrophobicContact CG-CB 4.31Å; Q943-F962 HydrophobicContact CG-CE1 4.37Å; Q943-F962 VanDerWaalsContact NE2-CD1 3.32Å; V947-F962 HydrophobicContact CG2-CE1 4.34Å; V947-F962 HydrophobicContact CG2-CZ 4.05Å; L957-F962 HydrophobicContact CB-CD2 4.01Å; L957-F962 HydrophobicContact CB-CE1 4.37Å; L957-F962 HydrophobicContact CB-CE2 3.58Å; L957-F962 HydrophobicContact CB-CZ 3.78Å; L957-F962 HydrophobicContact CD1-CD1 4.42Å; L957-F962 HydrophobicContact CD1-CE1 3.88Å; L957-F962 HydrophobicContact CD1-CZ 3.96Å; L957-F962 HydrophobicContact CG-CZ 4.42Å; G958-F962 WeakPolarHBondContact O-CD2 3.06Å; G958-F962 PolarHBondContact O-N 3.28Å; D959-F962 PolarHBondContact O-N 2.9Å; F962-A964 PolarHBondContact O-N 3.35Å; F962-I965 PolarHBondContact O-N 3.07Å; F962-D966 WeakPolarHBondContact O-CB 3.2Å; F962-D966 PolarHBondContact O-N 3.49Å; F962-D966 VanDerWaalsContact O-OD1 3.11Å
963	L	88.9	Confident	89.2	Confident	28 Å²	28	22 Å²	22	15%	0.147	13%	0.128	C	C	.	.	H	α-helix	trans	-59.9	-44.4	177.4	-172.2	68.2	0	0	0	112.6	Y258 C261 D959 L960 Q961 I965 L967	Y258-L963 HydrophobicContact CD2-CB 4.23Å; Y258-L963 HydrophobicContact CD2-CD1 4.12Å; C261-L963 HydrophobicContact CB-CD1 3.66Å; D959-L963 PolarHBondContact O-N 3.17Å; D959-L963 VanDerWaalsContact O-N 3.1Å; L960-L963 HydrophobicContact CD2-CD2 3.98Å; Q961-L963 VanDerWaalsContact C-N 3.33Å; Q961-L963 PolarHBondContact O-N 3.49Å; L963-I965 VanDerWaalsContact C-N 3.34Å; L963-I965 PolarHBondContact O-N 3.34Å; L963-L967 HydrophobicContact CD1-CB 4.12Å; L963-L967 HydrophobicContact CD1-CD2 3.86Å; L963-L967 VanDerWaalsContact O-CB 3.27Å; L963-L967 WeakPolarHBondContact O-CB 3.26Å; L963-L967 PolarHBondContact O-N 3.01Å
964	A	90.8	Very high	89.5	Confident	22 Å²	22	21 Å²	21	18%	0.182	12%	0.123	C	C	.	.	I	π-helix	trans	-63.2	-40.4	177.8	0	0	0	0	0	112.1	L960 Q961 F962 V968 I969 L1105	L960-A964 VanDerWaalsContact O-CB 3.32Å; L960-A964 WeakPolarHBondContact O-CB 3.37Å; L960-A964 PolarHBondContact O-N 2.91Å; Q961-A964 PolarHBondContact O-N 3.49Å; F962-A964 PolarHBondContact O-N 3.35Å; A964-V968 VanDerWaalsContact O-CB 3.3Å; A964-V968 WeakPolarHBondContact O-CB 3.32Å; A964-V968 PolarHBondContact O-N 3.37Å; A964-I969 PolarHBondContact O-N 3.4Å; A964-L1105 HydrophobicContact CB-CD2 4.23Å
965	I	91.9	Very high	90	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.135	C	C	.	.	I	π-helix	trans	-66.8	-55.8	179.2	-71	167.5	0	0	0	111	Y939 L957 Q961 F962 L963 T970 F1050 Y1057	Y939-I965 HydrophobicContact CE2-CG2 3.6Å; L957-I965 HydrophobicContact CD1-CD1 4.28Å; Q961-I965 WeakPolarHBondContact O-CB 3.48Å; Q961-I965 WeakPolarHBondContact O-CD1 3.36Å; Q961-I965 VanDerWaalsContact O-CG1 3.22Å; Q961-I965 WeakPolarHBondContact O-CG1 3.23Å; Q961-I965 PolarHBondContact O-N 2.98Å; F962-I965 PolarHBondContact O-N 3.07Å; L963-I965 VanDerWaalsContact C-N 3.34Å; L963-I965 PolarHBondContact O-N 3.34Å; I965-T970 VanDerWaalsContact O-CB 3.25Å; I965-T970 WeakPolarHBondContact O-CB 3.33Å; I965-T970 PolarHBondContact O-N 3.44Å; I965-T970 PolarHBondContact O-OG1 2.8Å; I965-F1050 HydrophobicContact CD1-CD2 3.94Å; I965-F1050 HydrophobicContact CD1-CE2 3.88Å; I965-F1050 HydrophobicContact CG1-CD2 4.48Å; I965-F1050 HydrophobicContact CG1-CE2 3.96Å; I965-Y1057 HydrophobicContact CB-CE2 4.19Å; I965-Y1057 HydrophobicContact CD1-CE2 4Å; I965-Y1057 HydrophobicContact CG1-CD2 4.45Å; I965-Y1057 HydrophobicContact CG1-CE2 3.81Å; I965-Y1057 HydrophobicContact CG2-CD2 3.96Å; I965-Y1057 HydrophobicContact CG2-CE2 3.38Å
966	D	89.4	Confident	90.3	Very high	18 Å²	18	24.4 Å²	24.4	10%	0.096	14%	0.143	C	C	.	.	I	π-helix	trans	-73.9	-47.7	-171.1	-73.6	57.1	0	0	0	111.6	Y258 Y939 Q943 F962 T971	Y258-D966 HydrophobicContact CE2-CB 4.08Å; Y258-D966 PolarHBondContact OH-OD2 3.05Å; Y939-D966 PolarHBondContact OH-OD1 3.43Å; Y939-D966 PolarHBondContact OH-OD2 3.31Å; Q943-D966 PolarHBondContact NE2-OD1 2.84Å; F962-D966 WeakPolarHBondContact O-CB 3.2Å; F962-D966 PolarHBondContact O-N 3.49Å; F962-D966 VanDerWaalsContact O-OD1 3.11Å; D966-T971 PolarHBondContact O-N 2.89Å; D966-T971 VanDerWaalsContact O-N 3.08Å; D966-T971 PolarHBondContact O-OG1 2.97Å
967	L	87.4	Confident	90.5	Very high	58 Å²	58	24.3 Å²	24.3	30%	0.304	14%	0.143	S	C	.	.	I	π-helix	trans	-90.5	-43.2	-171.7	-173.2	59.5	0	0	0	113	I265 L963 T971	I265-L967 HydrophobicContact CD1-CD1 3.46Å; I265-L967 VanDerWaalsContact CD1-CD1 3.46Å; I265-L967 HydrophobicContact CD1-CD2 4.01Å; I265-L967 HydrophobicContact CD1-CG 4.38Å; L963-L967 HydrophobicContact CD1-CB 4.12Å; L963-L967 HydrophobicContact CD1-CD2 3.86Å; L963-L967 VanDerWaalsContact O-CB 3.27Å; L963-L967 WeakPolarHBondContact O-CB 3.26Å; L963-L967 PolarHBondContact O-N 3.01Å; L967-T971 WeakPolarHBondContact O-CB 3.33Å
968	V	91.1	Very high	90.7	Very high	74 Å²	74	24.4 Å²	24.4	45%	0.448	14%	0.143	S	C	.	.	I	π-helix	trans	-84.1	-54.9	-175.3	-177.3	0	0	0	0	110.7	A964 T972 L1087	A964-V968 VanDerWaalsContact O-CB 3.3Å; A964-V968 WeakPolarHBondContact O-CB 3.32Å; A964-V968 PolarHBondContact O-N 3.37Å; V968-T972 WeakPolarHBondContact O-CB 3.4Å; V968-T972 PolarHBondContact O-OG1 3.15Å; V968-L1087 HydrophobicContact CG1-CD2 4.12Å
969	I	93.8	Very high	90.9	Very high	8 Å²	8	29.9 Å²	29.9	4%	0.041	16%	0.161	C	C	.	.	I	π-helix	trans	-77	-61.5	-175.7	-62.4	173.7	0	0	0	110.4	A964 V973 L1058 L1091	A964-I969 PolarHBondContact O-N 3.4Å; I969-V973 WeakPolarHBondContact O-CB 3.41Å; I969-V973 VanDerWaalsContact O-CG2 3.27Å; I969-V973 WeakPolarHBondContact O-CG2 3.32Å; I969-V973 PolarHBondContact O-N 3.39Å; I969-V973 VanDerWaalsContact O-N 3.08Å; I969-L1058 HydrophobicContact CG2-CD2 3.75Å; I969-L1058 HydrophobicContact CG2-CG 4.33Å; I969-L1091 HydrophobicContact CD1-CD2 4.43Å
970	T	91.8	Very high	91	Very high	5 Å²	5	28.9 Å²	28.9	3%	0.031	16%	0.156	C	C	.	.	I	π-helix	trans	-69.7	-46.8	-166.4	-57.2	0	0	0	0	112.3	Y935 M936 Y939 I965 V973 A974	Y935-T970 HydrophobicContact CE1-CG2 3.84Å; Y935-T970 WeakPolarHBondContact OH-CA 3.31Å; M936-T970 HydrophobicContact CE-CG2 4.45Å; M936-T970 HydrophobicContact SD-CG2 4.43Å; Y939-T970 HydrophobicContact CD1-CG2 3.95Å; Y939-T970 HydrophobicContact CD2-CG2 3.87Å; Y939-T970 WeakPolarHBondContact CD2-OG1 3.49Å; Y939-T970 HydrophobicContact CE1-CG2 4.09Å; Y939-T970 HydrophobicContact CE2-CG2 4.03Å; Y939-T970 WeakPolarHBondContact CE2-OG1 3.47Å; Y939-T970 HydrophobicContact CG-CG2 3.84Å; I965-T970 VanDerWaalsContact O-CB 3.25Å; I965-T970 WeakPolarHBondContact O-CB 3.33Å; I965-T970 PolarHBondContact O-N 3.44Å; I965-T970 PolarHBondContact O-OG1 2.8Å; T970-V973 PolarHBondContact O-N 2.71Å; T970-A974 WeakPolarHBondContact O-CB 3.44Å; T970-A974 PolarHBondContact O-N 3.29Å
971	T	88.9	Confident	91.2	Very high	58 Å²	58	26.7 Å²	26.7	36%	0.356	15%	0.148	S	C	.	.	H	α-helix	trans	-64.2	-46	179.4	-61.1	0	0	0	0	111.8	D966 L967 V973 A974 V975	D966-T971 PolarHBondContact O-N 2.89Å; D966-T971 VanDerWaalsContact O-N 3.08Å; D966-T971 PolarHBondContact O-OG1 2.97Å; L967-T971 WeakPolarHBondContact O-CB 3.33Å; T971-V973 PolarHBondContact O-N 3.02Å; T971-A974 PolarHBondContact O-N 3Å; T971-V975 HydrophobicContact CG2-CG2 4.38Å; T971-V975 WeakPolarHBondContact O-CB 3.33Å; T971-V975 VanDerWaalsContact O-CG2 3.3Å; T971-V975 WeakPolarHBondContact O-CG2 3.49Å; T971-V975 PolarHBondContact O-N 2.94Å
972	T	92.4	Very high	91.3	Very high	51 Å²	51	27.3 Å²	27.3	31%	0.313	15%	0.152	S	C	.	.	H	α-helix	trans	-58	-49.3	178.2	-60.3	0	0	0	0	111.2	V968 L976 A1083 L1087	V968-T972 WeakPolarHBondContact O-CB 3.4Å; V968-T972 PolarHBondContact O-OG1 3.15Å; T972-L976 HydrophobicContact CG2-CD1 3.76Å; T972-L976 WeakPolarHBondContact O-CB 3.31Å; T972-L976 VanDerWaalsContact O-CG 3.23Å; T972-L976 WeakPolarHBondContact O-CG 3.3Å; T972-L976 PolarHBondContact O-N 2.7Å; T972-A1083 HydrophobicContact CG2-CB 4.14Å; T972-L1087 HydrophobicContact CG2-CD1 4.43Å
973	V	93.3	Very high	91.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.3	-45.2	-178.6	169	0	0	0	0	111.4	Y935 I969 T970 T971 V975 L976 M977 L1058 A1061 F1080 L1084 L1087	Y935-V973 HydrophobicContact CE1-CG1 4.36Å; I969-V973 WeakPolarHBondContact O-CB 3.41Å; I969-V973 VanDerWaalsContact O-CG2 3.27Å; I969-V973 WeakPolarHBondContact O-CG2 3.32Å; I969-V973 PolarHBondContact O-N 3.39Å; I969-V973 VanDerWaalsContact O-N 3.08Å; T970-V973 PolarHBondContact O-N 2.71Å; T971-V973 PolarHBondContact O-N 3.02Å; V973-V975 VanDerWaalsContact C-N 3.34Å; V973-V975 PolarHBondContact O-N 3.13Å; V973-L976 PolarHBondContact O-N 2.9Å; V973-M977 VanDerWaalsContact O-CB 3.3Å; V973-M977 WeakPolarHBondContact O-CB 3.37Å; V973-M977 VanDerWaalsContact O-CG 3.22Å; V973-M977 WeakPolarHBondContact O-CG 3.47Å; V973-M977 PolarHBondContact O-N 3.43Å; V973-L1058 HydrophobicContact CG2-CD2 3.81Å; V973-A1061 HydrophobicContact CB-CB 4.49Å; V973-A1061 HydrophobicContact CG1-CB 3.09Å; V973-F1080 HydrophobicContact CB-CE2 4.36Å; V973-F1080 HydrophobicContact CG1-CE2 3.65Å; V973-F1080 HydrophobicContact CG1-CZ 4.19Å; V973-F1080 HydrophobicContact CG2-CE2 4.48Å; V973-L1084 HydrophobicContact CG2-CD2 4.38Å; V973-L1087 HydrophobicContact CG2-CD1 4.09Å
974	A	90.9	Very high	91.3	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.033	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-40.9	179	0	0	0	0	0	112.9	Y935 M936 T970 T971 M977 S978	Y935-A974 HydrophobicContact CD1-CB 4.33Å; Y935-A974 HydrophobicContact CE1-CB 4.1Å; M936-A974 HydrophobicContact CE-CB 3.41Å; M936-A974 VanDerWaalsContact CE-CB 3.41Å; T970-A974 WeakPolarHBondContact O-CB 3.44Å; T970-A974 PolarHBondContact O-N 3.29Å; T971-A974 PolarHBondContact O-N 3Å; A974-M977 WeakPolarHBondContact O-CG 3.24Å; A974-S978 PolarHBondContact O-N 2.94Å; A974-S978 PolarHBondContact O-OG 2.87Å
975	V	91.1	Very high	91.1	Very high	47 Å²	47	35.1 Å²	35.1	29%	0.285	20%	0.204	S	C	.	.	H	α-helix	trans	-70	-46.7	177.8	172.5	0	0	0	0	110.9	Y482 T971 V973 S978	Y482-V975 HydrophobicContact CE2-CG1 4.3Å; Y482-V975 VanDerWaalsContact OH-CG1 3.31Å; Y482-V975 WeakPolarHBondContact OH-CG1 3.42Å; T971-V975 HydrophobicContact CG2-CG2 4.38Å; T971-V975 WeakPolarHBondContact O-CB 3.33Å; T971-V975 VanDerWaalsContact O-CG2 3.3Å; T971-V975 WeakPolarHBondContact O-CG2 3.49Å; T971-V975 PolarHBondContact O-N 2.94Å; V973-V975 VanDerWaalsContact C-N 3.34Å; V973-V975 PolarHBondContact O-N 3.13Å; V975-S978 WeakPolarHBondContact O-CB 3.17Å; V975-S978 PolarHBondContact O-N 3.44Å
976	L	93.4	Very high	90.9	Very high	32 Å²	32	36.5 Å²	36.5	17%	0.168	21%	0.211	C	C	.	.	H	α-helix	trans	-72.7	-37.5	-175.6	-66.3	177.9	0	0	0	113	T972 V973 S978 R979 N1077 P1079 F1080 A1083	T972-L976 HydrophobicContact CG2-CD1 3.76Å; T972-L976 WeakPolarHBondContact O-CB 3.31Å; T972-L976 VanDerWaalsContact O-CG 3.23Å; T972-L976 WeakPolarHBondContact O-CG 3.3Å; T972-L976 PolarHBondContact O-N 2.7Å; V973-L976 PolarHBondContact O-N 2.9Å; L976-S978 PolarHBondContact O-N 3Å; L976-R979 VanDerWaalsContact O-CB 3.3Å; L976-R979 WeakPolarHBondContact O-CB 3.24Å; L976-R979 PolarHBondContact O-N 3.17Å; L976-R979 VanDerWaalsContact O-N 3.11Å; L976-N1077 PolarHBondContact O-ND2 3.15Å; L976-P1079 HydrophobicContact CD2-CB 4.08Å; L976-F1080 HydrophobicContact CB-CB 4.06Å; L976-F1080 HydrophobicContact CB-CD2 3.96Å; L976-F1080 HydrophobicContact CB-CG 4.41Å; L976-A1083 HydrophobicContact CD1-CB 3.36Å
977	M	92.4	Very high	90.6	Very high	1 Å²	1	37 Å²	37	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-61.4	-32	174.8	74.5	-179.1	-68.5	0	0	111.5	V932 Y935 V973 A974 R979 T980 V1064 S1065 F1080	V932-M977 HydrophobicContact CG2-CE 4.06Å; V932-M977 HydrophobicContact CG2-CG 4.01Å; V932-M977 HydrophobicContact CG2-SD 3.97Å; Y935-M977 HydrophobicContact CD1-SD 4Å; Y935-M977 HydrophobicContact CG-SD 4.14Å; V973-M977 VanDerWaalsContact O-CB 3.3Å; V973-M977 WeakPolarHBondContact O-CB 3.37Å; V973-M977 VanDerWaalsContact O-CG 3.22Å; V973-M977 WeakPolarHBondContact O-CG 3.47Å; V973-M977 PolarHBondContact O-N 3.43Å; A974-M977 WeakPolarHBondContact O-CG 3.24Å; M977-R979 PolarHBondContact O-N 3.43Å; M977-T980 PolarHBondContact O-N 2.82Å; M977-T980 PolarHBondContact O-OG1 2.84Å; M977-V1064 HydrophobicContact CE-CG2 4.01Å; M977-S1065 WeakPolarHBondContact CE-OG 3.42Å; M977-F1080 HydrophobicContact CB-CD1 4.38Å; M977-F1080 HydrophobicContact CB-CD2 4.34Å; M977-F1080 HydrophobicContact CB-CE1 3.95Å; M977-F1080 HydrophobicContact CB-CE2 3.98Å; M977-F1080 HydrophobicContact CB-CZ 3.76Å
978	S	91.3	Very high	90.5	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.007	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-15.8	178.7	-60.9	0	0	0	0	113.9	C479 V932 A974 V975 L976 T980	C479-S978 PolarHBondContact SG-OG 3.42Å; V932-S978 WeakPolarHBondContact CG2-OG 3.42Å; A974-S978 PolarHBondContact O-N 2.94Å; A974-S978 PolarHBondContact O-OG 2.87Å; V975-S978 WeakPolarHBondContact O-CB 3.17Å; V975-S978 PolarHBondContact O-N 3.44Å; L976-S978 PolarHBondContact O-N 3Å; S978-T980 VanDerWaalsContact C-N 3.28Å; S978-T980 PolarHBondContact O-N 2.87Å
979	R	92.2	Very high	90.3	Very high	123 Å²	123	42.1 Å²	42.1	46%	0.464	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-7.6	-178	-161.5	174.7	171.6	154.6	-3.1	113.6	Y482 L976 M977 G981	Y482-R979 HydrophobicContact CE2-CB 4.44Å; L976-R979 VanDerWaalsContact O-CB 3.3Å; L976-R979 WeakPolarHBondContact O-CB 3.24Å; L976-R979 PolarHBondContact O-N 3.17Å; L976-R979 VanDerWaalsContact O-N 3.11Å; M977-R979 PolarHBondContact O-N 3.43Å; R979-G981 PolarHBondContact O-N 3.12Å
980	T	91.4	Very high	89.9	Confident	7 Å²	7	46 Å²	46	4%	0.043	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-57.3	132	-178.6	-51.5	0	0	0	0	111.3	C924 M977 S978 R1071 N1077	C924-T980 PolarHBondContact SG-O 2.85Å; M977-T980 PolarHBondContact O-N 2.82Å; M977-T980 PolarHBondContact O-OG1 2.84Å; S978-T980 VanDerWaalsContact C-N 3.28Å; S978-T980 PolarHBondContact O-N 2.87Å; T980-R1071 HydrophobicContact CG2-CB 4.01Å; T980-R1071 HydrophobicContact CG2-CG 4.49Å; T980-N1077 PolarHBondContact OG1-ND2 2.9Å; T980-N1077 VanDerWaalsContact OG1-ND2 3.11Å
981	G	91.8	Very high	89.6	Confident	15 Å²	15	46 Å²	46	16%	0.155	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-85.4	166.8	-175.7	0	0	0	0	0	114.3	R979 R1071 R1072	R979-G981 PolarHBondContact O-N 3.12Å; G981-R1071 WeakPolarHBondContact O-CA 3.32Å; G981-R1072 PolarHBondContact O-N 3.29Å
982	P	93.8	Very high	89.1	Confident	13 Å²	13	46 Å²	46	8%	0.084	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-71.3	153.8	-179.1	32.4	-39.4	0	0	0	112.6	R920 E921 C924 R1072	R920-P982 HydrophobicContact CB-CB 4.4Å; E921-P982 HydrophobicContact CG-CG 4.27Å; E921-P982 WeakPolarHBondContact OE1-CD 3.09Å; E921-P982 VanDerWaalsContact OE1-CG 3.23Å; E921-P982 WeakPolarHBondContact OE1-CG 3.42Å; C924-P982 HydrophobicContact CB-CB 3.65Å; C924-P982 VanDerWaalsContact SG-CA 3.57Å; C924-P982 VanDerWaalsContact SG-N 3.44Å; P982-R1072 VanDerWaalsContact O-CG 3.22Å; P982-R1072 WeakPolarHBondContact O-CG 3.39Å; P982-R1072 PolarHBondContact O-NE 3.33Å
983	A	90.6	Very high	88	Confident	18 Å²	18	44.8 Å²	44.8	15%	0.149	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-53.8	148.4	170.1	0	0	0	0	0	111.8	R920 A985 F1070	R920-A983 VanDerWaalsContact CZ-O 3.23Å; R920-A983 PolarHBondContact NE-O 3.29Å; R920-A983 PolarHBondContact NH2-O 2.92Å; A983-A985 PolarHBondContact O-N 3.25Å; A983-F1070 PolarHBondContact N-O 3.49Å
984	L	86.8	Confident	87.3	Confident	132 Å²	132	46.3 Å²	46.3	69%	0.691	26%	0.263	S	S	*	.	S	Bend	trans	-68.9	-31.2	-176	-69.2	175.6	0	0	0	113.7	R920	R920-L984 PolarHBondContact NH1-O 3.28Å; R920-L984 VanDerWaalsContact NH2-C 3.28Å; R920-L984 VanDerWaalsContact NH2-CA 3.28Å; R920-L984 PolarHBondContact NH2-O 3Å
985	A	86.8	Confident	86.6	Confident	73 Å²	73	46.3 Å²	46.3	60%	0.603	26%	0.262	S	S	*	.	S	Bend	trans	-118.9	153	178.4	0	0	0	0	0	111	A983 G987	A983-A985 PolarHBondContact O-N 3.25Å; A985-G987 PolarHBondContact O-N 3.3Å
986	L	87.9	Confident	85.9	Confident	28 Å²	28	47.8 Å²	47.8	15%	0.147	27%	0.268	C	S	.	.			trans	-75.1	114.1	172.7	-171.6	68.4	0	0	0	108.8	L738 T741 I743 P916 I919 R920 R923	L738-L986 HydrophobicContact CD2-CD2 4.15Å; T741-L986 HydrophobicContact CG2-CB 3.99Å; T741-L986 HydrophobicContact CG2-CD2 3.81Å; T741-L986 HydrophobicContact CG2-CG 3.67Å; T741-L986 WeakPolarHBondContact CG2-O 3.24Å; T741-L986 WeakPolarHBondContact OG1-CD2 3.26Å; I743-L986 HydrophobicContact CD1-CD2 4.06Å; P916-L986 HydrophobicContact CB-CD2 4.5Å; I919-L986 HydrophobicContact CB-CD1 4.11Å; I919-L986 HydrophobicContact CG2-CD1 3.55Å; R920-L986 HydrophobicContact CG-CB 4.22Å; R920-L986 HydrophobicContact CG-CD1 3.74Å; R923-L986 VanDerWaalsContact NH1-CD1 3.27Å
987	G	84	Confident	85.2	Confident	30 Å²	30	47.8 Å²	47.8	31%	0.309	27%	0.271	S	S	.	.			trans	-79	168.7	176.5	0	0	0	0	0	113.8	T741 R923 A985	T741-G987 WeakPolarHBondContact CG2-O 3.37Å; R923-G987 PolarHBondContact NH1-O 3.44Å; A985-G987 PolarHBondContact O-N 3.3Å
988	R	85.6	Confident	84.7	Confident	147 Å²	147	50.8 Å²	50.8	56%	0.555	29%	0.289	S	S	*	.	S	Bend	trans	-83.8	-26.3	174.1	-178.3	169.2	153.2	-167.9	-15	113.5	R742	R742-R988 HydrophobicContact CG-CG 4.44Å
989	V	85.1	Confident	84.3	Confident	91 Å²	91	53.5 Å²	53.5	55%	0.552	31%	0.307	S	S	*	.			trans	-73.4	150.9	178.8	-167.1	0	0	0	0	108.9	R923 F1070	R923-V989 PolarHBondContact NH1-O 2.92Å; V989-F1070 HydrophobicContact CB-CE1 4.25Å; V989-F1070 HydrophobicContact CB-CZ 4.12Å; V989-F1070 HydrophobicContact CG1-CE1 4.49Å; V989-F1070 HydrophobicContact CG1-CZ 3.89Å; V989-F1070 WeakPolarHBondContact O-CE1 3.46Å
990	R	86.3	Confident	83.8	Confident	89 Å²	89	48.1 Å²	48.1	34%	0.336	29%	0.288	S	S	.	.			trans	-116.3	147.2	171.8	-69.6	174.3	-69.1	-148	-8.6	108.9	Q507 F1070	Q507-R990 VanDerWaalsContact CG-NH1 3.27Å; R990-F1070 VanDerWaalsContact C-CZ 3.4Å
991	P	85.3	Confident	83.5	Confident	7 Å²	7	51.6 Å²	51.6	5%	0.045	31%	0.306	C	S	.	.			trans	-58.4	160.6	175.3	-20.7	30	0	0	0	111.3	K505 R923 L926 F1070	K505-P991 VanDerWaalsContact NZ-C 3.26Å; K505-P991 PolarHBondContact NZ-O 2.81Å; R923-P991 HydrophobicContact CB-CG 3.98Å; R923-P991 HydrophobicContact CG-CG 4.13Å; L926-P991 HydrophobicContact CD2-CB 4.06Å; L926-P991 HydrophobicContact CD2-CG 4.45Å; L926-P991 HydrophobicContact CG-CB 4.34Å; P991-F1070 HydrophobicContact CB-CD2 4.44Å; P991-F1070 HydrophobicContact CB-CE2 4.18Å; P991-F1070 HydrophobicContact CB-CZ 4.39Å; P991-F1070 HydrophobicContact CG-CD1 4.01Å; P991-F1070 HydrophobicContact CG-CD2 4.08Å; P991-F1070 HydrophobicContact CG-CE1 4.01Å; P991-F1070 HydrophobicContact CG-CE2 4.07Å; P991-F1070 HydrophobicContact CG-CG 4.04Å; P991-F1070 HydrophobicContact CG-CZ 4.04Å
992	P	77.9	Confident	83.3	Confident	57 Å²	57	52.1 Å²	52.1	37%	0.37	31%	0.307	S	S	.	.			trans	-65	148.2	169.9	27.5	-33.1	0	0	0	110.9	K505 F930	K505-P992 PolarHBondContact NZ-O 3.01Å; F930-P992 HydrophobicContact CD1-CG 4.26Å; F930-P992 HydrophobicContact CE1-CB 4.35Å; F930-P992 HydrophobicContact CE1-CG 4Å; F930-P992 HydrophobicContact CE2-CG 4.37Å; F930-P992 WeakPolarHBondContact CE2-O 3.37Å; F930-P992 HydrophobicContact CZ-CB 4.26Å; F930-P992 HydrophobicContact CZ-CG 4.09Å; F930-P992 VanDerWaalsContact CZ-O 3.23Å; F930-P992 WeakPolarHBondContact CZ-O 3.47Å
993	G	70.6	Confident	83.1	Confident	26 Å²	26	51.6 Å²	51.6	27%	0.268	30%	0.304	S	S	.	.	S	Bend	trans	-106.7	-8.3	-178.6	0	0	0	0	0	114.7	K505	K505-G993 VanDerWaalsContact CE-CA 3.41Å
994	A	78.3	Confident	83	Confident	31 Å²	31	51.1 Å²	51.1	26%	0.256	30%	0.299	S	S	.	.			trans	-125.9	127.9	-178	0	0	0	0	0	109.4
995	L	75.2	Confident	83.2	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	29%	0.293	C	S	.	.	S	Bend	trans	-67.1	-41.5	177.9	-76.5	166.5	0	0	0	112.2	F420 H423 F930 F933 S997 V1000	F420-L995 HydrophobicContact CD1-CD1 4.25Å; F420-L995 HydrophobicContact CD2-CD1 3.82Å; F420-L995 HydrophobicContact CD2-CD2 3.9Å; F420-L995 HydrophobicContact CD2-CG 3.57Å; F420-L995 HydrophobicContact CE1-CD1 4.17Å; F420-L995 HydrophobicContact CE2-CD1 3.77Å; F420-L995 HydrophobicContact CE2-CD2 3.36Å; F420-L995 HydrophobicContact CE2-CG 3.56Å; F420-L995 HydrophobicContact CG-CD1 4.06Å; F420-L995 HydrophobicContact CG-CG 4.25Å; F420-L995 HydrophobicContact CZ-CD1 3.94Å; F420-L995 HydrophobicContact CZ-CD2 3.96Å; F420-L995 HydrophobicContact CZ-CG 4.21Å; F420-L995 VanDerWaalsContact O-CD1 3.31Å; F420-L995 WeakPolarHBondContact O-CD1 3.35Å; H423-L995 HydrophobicContact CB-CB 3.89Å; H423-L995 HydrophobicContact CB-CD1 4.47Å; F930-L995 HydrophobicContact CD1-CD2 3.58Å; F930-L995 HydrophobicContact CE1-CD2 3.57Å; F930-L995 HydrophobicContact CE1-CG 4.04Å; F930-L995 HydrophobicContact CG-CD2 4.34Å; F930-L995 HydrophobicContact CZ-CD2 4.28Å; F930-L995 HydrophobicContact CZ-CG 4.42Å; F933-L995 HydrophobicContact CB-CD2 4.36Å; F933-L995 HydrophobicContact CD1-CD1 4.39Å; F933-L995 HydrophobicContact CD1-CD2 3.49Å; F933-L995 VanDerWaalsContact CD1-CD2 3.49Å; F933-L995 HydrophobicContact CD2-CD1 4.12Å; F933-L995 HydrophobicContact CD2-CD2 4.46Å; F933-L995 HydrophobicContact CE1-CD1 4.21Å; F933-L995 HydrophobicContact CE1-CD2 3.79Å; F933-L995 HydrophobicContact CE1-CG 4.44Å; F933-L995 HydrophobicContact CE2-CD1 3.94Å; F933-L995 HydrophobicContact CG-CD1 4.32Å; F933-L995 HydrophobicContact CG-CD2 3.84Å; F933-L995 HydrophobicContact CZ-CD1 3.95Å; F933-L995 HydrophobicContact CZ-CD2 4.37Å; L995-S997 PolarHBondContact O-N 3.08Å; L995-V1000 WeakPolarHBondContact O-CB 3.21Å; L995-V1000 WeakPolarHBondContact O-CG1 3.4Å
996	L	76.9	Confident	83.5	Confident	78 Å²	78	50.3 Å²	50.3	41%	0.408	28%	0.284	S	S	.	.	S	Bend	trans	-80.2	53.6	179.8	-64.4	169.7	0	0	0	112	H423 K426 F427	H423-L996 HydrophobicContact CB-CD1 4.33Å; H423-L996 HydrophobicContact CB-CG 4.29Å; H423-L996 WeakPolarHBondContact ND1-CD1 3.1Å; K426-L996 HydrophobicContact CB-CD1 3.87Å; K426-L996 HydrophobicContact CD-CD1 4.25Å; F427-L996 HydrophobicContact CD2-CD2 4.33Å
997	S	79.7	Confident	83.9	Confident	32 Å²	32	49 Å²	49	22%	0.224	28%	0.277	C	S	.	.			trans	-99.9	148.8	172.6	69.9	0	0	0	0	110.2	L995 P999 V1000 L1001	L995-S997 PolarHBondContact O-N 3.08Å; S997-P999 VanDerWaalsContact C-CD 3.48Å; S997-P999 VanDerWaalsContact C-N 3.33Å; S997-V1000 PolarHBondContact O-N 2.81Å; S997-V1000 VanDerWaalsContact O-N 3.11Å; S997-V1000 VanDerWaalsContact OG-CG2 3.29Å; S997-V1000 WeakPolarHBondContact OG-CG2 3.32Å; S997-L1001 PolarHBondContact O-N 3.21Å
998	V	82.3	Confident	84.3	Confident	64 Å²	64	48.8 Å²	48.8	39%	0.388	27%	0.27	S	S	.	.	H	α-helix	trans	-52.4	-45.2	-179	-179.3	0	0	0	0	112.3	V1000 L1001 S1002 L1145	V998-V1000 PolarHBondContact O-N 3.41Å; V998-L1001 PolarHBondContact O-N 2.95Å; V998-S1002 WeakPolarHBondContact O-CB 3.42Å; V998-S1002 PolarHBondContact O-N 2.95Å; V998-S1002 PolarHBondContact O-OG 3.39Å; V998-S1002 VanDerWaalsContact O-OG 3.07Å; V998-L1145 HydrophobicContact CG1-CD1 4.4Å; V998-L1145 HydrophobicContact CG1-CD2 4.16Å
999	P	81	Confident	84.8	Confident	58 Å²	58	44.6 Å²	44.6	38%	0.377	27%	0.266	S	S	.	.	H	α-helix	trans	-63.5	-36.7	178.9	-22.9	35.1	0	0	0	114.8	S997 S1002 S1003 L1141 L1145	S997-P999 VanDerWaalsContact C-CD 3.48Å; S997-P999 VanDerWaalsContact C-N 3.33Å; P999-S1002 WeakPolarHBondContact CA-OG 3.23Å; P999-S1002 PolarHBondContact O-OG 2.95Å; P999-S1002 VanDerWaalsContact O-OG 3.09Å; P999-S1003 VanDerWaalsContact O-CB 3.23Å; P999-S1003 WeakPolarHBondContact O-CB 3.22Å; P999-S1003 PolarHBondContact O-N 2.93Å; P999-S1003 VanDerWaalsContact O-N 3.14Å; P999-L1141 VanDerWaalsContact CA-CD2 3.47Å; P999-L1141 HydrophobicContact CB-CD2 3.78Å; P999-L1141 HydrophobicContact CG-CD2 4.04Å; P999-L1145 HydrophobicContact CG-CD1 4.17Å
1000	V	82.7	Confident	85.4	Confident	10 Å²	10	42 Å²	42	6%	0.061	25%	0.249	C	C	.	.	H	α-helix	trans	-70.4	-45.1	178.3	173.3	0	0	0	0	109.9	F930 K934 L995 S997 V998 S1003 L1004	F930-V1000 HydrophobicContact CD1-CG2 4.49Å; K934-V1000 HydrophobicContact CG-CG1 4.36Å; L995-V1000 WeakPolarHBondContact O-CB 3.21Å; L995-V1000 WeakPolarHBondContact O-CG1 3.4Å; S997-V1000 PolarHBondContact O-N 2.81Å; S997-V1000 VanDerWaalsContact O-N 3.11Å; S997-V1000 VanDerWaalsContact OG-CG2 3.29Å; S997-V1000 WeakPolarHBondContact OG-CG2 3.32Å; V998-V1000 PolarHBondContact O-N 3.41Å; V1000-S1003 PolarHBondContact O-N 2.94Å; V1000-L1004 HydrophobicContact CG1-CD1 4.25Å; V1000-L1004 WeakPolarHBondContact O-CG 3.32Å; V1000-L1004 PolarHBondContact O-N 3.36Å
1001	L	85.6	Confident	85.8	Confident	80 Å²	80	37.8 Å²	37.8	42%	0.419	23%	0.233	S	C	.	.	H	α-helix	trans	-68	-39.4	-179.4	-171.8	64.5	0	0	0	112.3	S997 V998 L1004 L1005	S997-L1001 PolarHBondContact O-N 3.21Å; V998-L1001 PolarHBondContact O-N 2.95Å; L1001-L1004 PolarHBondContact O-N 2.75Å; L1001-L1005 HydrophobicContact CD1-CD1 4.35Å; L1001-L1005 HydrophobicContact CD1-CG 4.35Å; L1001-L1005 HydrophobicContact CG-CD1 3.95Å; L1001-L1005 HydrophobicContact CG-CG 4.36Å; L1001-L1005 WeakPolarHBondContact O-CB 3.49Å; L1001-L1005 WeakPolarHBondContact O-CG 3.45Å; L1001-L1005 PolarHBondContact O-N 2.88Å
1002	S	86.4	Confident	86.3	Confident	27 Å²	27	39.3 Å²	39.3	19%	0.189	24%	0.242	C	C	.	.	H	α-helix	trans	-65.6	-39.8	175.8	62	0	0	0	0	112.1	V998 P999 L1006 L1141	V998-S1002 WeakPolarHBondContact O-CB 3.42Å; V998-S1002 PolarHBondContact O-N 2.95Å; V998-S1002 PolarHBondContact O-OG 3.39Å; V998-S1002 VanDerWaalsContact O-OG 3.07Å; P999-S1002 WeakPolarHBondContact CA-OG 3.23Å; P999-S1002 PolarHBondContact O-OG 2.95Å; P999-S1002 VanDerWaalsContact O-OG 3.09Å; S1002-L1006 WeakPolarHBondContact O-CB 3.44Å; S1002-L1006 PolarHBondContact O-N 3.35Å; S1002-L1141 VanDerWaalsContact OG-CD2 3.27Å; S1002-L1141 WeakPolarHBondContact OG-CD2 3.4Å
1003	S	89.4	Confident	87.2	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.014	25%	0.246	C	C	.	.	H	α-helix	trans	-59	-47.7	172.6	156.8	0	0	0	0	111	K934 P999 V1000 Q1007 E1134	K934-S1003 PolarHBondContact NZ-OG 3Å; P999-S1003 VanDerWaalsContact O-CB 3.23Å; P999-S1003 WeakPolarHBondContact O-CB 3.22Å; P999-S1003 PolarHBondContact O-N 2.93Å; P999-S1003 VanDerWaalsContact O-N 3.14Å; V1000-S1003 PolarHBondContact O-N 2.94Å; S1003-Q1007 WeakPolarHBondContact O-CB 3.29Å; S1003-Q1007 WeakPolarHBondContact O-CG 3.4Å; S1003-Q1007 PolarHBondContact O-N 2.73Å; S1003-Q1007 VanDerWaalsContact O-N 3.14Å; S1003-E1134 WeakPolarHBondContact CB-OE1 3.1Å; S1003-E1134 PolarHBondContact OG-OE1 3.08Å
1004	L	89.7	Confident	88.4	Confident	7 Å²	7	37.8 Å²	37.8	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-54	177.1	-69.3	173.6	0	0	0	112.6	F427 K934 A937 L938 V1000 L1001 L1006 Q1007 V1008	F427-L1004 HydrophobicContact CE2-CD1 3.94Å; F427-L1004 HydrophobicContact CZ-CD1 4.07Å; K934-L1004 HydrophobicContact CB-CD2 4.12Å; K934-L1004 HydrophobicContact CG-CD2 4.12Å; A937-L1004 HydrophobicContact CB-CD2 4.21Å; L938-L1004 HydrophobicContact CD1-CD2 4.04Å; L938-L1004 HydrophobicContact CD2-CD2 3.88Å; L938-L1004 HydrophobicContact CG-CD2 3.61Å; V1000-L1004 HydrophobicContact CG1-CD1 4.25Å; V1000-L1004 WeakPolarHBondContact O-CG 3.32Å; V1000-L1004 PolarHBondContact O-N 3.36Å; L1001-L1004 PolarHBondContact O-N 2.75Å; L1004-L1006 VanDerWaalsContact C-N 3.34Å; L1004-L1006 PolarHBondContact O-N 3.19Å; L1004-Q1007 PolarHBondContact O-N 3Å; L1004-V1008 WeakPolarHBondContact O-CG2 3.27Å; L1004-V1008 PolarHBondContact O-N 2.74Å
1005	L	90.8	Very high	89.3	Confident	111 Å²	111	36.3 Å²	36.3	58%	0.581	22%	0.224	S	C	*	.	H	α-helix	trans	-62.3	-40.6	-174.9	-71.5	172.3	0	0	0	112.7	L1001 V1008 A1009	L1001-L1005 HydrophobicContact CD1-CD1 4.35Å; L1001-L1005 HydrophobicContact CD1-CG 4.35Å; L1001-L1005 HydrophobicContact CG-CD1 3.95Å; L1001-L1005 HydrophobicContact CG-CG 4.36Å; L1001-L1005 WeakPolarHBondContact O-CB 3.49Å; L1001-L1005 WeakPolarHBondContact O-CG 3.45Å; L1001-L1005 PolarHBondContact O-N 2.88Å; L1005-V1008 PolarHBondContact O-N 3.28Å; L1005-A1009 PolarHBondContact O-N 3.02Å
1006	L	93.4	Very high	90.3	Very high	77 Å²	77	39.1 Å²	39.1	40%	0.403	24%	0.238	S	C	.	.	H	α-helix	trans	-76.3	-34.1	-176.3	-164	61.9	0	0	0	111.9	S1002 L1004 A1009 L1010 L1133 L1137	S1002-L1006 WeakPolarHBondContact O-CB 3.44Å; S1002-L1006 PolarHBondContact O-N 3.35Å; L1004-L1006 VanDerWaalsContact C-N 3.34Å; L1004-L1006 PolarHBondContact O-N 3.19Å; L1006-A1009 PolarHBondContact O-N 3.47Å; L1006-L1010 PolarHBondContact O-N 3.05Å; L1006-L1133 HydrophobicContact CB-CD2 3.9Å; L1006-L1133 HydrophobicContact CB-CG 4.5Å; L1006-L1133 HydrophobicContact CD2-CD1 3.15Å; L1006-L1133 HydrophobicContact CD2-CD2 3.97Å; L1006-L1133 HydrophobicContact CD2-CG 3.72Å; L1006-L1133 HydrophobicContact CG-CD1 3.57Å; L1006-L1133 HydrophobicContact CG-CD2 3.59Å; L1006-L1133 HydrophobicContact CG-CG 3.93Å; L1006-L1137 HydrophobicContact CD2-CD1 4.36Å; L1006-L1137 HydrophobicContact CD2-CD2 4.43Å
1007	Q	94.9	Very high	91.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-43.2	169.8	-74.5	-68.4	-5.6	0	0	111.6	L938 S1003 L1004 A1009 L1010 V1011 L1060 A1130 L1133	L938-Q1007 HydrophobicContact CD2-CB 3.59Å; S1003-Q1007 WeakPolarHBondContact O-CB 3.29Å; S1003-Q1007 WeakPolarHBondContact O-CG 3.4Å; S1003-Q1007 PolarHBondContact O-N 2.73Å; S1003-Q1007 VanDerWaalsContact O-N 3.14Å; L1004-Q1007 PolarHBondContact O-N 3Å; Q1007-A1009 VanDerWaalsContact C-N 3.32Å; Q1007-A1009 PolarHBondContact O-N 3.31Å; Q1007-L1010 PolarHBondContact O-N 3.07Å; Q1007-V1011 WeakPolarHBondContact O-CB 3.27Å; Q1007-V1011 VanDerWaalsContact O-CG2 3.32Å; Q1007-V1011 WeakPolarHBondContact O-CG2 3.23Å; Q1007-V1011 PolarHBondContact O-N 2.97Å; Q1007-L1060 HydrophobicContact CB-CD2 4.25Å; Q1007-A1130 PolarHBondContact NE2-O 3.16Å; Q1007-L1133 HydrophobicContact CG-CD2 4.09Å
1008	V	94.1	Very high	91.9	Very high	27 Å²	27	35.1 Å²	35.1	16%	0.164	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-45.3	174.9	171.9	0	0	0	0	110.5	L938 L941 I945 L1004 L1005 L1010 V1011 T1012	L938-V1008 HydrophobicContact CD2-CG2 3.93Å; L941-V1008 HydrophobicContact CB-CG2 4.03Å; L941-V1008 HydrophobicContact CD1-CG2 3.62Å; L941-V1008 HydrophobicContact CG-CG2 4.45Å; I945-V1008 HydrophobicContact CD1-CG1 3.73Å; L1004-V1008 WeakPolarHBondContact O-CG2 3.27Å; L1004-V1008 PolarHBondContact O-N 2.74Å; L1005-V1008 PolarHBondContact O-N 3.28Å; V1008-L1010 PolarHBondContact O-N 3.29Å; V1008-V1011 PolarHBondContact O-N 3.48Å; V1008-T1012 PolarHBondContact O-N 2.99Å; V1008-T1012 PolarHBondContact O-OG1 3.36Å
1009	A	95.6	Very high	92.5	Very high	58 Å²	58	33.5 Å²	33.5	48%	0.479	21%	0.208	S	C	.	.	H	α-helix	trans	-60.4	-42.2	177.2	0	0	0	0	0	112.8	L1005 L1006 Q1007 T1012 G1013	L1005-A1009 PolarHBondContact O-N 3.02Å; L1006-A1009 PolarHBondContact O-N 3.47Å; Q1007-A1009 VanDerWaalsContact C-N 3.32Å; Q1007-A1009 PolarHBondContact O-N 3.31Å; A1009-T1012 PolarHBondContact O-N 2.97Å; A1009-G1013 PolarHBondContact O-N 3.45Å
1010	L	96.4	Very high	93.1	Very high	37 Å²	37	36.6 Å²	36.6	19%	0.194	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-46.8	175.8	178.5	63.7	0	0	0	111.5	L1006 Q1007 V1008 G1013 V1014 A1130	L1006-L1010 PolarHBondContact O-N 3.05Å; Q1007-L1010 PolarHBondContact O-N 3.07Å; V1008-L1010 PolarHBondContact O-N 3.29Å; L1010-G1013 PolarHBondContact O-N 2.95Å; L1010-V1014 HydrophobicContact CD1-CG2 4.4Å; L1010-V1014 WeakPolarHBondContact O-CG2 3.22Å; L1010-V1014 PolarHBondContact O-N 2.77Å; L1010-A1130 HydrophobicContact CD2-CB 4.16Å
1011	V	95.9	Very high	93.6	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-57.8	-49.6	176.8	163.6	0	0	0	0	111	T942 Q1007 V1008 G1013 V1014 Q1015 Q1056 L1060	T942-V1011 HydrophobicContact CG2-CG1 3.68Å; Q1007-V1011 WeakPolarHBondContact O-CB 3.27Å; Q1007-V1011 VanDerWaalsContact O-CG2 3.32Å; Q1007-V1011 WeakPolarHBondContact O-CG2 3.23Å; Q1007-V1011 PolarHBondContact O-N 2.97Å; V1008-V1011 PolarHBondContact O-N 3.48Å; V1011-G1013 VanDerWaalsContact C-N 3.34Å; V1011-G1013 PolarHBondContact O-N 3.01Å; V1011-V1014 PolarHBondContact O-N 3.24Å; V1011-Q1015 WeakPolarHBondContact O-CG 3.3Å; V1011-Q1015 PolarHBondContact O-N 2.85Å; V1011-Q1056 HydrophobicContact CG2-CG 4.38Å; V1011-Q1056 PolarHBondContact O-NE2 2.89Å; V1011-Q1056 VanDerWaalsContact O-NE2 3.12Å; V1011-L1060 HydrophobicContact CG2-CD1 4.1Å; V1011-L1060 HydrophobicContact CG2-CD2 4.17Å; V1011-L1060 HydrophobicContact CG2-CG 4.44Å
1012	T	95.9	Very high	94	Very high	38 Å²	38	35.3 Å²	35.3	23%	0.233	21%	0.209	C	C	.	.	H	α-helix	trans	-58.6	-45.8	177.1	-55.3	0	0	0	0	111.3	I945 V1008 A1009 V1014 Q1015 L1016	I945-T1012 WeakPolarHBondContact CD1-OG1 3.37Å; I945-T1012 HydrophobicContact CG2-CG2 4.2Å; V1008-T1012 PolarHBondContact O-N 2.99Å; V1008-T1012 PolarHBondContact O-OG1 3.36Å; A1009-T1012 PolarHBondContact O-N 2.97Å; T1012-V1014 VanDerWaalsContact C-N 3.35Å; T1012-V1014 PolarHBondContact O-N 2.96Å; T1012-Q1015 PolarHBondContact O-N 3.3Å; T1012-L1016 HydrophobicContact CG2-CD1 3.78Å; T1012-L1016 HydrophobicContact CG2-CG 4.22Å; T1012-L1016 WeakPolarHBondContact O-CB 3.42Å; T1012-L1016 WeakPolarHBondContact O-CG 3.38Å; T1012-L1016 PolarHBondContact O-N 3.35Å
1013	G	96.6	Very high	94.3	Very high	44 Å²	44	37 Å²	37	45%	0.454	22%	0.215	S	C	.	.	H	α-helix	trans	-60	-42.9	179.5	0	0	0	0	0	112.7	A1009 L1010 V1011 G1017	A1009-G1013 PolarHBondContact O-N 3.45Å; L1010-G1013 PolarHBondContact O-N 2.95Å; V1011-G1013 VanDerWaalsContact C-N 3.34Å; V1011-G1013 PolarHBondContact O-N 3.01Å; G1013-G1017 PolarHBondContact O-N 3.41Å
1014	V	96.7	Very high	94.4	Very high	8 Å²	8	40.5 Å²	40.5	5%	0.048	24%	0.244	C	C	.	.	H	α-helix	trans	-69.9	-40.9	178.3	173.9	0	0	0	0	111.8	L1010 V1011 T1012 G1017 G1018 L1052 F1125 N1126	L1010-V1014 HydrophobicContact CD1-CG2 4.4Å; L1010-V1014 WeakPolarHBondContact O-CG2 3.22Å; L1010-V1014 PolarHBondContact O-N 2.77Å; V1011-V1014 PolarHBondContact O-N 3.24Å; T1012-V1014 VanDerWaalsContact C-N 3.35Å; T1012-V1014 PolarHBondContact O-N 2.96Å; V1014-G1017 PolarHBondContact O-N 2.91Å; V1014-G1018 PolarHBondContact O-N 3.32Å; V1014-L1052 HydrophobicContact CG1-CD2 4.5Å; V1014-F1125 HydrophobicContact CG2-CD1 4.35Å; V1014-F1125 HydrophobicContact CG2-CE1 4.49Å; V1014-N1126 HydrophobicContact CG1-CB 4.28Å; V1014-N1126 HydrophobicContact CG2-CB 4.02Å
1015	Q	96.6	Very high	94.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.3	-46.3	176.7	-70.9	-168.7	6.3	0	0	112.1	S946 I949 V1011 T1012 G1017 G1018 Y1019 Q1056	S946-Q1015 PolarHBondContact OG-NE2 3.04Å; S946-Q1015 PolarHBondContact OG-OE1 3.38Å; I949-Q1015 HydrophobicContact CD1-CB 3.87Å; V1011-Q1015 WeakPolarHBondContact O-CG 3.3Å; V1011-Q1015 PolarHBondContact O-N 2.85Å; T1012-Q1015 PolarHBondContact O-N 3.3Å; Q1015-G1017 VanDerWaalsContact C-N 3.33Å; Q1015-G1017 PolarHBondContact O-N 2.84Å; Q1015-G1018 PolarHBondContact O-N 2.88Å; Q1015-Y1019 WeakPolarHBondContact O-CB 3.43Å; Q1015-Y1019 PolarHBondContact O-N 3.37Å; Q1015-Q1056 VanDerWaalsContact CG-OE1 3.29Å
1016	L	95.8	Very high	94.4	Very high	62 Å²	62	42.9 Å²	42.9	33%	0.325	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-41.4	175.2	-72.3	176.2	0	0	0	111.4	I949 T1012 Y1019 F1020	I949-L1016 HydrophobicContact CD1-CD2 3.93Å; I949-L1016 HydrophobicContact CD1-CG 4.33Å; I949-L1016 HydrophobicContact CG1-CD2 4.07Å; T1012-L1016 HydrophobicContact CG2-CD1 3.78Å; T1012-L1016 HydrophobicContact CG2-CG 4.22Å; T1012-L1016 WeakPolarHBondContact O-CB 3.42Å; T1012-L1016 WeakPolarHBondContact O-CG 3.38Å; T1012-L1016 PolarHBondContact O-N 3.35Å; L1016-Y1019 PolarHBondContact O-N 3.01Å; L1016-F1020 HydrophobicContact CB-CD2 4.31Å; L1016-F1020 HydrophobicContact CB-CE2 4.22Å; L1016-F1020 HydrophobicContact CD2-CE2 4.28Å; L1016-F1020 WeakPolarHBondContact O-CD2 3.09Å; L1016-F1020 PolarHBondContact O-N 3.1Å
1017	G	95.2	Very high	94.2	Very high	25 Å²	25	41.6 Å²	41.6	26%	0.258	25%	0.253	S	S	.	.	H	α-helix	trans	-57.7	-48.8	174.6	0	0	0	0	0	112	G1013 V1014 Q1015 Y1019 F1020 L1021	G1013-G1017 PolarHBondContact O-N 3.41Å; V1014-G1017 PolarHBondContact O-N 2.91Å; Q1015-G1017 VanDerWaalsContact C-N 3.33Å; Q1015-G1017 PolarHBondContact O-N 2.84Å; G1017-Y1019 PolarHBondContact O-N 3.33Å; G1017-F1020 PolarHBondContact O-N 2.79Å; G1017-L1021 VanDerWaalsContact O-CB 3.24Å; G1017-L1021 WeakPolarHBondContact O-CB 3.41Å; G1017-L1021 WeakPolarHBondContact O-CD1 3.44Å; G1017-L1021 WeakPolarHBondContact O-CG 3.27Å; G1017-L1021 PolarHBondContact O-N 2.85Å
1018	G	94.9	Very high	94	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-60.6	-43.4	174.8	0	0	0	0	0	113.2	V1014 Q1015 L1021 T1022	V1014-G1018 PolarHBondContact O-N 3.32Å; Q1015-G1018 PolarHBondContact O-N 2.88Å; G1018-L1021 PolarHBondContact O-N 3.11Å; G1018-T1022 PolarHBondContact O-N 2.99Å; G1018-T1022 PolarHBondContact O-OG1 3.37Å
1019	Y	94.3	Very high	93.5	Very high	31 Å²	31	46.3 Å²	46.3	12%	0.122	28%	0.279	C	S	.	.	H	α-helix	trans	-59.4	-54.6	175.9	171.4	-103.2	0	0	0	112	I949 I953 Q1015 L1016 G1017 L1021 T1022 L1023 E1045	I949-Y1019 HydrophobicContact CG2-CD2 4.13Å; I949-Y1019 HydrophobicContact CG2-CG 4.2Å; I953-Y1019 HydrophobicContact CD1-CE2 4.1Å; I953-Y1019 HydrophobicContact CG2-CE2 4.32Å; I953-Y1019 WeakPolarHBondContact CG2-OH 3.39Å; Q1015-Y1019 WeakPolarHBondContact O-CB 3.43Å; Q1015-Y1019 PolarHBondContact O-N 3.37Å; L1016-Y1019 PolarHBondContact O-N 3.01Å; G1017-Y1019 PolarHBondContact O-N 3.33Å; Y1019-L1021 VanDerWaalsContact C-N 3.34Å; Y1019-L1021 PolarHBondContact O-N 3.33Å; Y1019-T1022 VanDerWaalsContact O-CB 3.3Å; Y1019-T1022 WeakPolarHBondContact O-CB 3.47Å; Y1019-T1022 PolarHBondContact O-N 3.06Å; Y1019-T1022 VanDerWaalsContact O-N 3.13Å; Y1019-L1023 HydrophobicContact CD1-CD1 4.27Å; Y1019-L1023 HydrophobicContact CE1-CD1 3.61Å; Y1019-L1023 HydrophobicContact CE1-CG 4.4Å; Y1019-L1023 HydrophobicContact CE2-CD1 4.37Å; Y1019-L1023 HydrophobicContact CE2-CD2 4.43Å; Y1019-L1023 HydrophobicContact CE2-CG 4.46Å; Y1019-L1023 PolarHBondContact O-N 3.42Å; Y1019-L1023 VanDerWaalsContact O-N 3.13Å; Y1019-E1045 HydrophobicContact CD2-CB 4.43Å; Y1019-E1045 HydrophobicContact CD2-CG 4.38Å; Y1019-E1045 HydrophobicContact CE2-CB 4.37Å; Y1019-E1045 HydrophobicContact CE2-CG 4.02Å
1020	F	94.5	Very high	92.9	Very high	123 Å²	123	48.2 Å²	48.2	54%	0.539	29%	0.286	S	S	.	.	H	α-helix	trans	-65.7	-35	179.8	-71.9	-61.7	0	0	0	113	L1016 G1017 T1022 L1023 A1024	L1016-F1020 HydrophobicContact CB-CD2 4.31Å; L1016-F1020 HydrophobicContact CB-CE2 4.22Å; L1016-F1020 HydrophobicContact CD2-CE2 4.28Å; L1016-F1020 WeakPolarHBondContact O-CD2 3.09Å; L1016-F1020 PolarHBondContact O-N 3.1Å; G1017-F1020 PolarHBondContact O-N 2.79Å; F1020-T1022 VanDerWaalsContact C-N 3.27Å; F1020-T1022 PolarHBondContact O-N 2.78Å; F1020-L1023 HydrophobicContact CD1-CD1 4.07Å; F1020-L1023 PolarHBondContact O-N 2.89Å; F1020-A1024 PolarHBondContact O-N 2.77Å; F1020-A1024 VanDerWaalsContact O-N 3.1Å
1021	L	94	Very high	92.2	Very high	62 Å²	62	47.9 Å²	47.9	33%	0.325	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-35	173.9	-78.3	167.8	0	0	0	112.1	G1017 G1018 Y1019 A1024 Q1025 F1115 L1118 L1122	G1017-L1021 VanDerWaalsContact O-CB 3.24Å; G1017-L1021 WeakPolarHBondContact O-CB 3.41Å; G1017-L1021 WeakPolarHBondContact O-CD1 3.44Å; G1017-L1021 WeakPolarHBondContact O-CG 3.27Å; G1017-L1021 PolarHBondContact O-N 2.85Å; G1018-L1021 PolarHBondContact O-N 3.11Å; Y1019-L1021 VanDerWaalsContact C-N 3.34Å; Y1019-L1021 PolarHBondContact O-N 3.33Å; L1021-A1024 PolarHBondContact O-N 3.32Å; L1021-Q1025 WeakPolarHBondContact O-CG 3.43Å; L1021-Q1025 PolarHBondContact O-NE2 2.96Å; L1021-F1115 HydrophobicContact CB-CE2 4.39Å; L1021-L1118 HydrophobicContact CD1-CD2 4.28Å; L1021-L1118 HydrophobicContact CD2-CD2 4.42Å; L1021-L1122 HydrophobicContact CD1-CD1 3.74Å
1022	T	93.1	Very high	91.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.2	-45.9	174.8	-51.7	0	0	0	0	110.7	G1018 Y1019 F1020 A1024 Q1025 W1027 F1028 V1048 F1115	G1018-T1022 PolarHBondContact O-N 2.99Å; G1018-T1022 PolarHBondContact O-OG1 3.37Å; Y1019-T1022 VanDerWaalsContact O-CB 3.3Å; Y1019-T1022 WeakPolarHBondContact O-CB 3.47Å; Y1019-T1022 PolarHBondContact O-N 3.06Å; Y1019-T1022 VanDerWaalsContact O-N 3.13Å; F1020-T1022 VanDerWaalsContact C-N 3.27Å; F1020-T1022 PolarHBondContact O-N 2.78Å; T1022-A1024 PolarHBondContact O-N 2.98Å; T1022-Q1025 WeakPolarHBondContact O-CB 3.45Å; T1022-Q1025 PolarHBondContact O-N 3.35Å; T1022-Q1025 VanDerWaalsContact O-N 3.13Å; T1022-W1027 HydrophobicContact CG2-CH2 4.38Å; T1022-F1028 HydrophobicContact CG2-CD2 3.88Å; T1022-F1028 HydrophobicContact CG2-CE2 4.26Å; T1022-F1028 WeakPolarHBondContact O-CB 3.33Å; T1022-V1048 HydrophobicContact CG2-CG2 4.18Å; T1022-V1048 WeakPolarHBondContact OG1-CG1 3.41Å; T1022-V1048 WeakPolarHBondContact OG1-CG2 3.47Å; T1022-F1115 HydrophobicContact CG2-CZ 4.49Å
1023	L	91.8	Very high	89.7	Confident	63 Å²	63	59.6 Å²	59.6	33%	0.33	33%	0.331	S	S	.	.	H	α-helix	trans	-61.2	-29	177.3	-63.5	-177.9	0	0	0	113.1	Y1019 F1020 Q1025 F1028	Y1019-L1023 HydrophobicContact CD1-CD1 4.27Å; Y1019-L1023 HydrophobicContact CE1-CD1 3.61Å; Y1019-L1023 HydrophobicContact CE1-CG 4.4Å; Y1019-L1023 HydrophobicContact CE2-CD1 4.37Å; Y1019-L1023 HydrophobicContact CE2-CD2 4.43Å; Y1019-L1023 HydrophobicContact CE2-CG 4.46Å; Y1019-L1023 PolarHBondContact O-N 3.42Å; Y1019-L1023 VanDerWaalsContact O-N 3.13Å; F1020-L1023 HydrophobicContact CD1-CD1 4.07Å; F1020-L1023 PolarHBondContact O-N 2.89Å; L1023-Q1025 VanDerWaalsContact C-N 3.3Å; L1023-F1028 HydrophobicContact CD2-CD1 4.17Å; L1023-F1028 HydrophobicContact CD2-CE1 3.41Å; L1023-F1028 VanDerWaalsContact CD2-CE1 3.41Å; L1023-F1028 HydrophobicContact CD2-CE2 3.96Å; L1023-F1028 HydrophobicContact CD2-CZ 3.29Å
1024	A	92.4	Very high	88.3	Confident	75 Å²	75	63.3 Å²	63.3	62%	0.62	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-8.7	180	0	0	0	0	0	113.8	F1020 L1021 T1022	F1020-A1024 PolarHBondContact O-N 2.77Å; F1020-A1024 VanDerWaalsContact O-N 3.1Å; L1021-A1024 PolarHBondContact O-N 3.32Å; T1022-A1024 PolarHBondContact O-N 2.98Å
1025	Q	92.5	Very high	87	Confident	42 Å²	42	65 Å²	65	20%	0.196	36%	0.355	C	S	.	.	S	Bend	trans	-78.5	143.8	-176.7	-61.5	-50.9	-54.9	0	0	112.5	L1021 T1022 L1023 W1027 F1028 F1115	L1021-Q1025 WeakPolarHBondContact O-CG 3.43Å; L1021-Q1025 PolarHBondContact O-NE2 2.96Å; T1022-Q1025 WeakPolarHBondContact O-CB 3.45Å; T1022-Q1025 PolarHBondContact O-N 3.35Å; T1022-Q1025 VanDerWaalsContact O-N 3.13Å; L1023-Q1025 VanDerWaalsContact C-N 3.3Å; Q1025-W1027 VanDerWaalsContact C-N 3.26Å; Q1025-W1027 HydrophobicContact CB-CD2 3.92Å; Q1025-W1027 HydrophobicContact CB-CE3 4.46Å; Q1025-W1027 HydrophobicContact CB-CG 4.33Å; Q1025-W1027 HydrophobicContact CB-CH2 4.3Å; Q1025-W1027 HydrophobicContact CB-CZ2 3.75Å; Q1025-W1027 HydrophobicContact CG-CH2 4.16Å; Q1025-W1027 HydrophobicContact CG-CZ2 3.53Å; Q1025-W1027 PolarHBondContact O-N 2.97Å; Q1025-F1028 HydrophobicContact CB-CB 4.45Å; Q1025-F1028 VanDerWaalsContact O-CB 3.28Å; Q1025-F1028 WeakPolarHBondContact O-CB 3.43Å; Q1025-F1028 PolarHBondContact O-N 2.98Å; Q1025-F1115 HydrophobicContact CG-CD2 3.62Å; Q1025-F1115 HydrophobicContact CG-CE2 3.64Å; Q1025-F1115 HydrophobicContact CG-CG 4.44Å; Q1025-F1115 HydrophobicContact CG-CZ 4.47Å
1026	P	88.4	Confident	85.5	Confident	126 Å²	126	66.8 Å²	66.8	82%	0.818	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-23.1	-177.9	28.2	-35.3	0	0	0	113.5
1027	W	89	Confident	84.1	Confident	50 Å²	50	64 Å²	64	19%	0.189	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-1.3	178.5	50.6	-104.6	0	0	0	113.4	T1022 Q1025 Y1044 I1110 D1112 F1115	T1022-W1027 HydrophobicContact CG2-CH2 4.38Å; Q1025-W1027 VanDerWaalsContact C-N 3.26Å; Q1025-W1027 HydrophobicContact CB-CD2 3.92Å; Q1025-W1027 HydrophobicContact CB-CE3 4.46Å; Q1025-W1027 HydrophobicContact CB-CG 4.33Å; Q1025-W1027 HydrophobicContact CB-CH2 4.3Å; Q1025-W1027 HydrophobicContact CB-CZ2 3.75Å; Q1025-W1027 HydrophobicContact CG-CH2 4.16Å; Q1025-W1027 HydrophobicContact CG-CZ2 3.53Å; Q1025-W1027 PolarHBondContact O-N 2.97Å; W1027-Y1044 HydrophobicContact CE3-CD1 4.32Å; W1027-Y1044 HydrophobicContact CE3-CE1 4.11Å; W1027-Y1044 AromaticContact CZ3-CD1 3.66Å; W1027-Y1044 HydrophobicContact CZ3-CD1 3.66Å; W1027-Y1044 AromaticContact CZ3-CE1 3.88Å; W1027-Y1044 HydrophobicContact CZ3-CE1 3.88Å; W1027-Y1044 HydrophobicContact CZ3-CG 4.04Å; W1027-I1110 HydrophobicContact CH2-CD1 4.4Å; W1027-I1110 HydrophobicContact CH2-CG1 4.28Å; W1027-I1110 HydrophobicContact CH2-CG2 3.86Å; W1027-I1110 HydrophobicContact CZ2-CG2 3.8Å; W1027-I1110 HydrophobicContact CZ3-CG1 4.49Å; W1027-I1110 HydrophobicContact CZ3-CG2 4.44Å; W1027-D1112 PolarHBondContact NE1-OD2 3.37Å; W1027-D1112 VanDerWaalsContact NE1-OD2 3.08Å; W1027-F1115 AromaticContact CH2-CD1 3.86Å; W1027-F1115 HydrophobicContact CH2-CD1 3.86Å; W1027-F1115 AromaticContact CH2-CE1 3.83Å; W1027-F1115 HydrophobicContact CH2-CE1 3.83Å; W1027-F1115 HydrophobicContact CH2-CG 4.27Å; W1027-F1115 HydrophobicContact CH2-CZ 4.23Å; W1027-F1115 HydrophobicContact CZ2-CB 3.98Å; W1027-F1115 AromaticContact CZ2-CD1 3.59Å; W1027-F1115 HydrophobicContact CZ2-CD1 3.59Å; W1027-F1115 AromaticContact CZ2-CD2 3.98Å; W1027-F1115 HydrophobicContact CZ2-CD2 3.98Å; W1027-F1115 AromaticContact CZ2-CE1 3.98Å; W1027-F1115 HydrophobicContact CZ2-CE1 3.98Å; W1027-F1115 HydrophobicContact CZ2-CE2 4.35Å; W1027-F1115 AromaticContact CZ2-CG 3.57Å; W1027-F1115 HydrophobicContact CZ2-CG 3.57Å; W1027-F1115 HydrophobicContact CZ2-CZ 4.35Å
1028	F	89.4	Confident	82.7	Confident	36 Å²	36	65.4 Å²	65.4	16%	0.158	36%	0.358	C	S	.	.			trans	-68.8	133.3	-178.6	175.4	-104.2	0	0	0	111.2	T1022 L1023 Q1025 P1030 Y1044 E1045	T1022-F1028 HydrophobicContact CG2-CD2 3.88Å; T1022-F1028 HydrophobicContact CG2-CE2 4.26Å; T1022-F1028 WeakPolarHBondContact O-CB 3.33Å; L1023-F1028 HydrophobicContact CD2-CD1 4.17Å; L1023-F1028 HydrophobicContact CD2-CE1 3.41Å; L1023-F1028 VanDerWaalsContact CD2-CE1 3.41Å; L1023-F1028 HydrophobicContact CD2-CE2 3.96Å; L1023-F1028 HydrophobicContact CD2-CZ 3.29Å; Q1025-F1028 HydrophobicContact CB-CB 4.45Å; Q1025-F1028 VanDerWaalsContact O-CB 3.28Å; Q1025-F1028 WeakPolarHBondContact O-CB 3.43Å; Q1025-F1028 PolarHBondContact O-N 2.98Å; F1028-P1030 HydrophobicContact CE1-CB 4.1Å; F1028-Y1044 HydrophobicContact CD2-CD2 4.29Å; F1028-E1045 VanDerWaalsContact CE2-CD 3.5Å; F1028-E1045 HydrophobicContact CE2-CG 3.95Å; F1028-E1045 HydrophobicContact CZ-CG 4.25Å; F1028-E1045 VanDerWaalsContact CZ-OE1 3.24Å; F1028-E1045 WeakPolarHBondContact CZ-OE1 3.17Å
1029	V	84.7	Confident	81.6	Confident	90 Å²	90	70.9 Å²	70.9	55%	0.545	39%	0.387	S	S	.	.			trans	-116.8	119.5	176.9	179.6	0	0	0	0	108.2	Y1044	V1029-Y1044 HydrophobicContact CB-CE2 4.2Å; V1029-Y1044 HydrophobicContact CG2-CE2 4.38Å
1030	P	82.6	Confident	80.7	Confident	98 Å²	98	70.2 Å²	70.2	64%	0.636	39%	0.385	S	S	*	.			trans	-69.8	148.5	-179.1	28.7	-34.2	0	0	0	112	F1028	F1028-P1030 HydrophobicContact CE1-CB 4.1Å
1031	L	82.4	Confident	80.1	Confident	30 Å²	30	66.3 Å²	66.3	16%	0.157	37%	0.37	C	S	.	.			trans	-62.6	147.8	177.5	-77.6	159	0	0	0	113.9	I953 T955 R1033 N1040 N1043 E1045	I953-L1031 HydrophobicContact CB-CD1 4.24Å; I953-L1031 HydrophobicContact CD1-CD1 3.75Å; I953-L1031 HydrophobicContact CG1-CD1 4.13Å; T955-L1031 HydrophobicContact CG2-CD1 4.24Å; L1031-R1033 PolarHBondContact O-N 2.69Å; L1031-N1040 HydrophobicContact CD2-CB 3.95Å; L1031-N1043 HydrophobicContact CD2-CB 3.64Å; L1031-N1043 HydrophobicContact CG-CB 4.34Å; L1031-E1045 WeakPolarHBondContact CD1-OE1 3.44Å
1032	N	72.6	Confident	79.8	Confident	94 Å²	94	66.2 Å²	66.2	50%	0.503	37%	0.373	S	S	.	.			trans	-80	104.4	171	-169.8	4.9	0	0	0	110.6	T1034 V1035 N1040	N1032-T1034 PolarHBondContact ND2-OG1 3.29Å; N1032-T1034 PolarHBondContact O-N 2.81Å; N1032-T1034 VanDerWaalsContact O-N 3.11Å; N1032-T1034 PolarHBondContact OD1-OG1 3.43Å; N1032-V1035 HydrophobicContact CB-CG2 4.49Å; N1032-V1035 PolarHBondContact O-N 3.1Å; N1032-N1040 PolarHBondContact O-OD1 3.3Å
1033	R	65.9	Low	79.7	Confident	191 Å²	191	66.6 Å²	66.6	72%	0.721	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-11.5	-173.5	-65.5	-175.3	-179.5	171.3	1.1	114.8	L1031	L1031-R1033 PolarHBondContact O-N 2.69Å
1034	T	66.6	Low	79.6	Confident	123 Å²	123	65 Å²	65	76%	0.755	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-8.4	-178.3	58.7	0	0	0	0	114	N1032	N1032-T1034 PolarHBondContact ND2-OG1 3.29Å; N1032-T1034 PolarHBondContact O-N 2.81Å; N1032-T1034 VanDerWaalsContact O-N 3.11Å; N1032-T1034 PolarHBondContact OD1-OG1 3.43Å
1035	V	69.4	Low	79.6	Confident	42 Å²	42	61.7 Å²	61.7	26%	0.255	34%	0.337	S	S	.	.	S	Bend	trans	-101	138.1	-179.3	176	0	0	0	0	108.9	N954 N1032 D1039 N1040	N954-V1035 PolarHBondContact ND2-O 2.92Å; N954-V1035 VanDerWaalsContact ND2-O 3.14Å; N1032-V1035 HydrophobicContact CB-CG2 4.49Å; N1032-V1035 PolarHBondContact O-N 3.1Å; V1035-D1039 HydrophobicContact CG1-CB 3.46Å; V1035-D1039 VanDerWaalsContact CG1-CB 3.46Å; V1035-N1040 WeakPolarHBondContact CB-OD1 3.23Å; V1035-N1040 PolarHBondContact O-ND2 2.99Å
1036	P	66.1	Low	79.6	Confident	38 Å²	38	59.7 Å²	59.7	25%	0.247	33%	0.327	C	S	.	.			trans	-65	153.8	178.8	25.9	-33.5	0	0	0	112.2	P1038 D1039 N1040	P1036-P1038 VanDerWaalsContact C-CD 3.41Å; P1036-D1039 PolarHBondContact O-N 3.44Å; P1036-D1039 VanDerWaalsContact O-N 3.14Å; P1036-N1040 PolarHBondContact O-N 2.83Å
1037	A	65.3	Low	79.8	Confident	5 Å²	5	54.2 Å²	54.2	4%	0.041	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-40.8	-171.1	0	0	0	0	0	117.9	N954 N1040	N954-A1037 WeakPolarHBondContact O-CA 3.4Å; A1037-N1040 PolarHBondContact O-N 3.24Å
1038	P	66.6	Low	80.1	Confident	53 Å²	53	51.9 Å²	51.9	34%	0.344	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-30.9	-179.5	26.1	-31.1	0	0	0	112.7	P1036 N1040	P1036-P1038 VanDerWaalsContact C-CD 3.41Å; P1038-N1040 VanDerWaalsContact C-N 3.25Å; P1038-N1040 PolarHBondContact O-N 3.08Å
1039	D	71.2	Confident	80.4	Confident	116 Å²	116	50.1 Å²	50.1	62%	0.62	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-9.9	178.4	-63.9	-30.3	0	0	0	112.4	V1035 P1036 L1041	V1035-D1039 HydrophobicContact CG1-CB 3.46Å; V1035-D1039 VanDerWaalsContact CG1-CB 3.46Å; P1036-D1039 PolarHBondContact O-N 3.44Å; P1036-D1039 VanDerWaalsContact O-N 3.14Å; D1039-L1041 VanDerWaalsContact C-N 3.29Å
1040	N	76.6	Confident	80.9	Confident	17 Å²	17	46 Å²	46	9%	0.091	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	0.9	174.6	-79	-32.1	0	0	0	113.9	N954 L1031 N1032 V1035 P1036 A1037 P1038 N1043	N954-N1040 PolarHBondContact O-ND2 3.33Å; N954-N1040 VanDerWaalsContact O-ND2 3.08Å; L1031-N1040 HydrophobicContact CD2-CB 3.95Å; N1032-N1040 PolarHBondContact O-OD1 3.3Å; V1035-N1040 WeakPolarHBondContact CB-OD1 3.23Å; V1035-N1040 PolarHBondContact O-ND2 2.99Å; P1036-N1040 PolarHBondContact O-N 2.83Å; A1037-N1040 PolarHBondContact O-N 3.24Å; P1038-N1040 VanDerWaalsContact C-N 3.25Å; P1038-N1040 PolarHBondContact O-N 3.08Å; N1040-N1043 PolarHBondContact O-ND2 3.48Å
1041	L	82.3	Confident	81.4	Confident	41 Å²	41	41.8 Å²	41.8	22%	0.215	22%	0.222	C	C	.	.			trans	-94.4	139.3	176.6	-71.1	169.9	0	0	0	110.7	D1039 N1046 A1106	D1039-L1041 VanDerWaalsContact C-N 3.29Å; L1041-N1046 HydrophobicContact CD2-CB 3.94Å; L1041-N1046 WeakPolarHBondContact CD2-ND2 3.36Å; L1041-A1106 HydrophobicContact CB-CB 4.39Å
1042	P	87.3	Confident	82.1	Confident	61 Å²	61	40.4 Å²	40.4	40%	0.396	22%	0.215	S	C	.	.	S	Bend	cis	-88.2	142	2.9	34.7	-35.8	0	0	0	114	A1106 R1108	P1042-A1106 HydrophobicContact CB-CB 4.42Å; P1042-A1106 WeakPolarHBondContact CB-O 3.4Å; P1042-R1108 HydrophobicContact CB-CB 4.48Å
1043	N	89.8	Confident	83.2	Confident	8 Å²	8	36 Å²	36	4%	0.043	19%	0.191	C	C	.	.			trans	-134.4	165.7	176.3	62	70.7	0	0	0	113.5	T955 L1031 N1040 N1046 T1047	T955-N1043 PolarHBondContact OG1-ND2 3.2Å; L1031-N1043 HydrophobicContact CD2-CB 3.64Å; L1031-N1043 HydrophobicContact CG-CB 4.34Å; N1040-N1043 PolarHBondContact O-ND2 3.48Å; N1043-N1046 WeakPolarHBondContact OD1-CB 3.48Å; N1043-N1046 PolarHBondContact OD1-N 3.09Å; N1043-T1047 WeakPolarHBondContact O-CB 3.32Å; N1043-T1047 PolarHBondContact O-N 3.21Å; N1043-T1047 PolarHBondContact O-OG1 3.3Å
1044	Y	90.9	Very high	84.6	Confident	30 Å²	30	26.9 Å²	26.9	12%	0.118	16%	0.157	C	C	.	.	H	α-helix	trans	-71.4	-41.5	-173.8	-68	-67.6	0	0	0	112	W1027 F1028 V1029 T1047 V1048 R1108 I1110	W1027-Y1044 HydrophobicContact CE3-CD1 4.32Å; W1027-Y1044 HydrophobicContact CE3-CE1 4.11Å; W1027-Y1044 AromaticContact CZ3-CD1 3.66Å; W1027-Y1044 HydrophobicContact CZ3-CD1 3.66Å; W1027-Y1044 AromaticContact CZ3-CE1 3.88Å; W1027-Y1044 HydrophobicContact CZ3-CE1 3.88Å; W1027-Y1044 HydrophobicContact CZ3-CG 4.04Å; F1028-Y1044 HydrophobicContact CD2-CD2 4.29Å; V1029-Y1044 HydrophobicContact CB-CE2 4.2Å; V1029-Y1044 HydrophobicContact CG2-CE2 4.38Å; Y1044-T1047 PolarHBondContact O-N 3.4Å; Y1044-V1048 WeakPolarHBondContact O-CG2 3.49Å; Y1044-V1048 PolarHBondContact O-N 3.35Å; Y1044-R1108 HydrophobicContact CD1-CB 4.09Å; Y1044-R1108 HydrophobicContact CD1-CG 3.5Å; Y1044-R1108 VanDerWaalsContact CD1-CG 3.5Å; Y1044-R1108 HydrophobicContact CD2-CG 4.32Å; Y1044-R1108 HydrophobicContact CE1-CB 4.32Å; Y1044-R1108 HydrophobicContact CE1-CG 3.33Å; Y1044-R1108 HydrophobicContact CE2-CG 4.2Å; Y1044-R1108 HydrophobicContact CG-CG 4Å; Y1044-I1110 HydrophobicContact CD1-CG1 4.03Å; Y1044-I1110 HydrophobicContact CE1-CG1 4.27Å
1045	E	91.9	Very high	86.1	Confident	5 Å²	5	21.5 Å²	21.5	2%	0.023	12%	0.123	C	C	.	.	H	α-helix	trans	-61.7	-48.2	-178.5	-57.6	95.3	135.5	0	0	110.7	L950 I953 Y1019 F1028 L1031 T1047 V1048 V1049	L950-E1045 HydrophobicContact CD2-CB 4.47Å; I953-E1045 HydrophobicContact CD1-CB 3.41Å; I953-E1045 VanDerWaalsContact CD1-CB 3.41Å; I953-E1045 HydrophobicContact CD1-CG 3.62Å; Y1019-E1045 HydrophobicContact CD2-CB 4.43Å; Y1019-E1045 HydrophobicContact CD2-CG 4.38Å; Y1019-E1045 HydrophobicContact CE2-CB 4.37Å; Y1019-E1045 HydrophobicContact CE2-CG 4.02Å; F1028-E1045 VanDerWaalsContact CE2-CD 3.5Å; F1028-E1045 HydrophobicContact CE2-CG 3.95Å; F1028-E1045 HydrophobicContact CZ-CG 4.25Å; F1028-E1045 VanDerWaalsContact CZ-OE1 3.24Å; F1028-E1045 WeakPolarHBondContact CZ-OE1 3.17Å; L1031-E1045 WeakPolarHBondContact CD1-OE1 3.44Å; E1045-T1047 PolarHBondContact O-N 2.97Å; E1045-V1048 PolarHBondContact O-N 3.25Å; E1045-V1049 WeakPolarHBondContact O-CB 3.12Å; E1045-V1049 VanDerWaalsContact O-CG2 3.29Å; E1045-V1049 WeakPolarHBondContact O-CG2 3.41Å; E1045-V1049 PolarHBondContact O-N 3.16Å
1046	N	92.9	Very high	87.4	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59	-47.1	173.7	-176.7	46.8	0	0	0	111.3	L950 L957 Q961 L1041 N1043 V1048 V1049 F1050	L950-N1046 HydrophobicContact CD2-CB 4.37Å; L957-N1046 WeakPolarHBondContact CD2-OD1 2.73Å; Q961-N1046 PolarHBondContact NE2-ND2 3.42Å; Q961-N1046 PolarHBondContact OE1-ND2 3.5Å; Q961-N1046 PolarHBondContact OE1-OD1 2.86Å; L1041-N1046 HydrophobicContact CD2-CB 3.94Å; L1041-N1046 WeakPolarHBondContact CD2-ND2 3.36Å; N1043-N1046 WeakPolarHBondContact OD1-CB 3.48Å; N1043-N1046 PolarHBondContact OD1-N 3.09Å; N1046-V1048 VanDerWaalsContact C-N 3.32Å; N1046-V1048 PolarHBondContact O-N 3.13Å; N1046-V1049 PolarHBondContact O-N 3.25Å; N1046-F1050 WeakPolarHBondContact O-CB 2.95Å; N1046-F1050 PolarHBondContact O-N 2.95Å
1047	T	93.3	Very high	88.8	Confident	10 Å²	10	17.7 Å²	17.7	6%	0.061	10%	0.1	C	C	.	.	H	α-helix	trans	-59.1	-43.3	-178.9	-59.2	0	0	0	0	111.8	N1043 Y1044 E1045 S1051 L1107 R1108 I1110	N1043-T1047 WeakPolarHBondContact O-CB 3.32Å; N1043-T1047 PolarHBondContact O-N 3.21Å; N1043-T1047 PolarHBondContact O-OG1 3.3Å; Y1044-T1047 PolarHBondContact O-N 3.4Å; E1045-T1047 PolarHBondContact O-N 2.97Å; T1047-S1051 VanDerWaalsContact O-CB 3.28Å; T1047-S1051 WeakPolarHBondContact O-CB 3.33Å; T1047-S1051 PolarHBondContact O-N 3.46Å; T1047-S1051 PolarHBondContact O-OG 2.91Å; T1047-L1107 HydrophobicContact CG2-CB 4.38Å; T1047-L1107 HydrophobicContact CG2-CD2 4.16Å; T1047-R1108 PolarHBondContact OG1-N 3.13Å; T1047-I1110 HydrophobicContact CG2-CD1 4.45Å
1048	V	94.5	Very high	90.3	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.006	10%	0.099	C	C	.	.	H	α-helix	trans	-71.8	-46.8	-179.7	170.2	0	0	0	0	111.6	T1022 Y1044 E1045 N1046 S1051 L1052 I1110 F1115 L1119	T1022-V1048 HydrophobicContact CG2-CG2 4.18Å; T1022-V1048 WeakPolarHBondContact OG1-CG1 3.41Å; T1022-V1048 WeakPolarHBondContact OG1-CG2 3.47Å; Y1044-V1048 WeakPolarHBondContact O-CG2 3.49Å; Y1044-V1048 PolarHBondContact O-N 3.35Å; E1045-V1048 PolarHBondContact O-N 3.25Å; N1046-V1048 VanDerWaalsContact C-N 3.32Å; N1046-V1048 PolarHBondContact O-N 3.13Å; V1048-S1051 PolarHBondContact O-N 3.47Å; V1048-L1052 HydrophobicContact CG1-CD1 4.03Å; V1048-L1052 WeakPolarHBondContact O-CG 3.49Å; V1048-L1052 PolarHBondContact O-N 3.5Å; V1048-I1110 HydrophobicContact CG2-CD1 4.14Å; V1048-F1115 HydrophobicContact CG2-CE1 3.95Å; V1048-F1115 HydrophobicContact CG2-CZ 4.26Å; V1048-L1119 HydrophobicContact CG1-CD1 3.91Å
1049	V	95.4	Very high	91.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64	-43.5	178.7	173	0	0	0	0	110.9	I949 L950 E1045 N1046 S1053	I949-V1049 HydrophobicContact CG2-CG2 4.24Å; L950-V1049 HydrophobicContact CD1-CG1 4.44Å; L950-V1049 HydrophobicContact CD2-CB 4.24Å; L950-V1049 HydrophobicContact CD2-CG2 4.19Å; L950-V1049 HydrophobicContact CG-CG1 4.41Å; E1045-V1049 WeakPolarHBondContact O-CB 3.12Å; E1045-V1049 VanDerWaalsContact O-CG2 3.29Å; E1045-V1049 WeakPolarHBondContact O-CG2 3.41Å; E1045-V1049 PolarHBondContact O-N 3.16Å; N1046-V1049 PolarHBondContact O-N 3.25Å; V1049-S1053 VanDerWaalsContact O-CB 3.25Å; V1049-S1053 WeakPolarHBondContact O-CB 3.12Å; V1049-S1053 PolarHBondContact O-N 3.34Å; V1049-S1053 PolarHBondContact O-OG 2.88Å
1050	F	95.3	Very high	92.9	Very high	4 Å²	4	10.2 Å²	10.2	2%	0.018	6%	0.056	C	C	.	.	H	α-helix	trans	-60.4	-44.9	174.8	172.9	-103.5	0	0	0	111.8	L957 Q961 I965 N1046 S1053 S1054 L1094 L1105 L1107	L957-F1050 HydrophobicContact CD2-CB 4.11Å; L957-F1050 HydrophobicContact CD2-CD2 4.17Å; Q961-F1050 HydrophobicContact CB-CD2 3.7Å; Q961-F1050 HydrophobicContact CB-CE2 3.52Å; Q961-F1050 HydrophobicContact CB-CZ 4.29Å; Q961-F1050 HydrophobicContact CG-CD2 3.81Å; Q961-F1050 HydrophobicContact CG-CE2 3.73Å; Q961-F1050 HydrophobicContact CG-CG 4.24Å; Q961-F1050 HydrophobicContact CG-CZ 4.09Å; I965-F1050 HydrophobicContact CD1-CD2 3.94Å; I965-F1050 HydrophobicContact CD1-CE2 3.88Å; I965-F1050 HydrophobicContact CG1-CD2 4.48Å; I965-F1050 HydrophobicContact CG1-CE2 3.96Å; N1046-F1050 WeakPolarHBondContact O-CB 2.95Å; N1046-F1050 PolarHBondContact O-N 2.95Å; F1050-S1053 WeakPolarHBondContact CA-OG 3.5Å; F1050-S1053 PolarHBondContact O-OG 2.76Å; F1050-S1053 VanDerWaalsContact O-OG 3.09Å; F1050-S1054 VanDerWaalsContact O-CB 3.25Å; F1050-S1054 WeakPolarHBondContact O-CB 3.29Å; F1050-S1054 PolarHBondContact O-N 2.8Å; F1050-S1054 PolarHBondContact O-OG 3.41Å; F1050-L1094 HydrophobicContact CE1-CD2 3.95Å; F1050-L1105 HydrophobicContact CZ-CD2 4.32Å; F1050-L1107 HydrophobicContact CD1-CD2 3.7Å; F1050-L1107 HydrophobicContact CE1-CD2 4.08Å
1051	S	94.1	Very high	93.7	Very high	8 Å²	8	9.4 Å²	9.4	6%	0.056	5%	0.051	C	C	.	.	H	α-helix	trans	-64	-48.9	-179.9	-61.8	0	0	0	0	111.5	T1047 V1048 S1054 F1055	T1047-S1051 VanDerWaalsContact O-CB 3.28Å; T1047-S1051 WeakPolarHBondContact O-CB 3.33Å; T1047-S1051 PolarHBondContact O-N 3.46Å; T1047-S1051 PolarHBondContact O-OG 2.91Å; V1048-S1051 PolarHBondContact O-N 3.47Å; S1051-S1054 PolarHBondContact O-N 3.24Å; S1051-F1055 VanDerWaalsContact O-CD2 3.23Å; S1051-F1055 WeakPolarHBondContact O-CD2 3.37Å; S1051-F1055 PolarHBondContact O-N 3.48Å
1052	L	96.2	Very high	94.2	Very high	2 Å²	2	7.9 Å²	7.9	1%	0.01	5%	0.045	C	C	.	.	H	α-helix	trans	-65.3	-44.7	179.5	-71.6	174.6	0	0	0	112.6	V1014 V1048 S1054 F1055 Q1056 L1119 L1122 V1123	V1014-L1052 HydrophobicContact CG1-CD2 4.5Å; V1048-L1052 HydrophobicContact CG1-CD1 4.03Å; V1048-L1052 WeakPolarHBondContact O-CG 3.49Å; V1048-L1052 PolarHBondContact O-N 3.5Å; L1052-S1054 VanDerWaalsContact C-N 3.32Å; L1052-S1054 PolarHBondContact O-N 3.45Å; L1052-F1055 PolarHBondContact O-N 2.89Å; L1052-Q1056 WeakPolarHBondContact O-CG 3.2Å; L1052-Q1056 PolarHBondContact O-N 3.17Å; L1052-L1119 HydrophobicContact CD1-CD1 3.86Å; L1052-L1119 HydrophobicContact CD2-CD1 3.6Å; L1052-L1119 HydrophobicContact CD2-CG 3.98Å; L1052-L1119 HydrophobicContact CG-CD1 3.67Å; L1052-L1119 HydrophobicContact CG-CG 4.36Å; L1052-L1122 HydrophobicContact CD2-CB 4.35Å; L1052-V1123 HydrophobicContact CD2-CG2 3.84Å
1053	S	96.1	Very high	94.5	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-63.5	-38.2	177.9	59.3	0	0	0	0	112	V1049 F1050 F1055 Q1056 Y1057	V1049-S1053 VanDerWaalsContact O-CB 3.25Å; V1049-S1053 WeakPolarHBondContact O-CB 3.12Å; V1049-S1053 PolarHBondContact O-N 3.34Å; V1049-S1053 PolarHBondContact O-OG 2.88Å; F1050-S1053 WeakPolarHBondContact CA-OG 3.5Å; F1050-S1053 PolarHBondContact O-OG 2.76Å; F1050-S1053 VanDerWaalsContact O-OG 3.09Å; S1053-F1055 PolarHBondContact O-N 2.83Å; S1053-Q1056 WeakPolarHBondContact O-CA 3.31Å; S1053-Q1056 VanDerWaalsContact O-CB 3.31Å; S1053-Q1056 WeakPolarHBondContact O-CB 3.04Å; S1053-Q1056 PolarHBondContact O-N 2.71Å; S1053-Q1056 VanDerWaalsContact O-N 3.08Å; S1053-Y1057 WeakPolarHBondContact O-CD2 3.48Å; S1053-Y1057 VanDerWaalsContact O-CE2 3.32Å; S1053-Y1057 WeakPolarHBondContact O-CE2 3.33Å; S1053-Y1057 PolarHBondContact O-N 3.36Å
1054	S	95.9	Very high	94.5	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-59.5	-43.3	176.3	-65.3	0	0	0	0	112.7	F1050 S1051 L1052	F1050-S1054 VanDerWaalsContact O-CB 3.25Å; F1050-S1054 WeakPolarHBondContact O-CB 3.29Å; F1050-S1054 PolarHBondContact O-N 2.8Å; F1050-S1054 PolarHBondContact O-OG 3.41Å; S1051-S1054 PolarHBondContact O-N 3.24Å; L1052-S1054 VanDerWaalsContact C-N 3.32Å; L1052-S1054 PolarHBondContact O-N 3.45Å
1055	F	96.7	Very high	94.4	Very high	11 Å²	11	4 Å²	4	5%	0.048	2%	0.023	C	C	.	.	H	α-helix	trans	-68.2	-38.4	172.6	-77.6	-73.6	0	0	0	112.3	S1051 L1052 S1053 Y1057 L1058 I1059 L1091 V1092 V1095 L1120 V1123	S1051-F1055 VanDerWaalsContact O-CD2 3.23Å; S1051-F1055 WeakPolarHBondContact O-CD2 3.37Å; S1051-F1055 PolarHBondContact O-N 3.48Å; L1052-F1055 PolarHBondContact O-N 2.89Å; S1053-F1055 PolarHBondContact O-N 2.83Å; F1055-Y1057 VanDerWaalsContact C-N 3.28Å; F1055-Y1057 PolarHBondContact O-N 3.07Å; F1055-L1058 PolarHBondContact O-N 3.38Å; F1055-L1058 VanDerWaalsContact O-N 3.11Å; F1055-I1059 HydrophobicContact CB-CD1 4.37Å; F1055-I1059 VanDerWaalsContact O-CG1 3.26Å; F1055-I1059 WeakPolarHBondContact O-CG1 3.46Å; F1055-I1059 PolarHBondContact O-N 3.3Å; F1055-L1091 HydrophobicContact CD1-CB 4.22Å; F1055-L1091 HydrophobicContact CD1-CD1 4.01Å; F1055-L1091 HydrophobicContact CD2-CB 4.45Å; F1055-L1091 HydrophobicContact CE1-CB 3.59Å; F1055-L1091 HydrophobicContact CE1-CD1 4.21Å; F1055-L1091 HydrophobicContact CE2-CB 3.85Å; F1055-L1091 HydrophobicContact CG-CD1 4.19Å; F1055-L1091 HydrophobicContact CZ-CB 3.39Å; F1055-V1092 HydrophobicContact CE1-CG2 3.96Å; F1055-V1092 HydrophobicContact CZ-CG2 3.77Å; F1055-V1095 HydrophobicContact CE2-CG2 4.05Å; F1055-L1120 HydrophobicContact CE2-CD2 4.3Å; F1055-L1120 HydrophobicContact CZ-CD2 4.13Å; F1055-V1123 HydrophobicContact CB-CB 4.5Å; F1055-V1123 HydrophobicContact CB-CG1 3.74Å; F1055-V1123 HydrophobicContact CB-CG2 3.93Å; F1055-V1123 HydrophobicContact CD1-CG1 3.7Å; F1055-V1123 HydrophobicContact CD2-CB 4.49Å; F1055-V1123 HydrophobicContact CD2-CG1 4.14Å; F1055-V1123 HydrophobicContact CD2-CG2 3.55Å; F1055-V1123 HydrophobicContact CE1-CG1 4.29Å; F1055-V1123 HydrophobicContact CE2-CG2 4.18Å; F1055-V1123 HydrophobicContact CG-CB 4.38Å; F1055-V1123 HydrophobicContact CG-CG1 3.6Å; F1055-V1123 HydrophobicContact CG-CG2 3.8Å
1056	Q	97.2	Very high	93.9	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-56.9	-40	177.5	-80.8	167.2	-17.5	0	0	112.4	T942 V1011 Q1015 L1052 S1053 L1058 I1059 L1060 N1126	T942-Q1056 HydrophobicContact CG2-CB 4.17Å; V1011-Q1056 HydrophobicContact CG2-CG 4.38Å; V1011-Q1056 PolarHBondContact O-NE2 2.89Å; V1011-Q1056 VanDerWaalsContact O-NE2 3.12Å; Q1015-Q1056 VanDerWaalsContact CG-OE1 3.29Å; L1052-Q1056 WeakPolarHBondContact O-CG 3.2Å; L1052-Q1056 PolarHBondContact O-N 3.17Å; S1053-Q1056 WeakPolarHBondContact O-CA 3.31Å; S1053-Q1056 VanDerWaalsContact O-CB 3.31Å; S1053-Q1056 WeakPolarHBondContact O-CB 3.04Å; S1053-Q1056 PolarHBondContact O-N 2.71Å; S1053-Q1056 VanDerWaalsContact O-N 3.08Å; Q1056-L1058 VanDerWaalsContact C-N 3.33Å; Q1056-L1058 PolarHBondContact O-N 2.85Å; Q1056-I1059 PolarHBondContact O-N 3.08Å; Q1056-L1060 VanDerWaalsContact O-CB 3.32Å; Q1056-L1060 WeakPolarHBondContact O-CB 3.44Å; Q1056-L1060 WeakPolarHBondContact O-CD1 3.28Å; Q1056-L1060 WeakPolarHBondContact O-CG 3.33Å; Q1056-L1060 PolarHBondContact O-N 3.49Å; Q1056-N1126 WeakPolarHBondContact CG-ND2 3.36Å; Q1056-N1126 PolarHBondContact NE2-ND2 3.02Å
1057	Y	96.3	Very high	93.3	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-60.4	-41.2	176.2	-57.1	-49.1	0	0	0	112.5	Y935 Y939 T942 Q943 I965 S1053 F1055 A1061	Y935-Y1057 WeakPolarHBondContact CE2-O 3.48Å; Y939-Y1057 AromaticContact CD2-CD1 3.54Å; Y939-Y1057 HydrophobicContact CD2-CD1 3.54Å; Y939-Y1057 AromaticContact CD2-CE1 3.45Å; Y939-Y1057 HydrophobicContact CD2-CE1 3.45Å; Y939-Y1057 VanDerWaalsContact CD2-CE1 3.45Å; Y939-Y1057 HydrophobicContact CD2-CG 4.32Å; Y939-Y1057 HydrophobicContact CE2-CD1 4.23Å; Y939-Y1057 AromaticContact CE2-CE1 3.85Å; Y939-Y1057 HydrophobicContact CE2-CE1 3.85Å; T942-Y1057 HydrophobicContact CG2-CD1 4.19Å; T942-Y1057 HydrophobicContact CG2-CE1 3.59Å; Q943-Y1057 WeakPolarHBondContact CA-OH 3.49Å; Q943-Y1057 WeakPolarHBondContact CB-OH 3.41Å; I965-Y1057 HydrophobicContact CB-CE2 4.19Å; I965-Y1057 HydrophobicContact CD1-CE2 4Å; I965-Y1057 HydrophobicContact CG1-CD2 4.45Å; I965-Y1057 HydrophobicContact CG1-CE2 3.81Å; I965-Y1057 HydrophobicContact CG2-CD2 3.96Å; I965-Y1057 HydrophobicContact CG2-CE2 3.38Å; S1053-Y1057 WeakPolarHBondContact O-CD2 3.48Å; S1053-Y1057 VanDerWaalsContact O-CE2 3.32Å; S1053-Y1057 WeakPolarHBondContact O-CE2 3.33Å; S1053-Y1057 PolarHBondContact O-N 3.36Å; F1055-Y1057 VanDerWaalsContact C-N 3.28Å; F1055-Y1057 PolarHBondContact O-N 3.07Å; Y1057-A1061 WeakPolarHBondContact O-CB 3.5Å; Y1057-A1061 PolarHBondContact O-N 2.79Å
1058	L	96.4	Very high	92.7	Very high	5 Å²	5	10.4 Å²	10.4	3%	0.026	7%	0.069	C	C	.	.	H	α-helix	trans	-69.6	-43.4	176.5	-59.5	-177.8	0	0	0	112	I969 V973 F1055 Q1056 A1061 A1062 L1084 L1087 S1088 L1091	I969-L1058 HydrophobicContact CG2-CD2 3.75Å; I969-L1058 HydrophobicContact CG2-CG 4.33Å; V973-L1058 HydrophobicContact CG2-CD2 3.81Å; F1055-L1058 PolarHBondContact O-N 3.38Å; F1055-L1058 VanDerWaalsContact O-N 3.11Å; Q1056-L1058 VanDerWaalsContact C-N 3.33Å; Q1056-L1058 PolarHBondContact O-N 2.85Å; L1058-A1061 PolarHBondContact O-N 2.94Å; L1058-A1062 PolarHBondContact O-N 3.46Å; L1058-L1084 HydrophobicContact CB-CD2 4.27Å; L1058-L1084 HydrophobicContact CD2-CD2 4.14Å; L1058-L1087 HydrophobicContact CD1-CB 3.85Å; L1058-L1087 HydrophobicContact CD2-CB 4.03Å; L1058-L1087 HydrophobicContact CD2-CD1 3.95Å; L1058-S1088 VanDerWaalsContact CD1-OG 3.31Å; L1058-S1088 WeakPolarHBondContact CD1-OG 3.5Å; L1058-L1091 HydrophobicContact CD1-CD1 3.65Å; L1058-L1091 HydrophobicContact CG-CD1 4.38Å
1059	I	95.9	Very high	92.3	Very high	10 Å²	10	13.9 Å²	13.9	5%	0.051	9%	0.092	C	C	.	.	H	α-helix	trans	-60.6	-49.5	179.1	-67.8	166.2	0	0	0	110.5	F1055 Q1056 A1061 A1062 A1063 V1123 N1126 F1127 A1130	F1055-I1059 HydrophobicContact CB-CD1 4.37Å; F1055-I1059 VanDerWaalsContact O-CG1 3.26Å; F1055-I1059 WeakPolarHBondContact O-CG1 3.46Å; F1055-I1059 PolarHBondContact O-N 3.3Å; Q1056-I1059 PolarHBondContact O-N 3.08Å; I1059-A1061 VanDerWaalsContact C-N 3.31Å; I1059-A1061 PolarHBondContact O-N 3.06Å; I1059-A1062 PolarHBondContact O-N 2.97Å; I1059-A1063 WeakPolarHBondContact O-CB 3.4Å; I1059-A1063 PolarHBondContact O-N 2.84Å; I1059-V1123 HydrophobicContact CD1-CG1 4.21Å; I1059-N1126 HydrophobicContact CD1-CB 4.17Å; I1059-F1127 HydrophobicContact CD1-CB 4.12Å; I1059-F1127 HydrophobicContact CG1-CB 4.13Å; I1059-F1127 HydrophobicContact CG1-CD2 4.11Å; I1059-F1127 HydrophobicContact CG2-CB 4.46Å; I1059-F1127 HydrophobicContact CG2-CD2 4.37Å; I1059-A1130 HydrophobicContact CG2-CB 3.61Å
1060	L	95.4	Very high	92.1	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-62	-41.4	-179.2	-71.2	167.9	0	0	0	111.1	L938 Q1007 V1011 Q1056 A1062 A1063 V1064	L938-L1060 HydrophobicContact CB-CD1 3.99Å; L938-L1060 HydrophobicContact CB-CD2 4.45Å; L938-L1060 HydrophobicContact CD1-CD2 4.17Å; L938-L1060 HydrophobicContact CD2-CD2 4.49Å; Q1007-L1060 HydrophobicContact CB-CD2 4.25Å; V1011-L1060 HydrophobicContact CG2-CD1 4.1Å; V1011-L1060 HydrophobicContact CG2-CD2 4.17Å; V1011-L1060 HydrophobicContact CG2-CG 4.44Å; Q1056-L1060 VanDerWaalsContact O-CB 3.32Å; Q1056-L1060 WeakPolarHBondContact O-CB 3.44Å; Q1056-L1060 WeakPolarHBondContact O-CD1 3.28Å; Q1056-L1060 WeakPolarHBondContact O-CG 3.33Å; Q1056-L1060 PolarHBondContact O-N 3.49Å; L1060-A1062 PolarHBondContact O-N 3.24Å; L1060-A1063 PolarHBondContact O-N 3.04Å; L1060-V1064 WeakPolarHBondContact O-CG1 3.32Å; L1060-V1064 VanDerWaalsContact O-CG2 3.28Å; L1060-V1064 WeakPolarHBondContact O-CG2 3.48Å; L1060-V1064 PolarHBondContact O-N 2.95Å
1061	A	94.2	Very high	91.9	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.2	-42.7	176	0	0	0	0	0	112.8	Y935 V973 Y1057 L1058 I1059 S1065 F1080	Y935-A1061 HydrophobicContact CD2-CB 3.9Å; Y935-A1061 HydrophobicContact CE2-CB 3.64Å; V973-A1061 HydrophobicContact CB-CB 4.49Å; V973-A1061 HydrophobicContact CG1-CB 3.09Å; Y1057-A1061 WeakPolarHBondContact O-CB 3.5Å; Y1057-A1061 PolarHBondContact O-N 2.79Å; L1058-A1061 PolarHBondContact O-N 2.94Å; I1059-A1061 VanDerWaalsContact C-N 3.31Å; I1059-A1061 PolarHBondContact O-N 3.06Å; A1061-S1065 VanDerWaalsContact O-CB 3.24Å; A1061-S1065 WeakPolarHBondContact O-CB 3.31Å; A1061-S1065 PolarHBondContact O-N 2.88Å; A1061-S1065 PolarHBondContact O-OG 3.3Å; A1061-F1080 HydrophobicContact CB-CZ 4.34Å
1062	A	93.1	Very high	91.8	Very high	9 Å²	9	19.7 Å²	19.7	7%	0.074	11%	0.113	C	C	.	.	H	α-helix	trans	-66	-45.1	176.3	0	0	0	0	0	111.3	L1058 I1059 L1060 V1064 S1065 L1084 F1131	L1058-A1062 PolarHBondContact O-N 3.46Å; I1059-A1062 PolarHBondContact O-N 2.97Å; L1060-A1062 PolarHBondContact O-N 3.24Å; A1062-V1064 PolarHBondContact O-N 3.32Å; A1062-S1065 PolarHBondContact O-N 2.85Å; A1062-L1084 HydrophobicContact CB-CD1 4.28Å; A1062-F1131 HydrophobicContact CB-CE2 3.9Å; A1062-F1131 HydrophobicContact CB-CZ 3.81Å
1063	A	92.2	Very high	91.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.1	-37.6	-178	0	0	0	0	0	113.1	I1059 L1060 A1130 F1131 E1134	I1059-A1063 WeakPolarHBondContact O-CB 3.4Å; I1059-A1063 PolarHBondContact O-N 2.84Å; L1060-A1063 PolarHBondContact O-N 3.04Å; A1063-A1130 HydrophobicContact CB-CB 4.24Å; A1063-F1131 HydrophobicContact CB-CE2 4.46Å; A1063-E1134 HydrophobicContact CB-CG 4.39Å
1064	V	90.6	Very high	91.1	Very high	7 Å²	7	24 Å²	24	4%	0.042	14%	0.138	C	C	.	.	H	α-helix	trans	-86.1	-6.7	178.8	-55.4	0	0	0	0	114.1	S931 K934 L938 M977 L1060 A1062 K1066	S931-V1064 WeakPolarHBondContact CB-O 3.3Å; S931-V1064 PolarHBondContact OG-O 3.34Å; K934-V1064 HydrophobicContact CB-CG1 4.4Å; L938-V1064 HydrophobicContact CD1-CG1 3.78Å; M977-V1064 HydrophobicContact CE-CG2 4.01Å; L1060-V1064 WeakPolarHBondContact O-CG1 3.32Å; L1060-V1064 VanDerWaalsContact O-CG2 3.28Å; L1060-V1064 WeakPolarHBondContact O-CG2 3.48Å; L1060-V1064 PolarHBondContact O-N 2.95Å; A1062-V1064 PolarHBondContact O-N 3.32Å; V1064-K1066 VanDerWaalsContact C-N 3.3Å; V1064-K1066 PolarHBondContact O-N 3.16Å
1065	S	88.1	Confident	90.8	Very high	10 Å²	10	31.7 Å²	31.7	7%	0.07	17%	0.169	C	C	.	.			trans	-90.9	39.6	-178	-67.2	0	0	0	0	113.9	M977 A1061 A1062	M977-S1065 WeakPolarHBondContact CE-OG 3.42Å; A1061-S1065 VanDerWaalsContact O-CB 3.24Å; A1061-S1065 WeakPolarHBondContact O-CB 3.31Å; A1061-S1065 PolarHBondContact O-N 2.88Å; A1061-S1065 PolarHBondContact O-OG 3.3Å; A1062-S1065 PolarHBondContact O-N 2.85Å
1066	K	81.8	Confident	90.5	Very high	56 Å²	56	33.9 Å²	33.9	24%	0.243	18%	0.183	C	C	.	.			trans	-60.1	143.8	177	-65.3	175.1	-179.9	160.9	0	111.6	V1064 R1071 E1134 D1138	V1064-K1066 VanDerWaalsContact C-N 3.3Å; V1064-K1066 PolarHBondContact O-N 3.16Å; K1066-R1071 PolarHBondContact O-NE 3.14Å; K1066-E1134 VanDerWaalsContact NZ-C 3.27Å; K1066-E1134 PolarHBondContact NZ-O 3.47Å; K1066-E1134 IonicContact NZ-OE2 3.85Å; K1066-E1134 PolarHBondContact NZ-OE2 3.12Å; K1066-D1138 WeakPolarHBondContact CD-OD2 3.44Å; K1066-D1138 WeakPolarHBondContact CE-OD2 3.41Å; K1066-D1138 IonicContact NZ-OD1 3.73Å; K1066-D1138 IonicContact NZ-OD2 2.58Å; K1066-D1138 PolarHBondContact NZ-OD2 2.99Å
1067	G	80.1	Confident	90.3	Very high	10 Å²	10	34.4 Å²	34.4	10%	0.103	19%	0.185	C	C	.	.			trans	-88.7	-78.2	-177.7	0	0	0	0	0	113.8	R1071 R1072	G1067-R1071 CarbonylContact C-O 3.59Å; G1067-R1071 CarbonylContact O-C 3.57Å; G1067-R1071 WeakPolarHBondContact O-CA 3.4Å; G1067-R1071 VanDerWaalsContact O-CB 3.31Å; G1067-R1071 WeakPolarHBondContact O-CB 3.43Å; G1067-R1071 PolarHBondContact O-N 2.86Å; G1067-R1072 VanDerWaalsContact CA-O 3.23Å; G1067-R1072 WeakPolarHBondContact CA-O 3.42Å
1068	A	81.3	Confident	90.2	Very high	85 Å²	85	38.6 Å²	38.6	70%	0.702	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	145.8	-177.2	0	0	0	0	0	111.5
1069	P	86.6	Confident	90.2	Very high	73 Å²	73	41 Å²	41	47%	0.474	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	cis	-98.1	-1.2	8.2	36.9	-35.4	0	0	0	115.4
1070	F	90.4	Very high	90.1	Very high	19 Å²	19	40.6 Å²	40.6	8%	0.083	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-25.4	-171.5	-52.6	-59.6	0	0	0	114.2	R923 D927 A983 V989 R990 P991	R923-F1070 HydrophobicContact CB-CD1 4.16Å; D927-F1070 HydrophobicContact CB-CB 4.01Å; D927-F1070 HydrophobicContact CB-CD2 4.04Å; D927-F1070 HydrophobicContact CB-CG 4.35Å; A983-F1070 PolarHBondContact N-O 3.49Å; V989-F1070 HydrophobicContact CB-CE1 4.25Å; V989-F1070 HydrophobicContact CB-CZ 4.12Å; V989-F1070 HydrophobicContact CG1-CE1 4.49Å; V989-F1070 HydrophobicContact CG1-CZ 3.89Å; V989-F1070 WeakPolarHBondContact O-CE1 3.46Å; R990-F1070 VanDerWaalsContact C-CZ 3.4Å; P991-F1070 HydrophobicContact CB-CD2 4.44Å; P991-F1070 HydrophobicContact CB-CE2 4.18Å; P991-F1070 HydrophobicContact CB-CZ 4.39Å; P991-F1070 HydrophobicContact CG-CD1 4.01Å; P991-F1070 HydrophobicContact CG-CD2 4.08Å; P991-F1070 HydrophobicContact CG-CE1 4.01Å; P991-F1070 HydrophobicContact CG-CE2 4.07Å; P991-F1070 HydrophobicContact CG-CG 4.04Å; P991-F1070 HydrophobicContact CG-CZ 4.04Å
1071	R	91.7	Very high	90.1	Very high	12 Å²	12	43.5 Å²	43.5	5%	0.045	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-117.1	163	-177.2	-68.3	176.9	-90.5	-176.8	-6.2	110.3	C924 D927 T928 S931 T980 G981 K1066 G1067	C924-R1071 HydrophobicContact CB-CG 4.48Å; D927-R1071 PolarHBondContact O-NH2 2.86Å; D927-R1071 IonicContact OD1-NH2 3.45Å; D927-R1071 IonicContact OD2-CZ 3.25Å; D927-R1071 IonicContact OD2-NE 2.74Å; D927-R1071 PolarHBondContact OD2-NE 3.15Å; D927-R1071 IonicContact OD2-NH2 3.39Å; D927-R1071 PolarHBondContact OD2-NH2 3.05Å; T928-R1071 WeakPolarHBondContact OG1-CD 3.43Å; S931-R1071 VanDerWaalsContact CB-NH1 3.35Å; S931-R1071 VanDerWaalsContact OG-CZ 3.31Å; S931-R1071 PolarHBondContact OG-NH1 2.67Å; S931-R1071 PolarHBondContact OG-NH2 2.91Å; T980-R1071 HydrophobicContact CG2-CB 4.01Å; T980-R1071 HydrophobicContact CG2-CG 4.49Å; G981-R1071 WeakPolarHBondContact O-CA 3.32Å; K1066-R1071 PolarHBondContact O-NE 3.14Å; G1067-R1071 CarbonylContact C-O 3.59Å; G1067-R1071 CarbonylContact O-C 3.57Å; G1067-R1071 WeakPolarHBondContact O-CA 3.4Å; G1067-R1071 VanDerWaalsContact O-CB 3.31Å; G1067-R1071 WeakPolarHBondContact O-CB 3.43Å; G1067-R1071 PolarHBondContact O-N 2.86Å
1072	R	91.1	Very high	90.2	Very high	103 Å²	103	47.7 Å²	47.7	39%	0.389	27%	0.265	S	S	.	.			trans	-68.3	156	167.1	-62.7	-171.7	-177.7	-171.1	-2.4	110.4	G981 P982 G1067 T1076	G981-R1072 PolarHBondContact O-N 3.29Å; P982-R1072 VanDerWaalsContact O-CG 3.22Å; P982-R1072 WeakPolarHBondContact O-CG 3.39Å; P982-R1072 PolarHBondContact O-NE 3.33Å; G1067-R1072 VanDerWaalsContact CA-O 3.23Å; G1067-R1072 WeakPolarHBondContact CA-O 3.42Å; R1072-T1076 HydrophobicContact CB-CG2 4.06Å; R1072-T1076 WeakPolarHBondContact CB-OG1 3.03Å
1073	P	90.4	Very high	90.3	Very high	48 Å²	48	47.8 Å²	47.8	31%	0.312	27%	0.266	S	S	.	.			trans	-55.5	152.6	174	-26.9	36.7	0	0	0	112.9	Y1075 T1076	P1073-Y1075 HydrophobicContact CB-CD1 3.55Å; P1073-Y1075 HydrophobicContact CB-CE1 3.15Å; P1073-Y1075 HydrophobicContact CB-CE2 4.34Å; P1073-Y1075 HydrophobicContact CB-CG 4.29Å; P1073-Y1075 HydrophobicContact CG-CE1 3.74Å; P1073-Y1075 PolarHBondContact O-N 3.35Å; P1073-Y1075 VanDerWaalsContact O-N 3.12Å; P1073-T1076 WeakPolarHBondContact O-CB 3.46Å; P1073-T1076 PolarHBondContact O-N 2.95Å; P1073-T1076 PolarHBondContact O-OG1 3.09Å
1074	L	88.1	Confident	90.4	Very high	44 Å²	44	48.7 Å²	48.7	23%	0.23	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-49.4	-41.1	-179.1	-175	74.7	0	0	0	112.6	T1076 N1077 F1080 L1081	L1074-T1076 PolarHBondContact O-N 3.21Å; L1074-T1076 VanDerWaalsContact O-N 3.12Å; L1074-N1077 PolarHBondContact O-N 2.79Å; L1074-F1080 HydrophobicContact CD1-CD1 3.59Å; L1074-F1080 HydrophobicContact CD1-CE1 3.4Å; L1074-F1080 VanDerWaalsContact CD1-CE1 3.4Å; L1074-L1081 HydrophobicContact CD2-CD2 4.07Å; L1074-L1081 HydrophobicContact CG-CD2 4.05Å
1075	Y	88.7	Confident	90.7	Very high	163 Å²	163	51 Å²	51	64%	0.639	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-65.5	-16.2	-176.6	63.9	-102.5	0	0	0	115	P1073 N1077	P1073-Y1075 HydrophobicContact CB-CD1 3.55Å; P1073-Y1075 HydrophobicContact CB-CE1 3.15Å; P1073-Y1075 HydrophobicContact CB-CE2 4.34Å; P1073-Y1075 HydrophobicContact CB-CG 4.29Å; P1073-Y1075 HydrophobicContact CG-CE1 3.74Å; P1073-Y1075 PolarHBondContact O-N 3.35Å; P1073-Y1075 VanDerWaalsContact O-N 3.12Å; Y1075-N1077 VanDerWaalsContact C-N 3.28Å
1076	T	91.2	Very high	91.1	Very high	57 Å²	57	55.3 Å²	55.3	35%	0.35	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-76.2	-18.3	175.5	65.5	0	0	0	0	112.7	R1072 P1073 L1074 V1078	R1072-T1076 HydrophobicContact CB-CG2 4.06Å; R1072-T1076 WeakPolarHBondContact CB-OG1 3.03Å; P1073-T1076 WeakPolarHBondContact O-CB 3.46Å; P1073-T1076 PolarHBondContact O-N 2.95Å; P1073-T1076 PolarHBondContact O-OG1 3.09Å; L1074-T1076 PolarHBondContact O-N 3.21Å; L1074-T1076 VanDerWaalsContact O-N 3.12Å; T1076-V1078 PolarHBondContact O-N 3.43Å
1077	N	93.7	Very high	91.7	Very high	10 Å²	10	53.5 Å²	53.5	5%	0.053	31%	0.306	C	S	.	.			trans	-92.8	74.7	176.6	-168.5	-9.3	0	0	0	109.9	L976 T980 L1074 Y1075 F1080 L1081	L976-N1077 PolarHBondContact O-ND2 3.15Å; T980-N1077 PolarHBondContact OG1-ND2 2.9Å; T980-N1077 VanDerWaalsContact OG1-ND2 3.11Å; L1074-N1077 PolarHBondContact O-N 2.79Å; Y1075-N1077 VanDerWaalsContact C-N 3.28Å; N1077-F1080 HydrophobicContact CB-CB 4.06Å; N1077-F1080 WeakPolarHBondContact ND2-CB 3.49Å; N1077-F1080 WeakPolarHBondContact O-CB 3.45Å; N1077-F1080 PolarHBondContact O-N 3.42Å; N1077-F1080 VanDerWaalsContact O-N 3.1Å; N1077-F1080 WeakPolarHBondContact OD1-CB 3.49Å; N1077-F1080 PolarHBondContact OD1-N 2.95Å; N1077-L1081 PolarHBondContact O-N 3.04Å
1078	V	94.2	Very high	92.5	Very high	89 Å²	89	55 Å²	55	54%	0.539	31%	0.314	S	S	.	.	H	α-helix	trans	-53.9	-46.3	-177.8	179.9	0	0	0	0	112.7	T1076 F1080 L1081 V1082	T1076-V1078 PolarHBondContact O-N 3.43Å; V1078-F1080 VanDerWaalsContact C-N 3.27Å; V1078-F1080 PolarHBondContact O-N 3.45Å; V1078-L1081 PolarHBondContact O-N 2.97Å; V1078-V1082 HydrophobicContact CG1-CG2 4.1Å; V1078-V1082 WeakPolarHBondContact O-CG2 3.47Å; V1078-V1082 PolarHBondContact O-N 3.42Å
1079	P	94.9	Very high	93.1	Very high	56 Å²	56	54.8 Å²	54.8	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-58.3	-39.1	177.8	-25.3	35.4	0	0	0	113.1	L976 A1083	L976-P1079 HydrophobicContact CD2-CB 4.08Å; P1079-A1083 WeakPolarHBondContact O-CB 3.17Å; P1079-A1083 PolarHBondContact O-N 3.38Å
1080	F	94.9	Very high	93.5	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-68.7	-42.5	178.4	-178.6	-138	0	0	0	112.2	V973 L976 M977 A1061 L1074 N1077 V1078 A1083 L1084	V973-F1080 HydrophobicContact CB-CE2 4.36Å; V973-F1080 HydrophobicContact CG1-CE2 3.65Å; V973-F1080 HydrophobicContact CG1-CZ 4.19Å; V973-F1080 HydrophobicContact CG2-CE2 4.48Å; L976-F1080 HydrophobicContact CB-CB 4.06Å; L976-F1080 HydrophobicContact CB-CD2 3.96Å; L976-F1080 HydrophobicContact CB-CG 4.41Å; M977-F1080 HydrophobicContact CB-CD1 4.38Å; M977-F1080 HydrophobicContact CB-CD2 4.34Å; M977-F1080 HydrophobicContact CB-CE1 3.95Å; M977-F1080 HydrophobicContact CB-CE2 3.98Å; M977-F1080 HydrophobicContact CB-CZ 3.76Å; A1061-F1080 HydrophobicContact CB-CZ 4.34Å; L1074-F1080 HydrophobicContact CD1-CD1 3.59Å; L1074-F1080 HydrophobicContact CD1-CE1 3.4Å; L1074-F1080 VanDerWaalsContact CD1-CE1 3.4Å; N1077-F1080 HydrophobicContact CB-CB 4.06Å; N1077-F1080 WeakPolarHBondContact ND2-CB 3.49Å; N1077-F1080 WeakPolarHBondContact O-CB 3.45Å; N1077-F1080 PolarHBondContact O-N 3.42Å; N1077-F1080 VanDerWaalsContact O-N 3.1Å; N1077-F1080 WeakPolarHBondContact OD1-CB 3.49Å; N1077-F1080 PolarHBondContact OD1-N 2.95Å; V1078-F1080 VanDerWaalsContact C-N 3.27Å; V1078-F1080 PolarHBondContact O-N 3.45Å; F1080-A1083 PolarHBondContact O-N 3.35Å; F1080-L1084 HydrophobicContact CD1-CD1 4.32Å; F1080-L1084 HydrophobicContact CD2-CD1 4.34Å; F1080-L1084 HydrophobicContact CD2-CG 4.16Å; F1080-L1084 HydrophobicContact CE1-CD1 3.95Å; F1080-L1084 HydrophobicContact CE2-CD1 3.91Å; F1080-L1084 HydrophobicContact CE2-CD2 3.96Å; F1080-L1084 HydrophobicContact CE2-CG 3.79Å; F1080-L1084 HydrophobicContact CZ-CD1 3.71Å; F1080-L1084 HydrophobicContact CZ-CD2 4.23Å; F1080-L1084 HydrophobicContact CZ-CG 4.1Å; F1080-L1084 WeakPolarHBondContact O-CG 3.27Å; F1080-L1084 PolarHBondContact O-N 2.89Å
1081	L	94.6	Very high	93.6	Very high	63 Å²	63	55 Å²	55	33%	0.33	31%	0.305	S	S	.	.	H	α-helix	trans	-62.6	-44.3	175.1	-76.3	-173.8	0	0	0	112.6	L1074 N1077 V1078 A1083 L1084 A1085	L1074-L1081 HydrophobicContact CD2-CD2 4.07Å; L1074-L1081 HydrophobicContact CG-CD2 4.05Å; N1077-L1081 PolarHBondContact O-N 3.04Å; V1078-L1081 PolarHBondContact O-N 2.97Å; L1081-A1083 VanDerWaalsContact C-N 3.3Å; L1081-A1083 PolarHBondContact O-N 3.31Å; L1081-L1084 PolarHBondContact O-N 3.4Å; L1081-A1085 WeakPolarHBondContact O-CB 3.07Å; L1081-A1085 PolarHBondContact O-N 3.46Å
1082	V	95.9	Very high	93.8	Very high	87 Å²	87	57 Å²	57	53%	0.527	32%	0.318	S	S	.	.	H	α-helix	trans	-60.7	-43.1	177.2	171.2	0	0	0	0	110.1	V1078 A1085 L1086	V1078-V1082 HydrophobicContact CG1-CG2 4.1Å; V1078-V1082 WeakPolarHBondContact O-CG2 3.47Å; V1078-V1082 PolarHBondContact O-N 3.42Å; V1082-A1085 PolarHBondContact O-N 3.16Å; V1082-L1086 WeakPolarHBondContact O-CB 3.19Å; V1082-L1086 PolarHBondContact O-N 3.36Å
1083	A	95.4	Very high	93.8	Very high	11 Å²	11	53.6 Å²	53.6	9%	0.091	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-43.3	176.3	0	0	0	0	0	112.7	T972 L976 P1079 F1080 L1081 L1087	T972-A1083 HydrophobicContact CG2-CB 4.14Å; L976-A1083 HydrophobicContact CD1-CB 3.36Å; P1079-A1083 WeakPolarHBondContact O-CB 3.17Å; P1079-A1083 PolarHBondContact O-N 3.38Å; F1080-A1083 PolarHBondContact O-N 3.35Å; L1081-A1083 VanDerWaalsContact C-N 3.3Å; L1081-A1083 PolarHBondContact O-N 3.31Å; A1083-L1087 VanDerWaalsContact O-CB 3.24Å; A1083-L1087 WeakPolarHBondContact O-CB 3.48Å; A1083-L1087 WeakPolarHBondContact O-CG 3.31Å; A1083-L1087 PolarHBondContact O-N 2.91Å
1084	L	95.3	Very high	93.8	Very high	19 Å²	19	52.1 Å²	52.1	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-60.2	-48.7	175	-73.4	174.8	0	0	0	111.1	V973 L1058 A1062 F1080 L1081 S1088	V973-L1084 HydrophobicContact CG2-CD2 4.38Å; L1058-L1084 HydrophobicContact CB-CD2 4.27Å; L1058-L1084 HydrophobicContact CD2-CD2 4.14Å; A1062-L1084 HydrophobicContact CB-CD1 4.28Å; F1080-L1084 HydrophobicContact CD1-CD1 4.32Å; F1080-L1084 HydrophobicContact CD2-CD1 4.34Å; F1080-L1084 HydrophobicContact CD2-CG 4.16Å; F1080-L1084 HydrophobicContact CE1-CD1 3.95Å; F1080-L1084 HydrophobicContact CE2-CD1 3.91Å; F1080-L1084 HydrophobicContact CE2-CD2 3.96Å; F1080-L1084 HydrophobicContact CE2-CG 3.79Å; F1080-L1084 HydrophobicContact CZ-CD1 3.71Å; F1080-L1084 HydrophobicContact CZ-CD2 4.23Å; F1080-L1084 HydrophobicContact CZ-CG 4.1Å; F1080-L1084 WeakPolarHBondContact O-CG 3.27Å; F1080-L1084 PolarHBondContact O-N 2.89Å; L1081-L1084 PolarHBondContact O-N 3.4Å; L1084-S1088 VanDerWaalsContact O-CB 3.22Å; L1084-S1088 WeakPolarHBondContact O-CB 3.37Å; L1084-S1088 PolarHBondContact O-N 3.21Å; L1084-S1088 PolarHBondContact O-OG 3.06Å
1085	A	95.8	Very high	94	Very high	57 Å²	57	50.7 Å²	50.7	47%	0.471	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-44.7	180	0	0	0	0	0	112.1	L1081 V1082 S1089	L1081-A1085 WeakPolarHBondContact O-CB 3.07Å; L1081-A1085 PolarHBondContact O-N 3.46Å; V1082-A1085 PolarHBondContact O-N 3.16Å; A1085-S1089 VanDerWaalsContact O-CB 3.29Å; A1085-S1089 WeakPolarHBondContact O-CB 3.17Å; A1085-S1089 PolarHBondContact O-N 3.05Å; A1085-S1089 PolarHBondContact O-OG 3.43Å
1086	L	96.4	Very high	94.1	Very high	100 Å²	100	46.2 Å²	46.2	52%	0.524	29%	0.285	S	S	.	.	H	α-helix	trans	-63.5	-50.5	178.4	-178.9	67.8	0	0	0	111.2	V1082 S1089 I1090	V1082-L1086 WeakPolarHBondContact O-CB 3.19Å; V1082-L1086 PolarHBondContact O-N 3.36Å; L1086-S1089 PolarHBondContact O-N 3.19Å; L1086-I1090 HydrophobicContact CD1-CD1 4.29Å; L1086-I1090 HydrophobicContact CG-CD1 4.01Å; L1086-I1090 VanDerWaalsContact O-CG1 3.3Å; L1086-I1090 WeakPolarHBondContact O-CG1 3.44Å; L1086-I1090 PolarHBondContact O-N 3.09Å
1087	L	95.8	Very high	94	Very high	18 Å²	18	48.9 Å²	48.9	9%	0.094	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-42.3	-180	-69.2	171.5	0	0	0	111.4	V968 T972 V973 L1058 A1083 S1089 I1090 L1091	V968-L1087 HydrophobicContact CG1-CD2 4.12Å; T972-L1087 HydrophobicContact CG2-CD1 4.43Å; V973-L1087 HydrophobicContact CG2-CD1 4.09Å; L1058-L1087 HydrophobicContact CD1-CB 3.85Å; L1058-L1087 HydrophobicContact CD2-CB 4.03Å; L1058-L1087 HydrophobicContact CD2-CD1 3.95Å; A1083-L1087 VanDerWaalsContact O-CB 3.24Å; A1083-L1087 WeakPolarHBondContact O-CB 3.48Å; A1083-L1087 WeakPolarHBondContact O-CG 3.31Å; A1083-L1087 PolarHBondContact O-N 2.91Å; L1087-S1089 VanDerWaalsContact C-N 3.32Å; L1087-S1089 PolarHBondContact O-N 3.02Å; L1087-I1090 PolarHBondContact O-N 3.41Å; L1087-L1091 VanDerWaalsContact O-CG 3.31Å; L1087-L1091 WeakPolarHBondContact O-CG 3.26Å; L1087-L1091 PolarHBondContact O-N 2.92Å
1088	S	95.5	Very high	93.4	Very high	41 Å²	41	49.3 Å²	49.3	29%	0.287	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-40.5	173.7	-67.5	0	0	0	0	111.9	L1058 L1084 L1091 V1092	L1058-S1088 VanDerWaalsContact CD1-OG 3.31Å; L1058-S1088 WeakPolarHBondContact CD1-OG 3.5Å; L1084-S1088 VanDerWaalsContact O-CB 3.22Å; L1084-S1088 WeakPolarHBondContact O-CB 3.37Å; L1084-S1088 PolarHBondContact O-N 3.21Å; L1084-S1088 PolarHBondContact O-OG 3.06Å; S1088-L1091 PolarHBondContact O-N 3.31Å; S1088-V1092 VanDerWaalsContact O-CG2 3.31Å; S1088-V1092 WeakPolarHBondContact O-CG2 3.29Å; S1088-V1092 PolarHBondContact O-N 3.35Å
1089	S	95.1	Very high	92.9	Very high	81 Å²	81	47.4 Å²	47.4	57%	0.566	30%	0.302	S	S	*	.	H	α-helix	trans	-65	-41.4	177.3	-59	0	0	0	0	111.8	A1085 L1086 L1087 V1092 G1093	A1085-S1089 VanDerWaalsContact O-CB 3.29Å; A1085-S1089 WeakPolarHBondContact O-CB 3.17Å; A1085-S1089 PolarHBondContact O-N 3.05Å; A1085-S1089 PolarHBondContact O-OG 3.43Å; L1086-S1089 PolarHBondContact O-N 3.19Å; L1087-S1089 VanDerWaalsContact C-N 3.32Å; L1087-S1089 PolarHBondContact O-N 3.02Å; S1089-V1092 PolarHBondContact O-N 3.2Å; S1089-G1093 PolarHBondContact O-N 3.09Å
1090	I	93.5	Very high	92.2	Very high	83 Å²	83	52.9 Å²	52.9	43%	0.426	33%	0.328	S	S	.	.	H	α-helix	trans	-61.5	-44.2	174.4	-69	165.8	0	0	0	110.5	L1086 L1087 G1093 L1094	L1086-I1090 HydrophobicContact CD1-CD1 4.29Å; L1086-I1090 HydrophobicContact CG-CD1 4.01Å; L1086-I1090 VanDerWaalsContact O-CG1 3.3Å; L1086-I1090 WeakPolarHBondContact O-CG1 3.44Å; L1086-I1090 PolarHBondContact O-N 3.09Å; L1087-I1090 PolarHBondContact O-N 3.41Å; I1090-G1093 PolarHBondContact O-N 2.86Å; I1090-L1094 WeakPolarHBondContact O-CB 3.48Å; I1090-L1094 PolarHBondContact O-N 3.25Å
1091	L	94.1	Very high	91.7	Very high	14 Å²	14	57 Å²	57	7%	0.073	35%	0.349	C	S	.	.	H	α-helix	trans	-66.7	-38.5	178.2	-68.4	177.9	0	0	0	112.7	I969 F1055 L1058 L1087 S1088 L1094 V1095	I969-L1091 HydrophobicContact CD1-CD2 4.43Å; F1055-L1091 HydrophobicContact CD1-CB 4.22Å; F1055-L1091 HydrophobicContact CD1-CD1 4.01Å; F1055-L1091 HydrophobicContact CD2-CB 4.45Å; F1055-L1091 HydrophobicContact CE1-CB 3.59Å; F1055-L1091 HydrophobicContact CE1-CD1 4.21Å; F1055-L1091 HydrophobicContact CE2-CB 3.85Å; F1055-L1091 HydrophobicContact CG-CD1 4.19Å; F1055-L1091 HydrophobicContact CZ-CB 3.39Å; L1058-L1091 HydrophobicContact CD1-CD1 3.65Å; L1058-L1091 HydrophobicContact CG-CD1 4.38Å; L1087-L1091 VanDerWaalsContact O-CG 3.31Å; L1087-L1091 WeakPolarHBondContact O-CG 3.26Å; L1087-L1091 PolarHBondContact O-N 2.92Å; S1088-L1091 PolarHBondContact O-N 3.31Å; L1091-L1094 WeakPolarHBondContact O-CB 3.42Å; L1091-L1094 PolarHBondContact O-N 3.21Å; L1091-V1095 WeakPolarHBondContact O-CG2 3.41Å; L1091-V1095 PolarHBondContact O-N 2.78Å
1092	V	94.6	Very high	91.3	Very high	52 Å²	52	57 Å²	57	32%	0.315	35%	0.348	S	S	.	.	H	α-helix	trans	-63.4	-44.9	173.5	170.4	0	0	0	0	110.1	F1055 S1088 S1089 L1094 V1095 L1096 L1120	F1055-V1092 HydrophobicContact CE1-CG2 3.96Å; F1055-V1092 HydrophobicContact CZ-CG2 3.77Å; S1088-V1092 VanDerWaalsContact O-CG2 3.31Å; S1088-V1092 WeakPolarHBondContact O-CG2 3.29Å; S1088-V1092 PolarHBondContact O-N 3.35Å; S1089-V1092 PolarHBondContact O-N 3.2Å; V1092-L1094 VanDerWaalsContact C-N 3.3Å; V1092-L1094 PolarHBondContact O-N 3.26Å; V1092-V1095 PolarHBondContact O-N 2.81Å; V1092-L1096 HydrophobicContact CG1-CD1 3.76Å; V1092-L1096 HydrophobicContact CG1-CG 4.4Å; V1092-L1096 WeakPolarHBondContact O-CG 3.24Å; V1092-L1096 PolarHBondContact O-N 3.24Å; V1092-L1120 HydrophobicContact CG1-CD1 4.45Å; V1092-L1120 HydrophobicContact CG2-CD2 4.17Å
1093	G	91.8	Very high	90.7	Very high	33 Å²	33	55.9 Å²	55.9	34%	0.34	35%	0.354	S	S	.	.	H	α-helix	trans	-56.5	-44	173.1	0	0	0	0	0	112	S1089 I1090 V1095 L1096 V1097	S1089-G1093 PolarHBondContact O-N 3.09Å; I1090-G1093 PolarHBondContact O-N 2.86Å; G1093-V1095 PolarHBondContact O-N 3.01Å; G1093-L1096 PolarHBondContact O-N 3.47Å; G1093-V1097 CarbonylContact O-C 3.58Å; G1093-V1097 WeakPolarHBondContact O-CA 3.33Å; G1093-V1097 PolarHBondContact O-N 3.04Å; G1093-V1097 VanDerWaalsContact O-O 3.05Å
1094	L	91.1	Very high	90.2	Very high	17 Å²	17	58.7 Å²	58.7	9%	0.089	37%	0.371	C	S	.	.	H	α-helix	trans	-63.4	-38.8	179.4	-167	70.1	0	0	0	113	F1050 I1090 L1091 V1092 P1098 L1101 L1105 L1107	F1050-L1094 HydrophobicContact CE1-CD2 3.95Å; I1090-L1094 WeakPolarHBondContact O-CB 3.48Å; I1090-L1094 PolarHBondContact O-N 3.25Å; L1091-L1094 WeakPolarHBondContact O-CB 3.42Å; L1091-L1094 PolarHBondContact O-N 3.21Å; V1092-L1094 VanDerWaalsContact C-N 3.3Å; V1092-L1094 PolarHBondContact O-N 3.26Å; L1094-P1098 HydrophobicContact CD1-CB 4.21Å; L1094-P1098 WeakPolarHBondContact O-CB 3.34Å; L1094-P1098 WeakPolarHBondContact O-CD 3.33Å; L1094-L1101 HydrophobicContact CD1-CB 3.81Å; L1094-L1101 HydrophobicContact CD1-CD1 4.16Å; L1094-L1105 HydrophobicContact CD1-CD1 3.95Å; L1094-L1105 HydrophobicContact CD2-CD1 3.94Å; L1094-L1107 HydrophobicContact CD1-CD1 3.59Å; L1094-L1107 HydrophobicContact CD2-CD1 3.91Å; L1094-L1107 HydrophobicContact CG-CD1 3.72Å
1095	V	91.3	Very high	89.8	Confident	14 Å²	14	58.8 Å²	58.8	9%	0.085	37%	0.372	C	S	.	.	H	α-helix	trans	-71.1	-41.5	176.9	171.2	0	0	0	0	111.7	F1055 L1091 V1092 G1093 K1116 L1119 L1120	F1055-V1095 HydrophobicContact CE2-CG2 4.05Å; L1091-V1095 WeakPolarHBondContact O-CG2 3.41Å; L1091-V1095 PolarHBondContact O-N 2.78Å; V1092-V1095 PolarHBondContact O-N 2.81Å; G1093-V1095 PolarHBondContact O-N 3.01Å; V1095-K1116 HydrophobicContact CG1-CB 4.35Å; V1095-K1116 HydrophobicContact CG1-CG 4.42Å; V1095-K1116 WeakPolarHBondContact O-CD 3.27Å; V1095-K1116 WeakPolarHBondContact O-CE 3.39Å; V1095-L1119 HydrophobicContact CG1-CD2 4.09Å; V1095-L1119 HydrophobicContact CG2-CD2 4.34Å; V1095-L1120 HydrophobicContact CG1-CD2 4.45Å; V1095-L1120 HydrophobicContact CG1-CG 4.47Å
1096	L	91.3	Very high	89.4	Confident	68 Å²	68	57.2 Å²	57.2	36%	0.356	36%	0.359	S	S	.	.	H	α-helix	trans	-77	-51.1	-176.6	-66.4	175.4	0	0	0	111.7	V1092 G1093 K1116 L1120	V1092-L1096 HydrophobicContact CG1-CD1 3.76Å; V1092-L1096 HydrophobicContact CG1-CG 4.4Å; V1092-L1096 WeakPolarHBondContact O-CG 3.24Å; V1092-L1096 PolarHBondContact O-N 3.24Å; G1093-L1096 PolarHBondContact O-N 3.47Å; L1096-K1116 HydrophobicContact CD2-CB 4.42Å; L1096-K1116 PolarHBondContact O-NZ 3.4Å; L1096-L1120 HydrophobicContact CD2-CD1 4.12Å; L1096-L1120 HydrophobicContact CG-CD1 4.4Å
1097	V	88.7	Confident	89.1	Confident	114 Å²	114	52.9 Å²	52.9	69%	0.691	34%	0.336	S	S	*	.			trans	-141.7	85	-173.9	-171.4	0	0	0	0	109.9	G1093 G1099	G1093-V1097 CarbonylContact O-C 3.58Å; G1093-V1097 WeakPolarHBondContact O-CA 3.33Å; G1093-V1097 PolarHBondContact O-N 3.04Å; G1093-V1097 VanDerWaalsContact O-O 3.05Å; V1097-G1099 VanDerWaalsContact C-N 3.29Å; V1097-G1099 PolarHBondContact O-N 3.27Å
1098	P	81.6	Confident	88.7	Confident	18 Å²	18	57.4 Å²	57.4	12%	0.117	35%	0.352	C	S	.	.			trans	-66.7	-25.7	-176.9	22.4	-31.1	0	0	0	114.2	L1094 L1100 L1101 Q1102 L1107	L1094-P1098 HydrophobicContact CD1-CB 4.21Å; L1094-P1098 WeakPolarHBondContact O-CB 3.34Å; L1094-P1098 WeakPolarHBondContact O-CD 3.33Å; P1098-L1100 PolarHBondContact O-N 3.41Å; P1098-L1101 PolarHBondContact O-N 3.17Å; P1098-Q1102 HydrophobicContact CB-CB 4Å; P1098-Q1102 HydrophobicContact CB-CG 4.36Å; P1098-Q1102 HydrophobicContact CG-CB 4.4Å; P1098-Q1102 HydrophobicContact CG-CG 4.37Å; P1098-Q1102 PolarHBondContact O-N 3.15Å; P1098-L1107 HydrophobicContact CB-CD1 4.33Å
1099	G	83.4	Confident	88.3	Confident	49 Å²	49	58.7 Å²	58.7	51%	0.505	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	48.3	-124.7	169.7	0	0	0	0	0	114.3	V1097 L1101 Q1102	V1097-G1099 VanDerWaalsContact C-N 3.29Å; V1097-G1099 PolarHBondContact O-N 3.27Å; G1099-L1101 VanDerWaalsContact C-N 3.26Å; G1099-L1101 PolarHBondContact O-N 3.4Å; G1099-Q1102 WeakPolarHBondContact O-CB 3.08Å; G1099-Q1102 PolarHBondContact O-N 3.11Å
1100	L	80.4	Confident	87.9	Confident	171 Å²	171	55.5 Å²	55.5	90%	0.895	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-64.8	-23.5	-179.4	-74.5	153.5	0	0	0	114	P1098 P1104	P1098-L1100 PolarHBondContact O-N 3.41Å; L1100-P1104 WeakPolarHBondContact O-CD 3.41Å
1101	L	84.4	Confident	87.5	Confident	87 Å²	87	57 Å²	57	46%	0.455	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-85.9	-10	-178.5	-65.3	176.2	0	0	0	112.9	L1094 P1098 G1099 G1103 L1105	L1094-L1101 HydrophobicContact CD1-CB 3.81Å; L1094-L1101 HydrophobicContact CD1-CD1 4.16Å; P1098-L1101 PolarHBondContact O-N 3.17Å; G1099-L1101 VanDerWaalsContact C-N 3.26Å; G1099-L1101 PolarHBondContact O-N 3.4Å; L1101-G1103 PolarHBondContact O-N 3.45Å; L1101-L1105 HydrophobicContact CB-CD1 4.17Å; L1101-L1105 WeakPolarHBondContact O-CB 3.37Å; L1101-L1105 PolarHBondContact O-N 2.84Å; L1101-L1105 VanDerWaalsContact O-N 3.09Å
1102	Q	85	Confident	87.3	Confident	63 Å²	63	58.3 Å²	58.3	29%	0.294	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-47	-178.2	-170	-173	-30.9	0	0	112.6	P1098 G1099 A1106 L1107	P1098-Q1102 HydrophobicContact CB-CB 4Å; P1098-Q1102 HydrophobicContact CB-CG 4.36Å; P1098-Q1102 HydrophobicContact CG-CB 4.4Å; P1098-Q1102 HydrophobicContact CG-CG 4.37Å; P1098-Q1102 PolarHBondContact O-N 3.15Å; G1099-Q1102 WeakPolarHBondContact O-CB 3.08Å; G1099-Q1102 PolarHBondContact O-N 3.11Å; Q1102-A1106 PolarHBondContact O-N 3.25Å; Q1102-L1107 HydrophobicContact CG-CB 4.23Å; Q1102-L1107 VanDerWaalsContact CG-O 3.23Å; Q1102-L1107 WeakPolarHBondContact CG-O 3.31Å; Q1102-L1107 PolarHBondContact O-N 3.5Å
1103	G	83.3	Confident	87	Confident	63 Å²	63	60.3 Å²	60.3	65%	0.649	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-57.4	-179.7	0	0	0	0	0	112.6	L1101 L1105 A1106	L1101-G1103 PolarHBondContact O-N 3.45Å; G1103-L1105 VanDerWaalsContact C-N 3.34Å; G1103-L1105 PolarHBondContact O-N 3.08Å; G1103-A1106 PolarHBondContact O-N 2.84Å
1104	P	85.4	Confident	87	Confident	71 Å²	71	63 Å²	63	46%	0.461	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-40.3	-180	-26.7	34.8	0	0	0	113.9	L960 L1100 A1106	L960-P1104 WeakPolarHBondContact CB-O 3.44Å; L960-P1104 HydrophobicContact CD1-CB 3.82Å; L960-P1104 WeakPolarHBondContact CD1-O 3.27Å; L1100-P1104 WeakPolarHBondContact O-CD 3.41Å; P1104-A1106 VanDerWaalsContact C-N 3.25Å; P1104-A1106 PolarHBondContact O-N 3.41Å
1105	L	87.5	Confident	87.1	Confident	21 Å²	21	62.6 Å²	62.6	11%	0.11	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	7.4	179	-69.5	170.2	0	0	0	113.5	L960 Q961 A964 F1050 L1094 L1101 G1103 L1107	L960-L1105 HydrophobicContact CB-CD2 4.36Å; Q961-L1105 HydrophobicContact CG-CD2 4.27Å; Q961-L1105 WeakPolarHBondContact CG-O 3.2Å; Q961-L1105 PolarHBondContact NE2-O 2.88Å; A964-L1105 HydrophobicContact CB-CD2 4.23Å; F1050-L1105 HydrophobicContact CZ-CD2 4.32Å; L1094-L1105 HydrophobicContact CD1-CD1 3.95Å; L1094-L1105 HydrophobicContact CD2-CD1 3.94Å; L1101-L1105 HydrophobicContact CB-CD1 4.17Å; L1101-L1105 WeakPolarHBondContact O-CB 3.37Å; L1101-L1105 PolarHBondContact O-N 2.84Å; L1101-L1105 VanDerWaalsContact O-N 3.09Å; G1103-L1105 VanDerWaalsContact C-N 3.34Å; G1103-L1105 PolarHBondContact O-N 3.08Å; L1105-L1107 VanDerWaalsContact C-N 3.26Å; L1105-L1107 HydrophobicContact CB-CD1 3.88Å; L1105-L1107 HydrophobicContact CB-CD2 4.32Å; L1105-L1107 HydrophobicContact CB-CG 3.73Å; L1105-L1107 HydrophobicContact CD1-CD1 4.24Å; L1105-L1107 PolarHBondContact O-N 3.48Å
1106	A	87.4	Confident	87.2	Confident	24 Å²	24	63 Å²	63	20%	0.198	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	47.4	-177.9	0	0	0	0	0	113	L1041 P1042 Q1102 G1103 P1104	L1041-A1106 HydrophobicContact CB-CB 4.39Å; P1042-A1106 HydrophobicContact CB-CB 4.42Å; P1042-A1106 WeakPolarHBondContact CB-O 3.4Å; Q1102-A1106 PolarHBondContact O-N 3.25Å; G1103-A1106 PolarHBondContact O-N 2.84Å; P1104-A1106 VanDerWaalsContact C-N 3.25Å; P1104-A1106 PolarHBondContact O-N 3.41Å
1107	L	89.1	Confident	87.3	Confident	8 Å²	8	65.1 Å²	65.1	4%	0.042	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-92.5	135.6	-179.1	-58.6	173	0	0	0	111	T1047 F1050 L1094 P1098 Q1102 L1105	T1047-L1107 HydrophobicContact CG2-CB 4.38Å; T1047-L1107 HydrophobicContact CG2-CD2 4.16Å; F1050-L1107 HydrophobicContact CD1-CD2 3.7Å; F1050-L1107 HydrophobicContact CE1-CD2 4.08Å; L1094-L1107 HydrophobicContact CD1-CD1 3.59Å; L1094-L1107 HydrophobicContact CD2-CD1 3.91Å; L1094-L1107 HydrophobicContact CG-CD1 3.72Å; P1098-L1107 HydrophobicContact CB-CD1 4.33Å; Q1102-L1107 HydrophobicContact CG-CB 4.23Å; Q1102-L1107 VanDerWaalsContact CG-O 3.23Å; Q1102-L1107 WeakPolarHBondContact CG-O 3.31Å; Q1102-L1107 PolarHBondContact O-N 3.5Å; L1105-L1107 VanDerWaalsContact C-N 3.26Å; L1105-L1107 HydrophobicContact CB-CD1 3.88Å; L1105-L1107 HydrophobicContact CB-CD2 4.32Å; L1105-L1107 HydrophobicContact CB-CG 3.73Å; L1105-L1107 HydrophobicContact CD1-CD1 4.24Å; L1105-L1107 PolarHBondContact O-N 3.48Å
1108	R	89.1	Confident	87.5	Confident	113 Å²	113	63.5 Å²	63.5	43%	0.426	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-85.5	126.5	173.6	-171.6	69.5	-178	-171.3	0.7	109.3	P1042 Y1044 T1047 I1110	P1042-R1108 HydrophobicContact CB-CB 4.48Å; Y1044-R1108 HydrophobicContact CD1-CB 4.09Å; Y1044-R1108 HydrophobicContact CD1-CG 3.5Å; Y1044-R1108 VanDerWaalsContact CD1-CG 3.5Å; Y1044-R1108 HydrophobicContact CD2-CG 4.32Å; Y1044-R1108 HydrophobicContact CE1-CB 4.32Å; Y1044-R1108 HydrophobicContact CE1-CG 3.33Å; Y1044-R1108 HydrophobicContact CE2-CG 4.2Å; Y1044-R1108 HydrophobicContact CG-CG 4Å; T1047-R1108 PolarHBondContact OG1-N 3.13Å; R1108-I1110 PolarHBondContact O-N 2.96Å
1109	N	85.4	Confident	88.1	Confident	69 Å²	69	63 Å²	63	37%	0.369	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-68.6	126.7	179.6	-169.5	16.5	0	0	0	110.9
1110	I	87.9	Confident	88.7	Confident	14 Å²	14	62.1 Å²	62.1	7%	0.072	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-101.5	118.9	173.1	-60.1	167.7	0	0	0	107.1	W1027 Y1044 T1047 V1048 R1108 D1112 F1115 K1116	W1027-I1110 HydrophobicContact CH2-CD1 4.4Å; W1027-I1110 HydrophobicContact CH2-CG1 4.28Å; W1027-I1110 HydrophobicContact CH2-CG2 3.86Å; W1027-I1110 HydrophobicContact CZ2-CG2 3.8Å; W1027-I1110 HydrophobicContact CZ3-CG1 4.49Å; W1027-I1110 HydrophobicContact CZ3-CG2 4.44Å; Y1044-I1110 HydrophobicContact CD1-CG1 4.03Å; Y1044-I1110 HydrophobicContact CE1-CG1 4.27Å; T1047-I1110 HydrophobicContact CG2-CD1 4.45Å; V1048-I1110 HydrophobicContact CG2-CD1 4.14Å; R1108-I1110 PolarHBondContact O-N 2.96Å; I1110-D1112 HydrophobicContact CG2-CB 4.34Å; I1110-F1115 HydrophobicContact CD1-CD1 4.26Å; I1110-F1115 HydrophobicContact CD1-CE1 4.1Å; I1110-F1115 HydrophobicContact CG2-CD1 4.04Å; I1110-K1116 WeakPolarHBondContact O-CE 3.49Å; I1110-K1116 PolarHBondContact O-NZ 2.92Å
1111	T	84.3	Confident	89.4	Confident	115 Å²	115	55.8 Å²	55.8	71%	0.706	33%	0.33	S	S	*	.			trans	-82.4	-25.1	-178.1	49.6	0	0	0	0	112.8	T1113	T1111-T1113 PolarHBondContact O-N 2.87Å
1112	D	89.9	Confident	89.9	Confident	40 Å²	40	53.3 Å²	53.3	21%	0.214	32%	0.317	C	S	.	.			trans	-72.2	110	-179.3	-175.2	-9.1	0	0	0	112.1	W1027 I1110 C1114 F1115 K1116	W1027-D1112 PolarHBondContact NE1-OD2 3.37Å; W1027-D1112 VanDerWaalsContact NE1-OD2 3.08Å; I1110-D1112 HydrophobicContact CG2-CB 4.34Å; D1112-C1114 WeakPolarHBondContact OD1-CA 3.45Å; D1112-C1114 WeakPolarHBondContact OD1-CB 3.44Å; D1112-C1114 PolarHBondContact OD1-N 2.93Å; D1112-F1115 HydrophobicContact CB-CB 4.01Å; D1112-F1115 PolarHBondContact OD1-N 3.39Å; D1112-F1115 VanDerWaalsContact OD1-N 3.13Å; D1112-K1116 WeakPolarHBondContact O-CG 3.36Å; D1112-K1116 PolarHBondContact O-N 3.41Å
1113	T	89.3	Confident	90.4	Very high	94 Å²	94	51.1 Å²	51.1	58%	0.577	31%	0.307	S	S	*	.	H	α-helix	trans	-71.6	-30.8	177.8	50.7	0	0	0	0	112.8	T1111 K1116 L1117	T1111-T1113 PolarHBondContact O-N 2.87Å; T1113-K1116 PolarHBondContact O-N 3.48Å; T1113-L1117 WeakPolarHBondContact O-CG 3.3Å; T1113-L1117 PolarHBondContact O-N 3.38Å
1114	C	91.7	Very high	91	Very high	91 Å²	91	52.2 Å²	52.2	62%	0.615	30%	0.302	S	S	*	.	H	α-helix	trans	-67.3	-42.1	177.5	-66.1	0	0	0	0	110.2	D1112 L1117 L1118	D1112-C1114 WeakPolarHBondContact OD1-CA 3.45Å; D1112-C1114 WeakPolarHBondContact OD1-CB 3.44Å; D1112-C1114 PolarHBondContact OD1-N 2.93Å; C1114-L1117 PolarHBondContact O-N 2.82Å; C1114-L1118 WeakPolarHBondContact O-CB 3.41Å; C1114-L1118 PolarHBondContact O-N 3.38Å
1115	F	92.8	Very high	91.5	Very high	8 Å²	8	55 Å²	55	4%	0.035	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-40.2	174.9	-174	-98.3	0	0	0	112.7	L1021 T1022 Q1025 W1027 V1048 I1110 D1112 L1117 L1118 L1119	L1021-F1115 HydrophobicContact CB-CE2 4.39Å; T1022-F1115 HydrophobicContact CG2-CZ 4.49Å; Q1025-F1115 HydrophobicContact CG-CD2 3.62Å; Q1025-F1115 HydrophobicContact CG-CE2 3.64Å; Q1025-F1115 HydrophobicContact CG-CG 4.44Å; Q1025-F1115 HydrophobicContact CG-CZ 4.47Å; W1027-F1115 AromaticContact CH2-CD1 3.86Å; W1027-F1115 HydrophobicContact CH2-CD1 3.86Å; W1027-F1115 AromaticContact CH2-CE1 3.83Å; W1027-F1115 HydrophobicContact CH2-CE1 3.83Å; W1027-F1115 HydrophobicContact CH2-CG 4.27Å; W1027-F1115 HydrophobicContact CH2-CZ 4.23Å; W1027-F1115 HydrophobicContact CZ2-CB 3.98Å; W1027-F1115 AromaticContact CZ2-CD1 3.59Å; W1027-F1115 HydrophobicContact CZ2-CD1 3.59Å; W1027-F1115 AromaticContact CZ2-CD2 3.98Å; W1027-F1115 HydrophobicContact CZ2-CD2 3.98Å; W1027-F1115 AromaticContact CZ2-CE1 3.98Å; W1027-F1115 HydrophobicContact CZ2-CE1 3.98Å; W1027-F1115 HydrophobicContact CZ2-CE2 4.35Å; W1027-F1115 AromaticContact CZ2-CG 3.57Å; W1027-F1115 HydrophobicContact CZ2-CG 3.57Å; W1027-F1115 HydrophobicContact CZ2-CZ 4.35Å; V1048-F1115 HydrophobicContact CG2-CE1 3.95Å; V1048-F1115 HydrophobicContact CG2-CZ 4.26Å; I1110-F1115 HydrophobicContact CD1-CD1 4.26Å; I1110-F1115 HydrophobicContact CD1-CE1 4.1Å; I1110-F1115 HydrophobicContact CG2-CD1 4.04Å; D1112-F1115 HydrophobicContact CB-CB 4.01Å; D1112-F1115 PolarHBondContact OD1-N 3.39Å; D1112-F1115 VanDerWaalsContact OD1-N 3.13Å; F1115-L1117 VanDerWaalsContact C-N 3.33Å; F1115-L1117 PolarHBondContact O-N 2.92Å; F1115-L1118 HydrophobicContact CD2-CD2 4.38Å; F1115-L1118 WeakPolarHBondContact O-CB 3.25Å; F1115-L1118 PolarHBondContact O-N 3.02Å; F1115-L1119 PolarHBondContact O-N 3.42Å
1116	K	92.8	Very high	91.9	Very high	23 Å²	23	54.1 Å²	54.1	10%	0.1	30%	0.302	C	S	.	.	H	α-helix	trans	-58.3	-44.2	173.3	-73.7	172.8	170.9	174.2	0	112.1	V1095 L1096 I1110 D1112 T1113 L1119 L1120	V1095-K1116 HydrophobicContact CG1-CB 4.35Å; V1095-K1116 HydrophobicContact CG1-CG 4.42Å; V1095-K1116 WeakPolarHBondContact O-CD 3.27Å; V1095-K1116 WeakPolarHBondContact O-CE 3.39Å; L1096-K1116 HydrophobicContact CD2-CB 4.42Å; L1096-K1116 PolarHBondContact O-NZ 3.4Å; I1110-K1116 WeakPolarHBondContact O-CE 3.49Å; I1110-K1116 PolarHBondContact O-NZ 2.92Å; D1112-K1116 WeakPolarHBondContact O-CG 3.36Å; D1112-K1116 PolarHBondContact O-N 3.41Å; T1113-K1116 PolarHBondContact O-N 3.48Å; K1116-L1119 WeakPolarHBondContact O-CB 3.45Å; K1116-L1119 PolarHBondContact O-N 2.65Å; K1116-L1120 PolarHBondContact O-N 3.22Å; K1116-L1120 VanDerWaalsContact O-N 3.15Å
1117	L	93.2	Very high	92.3	Very high	111 Å²	111	57.7 Å²	57.7	58%	0.581	31%	0.313	S	S	*	.	H	α-helix	trans	-67.2	-37.8	176.4	-69.3	174.6	0	0	0	112.1	T1113 C1114 F1115 L1119 L1120 G1121	T1113-L1117 WeakPolarHBondContact O-CG 3.3Å; T1113-L1117 PolarHBondContact O-N 3.38Å; C1114-L1117 PolarHBondContact O-N 2.82Å; F1115-L1117 VanDerWaalsContact C-N 3.33Å; F1115-L1117 PolarHBondContact O-N 2.92Å; L1117-L1119 VanDerWaalsContact C-N 3.3Å; L1117-L1119 PolarHBondContact O-N 3.45Å; L1117-L1120 PolarHBondContact O-N 2.87Å; L1117-G1121 PolarHBondContact O-N 2.91Å
1118	L	94.1	Very high	92.6	Very high	81 Å²	81	60.9 Å²	60.9	42%	0.424	33%	0.333	S	S	.	.	H	α-helix	trans	-60	-41.5	173.3	-177.7	67.7	0	0	0	111.3	L1021 C1114 F1115 G1121 L1122	L1021-L1118 HydrophobicContact CD1-CD2 4.28Å; L1021-L1118 HydrophobicContact CD2-CD2 4.42Å; C1114-L1118 WeakPolarHBondContact O-CB 3.41Å; C1114-L1118 PolarHBondContact O-N 3.38Å; F1115-L1118 HydrophobicContact CD2-CD2 4.38Å; F1115-L1118 WeakPolarHBondContact O-CB 3.25Å; F1115-L1118 PolarHBondContact O-N 3.02Å; L1118-G1121 WeakPolarHBondContact O-CA 2.96Å; L1118-G1121 PolarHBondContact O-N 3.35Å; L1118-G1121 VanDerWaalsContact O-N 3.12Å; L1118-L1122 PolarHBondContact O-N 2.9Å
1119	L	93.7	Very high	92.9	Very high	7 Å²	7	56.5 Å²	56.5	4%	0.037	32%	0.323	C	S	.	.	H	α-helix	trans	-61.6	-44.3	176.3	-163.2	71.7	0	0	0	111.7	V1048 L1052 V1095 F1115 K1116 L1117 G1121 L1122 V1123	V1048-L1119 HydrophobicContact CG1-CD1 3.91Å; L1052-L1119 HydrophobicContact CD1-CD1 3.86Å; L1052-L1119 HydrophobicContact CD2-CD1 3.6Å; L1052-L1119 HydrophobicContact CD2-CG 3.98Å; L1052-L1119 HydrophobicContact CG-CD1 3.67Å; L1052-L1119 HydrophobicContact CG-CG 4.36Å; V1095-L1119 HydrophobicContact CG1-CD2 4.09Å; V1095-L1119 HydrophobicContact CG2-CD2 4.34Å; F1115-L1119 PolarHBondContact O-N 3.42Å; K1116-L1119 WeakPolarHBondContact O-CB 3.45Å; K1116-L1119 PolarHBondContact O-N 2.65Å; L1117-L1119 VanDerWaalsContact C-N 3.3Å; L1117-L1119 PolarHBondContact O-N 3.45Å; L1119-G1121 VanDerWaalsContact C-N 3.29Å; L1119-G1121 PolarHBondContact O-N 3.19Å; L1119-L1122 WeakPolarHBondContact O-CB 3.02Å; L1119-L1122 PolarHBondContact O-N 3.12Å; L1119-V1123 WeakPolarHBondContact O-CG2 3.42Å; L1119-V1123 PolarHBondContact O-N 3.37Å
1120	L	95.1	Very high	93.3	Very high	30 Å²	30	53.2 Å²	53.2	16%	0.157	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-32	173.5	-65.7	177.5	0	0	0	112.3	F1055 V1092 V1095 L1096 K1116 L1117 V1123 T1124	F1055-L1120 HydrophobicContact CE2-CD2 4.3Å; F1055-L1120 HydrophobicContact CZ-CD2 4.13Å; V1092-L1120 HydrophobicContact CG1-CD1 4.45Å; V1092-L1120 HydrophobicContact CG2-CD2 4.17Å; V1095-L1120 HydrophobicContact CG1-CD2 4.45Å; V1095-L1120 HydrophobicContact CG1-CG 4.47Å; L1096-L1120 HydrophobicContact CD2-CD1 4.12Å; L1096-L1120 HydrophobicContact CG-CD1 4.4Å; K1116-L1120 PolarHBondContact O-N 3.22Å; K1116-L1120 VanDerWaalsContact O-N 3.15Å; L1117-L1120 PolarHBondContact O-N 2.87Å; L1120-V1123 WeakPolarHBondContact O-CB 3.43Å; L1120-V1123 PolarHBondContact O-N 3.44Å; L1120-T1124 PolarHBondContact O-N 3.33Å; L1120-T1124 PolarHBondContact O-OG1 3.26Å
1121	G	95.5	Very high	93.5	Very high	39 Å²	39	55.5 Å²	55.5	40%	0.402	32%	0.315	S	S	.	.	H	α-helix	trans	-61.4	-45.4	170.6	0	0	0	0	0	112.4	L1117 L1118 L1119 V1123 T1124 F1125	L1117-G1121 PolarHBondContact O-N 2.91Å; L1118-G1121 WeakPolarHBondContact O-CA 2.96Å; L1118-G1121 PolarHBondContact O-N 3.35Å; L1118-G1121 VanDerWaalsContact O-N 3.12Å; L1119-G1121 VanDerWaalsContact C-N 3.29Å; L1119-G1121 PolarHBondContact O-N 3.19Å; G1121-V1123 VanDerWaalsContact C-N 3.34Å; G1121-V1123 PolarHBondContact O-N 3.3Å; G1121-T1124 PolarHBondContact O-N 3Å; G1121-F1125 WeakPolarHBondContact O-CB 3.45Å; G1121-F1125 PolarHBondContact O-N 3.3Å
1122	L	95.4	Very high	93.8	Very high	34 Å²	34	55.3 Å²	55.3	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-62.1	-39.8	173.9	-72.5	169.4	0	0	0	112.3	L1021 L1052 L1118 L1119 T1124 F1125 N1126	L1021-L1122 HydrophobicContact CD1-CD1 3.74Å; L1052-L1122 HydrophobicContact CD2-CB 4.35Å; L1118-L1122 PolarHBondContact O-N 2.9Å; L1119-L1122 WeakPolarHBondContact O-CB 3.02Å; L1119-L1122 PolarHBondContact O-N 3.12Å; L1122-T1124 VanDerWaalsContact C-N 3.34Å; L1122-F1125 PolarHBondContact O-N 3.3Å; L1122-N1126 WeakPolarHBondContact O-CB 3.23Å; L1122-N1126 PolarHBondContact O-N 3Å
1123	V	96.4	Very high	93.9	Very high	17 Å²	17	55.2 Å²	55.2	10%	0.103	31%	0.307	C	S	.	.	H	α-helix	trans	-60.8	-45.1	174.1	169.5	0	0	0	0	110.9	L1052 F1055 I1059 L1119 L1120 G1121 N1126 F1127	L1052-V1123 HydrophobicContact CD2-CG2 3.84Å; F1055-V1123 HydrophobicContact CB-CB 4.5Å; F1055-V1123 HydrophobicContact CB-CG1 3.74Å; F1055-V1123 HydrophobicContact CB-CG2 3.93Å; F1055-V1123 HydrophobicContact CD1-CG1 3.7Å; F1055-V1123 HydrophobicContact CD2-CB 4.49Å; F1055-V1123 HydrophobicContact CD2-CG1 4.14Å; F1055-V1123 HydrophobicContact CD2-CG2 3.55Å; F1055-V1123 HydrophobicContact CE1-CG1 4.29Å; F1055-V1123 HydrophobicContact CE2-CG2 4.18Å; F1055-V1123 HydrophobicContact CG-CB 4.38Å; F1055-V1123 HydrophobicContact CG-CG1 3.6Å; F1055-V1123 HydrophobicContact CG-CG2 3.8Å; I1059-V1123 HydrophobicContact CD1-CG1 4.21Å; L1119-V1123 WeakPolarHBondContact O-CG2 3.42Å; L1119-V1123 PolarHBondContact O-N 3.37Å; L1120-V1123 WeakPolarHBondContact O-CB 3.43Å; L1120-V1123 PolarHBondContact O-N 3.44Å; G1121-V1123 VanDerWaalsContact C-N 3.34Å; G1121-V1123 PolarHBondContact O-N 3.3Å; V1123-N1126 WeakPolarHBondContact O-CB 3.46Å; V1123-N1126 PolarHBondContact O-N 3.46Å; V1123-F1127 PolarHBondContact O-N 3.21Å
1124	T	95.4	Very high	93.9	Very high	86 Å²	86	51 Å²	51	53%	0.528	28%	0.28	S	S	.	.	H	α-helix	trans	-64.5	-44.2	178.3	-55.2	0	0	0	0	111.3	L1120 G1121 L1122 N1126 F1127 V1128	L1120-T1124 PolarHBondContact O-N 3.33Å; L1120-T1124 PolarHBondContact O-OG1 3.26Å; G1121-T1124 PolarHBondContact O-N 3Å; L1122-T1124 VanDerWaalsContact C-N 3.34Å; T1124-N1126 VanDerWaalsContact C-N 3.3Å; T1124-N1126 PolarHBondContact O-N 3.14Å; T1124-F1127 PolarHBondContact O-N 2.87Å; T1124-V1128 WeakPolarHBondContact O-CG2 3.3Å; T1124-V1128 PolarHBondContact O-N 3.42Å
1125	F	96.2	Very high	93.6	Very high	129 Å²	129	48.9 Å²	48.9	57%	0.566	27%	0.267	S	S	*	.	H	α-helix	trans	-57.1	-44.9	173.9	172	-100.1	0	0	0	111.5	V1014 G1121 L1122 V1128 G1129	V1014-F1125 HydrophobicContact CG2-CD1 4.35Å; V1014-F1125 HydrophobicContact CG2-CE1 4.49Å; G1121-F1125 WeakPolarHBondContact O-CB 3.45Å; G1121-F1125 PolarHBondContact O-N 3.3Å; L1122-F1125 PolarHBondContact O-N 3.3Å; F1125-V1128 PolarHBondContact O-N 2.88Å; F1125-G1129 PolarHBondContact O-N 3.49Å
1126	N	96.3	Very high	93.2	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-64.3	-42.3	177.7	-170.1	8.2	0	0	0	112.3	V1014 Q1056 I1059 L1122 V1123 T1124 V1128 G1129 A1130	V1014-N1126 HydrophobicContact CG1-CB 4.28Å; V1014-N1126 HydrophobicContact CG2-CB 4.02Å; Q1056-N1126 WeakPolarHBondContact CG-ND2 3.36Å; Q1056-N1126 PolarHBondContact NE2-ND2 3.02Å; I1059-N1126 HydrophobicContact CD1-CB 4.17Å; L1122-N1126 WeakPolarHBondContact O-CB 3.23Å; L1122-N1126 PolarHBondContact O-N 3Å; V1123-N1126 WeakPolarHBondContact O-CB 3.46Å; V1123-N1126 PolarHBondContact O-N 3.46Å; T1124-N1126 VanDerWaalsContact C-N 3.3Å; T1124-N1126 PolarHBondContact O-N 3.14Å; N1126-V1128 PolarHBondContact O-N 3.32Å; N1126-G1129 PolarHBondContact O-N 3.31Å; N1126-A1130 VanDerWaalsContact O-CB 3.25Å; N1126-A1130 WeakPolarHBondContact O-CB 3.47Å; N1126-A1130 PolarHBondContact O-N 3.49Å
1127	F	95.6	Very high	92.8	Very high	99 Å²	99	52.2 Å²	52.2	43%	0.434	29%	0.289	S	S	.	.	H	α-helix	trans	-57.7	-50.4	176	176.8	-98.1	0	0	0	111.7	I1059 V1123 T1124 A1130 F1131	I1059-F1127 HydrophobicContact CD1-CB 4.12Å; I1059-F1127 HydrophobicContact CG1-CB 4.13Å; I1059-F1127 HydrophobicContact CG1-CD2 4.11Å; I1059-F1127 HydrophobicContact CG2-CB 4.46Å; I1059-F1127 HydrophobicContact CG2-CD2 4.37Å; V1123-F1127 PolarHBondContact O-N 3.21Å; T1124-F1127 PolarHBondContact O-N 2.87Å; F1127-A1130 PolarHBondContact O-N 3.04Å; F1127-F1131 HydrophobicContact CD2-CD2 4.06Å; F1127-F1131 AromaticContact CD2-CE2 3.91Å; F1127-F1131 HydrophobicContact CD2-CE2 3.91Å; F1127-F1131 HydrophobicContact CE1-CD2 4.28Å; F1127-F1131 HydrophobicContact CE1-CE2 4.43Å; F1127-F1131 AromaticContact CE2-CD2 3.78Å; F1127-F1131 HydrophobicContact CE2-CD2 3.78Å; F1127-F1131 AromaticContact CE2-CE2 3.3Å; F1127-F1131 HydrophobicContact CE2-CE2 3.3Å; F1127-F1131 HydrophobicContact CE2-CZ 4.29Å; F1127-F1131 HydrophobicContact CG-CD2 4.47Å; F1127-F1131 AromaticContact CZ-CD2 3.88Å; F1127-F1131 HydrophobicContact CZ-CD2 3.88Å; F1127-F1131 AromaticContact CZ-CE2 3.6Å; F1127-F1131 HydrophobicContact CZ-CE2 3.6Å; F1127-F1131 HydrophobicContact CZ-CZ 4.39Å; F1127-F1131 WeakPolarHBondContact O-CD2 3.33Å; F1127-F1131 PolarHBondContact O-N 3.01Å
1128	V	95.4	Very high	92	Very high	76 Å²	76	51.3 Å²	51.3	46%	0.461	29%	0.285	S	S	.	.	H	α-helix	trans	-63.3	-46.4	177.9	176.7	0	0	0	0	110.7	T1124 F1125 N1126 A1130 F1131 M1132	T1124-V1128 WeakPolarHBondContact O-CG2 3.3Å; T1124-V1128 PolarHBondContact O-N 3.42Å; F1125-V1128 PolarHBondContact O-N 2.88Å; N1126-V1128 PolarHBondContact O-N 3.32Å; V1128-A1130 PolarHBondContact O-N 2.81Å; V1128-F1131 PolarHBondContact O-N 3.5Å; V1128-M1132 HydrophobicContact CG1-CG 4.18Å; V1128-M1132 WeakPolarHBondContact O-CB 3.42Å; V1128-M1132 VanDerWaalsContact O-CG 3.26Å; V1128-M1132 WeakPolarHBondContact O-CG 3.36Å; V1128-M1132 PolarHBondContact O-N 2.85Å
1129	G	95.1	Very high	91.3	Very high	21 Å²	21	54.7 Å²	54.7	22%	0.216	30%	0.298	C	S	.	.	H	α-helix	trans	-57.4	-48.4	178.5	0	0	0	0	0	112.5	F1125 N1126 F1131 M1132 L1133	F1125-G1129 PolarHBondContact O-N 3.49Å; N1126-G1129 PolarHBondContact O-N 3.31Å; G1129-F1131 PolarHBondContact O-N 3.31Å; G1129-M1132 PolarHBondContact O-N 2.87Å; G1129-L1133 VanDerWaalsContact O-CB 3.22Å; G1129-L1133 WeakPolarHBondContact O-CB 3.5Å; G1129-L1133 PolarHBondContact O-N 2.95Å
1130	A	94.4	Very high	90.6	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-62.7	-42.3	-178.5	0	0	0	0	0	112.3	Q1007 L1010 I1059 A1063 N1126 F1127 V1128 E1134	Q1007-A1130 PolarHBondContact NE2-O 3.16Å; L1010-A1130 HydrophobicContact CD2-CB 4.16Å; I1059-A1130 HydrophobicContact CG2-CB 3.61Å; A1063-A1130 HydrophobicContact CB-CB 4.24Å; N1126-A1130 VanDerWaalsContact O-CB 3.25Å; N1126-A1130 WeakPolarHBondContact O-CB 3.47Å; N1126-A1130 PolarHBondContact O-N 3.49Å; F1127-A1130 PolarHBondContact O-N 3.04Å; V1128-A1130 PolarHBondContact O-N 2.81Å; A1130-E1134 PolarHBondContact O-N 3.41Å
1131	F	91	Very high	89.6	Confident	61 Å²	61	57.7 Å²	57.7	27%	0.268	32%	0.318	S	S	.	.	H	α-helix	trans	-69.2	-42.4	177	-93.2	-84.8	0	0	0	112.9	A1062 A1063 F1127 V1128 G1129 E1134 S1135	A1062-F1131 HydrophobicContact CB-CE2 3.9Å; A1062-F1131 HydrophobicContact CB-CZ 3.81Å; A1063-F1131 HydrophobicContact CB-CE2 4.46Å; F1127-F1131 HydrophobicContact CD2-CD2 4.06Å; F1127-F1131 AromaticContact CD2-CE2 3.91Å; F1127-F1131 HydrophobicContact CD2-CE2 3.91Å; F1127-F1131 HydrophobicContact CE1-CD2 4.28Å; F1127-F1131 HydrophobicContact CE1-CE2 4.43Å; F1127-F1131 AromaticContact CE2-CD2 3.78Å; F1127-F1131 HydrophobicContact CE2-CD2 3.78Å; F1127-F1131 AromaticContact CE2-CE2 3.3Å; F1127-F1131 HydrophobicContact CE2-CE2 3.3Å; F1127-F1131 HydrophobicContact CE2-CZ 4.29Å; F1127-F1131 HydrophobicContact CG-CD2 4.47Å; F1127-F1131 AromaticContact CZ-CD2 3.88Å; F1127-F1131 HydrophobicContact CZ-CD2 3.88Å; F1127-F1131 AromaticContact CZ-CE2 3.6Å; F1127-F1131 HydrophobicContact CZ-CE2 3.6Å; F1127-F1131 HydrophobicContact CZ-CZ 4.39Å; F1127-F1131 WeakPolarHBondContact O-CD2 3.33Å; F1127-F1131 PolarHBondContact O-N 3.01Å; V1128-F1131 PolarHBondContact O-N 3.5Å; G1129-F1131 PolarHBondContact O-N 3.31Å; F1131-E1134 PolarHBondContact O-N 3.33Å; F1131-S1135 WeakPolarHBondContact O-CB 3.35Å; F1131-S1135 PolarHBondContact O-N 3.28Å; F1131-S1135 PolarHBondContact O-OG 3.11Å
1132	M	90.7	Very high	88.5	Confident	112 Å²	112	58.1 Å²	58.1	55%	0.552	31%	0.314	S	S	*	.	H	α-helix	trans	-63.7	-43.5	177.3	-73	-63	137.2	0	0	111.1	V1128 G1129 E1134 S1135 V1136	V1128-M1132 HydrophobicContact CG1-CG 4.18Å; V1128-M1132 WeakPolarHBondContact O-CB 3.42Å; V1128-M1132 VanDerWaalsContact O-CG 3.26Å; V1128-M1132 WeakPolarHBondContact O-CG 3.36Å; V1128-M1132 PolarHBondContact O-N 2.85Å; G1129-M1132 PolarHBondContact O-N 2.87Å; M1132-E1134 VanDerWaalsContact C-N 3.34Å; M1132-E1134 PolarHBondContact O-N 3.45Å; M1132-S1135 PolarHBondContact O-N 3.29Å; M1132-S1135 VanDerWaalsContact O-N 3.13Å; M1132-V1136 WeakPolarHBondContact O-CB 3.19Å; M1132-V1136 VanDerWaalsContact O-CG2 3.29Å; M1132-V1136 WeakPolarHBondContact O-CG2 3.34Å; M1132-V1136 PolarHBondContact O-N 3.16Å
1133	L	91.3	Very high	87.5	Confident	38 Å²	38	58.5 Å²	58.5	20%	0.199	32%	0.322	C	S	.	.	H	α-helix	trans	-56.7	-49.2	178.2	-163.7	66	0	0	0	112.1	L1006 Q1007 G1129 S1135 V1136 L1137	L1006-L1133 HydrophobicContact CB-CD2 3.9Å; L1006-L1133 HydrophobicContact CB-CG 4.5Å; L1006-L1133 HydrophobicContact CD2-CD1 3.15Å; L1006-L1133 HydrophobicContact CD2-CD2 3.97Å; L1006-L1133 HydrophobicContact CD2-CG 3.72Å; L1006-L1133 HydrophobicContact CG-CD1 3.57Å; L1006-L1133 HydrophobicContact CG-CD2 3.59Å; L1006-L1133 HydrophobicContact CG-CG 3.93Å; Q1007-L1133 HydrophobicContact CG-CD2 4.09Å; G1129-L1133 VanDerWaalsContact O-CB 3.22Å; G1129-L1133 WeakPolarHBondContact O-CB 3.5Å; G1129-L1133 PolarHBondContact O-N 2.95Å; L1133-S1135 VanDerWaalsContact C-N 3.32Å; L1133-S1135 PolarHBondContact O-N 3.47Å; L1133-V1136 PolarHBondContact O-N 2.94Å; L1133-L1137 HydrophobicContact CG-CD1 4.35Å; L1133-L1137 WeakPolarHBondContact O-CB 3.22Å; L1133-L1137 VanDerWaalsContact O-CG 3.24Å; L1133-L1137 WeakPolarHBondContact O-CG 3.44Å; L1133-L1137 PolarHBondContact O-N 3.02Å
1134	E	89.3	Confident	86.3	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.019	34%	0.338	C	S	.	.	H	α-helix	trans	-63.8	-37.6	177.4	-88.3	-57.8	141.2	0	0	112.3	S1003 A1063 K1066 A1130 F1131 M1132 D1138	S1003-E1134 WeakPolarHBondContact CB-OE1 3.1Å; S1003-E1134 PolarHBondContact OG-OE1 3.08Å; A1063-E1134 HydrophobicContact CB-CG 4.39Å; K1066-E1134 VanDerWaalsContact NZ-C 3.27Å; K1066-E1134 PolarHBondContact NZ-O 3.47Å; K1066-E1134 IonicContact NZ-OE2 3.85Å; K1066-E1134 PolarHBondContact NZ-OE2 3.12Å; A1130-E1134 PolarHBondContact O-N 3.41Å; F1131-E1134 PolarHBondContact O-N 3.33Å; M1132-E1134 VanDerWaalsContact C-N 3.34Å; M1132-E1134 PolarHBondContact O-N 3.45Å; E1134-D1138 PolarHBondContact O-N 2.84Å
1135	S	85.4	Confident	85.1	Confident	47 Å²	47	58.8 Å²	58.8	33%	0.329	32%	0.324	S	S	.	.	H	α-helix	trans	-70.4	-43	179.2	-58.2	0	0	0	0	111.9	F1131 M1132 L1133 D1138 Q1139	F1131-S1135 WeakPolarHBondContact O-CB 3.35Å; F1131-S1135 PolarHBondContact O-N 3.28Å; F1131-S1135 PolarHBondContact O-OG 3.11Å; M1132-S1135 PolarHBondContact O-N 3.29Å; M1132-S1135 VanDerWaalsContact O-N 3.13Å; L1133-S1135 VanDerWaalsContact C-N 3.32Å; L1133-S1135 PolarHBondContact O-N 3.47Å; S1135-D1138 PolarHBondContact O-N 3.14Å; S1135-Q1139 WeakPolarHBondContact O-CG 3.42Å; S1135-Q1139 PolarHBondContact O-N 3.35Å
1136	V	86	Confident	83.9	Confident	79 Å²	79	62 Å²	62	48%	0.479	33%	0.333	S	S	.	.	H	α-helix	trans	-65.4	-42.6	177.2	171.2	0	0	0	0	110.9	M1132 L1133 D1138 Q1139 C1140	M1132-V1136 WeakPolarHBondContact O-CB 3.19Å; M1132-V1136 VanDerWaalsContact O-CG2 3.29Å; M1132-V1136 WeakPolarHBondContact O-CG2 3.34Å; M1132-V1136 PolarHBondContact O-N 3.16Å; L1133-V1136 PolarHBondContact O-N 2.94Å; V1136-D1138 VanDerWaalsContact C-N 3.33Å; V1136-D1138 PolarHBondContact O-N 3.36Å; V1136-Q1139 PolarHBondContact O-N 3.03Å; V1136-C1140 HydrophobicContact CG1-CB 4.27Å; V1136-C1140 VanDerWaalsContact O-CB 3.25Å; V1136-C1140 WeakPolarHBondContact O-CB 3.17Å; V1136-C1140 PolarHBondContact O-N 3.47Å
1137	L	84.1	Confident	82.8	Confident	22 Å²	22	72.7 Å²	72.7	12%	0.115	37%	0.373	C	S	.	.	H	α-helix	trans	-61.8	-40.1	177.5	-76.3	172.5	0	0	0	112.2	L1006 L1133 L1141 P1142	L1006-L1137 HydrophobicContact CD2-CD1 4.36Å; L1006-L1137 HydrophobicContact CD2-CD2 4.43Å; L1133-L1137 HydrophobicContact CG-CD1 4.35Å; L1133-L1137 WeakPolarHBondContact O-CB 3.22Å; L1133-L1137 VanDerWaalsContact O-CG 3.24Å; L1133-L1137 WeakPolarHBondContact O-CG 3.44Å; L1133-L1137 PolarHBondContact O-N 3.02Å; L1137-L1141 HydrophobicContact CD2-CB 4.48Å; L1137-L1141 HydrophobicContact CD2-CD1 4.22Å; L1137-L1141 HydrophobicContact CD2-CD2 4.38Å; L1137-L1141 WeakPolarHBondContact O-CB 3.33Å; L1137-L1141 PolarHBondContact O-N 2.9Å; L1137-P1142 WeakPolarHBondContact O-CD 3.2Å
1138	D	76.7	Confident	81.6	Confident	93 Å²	93	74.6 Å²	74.6	50%	0.497	39%	0.387	S	S	.	.	H	α-helix	trans	-68.5	-35.6	178.8	-81.6	-4.8	0	0	0	112.8	K1066 E1134 S1135 V1136 P1142	K1066-D1138 WeakPolarHBondContact CD-OD2 3.44Å; K1066-D1138 WeakPolarHBondContact CE-OD2 3.41Å; K1066-D1138 IonicContact NZ-OD1 3.73Å; K1066-D1138 IonicContact NZ-OD2 2.58Å; K1066-D1138 PolarHBondContact NZ-OD2 2.99Å; E1134-D1138 PolarHBondContact O-N 2.84Å; S1135-D1138 PolarHBondContact O-N 3.14Å; V1136-D1138 VanDerWaalsContact C-N 3.33Å; V1136-D1138 PolarHBondContact O-N 3.36Å; D1138-P1142 VanDerWaalsContact O-CD 3.3Å; D1138-P1142 WeakPolarHBondContact O-CD 3.35Å; D1138-P1142 VanDerWaalsContact O-CG 3.3Å; D1138-P1142 WeakPolarHBondContact O-CG 3.33Å
1139	Q	79	Confident	80	Confident	152 Å²	152	78.6 Å²	78.6	71%	0.71	39%	0.393	S	S	*	.	H	α-helix	trans	-85.9	-49.6	-177.7	-66.2	-179.5	7.6	0	0	112.9	S1135 V1136	S1135-Q1139 WeakPolarHBondContact O-CG 3.42Å; S1135-Q1139 PolarHBondContact O-N 3.35Å; V1136-Q1139 PolarHBondContact O-N 3.03Å
1140	C	77.6	Confident	78.3	Confident	63 Å²	63	83.3 Å²	83.3	43%	0.426	42%	0.42	S	S	.	.	H	α-helix	trans	-86.3	-39.9	-169.3	-63.6	0	0	0	0	112.6	V1136 A1143 C1144	V1136-C1140 HydrophobicContact CG1-CB 4.27Å; V1136-C1140 VanDerWaalsContact O-CB 3.25Å; V1136-C1140 WeakPolarHBondContact O-CB 3.17Å; V1136-C1140 PolarHBondContact O-N 3.47Å; C1140-A1143 WeakPolarHBondContact O-CB 3.19Å; C1140-A1143 PolarHBondContact O-N 3.47Å; C1140-C1144 PolarHBondContact O-N 3.49Å
1141	L	76.1	Confident	76.5	Confident	36 Å²	36	93.2 Å²	93.2	19%	0.188	46%	0.463	C	S	.	.	H	α-helix	trans	-61.9	-41.6	-173.6	-162	79.7	0	0	0	112.9	P999 S1002 L1137 A1143 C1144 L1145	P999-L1141 VanDerWaalsContact CA-CD2 3.47Å; P999-L1141 HydrophobicContact CB-CD2 3.78Å; P999-L1141 HydrophobicContact CG-CD2 4.04Å; S1002-L1141 VanDerWaalsContact OG-CD2 3.27Å; S1002-L1141 WeakPolarHBondContact OG-CD2 3.4Å; L1137-L1141 HydrophobicContact CD2-CB 4.48Å; L1137-L1141 HydrophobicContact CD2-CD1 4.22Å; L1137-L1141 HydrophobicContact CD2-CD2 4.38Å; L1137-L1141 WeakPolarHBondContact O-CB 3.33Å; L1137-L1141 PolarHBondContact O-N 2.9Å; L1141-A1143 VanDerWaalsContact C-N 3.26Å; L1141-A1143 PolarHBondContact O-N 3.44Å; L1141-C1144 PolarHBondContact O-N 2.83Å; L1141-L1145 HydrophobicContact CD2-CD1 4.19Å; L1141-L1145 HydrophobicContact CG-CD1 3.97Å; L1141-L1145 HydrophobicContact CG-CG 4.31Å; L1141-L1145 VanDerWaalsContact O-CB 3.29Å; L1141-L1145 WeakPolarHBondContact O-CB 3.35Å; L1141-L1145 VanDerWaalsContact O-CG 3.25Å; L1141-L1145 WeakPolarHBondContact O-CG 3.29Å; L1141-L1145 PolarHBondContact O-N 3.23Å
1142	P	72.2	Confident	74.9	Confident	48 Å²	48	100.6 Å²	100.6	31%	0.312	49%	0.489	S	S	.	.	H	α-helix	trans	-65.9	-27.2	175.5	-22	35.1	0	0	0	113.6	L1137 D1138 R1146	L1137-P1142 WeakPolarHBondContact O-CD 3.2Å; D1138-P1142 VanDerWaalsContact O-CD 3.3Å; D1138-P1142 WeakPolarHBondContact O-CD 3.35Å; D1138-P1142 VanDerWaalsContact O-CG 3.3Å; D1138-P1142 WeakPolarHBondContact O-CG 3.33Å; P1142-R1146 WeakPolarHBondContact O-CB 3.41Å; P1142-R1146 VanDerWaalsContact O-CG 3.26Å; P1142-R1146 WeakPolarHBondContact O-CG 3.43Å; P1142-R1146 PolarHBondContact O-N 3Å; P1142-R1146 PolarHBondContact O-NE 3.26Å
1143	A	73.6	Confident	73.4	Confident	43 Å²	43	99.8 Å²	99.8	36%	0.355	49%	0.491	S	S	.	.	H	α-helix	trans	-75.6	-46.1	175.6	0	0	0	0	0	110.9	C1140 L1141 R1146 R1147	C1140-A1143 WeakPolarHBondContact O-CB 3.19Å; C1140-A1143 PolarHBondContact O-N 3.47Å; L1141-A1143 VanDerWaalsContact C-N 3.26Å; L1141-A1143 PolarHBondContact O-N 3.44Å; A1143-R1146 PolarHBondContact O-N 3.36Å; A1143-R1147 PolarHBondContact O-N 2.78Å; A1143-R1147 VanDerWaalsContact O-N 3.12Å
1144	C	71.8	Confident	72.2	Confident	64 Å²	64	99.1 Å²	99.1	43%	0.432	49%	0.489	S	S	.	.	H	α-helix	trans	-62.2	-45.5	175.3	-70.2	0	0	0	0	112.2	C1140 L1141 R1146 R1147 L1148	C1140-C1144 PolarHBondContact O-N 3.49Å; L1141-C1144 PolarHBondContact O-N 2.83Å; C1144-R1146 VanDerWaalsContact C-N 3.26Å; C1144-R1146 PolarHBondContact O-N 2.98Å; C1144-R1147 PolarHBondContact O-N 3.3Å; C1144-R1147 VanDerWaalsContact O-N 3.1Å; C1144-L1148 WeakPolarHBondContact O-CB 3.5Å; C1144-L1148 WeakPolarHBondContact O-CG 3.15Å; C1144-L1148 PolarHBondContact O-N 3.03Å
1145	L	70.4	Confident	71.5	Confident	45 Å²	45	107.3 Å²	107.3	24%	0.236	53%	0.525	C	S	.	.	H	α-helix	trans	-62.6	-32.9	176.7	-74.4	171.6	0	0	0	112.5	V998 P999 L1141 R1149	V998-L1145 HydrophobicContact CG1-CD1 4.4Å; V998-L1145 HydrophobicContact CG1-CD2 4.16Å; P999-L1145 HydrophobicContact CG-CD1 4.17Å; L1141-L1145 HydrophobicContact CD2-CD1 4.19Å; L1141-L1145 HydrophobicContact CG-CD1 3.97Å; L1141-L1145 HydrophobicContact CG-CG 4.31Å; L1141-L1145 VanDerWaalsContact O-CB 3.29Å; L1141-L1145 WeakPolarHBondContact O-CB 3.35Å; L1141-L1145 VanDerWaalsContact O-CG 3.25Å; L1141-L1145 WeakPolarHBondContact O-CG 3.29Å; L1141-L1145 PolarHBondContact O-N 3.23Å; L1145-R1149 WeakPolarHBondContact O-CB 3.38Å; L1145-R1149 PolarHBondContact O-N 3.08Å; L1145-R1149 VanDerWaalsContact O-N 3.09Å
1146	R	70.1	Confident	71.3	Confident	197 Å²	197	108.5 Å²	108.5	74%	0.743	52%	0.524	S	S	*	.	H	α-helix	trans	-70.2	-31.1	174.6	-86.2	-176.8	-89.7	-175.8	-6.2	112.9	P1142 A1143 C1144	P1142-R1146 WeakPolarHBondContact O-CB 3.41Å; P1142-R1146 VanDerWaalsContact O-CG 3.26Å; P1142-R1146 WeakPolarHBondContact O-CG 3.43Å; P1142-R1146 PolarHBondContact O-N 3Å; P1142-R1146 PolarHBondContact O-NE 3.26Å; A1143-R1146 PolarHBondContact O-N 3.36Å; C1144-R1146 VanDerWaalsContact C-N 3.26Å; C1144-R1146 PolarHBondContact O-N 2.98Å
1147	R	73	Confident	71.1	Confident	226 Å²	226	111 Å²	111	85%	0.853	53%	0.525	S	S	*	.	H	α-helix	trans	-76.9	-40.9	174.1	-71.4	-178	-178.9	177.5	0.4	112.3	A1143 C1144	A1143-R1147 PolarHBondContact O-N 2.78Å; A1143-R1147 VanDerWaalsContact O-N 3.12Å; C1144-R1147 PolarHBondContact O-N 3.3Å; C1144-R1147 VanDerWaalsContact O-N 3.1Å
1148	L	71.1	Confident	71.1	Confident	139 Å²	139	110.2 Å²	110.2	73%	0.728	52%	0.521	S	S	*	.	H	α-helix	trans	-81.7	-22.2	-174.1	-71.3	165.8	0	0	0	114.4	C1144	C1144-L1148 WeakPolarHBondContact O-CB 3.5Å; C1144-L1148 WeakPolarHBondContact O-CG 3.15Å; C1144-L1148 PolarHBondContact O-N 3.03Å
1149	R	62.3	Low	71.5	Confident	160 Å²	160	109.1 Å²	109.1	60%	0.604	51%	0.512	S	S	*	.	S	Bend	trans	-114.2	121	176.9	-71.4	-174.2	174.2	-175.1	-0.1	110.3	L1145	L1145-R1149 WeakPolarHBondContact O-CB 3.38Å; L1145-R1149 PolarHBondContact O-N 3.08Å; L1145-R1149 VanDerWaalsContact O-N 3.09Å
1150	P	59	Low	71.8	Confident	120 Å²	120	106.3 Å²	106.3	78%	0.779	50%	0.498	S	S	*	.			trans	-55.2	146.5	166.8	22.2	-30.4	0	0	0	109.3	R1152	P1150-R1152 VanDerWaalsContact C-N 3.26Å; P1150-R1152 PolarHBondContact O-N 2.98Å
1151	K	57	Low	72.1	Confident	208 Å²	208	104 Å²	104	90%	0.904	48%	0.482	S	S	*	.			trans	-56.6	86.6	-179.7	-82.8	179.8	179.8	170	0	110.2	T1153	K1151-T1153 PolarHBondContact O-N 2.9Å
1152	R	56.3	Low	72.5	Confident	217 Å²	217	106.4 Å²	106.4	82%	0.819	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-62.9	127.8	178.7	-143.4	172.6	-175.2	169.1	2.8	107.7	P1150 S1154	P1150-R1152 VanDerWaalsContact C-N 3.26Å; P1150-R1152 PolarHBondContact O-N 2.98Å; R1152-S1154 PolarHBondContact O-N 3.09Å
1153	T	58.6	Low	73.1	Confident	95 Å²	95	109.2 Å²	109.2	58%	0.583	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-54.3	136.6	175.5	48.7	0	0	0	0	108.8	K1151 K1155	K1151-T1153 PolarHBondContact O-N 2.9Å; T1153-K1155 PolarHBondContact O-N 3.37Å
1154	S	67	Low	73.6	Confident	24 Å²	24	110.6 Å²	110.6	17%	0.168	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-60.5	133.1	179.3	168.6	0	0	0	0	108.7	R1152 K1156 K1159 Q1160	R1152-S1154 PolarHBondContact O-N 3.09Å; S1154-K1156 PolarHBondContact O-N 3.32Å; S1154-K1156 WeakPolarHBondContact OG-CB 3.45Å; S1154-K1156 PolarHBondContact OG-N 3.15Å; S1154-K1156 VanDerWaalsContact OG-N 3.09Å; S1154-K1159 VanDerWaalsContact OG-CD 3.24Å; S1154-K1159 WeakPolarHBondContact OG-CD 3.4Å; S1154-Q1160 WeakPolarHBondContact O-CG 3.43Å; S1154-Q1160 PolarHBondContact O-NE2 3.28Å
1155	K	73.9	Confident	74.1	Confident	176 Å²	176	108.3 Å²	108.3	77%	0.765	48%	0.479	S	S	*	.	S	Bend	trans	-69.2	-13.6	172.5	-64.9	-170.2	177.3	-169.4	0	113.1	T1153 R1157	T1153-K1155 PolarHBondContact O-N 3.37Å; K1155-R1157 PolarHBondContact O-N 3.45Å
1156	K	80.8	Confident	74.5	Confident	72 Å²	72	108.1 Å²	108.1	31%	0.313	48%	0.484	S	S	.	.			trans	-71.1	125.2	179.7	-62.8	-155	176.6	-155.7	0	111.6	Q869 S1154 F1158 K1159 Q1160	Q869-K1156 PolarHBondContact O-NZ 3.49Å; Q869-K1156 VanDerWaalsContact OE1-CA 3.25Å; S1154-K1156 PolarHBondContact O-N 3.32Å; S1154-K1156 WeakPolarHBondContact OG-CB 3.45Å; S1154-K1156 PolarHBondContact OG-N 3.15Å; S1154-K1156 VanDerWaalsContact OG-N 3.09Å; K1156-F1158 HydrophobicContact CB-CD1 4.16Å; K1156-F1158 HydrophobicContact CB-CE1 3.94Å; K1156-F1158 HydrophobicContact CD-CD1 4.25Å; K1156-F1158 HydrophobicContact CD-CE1 3.37Å; K1156-F1158 HydrophobicContact CD-CZ 3.95Å; K1156-F1158 HydrophobicContact CG-CE1 4.34Å; K1156-F1158 PolarHBondContact O-N 3.03Å; K1156-K1159 HydrophobicContact CB-CB 4.39Å; K1156-K1159 HydrophobicContact CB-CD 4.44Å; K1156-K1159 HydrophobicContact CB-CG 4.29Å; K1156-K1159 PolarHBondContact O-N 3.46Å; K1156-K1159 VanDerWaalsContact O-N 3.13Å; K1156-Q1160 PolarHBondContact O-N 3.32Å
1157	R	83.6	Confident	75	Confident	132 Å²	132	106.2 Å²	106.2	50%	0.498	48%	0.483	S	S	.	.	H	α-helix	trans	-56.8	-47.6	-176.6	-169.9	171	-175.9	177.5	0.3	113	L868 Q869 K1155 K1159 Q1160 L1161	L868-R1157 HydrophobicContact CD2-CG 4.3Å; Q869-R1157 VanDerWaalsContact OE1-N 3.14Å; K1155-R1157 PolarHBondContact O-N 3.45Å; R1157-K1159 VanDerWaalsContact C-N 3.28Å; R1157-K1159 PolarHBondContact O-N 3.36Å; R1157-Q1160 WeakPolarHBondContact O-CB 3.43Å; R1157-Q1160 PolarHBondContact O-N 3.37Å; R1157-Q1160 VanDerWaalsContact O-N 3.09Å; R1157-L1161 HydrophobicContact CG-CD1 4.15Å; R1157-L1161 PolarHBondContact O-N 3.39Å
1158	F	84.1	Confident	75.3	Confident	4 Å²	4	101.9 Å²	101.9	2%	0.018	47%	0.473	C	S	.	.	H	α-helix	trans	-60.5	-35	178.7	79.8	-96.8	0	0	0	113.5	V845 L868 Q869 Y870 K1156 Q1160 L1161 E1162	V845-F1158 HydrophobicContact CG2-CB 4.44Å; L868-F1158 HydrophobicContact CB-CB 4.15Å; L868-F1158 WeakPolarHBondContact O-CD1 3.47Å; L868-F1158 PolarHBondContact O-N 2.9Å; Q869-F1158 WeakPolarHBondContact O-CE1 3.38Å; Y870-F1158 HydrophobicContact CD1-CD1 4.02Å; Y870-F1158 HydrophobicContact CD1-CD2 4.17Å; Y870-F1158 HydrophobicContact CD1-CE1 4.16Å; Y870-F1158 HydrophobicContact CD1-CE2 4.34Å; Y870-F1158 HydrophobicContact CD1-CG 4.06Å; Y870-F1158 HydrophobicContact CD1-CZ 4.39Å; Y870-F1158 HydrophobicContact CD2-CB 3.9Å; Y870-F1158 HydrophobicContact CD2-CD1 4.21Å; Y870-F1158 HydrophobicContact CD2-CG 4.07Å; Y870-F1158 HydrophobicContact CE1-CB 4.18Å; Y870-F1158 HydrophobicContact CE1-CD1 4.04Å; Y870-F1158 AromaticContact CE1-CD2 3.39Å; Y870-F1158 HydrophobicContact CE1-CD2 3.39Å; Y870-F1158 HydrophobicContact CE1-CE1 4.3Å; Y870-F1158 AromaticContact CE1-CE2 3.72Å; Y870-F1158 HydrophobicContact CE1-CE2 3.72Å; Y870-F1158 AromaticContact CE1-CG 3.61Å; Y870-F1158 HydrophobicContact CE1-CG 3.61Å; Y870-F1158 HydrophobicContact CE1-CZ 4.21Å; Y870-F1158 HydrophobicContact CE2-CB 3.26Å; Y870-F1158 HydrophobicContact CE2-CD1 4.24Å; Y870-F1158 HydrophobicContact CE2-CD2 4.1Å; Y870-F1158 AromaticContact CE2-CG 3.64Å; Y870-F1158 HydrophobicContact CE2-CG 3.64Å; Y870-F1158 HydrophobicContact CG-CD1 4.1Å; Y870-F1158 HydrophobicContact CG-CG 4.27Å; Y870-F1158 VanDerWaalsContact CZ-CB 3.43Å; Y870-F1158 AromaticContact CZ-CD2 3.34Å; Y870-F1158 AromaticContact CZ-CG 3.38Å; Y870-F1158 WeakPolarHBondContact OH-CD2 3.31Å; K1156-F1158 HydrophobicContact CB-CD1 4.16Å; K1156-F1158 HydrophobicContact CB-CE1 3.94Å; K1156-F1158 HydrophobicContact CD-CD1 4.25Å; K1156-F1158 HydrophobicContact CD-CE1 3.37Å; K1156-F1158 HydrophobicContact CD-CZ 3.95Å; K1156-F1158 HydrophobicContact CG-CE1 4.34Å; K1156-F1158 PolarHBondContact O-N 3.03Å; F1158-Q1160 VanDerWaalsContact C-N 3.31Å; F1158-Q1160 PolarHBondContact O-N 3.06Å; F1158-L1161 PolarHBondContact O-N 3.04Å; F1158-E1162 WeakPolarHBondContact O-CG 3.47Å; F1158-E1162 PolarHBondContact O-N 3.47Å
1159	K	84.8	Confident	75.4	Confident	71 Å²	71	98.2 Å²	98.2	31%	0.309	46%	0.457	S	S	.	.	H	α-helix	trans	-72.8	-25.7	178.1	-70.9	-171.3	166.7	-177.8	0	113	S1154 K1156 R1157 R1163	S1154-K1159 VanDerWaalsContact OG-CD 3.24Å; S1154-K1159 WeakPolarHBondContact OG-CD 3.4Å; K1156-K1159 HydrophobicContact CB-CB 4.39Å; K1156-K1159 HydrophobicContact CB-CD 4.44Å; K1156-K1159 HydrophobicContact CB-CG 4.29Å; K1156-K1159 PolarHBondContact O-N 3.46Å; K1156-K1159 VanDerWaalsContact O-N 3.13Å; R1157-K1159 VanDerWaalsContact C-N 3.28Å; R1157-K1159 PolarHBondContact O-N 3.36Å; K1159-R1163 WeakPolarHBondContact O-CG 3.27Å; K1159-R1163 PolarHBondContact O-N 3.16Å
1160	Q	85.1	Confident	75.9	Confident	92 Å²	92	92.6 Å²	92.6	43%	0.43	44%	0.436	S	S	.	.	H	α-helix	trans	-71.9	-46.3	173.2	-66.6	170.9	-8.7	0	0	108.7	S1154 K1156 R1157 F1158 R1163 E1164	S1154-Q1160 WeakPolarHBondContact O-CG 3.43Å; S1154-Q1160 PolarHBondContact O-NE2 3.28Å; K1156-Q1160 PolarHBondContact O-N 3.32Å; R1157-Q1160 WeakPolarHBondContact O-CB 3.43Å; R1157-Q1160 PolarHBondContact O-N 3.37Å; R1157-Q1160 VanDerWaalsContact O-N 3.09Å; F1158-Q1160 VanDerWaalsContact C-N 3.31Å; F1158-Q1160 PolarHBondContact O-N 3.06Å; Q1160-R1163 PolarHBondContact O-N 3.16Å; Q1160-R1163 VanDerWaalsContact O-N 3.17Å; Q1160-E1164 PolarHBondContact O-N 3.43Å
1161	L	83.9	Confident	76.4	Confident	16 Å²	16	87 Å²	87	8%	0.084	40%	0.399	C	S	.	.	H	α-helix	trans	-61.8	-43.4	175.2	-72.7	160.7	0	0	0	112.8	P841 K842 V845 L868 R1157 F1158 R1163 E1164 L1165	P841-L1161 HydrophobicContact CB-CD1 3.61Å; P841-L1161 HydrophobicContact CB-CD2 4.31Å; K842-L1161 HydrophobicContact CG-CD2 4.11Å; V845-L1161 HydrophobicContact CG2-CB 3.97Å; V845-L1161 HydrophobicContact CG2-CD1 4.15Å; L868-L1161 HydrophobicContact CD2-CD1 4.04Å; R1157-L1161 HydrophobicContact CG-CD1 4.15Å; R1157-L1161 PolarHBondContact O-N 3.39Å; F1158-L1161 PolarHBondContact O-N 3.04Å; L1161-R1163 PolarHBondContact O-N 3.26Å; L1161-E1164 PolarHBondContact O-N 2.99Å; L1161-L1165 WeakPolarHBondContact O-CB 3.33Å; L1161-L1165 VanDerWaalsContact O-CG 3.24Å; L1161-L1165 WeakPolarHBondContact O-CG 3.28Å; L1161-L1165 PolarHBondContact O-N 3.05Å
1162	E	84.4	Confident	76.7	Confident	86 Å²	86	84.2 Å²	84.2	40%	0.402	39%	0.394	S	S	.	.	H	α-helix	trans	-57.6	-36.1	174.7	-78.4	174.6	163	0	0	112.2	V845 F1158 A1166	V845-E1162 HydrophobicContact CG1-CG 3.73Å; F1158-E1162 WeakPolarHBondContact O-CG 3.47Å; F1158-E1162 PolarHBondContact O-N 3.47Å; E1162-A1166 VanDerWaalsContact O-CB 3.29Å; E1162-A1166 WeakPolarHBondContact O-CB 3.36Å; E1162-A1166 PolarHBondContact O-N 3.5Å; E1162-A1166 VanDerWaalsContact O-N 3.09Å
1163	R	83.6	Confident	76.8	Confident	107 Å²	107	77.2 Å²	77.2	40%	0.404	37%	0.372	S	S	.	.	H	α-helix	trans	-74.8	-45.2	175.6	-71.6	-178.6	-154.8	-171.3	0.3	111.9	K1159 Q1160 L1161 L1165 A1166 E1167	K1159-R1163 WeakPolarHBondContact O-CG 3.27Å; K1159-R1163 PolarHBondContact O-N 3.16Å; Q1160-R1163 PolarHBondContact O-N 3.16Å; Q1160-R1163 VanDerWaalsContact O-N 3.17Å; L1161-R1163 PolarHBondContact O-N 3.26Å; R1163-L1165 PolarHBondContact O-N 3.25Å; R1163-A1166 CarbonylContact O-C 3.58Å; R1163-A1166 PolarHBondContact O-N 2.91Å; R1163-E1167 WeakPolarHBondContact O-CB 3.22Å; R1163-E1167 WeakPolarHBondContact O-CG 3.22Å; R1163-E1167 PolarHBondContact O-N 3.41Å
1164	E	84.3	Confident	76.2	Confident	72 Å²	72	78.2 Å²	78.2	34%	0.336	38%	0.38	S	S	.	.	H	α-helix	trans	-55.1	-43.8	175.9	-171.8	-171	155.3	0	0	110.5	K842 Q1160 L1161 E1167 Q1168	K842-E1164 WeakPolarHBondContact CE-OE1 3.19Å; K842-E1164 IonicContact NZ-OE1 2.7Å; K842-E1164 PolarHBondContact NZ-OE1 3.35Å; Q1160-E1164 PolarHBondContact O-N 3.43Å; L1161-E1164 PolarHBondContact O-N 2.99Å; E1164-E1167 PolarHBondContact O-N 3.29Å; E1164-Q1168 WeakPolarHBondContact O-CA 3.27Å; E1164-Q1168 PolarHBondContact O-N 3.31Å
1165	L	82.1	Confident	74.7	Confident	16 Å²	16	81.9 Å²	81.9	8%	0.084	41%	0.412	C	S	.	.	H	α-helix	trans	-71.3	-27.5	176.9	-68.8	167.8	0	0	0	113.5	K842 V845 Q846 L1161 R1163 Q1168 W1170	K842-L1165 HydrophobicContact CB-CD2 4.36Å; K842-L1165 HydrophobicContact CD-CD2 4.29Å; K842-L1165 HydrophobicContact CG-CD2 4.34Å; V845-L1165 HydrophobicContact CB-CD1 4.04Å; V845-L1165 HydrophobicContact CG1-CD1 3.74Å; Q846-L1165 HydrophobicContact CG-CD1 3.9Å; L1161-L1165 WeakPolarHBondContact O-CB 3.33Å; L1161-L1165 VanDerWaalsContact O-CG 3.24Å; L1161-L1165 WeakPolarHBondContact O-CG 3.28Å; L1161-L1165 PolarHBondContact O-N 3.05Å; R1163-L1165 PolarHBondContact O-N 3.25Å; L1165-Q1168 CarbonylContact O-C 3.5Å; L1165-W1170 HydrophobicContact CD2-CB 3.8Å
1166	A	78.7	Confident	72.8	Confident	40 Å²	40	76.1 Å²	76.1	33%	0.331	40%	0.402	S	S	.	.	H	α-helix	trans	-77.9	-29	174.6	0	0	0	0	0	112.7	E1162 R1163	E1162-A1166 VanDerWaalsContact O-CB 3.29Å; E1162-A1166 WeakPolarHBondContact O-CB 3.36Å; E1162-A1166 PolarHBondContact O-N 3.5Å; E1162-A1166 VanDerWaalsContact O-N 3.09Å; R1163-A1166 CarbonylContact O-C 3.58Å; R1163-A1166 PolarHBondContact O-N 2.91Å
1167	E	82	Confident	70.4	Confident	157 Å²	157	78.5 Å²	78.5	73%	0.734	43%	0.425	S	S	*	.	H	α-helix	trans	-84	-40.5	175.8	-71.4	170.7	-166.3	0	0	111.5	R1163 E1164	R1163-E1167 WeakPolarHBondContact O-CB 3.22Å; R1163-E1167 WeakPolarHBondContact O-CG 3.22Å; R1163-E1167 PolarHBondContact O-N 3.41Å; E1164-E1167 PolarHBondContact O-N 3.29Å
1168	Q	79.1	Confident	67.8	Low	136 Å²	136	80.8 Å²	80.8	64%	0.636	45%	0.447	S	S	*	.	S	Bend	trans	-124.4	95	178.4	-67.4	-175.1	-5.9	0	0	109.6	E1164 L1165 W1170	E1164-Q1168 WeakPolarHBondContact O-CA 3.27Å; E1164-Q1168 PolarHBondContact O-N 3.31Å; L1165-Q1168 CarbonylContact O-C 3.5Å; Q1168-W1170 PolarHBondContact O-N 2.97Å
1169	P	71.9	Confident	65.1	Low	62 Å²	62	95.6 Å²	95.6	40%	0.403	50%	0.502	S	S	.	.			trans	-60.9	124.2	-179	-18.2	29.3	0	0	0	110.8
1170	W	74.4	Confident	64.2	Low	42 Å²	42	96.9 Å²	96.9	16%	0.159	51%	0.512	C	S	.	.	S	Bend	trans	-128	144.8	176.8	-176.6	87.2	0	0	0	109.6	F790 L822 L839 K842 V843 Q846 L1165 Q1168	F790-W1170 AromaticContact CE1-CH2 3.84Å; F790-W1170 HydrophobicContact CE1-CH2 3.84Å; F790-W1170 HydrophobicContact CE1-CZ2 4.07Å; F790-W1170 HydrophobicContact CE1-CZ3 4.42Å; F790-W1170 HydrophobicContact CE2-CZ2 4.3Å; F790-W1170 AromaticContact CZ-CH2 3.65Å; F790-W1170 HydrophobicContact CZ-CH2 3.65Å; F790-W1170 AromaticContact CZ-CZ2 3.44Å; F790-W1170 HydrophobicContact CZ-CZ2 3.44Å; F790-W1170 VanDerWaalsContact CZ-CZ2 3.44Å; L822-W1170 HydrophobicContact CD1-CZ3 4.05Å; L839-W1170 HydrophobicContact CD1-CZ2 4.34Å; L839-W1170 HydrophobicContact CD2-CZ2 3.99Å; K842-W1170 HydrophobicContact CB-CE3 3.97Å; K842-W1170 HydrophobicContact CB-CZ3 3.99Å; K842-W1170 HydrophobicContact CD-CD2 4.42Å; V843-W1170 HydrophobicContact CG2-CH2 3.65Å; V843-W1170 HydrophobicContact CG2-CZ3 3.9Å; Q846-W1170 PolarHBondContact NE2-O 3.37Å; Q846-W1170 PolarHBondContact OE1-O 2.9Å; L1165-W1170 HydrophobicContact CD2-CB 3.8Å; Q1168-W1170 PolarHBondContact O-N 2.97Å
1171	P	68.8	Low	63.1	Low	1 Å²	1	97.1 Å²	97.1	1%	0.006	52%	0.516	C	S	.	.	S	Bend	cis	-68.3	153.2	-7.3	31.3	-37.8	0	0	0	112.8	I773 F790 R820 L1173	I773-P1171 HydrophobicContact CD1-CG 3.84Å; I773-P1171 HydrophobicContact CG2-CG 4.45Å; F790-P1171 HydrophobicContact CB-CB 4.28Å; F790-P1171 HydrophobicContact CB-CG 4.07Å; F790-P1171 HydrophobicContact CD1-CB 3.69Å; F790-P1171 HydrophobicContact CD1-CG 3.47Å; F790-P1171 VanDerWaalsContact CD1-CG 3.47Å; F790-P1171 HydrophobicContact CD2-CB 3.7Å; F790-P1171 HydrophobicContact CD2-CG 4.31Å; F790-P1171 HydrophobicContact CE1-CB 3.85Å; F790-P1171 HydrophobicContact CE1-CG 3.91Å; F790-P1171 HydrophobicContact CE2-CB 3.88Å; F790-P1171 HydrophobicContact CG-CB 3.6Å; F790-P1171 HydrophobicContact CG-CG 3.68Å; F790-P1171 HydrophobicContact CZ-CB 3.95Å; R820-P1171 PolarHBondContact NH1-O 2.74Å; P1171-L1173 PolarHBondContact O-N 2.84Å
1172	L	63.3	Low	61.9	Low	151 Å²	151	101.6 Å²	101.6	79%	0.791	54%	0.54	S	S	*	.			trans	-76.6	106.9	169.9	-69.9	166.9	0	0	0	107.1
1173	L	57.8	Low	60.6	Low	69 Å²	69	102.5 Å²	102.5	36%	0.361	55%	0.549	S	S	.	.			trans	-70.2	141.1	173.1	-68.7	166.7	0	0	0	108.4	I773 P792 P1171 A1175	I773-L1173 HydrophobicContact CD1-CD1 4.33Å; I773-L1173 HydrophobicContact CD1-CD2 4.37Å; I773-L1173 HydrophobicContact CD1-CG 4.49Å; P792-L1173 HydrophobicContact CB-CD2 4.36Å; P792-L1173 HydrophobicContact CG-CD2 4.24Å; P1171-L1173 PolarHBondContact O-N 2.84Å; L1173-A1175 PolarHBondContact O-N 3.26Å
1174	P	45.9	Very low	59.1	Low	117 Å²	117	102.3 Å²	102.3	76%	0.76	56%	0.558	S	S	*	*			trans	-56.4	126.6	170.2	22.3	-29.7	0	0	0	108.2	G1176	P1174-G1176 PolarHBondContact O-N 2.87Å
1175	A	37	Very low	57.5	Low	101 Å²	101	104.3 Å²	104.3	84%	0.835	57%	0.572	S	S	*	*			trans	-59.2	110.5	172.5	0	0	0	0	0	107	L1173	L1173-A1175 PolarHBondContact O-N 3.26Å
1176	G	33.8	Very low	55.7	Low	54 Å²	54	110.6 Å²	110.6	56%	0.557	61%	0.607	S	S	*	*			trans	-54.6	153	166.8	0	0	0	0	0	109.1	P1174 L1178	P1174-G1176 PolarHBondContact O-N 2.87Å; G1176-L1178 PolarHBondContact O-N 2.92Å
1177	P	30.7	Very low	53.9	Low	123 Å²	123	116 Å²	116	80%	0.799	63%	0.628	S	S	*	*			trans	-54.8	122.8	175.2	23.8	-30.7	0	0	0	107.6	R1179	P1177-R1179 PolarHBondContact O-N 3.03Å
1178	L	27.5	Very low	51.6	Low	180 Å²	180	112.6 Å²	112.6	94%	0.942	62%	0.62	S	S	*	*			trans	-47.6	111.1	168.6	-83.4	132.5	0	0	0	107	G1176	G1176-L1178 PolarHBondContact O-N 2.92Å
1179	R	28.9	Very low	49.1	Very low	315 Å²	315	110.5 Å²	110.5	100%	1.189	62%	0.618	S	S	*	*			trans	-81.8	0	166.4	-89.7	-169.7	177.2	177.9	0.7	109.2	P1177	P1177-R1179 PolarHBondContact O-N 3.03Å

Retrieved 1,179 of 1,179 residues in 4942.6 ms (Link to these results)

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