A0A3Q0KQ27_SCHMA Loading...

Putative voltage-gated potassium channel

AlphaFold DB , UniProt , Accession A0A3Q0KQ27, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,243 aa.

						>A0A3Q0KQ27_SCHMA|A0A3Q0KQ27
MPIKRGHIAPHNNYIVTLIRNFDSQYENFIVANATLPSRPIIYCSDGLCELLRYTKGQLMLKSSALSIFYGPETTADSMETLLAALNQTNETEVLMNLYSRDNCVIYFRIVVTPVRDETGGLPLYLLFFREEVNNTQTLSQINKGPGLRTRWQLKSFRVNKSPNHMPKTPIRTNISKSTKPSLLDVGKHFRDKYNTSDLKLGPVGEGVTTTESLAHPQSLSSSDKIQFLEDYPNEPVSGQSKECRPTSLFLPKSQDDLFKRNSLSKTDVSESQHGTPKCSDKSKRRPSTWYRGYAEDESSEIIHGSGRKSRHLHPTSEESEALQLVLSSHAEPPKSSVTEKFAQFLSMDEDLHVEHRFQSPRMHKFTLKHYSVFKAVWDWIILALIIYTAIFTPYVTVFLMNTGNKYAKLISSGNITTTTPQIATTFDINRTQNKSSTNNHSESSDISHTAHPSITTSSSSPTLLSTVDILVDVMFIIDILINFRTTYVNKNDEVVSHPKRIAAHYIKGWFIIDLVAAIPFDLLFFRTAGDQPTALTGLLKSARLLRLVGIVRKLDRYSEYGASILILLTALFALIAHWLACIWYAIGNAEHLYRDPKIGWLDTLAIHTEQYYTDQPNSGPDLKTKYITALYFTFSSLTSIGFGNVSPNTNAEKVFSIIVMLVGSLMYASIFGNVGALIQRLYSGTARYHAQMLRIKEFIRFHQIPSPLRQRLEEYSTQVWEHTNGIDMTMVQYSFPESLQSDICLYVYRHFLSGSAAFKSLNDGCLRNISLRIRSSHMPPSDTLVHTGDLLTAMYYVVKGSLEVVTTDDIILGVLNPGDFFGGLPPLASVQKNPYSVQMNSGWDYWSENHLTHMNTNAKYMQMEDYTPMPNTTGTTTNYNNNNTNNHNSNSVIYQPNPPPKSRFAVRALTYADVQFIDRHDLAELCSIYPELSLRLLERFELTLPLTISSDTKPINTTNTDRCSTIPNVESFLDATSSWHIVCSLLTGSFSSPGLSKRPSDNSKFCMLNETSYQSRCFDNPFIGKPPWELERYQRLFDHGALSLHLTGYSNTQIPVCFIDTLYSNNDSNNNNTSGVTAPSTHQHHSVTRKSESFTMCSTHSSEKNHSLPITPVTKTQTLHERRMRMRLARNLPNRQQQVPPPTIPSILVPPTSSCCSSVSNLPVKSTDKINPMIHSSVIYQPTTLRDMNNLNEEKEIIDLLVKRFANVEKQIENLDVRISQSVTTILQQLEMKVTKHRSIPM
					

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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	33.8	Very low	44.9	Very low	99 Å²	99	98.5 Å²	98.5	49%	0.488	50%	0.497	S	S	.	.				0	110.1	0	-63	169.9	176.4	0	0	109.2	I3 W380 R557 Y558 Y561	M1-I3 HydrophobicContact CB-CG1 4.13Å; M1-I3 PolarHBondContact O-N 3.43Å; M1-W380 HydrophobicContact CE-CZ2 3.98Å; M1-R557 HydrophobicContact SD-CG 4.26Å; M1-Y558 HydrophobicContact CE-CE1 4.41Å; M1-Y561 WeakPolarHBondContact CA-OH 3.27Å; M1-Y561 HydrophobicContact CG-CE2 4.39Å
2	P	39.9	Very low	45	Very low	94 Å²	94	101.9 Å²	101.9	61%	0.61	52%	0.517	S	S	*	.			trans	-81	63	170.5	37.1	-34.8	0	0	0	109.9	K4 Y561	P2-K4 PolarHBondContact O-N 2.74Å; P2-Y561 WeakPolarHBondContact CD-OH 3.4Å
3	I	51.6	Low	45.5	Very low	34 Å²	34	98.7 Å²	98.7	17%	0.174	50%	0.502	C	S	.	.			trans	-47.9	134	175.3	-61.6	169.4	0	0	0	108.3	M1 R5	M1-I3 HydrophobicContact CB-CG1 4.13Å; M1-I3 PolarHBondContact O-N 3.43Å; I3-R5 VanDerWaalsContact C-N 3.33Å; I3-R5 PolarHBondContact O-N 3.33Å
4	K	49.6	Very low	45.8	Very low	162 Å²	162	99.6 Å²	99.6	70%	0.704	50%	0.497	S	S	*	.			trans	-50.2	98.1	169.5	-83.9	-164.9	173.3	-166.4	0	109.8	P2 G6	P2-K4 PolarHBondContact O-N 2.74Å; K4-G6 PolarHBondContact O-N 3.49Å; K4-G6 VanDerWaalsContact O-N 3.13Å
5	R	54.8	Low	46.9	Very low	194 Å²	194	95.9 Å²	95.9	73%	0.732	48%	0.48	S	S	*	.			trans	-76.7	99.4	170.4	-66.2	179.3	-174.2	175.8	1.1	105.4	I3 H7	I3-R5 VanDerWaalsContact C-N 3.33Å; I3-R5 PolarHBondContact O-N 3.33Å; R5-H7 PolarHBondContact O-N 3.03Å
6	G	44.9	Very low	47.6	Very low	3 Å²	3	92 Å²	92	3%	0.031	46%	0.462	C	S	.	.			trans	-47.2	135.4	168.1	0	0	0	0	0	109.8	K4 I8 D493	K4-G6 PolarHBondContact O-N 3.49Å; K4-G6 VanDerWaalsContact O-N 3.13Å; G6-I8 PolarHBondContact O-N 3.47Å; G6-D493 CarbonylContact C-O 3.55Å; G6-D493 WeakPolarHBondContact CA-O 3.32Å
7	H	43.4	Very low	48.1	Very low	154 Å²	154	90.3 Å²	90.3	71%	0.713	46%	0.458	S	S	*	.			trans	-60.6	112.6	-172.4	-88.8	-105.2	0	0	0	109.9	R5 A9 D493	R5-H7 PolarHBondContact O-N 3.03Å; H7-A9 PolarHBondContact O-N 2.9Å; H7-D493 PolarHBondContact N-O 3.3Å
8	I	49.1	Very low	48.9	Very low	80 Å²	80	87.3 Å²	87.3	41%	0.41	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-65.2	117.1	165	-57.9	175.2	0	0	0	105.4	G6 P361	G6-I8 PolarHBondContact O-N 3.47Å; I8-P361 HydrophobicContact CG2-CG 4.17Å
9	A	43.6	Very low	49.9	Very low	57 Å²	57	83.9 Å²	83.9	47%	0.471	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-53.6	127.8	-176.3	0	0	0	0	0	109.9	H7 H11	H7-A9 PolarHBondContact O-N 2.9Å; A9-H11 PolarHBondContact O-N 3.23Å
10	P	40.8	Very low	50.7	Low	92 Å²	92	87.8 Å²	87.8	60%	0.597	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-63.4	132.2	-169.5	23.8	-33.6	0	0	0	111.2	N12 N13	P10-N12 PolarHBondContact O-N 3.18Å; P10-N13 WeakPolarHBondContact O-CB 3.35Å; P10-N13 PolarHBondContact O-N 2.71Å
11	H	42.4	Very low	51.2	Low	115 Å²	115	87 Å²	87	53%	0.532	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-24.2	-169.1	-67.3	-80.2	0	0	0	115.4	A9 N13 Y14	A9-H11 PolarHBondContact O-N 3.23Å; H11-N13 PolarHBondContact O-N 2.88Å; H11-N13 VanDerWaalsContact O-N 3.07Å; H11-Y14 PolarHBondContact O-N 3.14Å
12	N	46.9	Very low	52.8	Low	139 Å²	139	83.3 Å²	83.3	74%	0.743	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-10.4	174.5	-68.6	12.7	0	0	0	113.7	P10 Y14	P10-N12 PolarHBondContact O-N 3.18Å; N12-Y14 PolarHBondContact O-N 3.14Å; N12-Y14 VanDerWaalsContact O-N 3.11Å
13	N	50.7	Low	54.2	Low	60 Å²	60	82.2 Å²	82.2	32%	0.321	40%	0.403	S	S	.	.	H	α-helix	trans	-62.9	-6.2	169.9	-107.1	1.6	0	0	0	113.7	P10 H11 I15 V16 T17	P10-N13 WeakPolarHBondContact O-CB 3.35Å; P10-N13 PolarHBondContact O-N 2.71Å; H11-N13 PolarHBondContact O-N 2.88Å; H11-N13 VanDerWaalsContact O-N 3.07Å; N13-I15 VanDerWaalsContact C-N 3.32Å; N13-I15 PolarHBondContact O-N 3.25Å; N13-V16 PolarHBondContact O-N 3.34Å; N13-V16 VanDerWaalsContact O-N 3.09Å; N13-T17 WeakPolarHBondContact O-CB 3.41Å; N13-T17 PolarHBondContact O-N 2.85Å; N13-T17 PolarHBondContact O-OG1 2.93Å
14	Y	50.5	Low	54.9	Low	111 Å²	111	84.8 Å²	84.8	44%	0.435	42%	0.424	S	S	.	.	H	α-helix	trans	-54.7	-46.2	178.6	87.6	-92.1	0	0	0	112	H11 N12 L18 L124	H11-Y14 PolarHBondContact O-N 3.14Å; N12-Y14 PolarHBondContact O-N 3.14Å; N12-Y14 VanDerWaalsContact O-N 3.11Å; Y14-L18 WeakPolarHBondContact O-CB 3.48Å; Y14-L18 PolarHBondContact O-N 2.92Å; Y14-L124 HydrophobicContact CE2-CD1 4.11Å
15	I	61	Low	55.7	Low	45 Å²	45	83.1 Å²	83.1	23%	0.231	42%	0.418	C	S	.	.	H	α-helix	trans	-64.7	-42.2	176.2	-54	-179.5	0	0	0	110.9	N13 L18 I19 L124	N13-I15 VanDerWaalsContact C-N 3.32Å; N13-I15 PolarHBondContact O-N 3.25Å; I15-L18 PolarHBondContact O-N 2.92Å; I15-I19 HydrophobicContact CG2-CD1 3.73Å; I15-I19 HydrophobicContact CG2-CG1 4.36Å; I15-I19 WeakPolarHBondContact O-CB 3.33Å; I15-I19 VanDerWaalsContact O-CG1 3.26Å; I15-I19 WeakPolarHBondContact O-CG1 3.48Å; I15-I19 PolarHBondContact O-N 2.87Å; I15-L124 HydrophobicContact CG1-CD1 4.49Å
16	V	58.4	Low	56.2	Low	33 Å²	33	77.4 Å²	77.4	20%	0.2	40%	0.397	C	S	.	.	H	α-helix	trans	-69.8	-39.9	-176.3	-178.4	0	0	0	0	111.8	N13 R20	N13-V16 PolarHBondContact O-N 3.34Å; N13-V16 VanDerWaalsContact O-N 3.09Å; V16-R20 WeakPolarHBondContact O-CB 3.45Å; V16-R20 WeakPolarHBondContact O-CG 3.43Å; V16-R20 PolarHBondContact O-N 2.93Å
17	T	57.3	Low	57.5	Low	63 Å²	63	84.7 Å²	84.7	39%	0.387	43%	0.431	S	S	.	.	H	α-helix	trans	-70.4	-40.4	174.7	-62.6	0	0	0	0	110.9	N13 R20 N21	N13-T17 WeakPolarHBondContact O-CB 3.41Å; N13-T17 PolarHBondContact O-N 2.85Å; N13-T17 PolarHBondContact O-OG1 2.93Å; T17-R20 PolarHBondContact O-N 2.68Å; T17-N21 WeakPolarHBondContact O-CB 3.43Å; T17-N21 PolarHBondContact O-N 2.85Å; T17-N21 PolarHBondContact O-ND2 3.4Å; T17-N21 PolarHBondContact O-OD1 3.48Å
18	L	62.2	Low	59.6	Low	36 Å²	36	78.8 Å²	78.8	19%	0.188	41%	0.405	C	S	.	.	H	α-helix	trans	-61.5	-46.9	174.5	177	145.6	0	0	0	111.2	Y14 I15 N21 F22 L126	Y14-L18 WeakPolarHBondContact O-CB 3.48Å; Y14-L18 PolarHBondContact O-N 2.92Å; I15-L18 PolarHBondContact O-N 2.92Å; L18-N21 PolarHBondContact O-N 3.39Å; L18-F22 HydrophobicContact CD1-CE2 4.02Å; L18-F22 HydrophobicContact CD2-CD2 3.67Å; L18-F22 HydrophobicContact CD2-CE2 3.56Å; L18-F22 HydrophobicContact CG-CD2 3.85Å; L18-F22 HydrophobicContact CG-CE2 3.44Å; L18-F22 VanDerWaalsContact CG-CE2 3.44Å; L18-F22 HydrophobicContact CG-CZ 4.32Å; L18-F22 VanDerWaalsContact O-CD2 3.28Å; L18-F22 WeakPolarHBondContact O-CD2 3.33Å; L18-F22 WeakPolarHBondContact O-CG 3.33Å; L18-F22 PolarHBondContact O-N 2.85Å; L18-L126 HydrophobicContact CD2-CD2 4.25Å
19	I	68.2	Low	61.5	Low	24 Å²	24	75 Å²	75	12%	0.123	39%	0.385	C	S	.	.	H	α-helix	trans	-59.2	-52	172.7	-74.3	168.4	0	0	0	110.8	I15 N21 F22 D23 V31 Y43	I15-I19 HydrophobicContact CG2-CD1 3.73Å; I15-I19 HydrophobicContact CG2-CG1 4.36Å; I15-I19 WeakPolarHBondContact O-CB 3.33Å; I15-I19 VanDerWaalsContact O-CG1 3.26Å; I15-I19 WeakPolarHBondContact O-CG1 3.48Å; I15-I19 PolarHBondContact O-N 2.87Å; I19-N21 VanDerWaalsContact C-N 3.28Å; I19-N21 PolarHBondContact O-N 3.46Å; I19-F22 CarbonylContact O-C 3.51Å; I19-F22 PolarHBondContact O-N 2.8Å; I19-F22 VanDerWaalsContact O-N 3.08Å; I19-D23 WeakPolarHBondContact CG2-OD2 3.4Å; I19-D23 WeakPolarHBondContact O-CB 3.28Å; I19-D23 VanDerWaalsContact O-CG 3.31Å; I19-D23 PolarHBondContact O-N 3.39Å; I19-V31 HydrophobicContact CG1-CG2 4.37Å; I19-Y43 HydrophobicContact CB-CE1 4.5Å; I19-Y43 HydrophobicContact CD1-CD1 3.95Å; I19-Y43 HydrophobicContact CD1-CD2 3.84Å; I19-Y43 HydrophobicContact CD1-CE2 4.43Å; I19-Y43 HydrophobicContact CD1-CG 3.56Å; I19-Y43 HydrophobicContact CG1-CD1 3.86Å; I19-Y43 HydrophobicContact CG1-CE1 4.23Å; I19-Y43 HydrophobicContact CG1-CG 4.03Å; I19-Y43 HydrophobicContact CG2-CD1 4.08Å; I19-Y43 HydrophobicContact CG2-CD2 4.37Å; I19-Y43 HydrophobicContact CG2-CE1 3.59Å; I19-Y43 HydrophobicContact CG2-CE2 3.93Å; I19-Y43 HydrophobicContact CG2-CG 4.44Å
20	R	64.8	Low	63.7	Low	161 Å²	161	72.3 Å²	72.3	61%	0.608	36%	0.363	S	S	*	.	H	α-helix	trans	-59.2	-36.9	179.6	-77	171.5	176.9	-170.8	-1.6	113.4	V16 T17 S24	V16-R20 WeakPolarHBondContact O-CB 3.45Å; V16-R20 WeakPolarHBondContact O-CG 3.43Å; V16-R20 PolarHBondContact O-N 2.93Å; T17-R20 PolarHBondContact O-N 2.68Å; R20-S24 PolarHBondContact O-N 3.04Å
21	N	62.6	Low	65.9	Low	72 Å²	72	67.9 Å²	67.9	39%	0.385	33%	0.334	S	S	.	.	H	α-helix	trans	-68.7	-43.5	175.3	-71.7	-10.2	0	0	0	110.7	T17 L18 I19 S24 Q25	T17-N21 WeakPolarHBondContact O-CB 3.43Å; T17-N21 PolarHBondContact O-N 2.85Å; T17-N21 PolarHBondContact O-ND2 3.4Å; T17-N21 PolarHBondContact O-OD1 3.48Å; L18-N21 PolarHBondContact O-N 3.39Å; I19-N21 VanDerWaalsContact C-N 3.28Å; I19-N21 PolarHBondContact O-N 3.46Å; N21-S24 PolarHBondContact O-N 3.19Å; N21-S24 PolarHBondContact O-OG 2.82Å; N21-Q25 WeakPolarHBondContact O-CG 3.44Å; N21-Q25 PolarHBondContact O-N 3.43Å
22	F	67	Low	68.1	Low	20 Å²	20	62.4 Å²	62.4	9%	0.088	31%	0.309	C	S	.	.	H	α-helix	trans	-72.7	-39.1	178.6	-67.3	-38.2	0	0	0	113.9	L18 I19 S24 Q25 Y26 F29 L126 F342	L18-F22 HydrophobicContact CD1-CE2 4.02Å; L18-F22 HydrophobicContact CD2-CD2 3.67Å; L18-F22 HydrophobicContact CD2-CE2 3.56Å; L18-F22 HydrophobicContact CG-CD2 3.85Å; L18-F22 HydrophobicContact CG-CE2 3.44Å; L18-F22 VanDerWaalsContact CG-CE2 3.44Å; L18-F22 HydrophobicContact CG-CZ 4.32Å; L18-F22 VanDerWaalsContact O-CD2 3.28Å; L18-F22 WeakPolarHBondContact O-CD2 3.33Å; L18-F22 WeakPolarHBondContact O-CG 3.33Å; L18-F22 PolarHBondContact O-N 2.85Å; I19-F22 CarbonylContact O-C 3.51Å; I19-F22 PolarHBondContact O-N 2.8Å; I19-F22 VanDerWaalsContact O-N 3.08Å; F22-S24 PolarHBondContact O-N 3.24Å; F22-Q25 PolarHBondContact O-N 3.02Å; F22-Y26 HydrophobicContact CB-CD2 4.48Å; F22-Y26 AromaticContact CD1-CD2 3.77Å; F22-Y26 HydrophobicContact CD1-CD2 3.77Å; F22-Y26 AromaticContact CD1-CE2 3.87Å; F22-Y26 HydrophobicContact CD1-CE2 3.87Å; F22-Y26 HydrophobicContact CE1-CE2 4.23Å; F22-Y26 HydrophobicContact CG-CD2 4.49Å; F22-Y26 PolarHBondContact O-N 3.45Å; F22-F29 HydrophobicContact CB-CD1 4.25Å; F22-F29 HydrophobicContact CB-CD2 4.46Å; F22-F29 HydrophobicContact CB-CE1 3.63Å; F22-F29 HydrophobicContact CB-CE2 3.87Å; F22-F29 HydrophobicContact CB-CZ 3.42Å; F22-F29 VanDerWaalsContact CB-CZ 3.42Å; F22-F29 HydrophobicContact CD2-CE2 4.38Å; F22-L126 HydrophobicContact CE2-CD1 3.58Å; F22-L126 HydrophobicContact CE2-CD2 4.3Å; F22-L126 HydrophobicContact CZ-CD1 4.01Å; F22-F342 HydrophobicContact CE1-CE1 4.24Å; F22-F342 HydrophobicContact CE1-CE2 4.06Å; F22-F342 AromaticContact CE1-CZ 3.42Å; F22-F342 HydrophobicContact CE1-CZ 3.42Å; F22-F342 VanDerWaalsContact CE1-CZ 3.42Å; F22-F342 HydrophobicContact CE2-CZ 4.37Å; F22-F342 AromaticContact CZ-CE1 3.78Å; F22-F342 HydrophobicContact CZ-CE1 3.78Å; F22-F342 HydrophobicContact CZ-CE2 4.38Å; F22-F342 AromaticContact CZ-CZ 3.33Å; F22-F342 HydrophobicContact CZ-CZ 3.33Å
23	D	69.4	Low	70	Confident	71 Å²	71	57.5 Å²	57.5	38%	0.38	28%	0.283	S	S	.	.	H	α-helix	trans	-56.6	-24.5	171.6	-67.7	-34.6	0	0	0	111.5	I19 F29 Y43	I19-D23 WeakPolarHBondContact CG2-OD2 3.4Å; I19-D23 WeakPolarHBondContact O-CB 3.28Å; I19-D23 VanDerWaalsContact O-CG 3.31Å; I19-D23 PolarHBondContact O-N 3.39Å; D23-F29 WeakPolarHBondContact OD1-CZ 3.49Å; D23-Y43 VanDerWaalsContact CG-OH 3.31Å; D23-Y43 WeakPolarHBondContact OD1-CE1 3.31Å; D23-Y43 PolarHBondContact OD1-OH 2.9Å; D23-Y43 PolarHBondContact OD2-OH 3.49Å; D23-Y43 VanDerWaalsContact OD2-OH 3.11Å
24	S	65.3	Low	71.7	Confident	89 Å²	89	55.5 Å²	55.5	62%	0.622	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-5.8	176.1	79.9	0	0	0	0	115.5	R20 N21 F22	R20-S24 PolarHBondContact O-N 3.04Å; N21-S24 PolarHBondContact O-N 3.19Å; N21-S24 PolarHBondContact O-OG 2.82Å; F22-S24 PolarHBondContact O-N 3.24Å
25	Q	65.6	Low	73.3	Confident	126 Å²	126	54.8 Å²	54.8	59%	0.589	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.9	-26.3	-172	-69.2	-178.6	12.5	0	0	114.3	N21 F22	N21-Q25 WeakPolarHBondContact O-CG 3.44Å; N21-Q25 PolarHBondContact O-N 3.43Å; F22-Q25 PolarHBondContact O-N 3.02Å
26	Y	66.4	Low	74.4	Confident	74 Å²	74	56.4 Å²	56.4	29%	0.29	29%	0.29	S	S	.	.			trans	-138.7	116.7	-175.4	-59.2	-92.1	0	0	0	109.4	F22 N28 F29 F128 F342	F22-Y26 HydrophobicContact CB-CD2 4.48Å; F22-Y26 AromaticContact CD1-CD2 3.77Å; F22-Y26 HydrophobicContact CD1-CD2 3.77Å; F22-Y26 AromaticContact CD1-CE2 3.87Å; F22-Y26 HydrophobicContact CD1-CE2 3.87Å; F22-Y26 HydrophobicContact CE1-CE2 4.23Å; F22-Y26 HydrophobicContact CG-CD2 4.49Å; F22-Y26 PolarHBondContact O-N 3.45Å; Y26-N28 VanDerWaalsContact C-N 3.31Å; Y26-N28 PolarHBondContact O-N 2.86Å; Y26-F29 WeakPolarHBondContact O-CD1 3.44Å; Y26-F128 AromaticContact CD1-CD1 3.97Å; Y26-F128 HydrophobicContact CD1-CD1 3.97Å; Y26-F128 HydrophobicContact CD1-CE1 4.18Å; Y26-F128 HydrophobicContact CD2-CE1 4.13Å; Y26-F128 HydrophobicContact CG-CD1 4.06Å; Y26-F128 AromaticContact CG-CE1 3.95Å; Y26-F128 HydrophobicContact CG-CE1 3.95Å; Y26-F342 HydrophobicContact CE2-CE2 4.42Å
27	E	72.8	Confident	75.6	Confident	156 Å²	156	60.9 Å²	60.9	73%	0.729	32%	0.32	S	S	*	.	S	Bend	trans	-68.3	-31.7	-176.9	-61.3	174.4	154.9	0	0	112.5	S45 G47	E27-S45 VanDerWaalsContact O-CB 3.3Å; E27-S45 WeakPolarHBondContact O-CB 3.11Å; E27-S45 PolarHBondContact O-OG 3.18Å; E27-G47 WeakPolarHBondContact O-CA 3.48Å
28	N	87.4	Confident	76.9	Confident	31 Å²	31	61.4 Å²	61.4	17%	0.166	33%	0.326	C	S	.	.	S	Bend	trans	-128.8	90.9	-162.9	-63.7	-28.4	0	0	0	112.3	Y26 S45 G47 L48 F129	Y26-N28 VanDerWaalsContact C-N 3.31Å; Y26-N28 PolarHBondContact O-N 2.86Å; N28-S45 WeakPolarHBondContact CA-OG 3.24Å; N28-G47 PolarHBondContact OD1-O 2.67Å; N28-L48 HydrophobicContact CB-CB 4.4Å; N28-L48 HydrophobicContact CB-CD1 4.26Å; N28-L48 PolarHBondContact OD1-N 2.9Å; N28-L48 VanDerWaalsContact OD1-N 3.09Å; N28-F129 HydrophobicContact CB-CB 4.1Å; N28-F129 WeakPolarHBondContact CB-O 3.23Å; N28-F129 PolarHBondContact O-N 3.18Å
29	F	88.1	Confident	78.2	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	161.6	177.7	73	-82.9	0	0	0	114.6	F22 D23 Y26 V31 Y43 S45 L127 F128	F22-F29 HydrophobicContact CB-CD1 4.25Å; F22-F29 HydrophobicContact CB-CD2 4.46Å; F22-F29 HydrophobicContact CB-CE1 3.63Å; F22-F29 HydrophobicContact CB-CE2 3.87Å; F22-F29 HydrophobicContact CB-CZ 3.42Å; F22-F29 VanDerWaalsContact CB-CZ 3.42Å; F22-F29 HydrophobicContact CD2-CE2 4.38Å; D23-F29 WeakPolarHBondContact OD1-CZ 3.49Å; Y26-F29 WeakPolarHBondContact O-CD1 3.44Å; F29-V31 HydrophobicContact CD2-CG2 4.21Å; F29-V31 HydrophobicContact CE2-CG2 4Å; F29-Y43 HydrophobicContact CE1-CE1 4.49Å; F29-Y43 AromaticContact CE2-CD1 3.78Å; F29-Y43 HydrophobicContact CE2-CD1 3.78Å; F29-Y43 AromaticContact CE2-CE1 3.82Å; F29-Y43 HydrophobicContact CE2-CE1 3.82Å; F29-Y43 HydrophobicContact CZ-CD1 4.11Å; F29-Y43 AromaticContact CZ-CE1 3.64Å; F29-Y43 HydrophobicContact CZ-CE1 3.64Å; F29-S45 PolarHBondContact N-OG 2.69Å; F29-S45 PolarHBondContact O-N 2.73Å; F29-S45 PolarHBondContact O-OG 2.97Å; F29-L127 CarbonylContact C-O 3.6Å; F29-L127 VanDerWaalsContact CA-O 3.23Å; F29-L127 WeakPolarHBondContact CA-O 3.36Å; F29-F128 HydrophobicContact CB-CD1 3.65Å; F29-F128 HydrophobicContact CB-CE1 3.91Å; F29-F128 HydrophobicContact CB-CG 4.46Å; F29-F128 HydrophobicContact CG-CD1 4.49Å; F29-F128 HydrophobicContact CG-CE1 4.32Å
30	I	89.6	Confident	79.3	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	145.5	174.3	-83.6	167.3	0	0	0	109.8	I41 Y43 C44 L48 L66 L126 L127 F129	I30-I41 HydrophobicContact CD1-CD1 3.97Å; I30-I41 HydrophobicContact CG2-CD1 4.35Å; I30-I41 HydrophobicContact CG2-CG1 3.83Å; I30-I41 HydrophobicContact CG2-CG2 4.19Å; I30-Y43 WeakPolarHBondContact CA-O 3.45Å; I30-C44 HydrophobicContact CG1-CB 3.99Å; I30-L48 HydrophobicContact CD1-CD2 3.59Å; I30-L48 HydrophobicContact CG1-CD2 3.61Å; I30-L66 HydrophobicContact CD1-CD2 4.22Å; I30-L126 WeakPolarHBondContact O-CA 3.29Å; I30-L127 HydrophobicContact CB-CB 4.31Å; I30-L127 HydrophobicContact CG2-CD1 4.38Å; I30-L127 PolarHBondContact N-O 2.79Å; I30-L127 PolarHBondContact O-N 3.08Å; I30-F129 HydrophobicContact CB-CE2 4.15Å; I30-F129 HydrophobicContact CD1-CE2 3.84Å; I30-F129 HydrophobicContact CD1-CZ 3.97Å; I30-F129 HydrophobicContact CG1-CE2 4.17Å
31	V	87.4	Confident	80.6	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.9	165.8	-167.4	0	0	0	0	108.4	I19 F29 I42 Y43 L124 Y125 L126	I19-V31 HydrophobicContact CG1-CG2 4.37Å; F29-V31 HydrophobicContact CD2-CG2 4.21Å; F29-V31 HydrophobicContact CE2-CG2 4Å; V31-I42 HydrophobicContact CB-CG1 4.09Å; V31-I42 HydrophobicContact CG1-CD1 4.01Å; V31-I42 HydrophobicContact CG1-CG1 3.95Å; V31-I42 WeakPolarHBondContact O-CG1 3.44Å; V31-I42 PolarHBondContact O-N 2.72Å; V31-Y43 HydrophobicContact CG2-CD1 4.16Å; V31-Y43 PolarHBondContact N-O 2.95Å; V31-Y43 PolarHBondContact O-N 3.06Å; V31-Y43 VanDerWaalsContact O-N 3.11Å; V31-L124 HydrophobicContact CG1-CD1 4.18Å; V31-L124 HydrophobicContact CG1-CD2 4.17Å; V31-Y125 WeakPolarHBondContact CA-O 3.48Å; V31-L126 HydrophobicContact CB-CD2 4.25Å; V31-L126 HydrophobicContact CG1-CD2 4.02Å; V31-L126 HydrophobicContact CG2-CD2 3.73Å
32	A	88.2	Confident	81.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	148.2	178	0	0	0	0	0	112.1	A34 P40 L124 Y125	A32-A34 PolarHBondContact O-N 3.35Å; A32-P40 VanDerWaalsContact CA-O 3.29Å; A32-P40 WeakPolarHBondContact CA-O 3.32Å; A32-L124 WeakPolarHBondContact O-CA 3.38Å; A32-Y125 PolarHBondContact N-O 2.96Å; A32-Y125 PolarHBondContact O-N 3.24Å
33	N	87.7	Confident	82.8	Confident	36 Å²	36	53.8 Å²	53.8	19%	0.193	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	113.1	179	-178.9	-1.9	0	0	0	110.4	T35 L36 R39 P40 I42 P123	N33-T35 PolarHBondContact ND2-OG1 2.82Å; N33-T35 WeakPolarHBondContact OD1-CB 3.48Å; N33-T35 PolarHBondContact OD1-N 2.78Å; N33-T35 PolarHBondContact OD1-OG1 3.1Å; N33-L36 WeakPolarHBondContact ND2-CD1 3.36Å; N33-R39 WeakPolarHBondContact O-CA 3.17Å; N33-P40 HydrophobicContact CB-CG 4.39Å; N33-P40 PolarHBondContact N-O 3.27Å; N33-I42 HydrophobicContact CB-CG2 3.99Å; N33-P123 PolarHBondContact OD1-O 2.98Å
34	A	85.4	Confident	83.7	Confident	18 Å²	18	50.5 Å²	50.5	15%	0.149	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-17	-178.2	0	0	0	0	0	113.6	A32 L36 L122 P123 Y125	A32-A34 PolarHBondContact O-N 3.35Å; A34-L36 VanDerWaalsContact C-N 3.3Å; A34-L36 PolarHBondContact O-N 3.17Å; A34-L122 HydrophobicContact CB-CD2 4.03Å; A34-L122 HydrophobicContact CB-CG 3.99Å; A34-L122 WeakPolarHBondContact CB-O 3.43Å; A34-P123 PolarHBondContact N-O 3.41Å; A34-Y125 HydrophobicContact CB-CD2 3.5Å; A34-Y125 HydrophobicContact CB-CE2 3.55Å; A34-Y125 HydrophobicContact CB-CG 4.37Å
35	T	83.9	Confident	84.8	Confident	96 Å²	96	46.3 Å²	46.3	59%	0.589	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-15.5	-179.8	68.2	0	0	0	0	114.1	N33	N33-T35 PolarHBondContact ND2-OG1 2.82Å; N33-T35 WeakPolarHBondContact OD1-CB 3.48Å; N33-T35 PolarHBondContact OD1-N 2.78Å; N33-T35 PolarHBondContact OD1-OG1 3.1Å
36	L	85.4	Confident	85.8	Confident	79 Å²	79	44.8 Å²	44.8	41%	0.414	24%	0.242	S	C	.	.	S	Bend	trans	-103.6	137	-179.8	-67.5	174.4	0	0	0	110.5	N33 A34 S38 R39 P40	N33-L36 WeakPolarHBondContact ND2-CD1 3.36Å; A34-L36 VanDerWaalsContact C-N 3.3Å; A34-L36 PolarHBondContact O-N 3.17Å; L36-S38 VanDerWaalsContact C-N 3.28Å; L36-S38 PolarHBondContact O-N 3.27Å; L36-R39 WeakPolarHBondContact O-CA 3.48Å; L36-R39 WeakPolarHBondContact O-CG 3.32Å; L36-R39 PolarHBondContact O-N 3.16Å; L36-P40 HydrophobicContact CB-CG 4.32Å; L36-P40 HydrophobicContact CD1-CG 3.78Å
37	P	84.1	Confident	86.7	Confident	127 Å²	127	42.4 Å²	42.4	83%	0.825	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-28.7	-172.2	23.7	-33.9	0	0	0	114.1	R39	P37-R39 PolarHBondContact O-N 3.08Å
38	S	83.5	Confident	87.5	Confident	73 Å²	73	35 Å²	35	51%	0.51	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-9.1	174.1	54.8	0	0	0	0	114.2	L36 S63	L36-S38 VanDerWaalsContact C-N 3.28Å; L36-S38 PolarHBondContact O-N 3.27Å; S38-S63 WeakPolarHBondContact O-CB 3.16Å; S38-S63 PolarHBondContact O-OG 3.29Å
39	R	88.9	Confident	87.6	Confident	51 Å²	51	34.1 Å²	34.1	19%	0.192	20%	0.201	C	C	.	.			trans	43.9	61.5	-176.3	-58.8	178.2	-176.1	127.9	1.3	113.2	N33 L36 P37 S64 L86 N87	N33-R39 WeakPolarHBondContact O-CA 3.17Å; L36-R39 WeakPolarHBondContact O-CA 3.48Å; L36-R39 WeakPolarHBondContact O-CG 3.32Å; L36-R39 PolarHBondContact O-N 3.16Å; P37-R39 PolarHBondContact O-N 3.08Å; R39-S64 WeakPolarHBondContact CB-OG 3.47Å; R39-S64 WeakPolarHBondContact O-CB 3.48Å; R39-S64 PolarHBondContact O-N 3.21Å; R39-S64 PolarHBondContact O-OG 3.08Å; R39-L86 PolarHBondContact NE-O 2.95Å; R39-L86 PolarHBondContact NH1-O 2.9Å; R39-L86 VanDerWaalsContact NH1-O 3.08Å; R39-L86 PolarHBondContact NH2-O 2.92Å; R39-L86 VanDerWaalsContact NH2-O 3.16Å; R39-N87 VanDerWaalsContact CZ-OD1 3.24Å; R39-N87 PolarHBondContact NH1-OD1 2.79Å; R39-N87 PolarHBondContact NH2-OD1 2.94Å
40	P	91.6	Very high	87.6	Confident	11 Å²	11	41.5 Å²	41.5	7%	0.071	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-71.3	143.2	-171.2	29.7	-34.1	0	0	0	112.1	A32 N33 L36 I42 L61 K62	A32-P40 VanDerWaalsContact CA-O 3.29Å; A32-P40 WeakPolarHBondContact CA-O 3.32Å; N33-P40 HydrophobicContact CB-CG 4.39Å; N33-P40 PolarHBondContact N-O 3.27Å; L36-P40 HydrophobicContact CB-CG 4.32Å; L36-P40 HydrophobicContact CD1-CG 3.78Å; P40-I42 PolarHBondContact O-N 2.64Å; P40-L61 HydrophobicContact CB-CD2 4.47Å; P40-K62 CarbonylContact C-O 3.58Å; P40-K62 WeakPolarHBondContact CA-O 3.49Å
41	I	91.4	Very high	87.5	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	122.9	172.1	-66.9	168.1	0	0	0	109.3	I30 L61 K62	I30-I41 HydrophobicContact CD1-CD1 3.97Å; I30-I41 HydrophobicContact CG2-CD1 4.35Å; I30-I41 HydrophobicContact CG2-CG1 3.83Å; I30-I41 HydrophobicContact CG2-CG2 4.19Å; I41-L61 PolarHBondContact O-N 3.11Å; I41-K62 HydrophobicContact CD1-CB 4.32Å; I41-K62 WeakPolarHBondContact CG1-O 3.4Å; I41-K62 PolarHBondContact N-O 2.75Å
42	I	87.9	Confident	87.5	Confident	56 Å²	56	43.5 Å²	43.5	29%	0.287	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-14.7	177.5	65.2	166.8	0	0	0	113.2	V31 N33 P40 M60 L124	V31-I42 HydrophobicContact CB-CG1 4.09Å; V31-I42 HydrophobicContact CG1-CD1 4.01Å; V31-I42 HydrophobicContact CG1-CG1 3.95Å; V31-I42 WeakPolarHBondContact O-CG1 3.44Å; V31-I42 PolarHBondContact O-N 2.72Å; N33-I42 HydrophobicContact CB-CG2 3.99Å; P40-I42 PolarHBondContact O-N 2.64Å; I42-M60 VanDerWaalsContact C-SD 3.53Å; I42-M60 WeakPolarHBondContact O-CE 3.29Å; I42-M60 VanDerWaalsContact O-SD 3.41Å; I42-L124 HydrophobicContact CD1-CD2 3.56Å
43	Y	88.5	Confident	87.5	Confident	35 Å²	35	50.3 Å²	50.3	14%	0.137	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	152.3	168.5	-176.1	-104.1	0	0	0	111.2	I19 D23 F29 I30 V31 K56	I19-Y43 HydrophobicContact CB-CE1 4.5Å; I19-Y43 HydrophobicContact CD1-CD1 3.95Å; I19-Y43 HydrophobicContact CD1-CD2 3.84Å; I19-Y43 HydrophobicContact CD1-CE2 4.43Å; I19-Y43 HydrophobicContact CD1-CG 3.56Å; I19-Y43 HydrophobicContact CG1-CD1 3.86Å; I19-Y43 HydrophobicContact CG1-CE1 4.23Å; I19-Y43 HydrophobicContact CG1-CG 4.03Å; I19-Y43 HydrophobicContact CG2-CD1 4.08Å; I19-Y43 HydrophobicContact CG2-CD2 4.37Å; I19-Y43 HydrophobicContact CG2-CE1 3.59Å; I19-Y43 HydrophobicContact CG2-CE2 3.93Å; I19-Y43 HydrophobicContact CG2-CG 4.44Å; D23-Y43 VanDerWaalsContact CG-OH 3.31Å; D23-Y43 WeakPolarHBondContact OD1-CE1 3.31Å; D23-Y43 PolarHBondContact OD1-OH 2.9Å; D23-Y43 PolarHBondContact OD2-OH 3.49Å; D23-Y43 VanDerWaalsContact OD2-OH 3.11Å; F29-Y43 HydrophobicContact CE1-CE1 4.49Å; F29-Y43 AromaticContact CE2-CD1 3.78Å; F29-Y43 HydrophobicContact CE2-CD1 3.78Å; F29-Y43 AromaticContact CE2-CE1 3.82Å; F29-Y43 HydrophobicContact CE2-CE1 3.82Å; F29-Y43 HydrophobicContact CZ-CD1 4.11Å; F29-Y43 AromaticContact CZ-CE1 3.64Å; F29-Y43 HydrophobicContact CZ-CE1 3.64Å; I30-Y43 WeakPolarHBondContact CA-O 3.45Å; V31-Y43 HydrophobicContact CG2-CD1 4.16Å; V31-Y43 PolarHBondContact N-O 2.95Å; V31-Y43 PolarHBondContact O-N 3.06Å; V31-Y43 VanDerWaalsContact O-N 3.11Å; Y43-K56 PolarHBondContact OH-NZ 3.47Å; Y43-K56 VanDerWaalsContact OH-NZ 3.12Å
44	C	88.8	Confident	87.6	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.007	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	140.1	169	37.7	0	0	0	0	108.3	I30 K56 L59	I30-C44 HydrophobicContact CG1-CB 3.99Å; C44-K56 WeakPolarHBondContact O-CD 3.42Å; C44-K56 WeakPolarHBondContact O-CE 3.33Å; C44-K56 PolarHBondContact O-NZ 2.98Å; C44-L59 HydrophobicContact CB-CD1 4.43Å
45	S	87.7	Confident	87.8	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.014	29%	0.286	C	S	.	.			trans	-70.1	158.1	176	67.7	0	0	0	0	111.6	E27 N28 F29 L48 C49	E27-S45 VanDerWaalsContact O-CB 3.3Å; E27-S45 WeakPolarHBondContact O-CB 3.11Å; E27-S45 PolarHBondContact O-OG 3.18Å; N28-S45 WeakPolarHBondContact CA-OG 3.24Å; F29-S45 PolarHBondContact N-OG 2.69Å; F29-S45 PolarHBondContact O-N 2.73Å; F29-S45 PolarHBondContact O-OG 2.97Å; S45-L48 PolarHBondContact OG-N 2.82Å; S45-C49 PolarHBondContact O-N 3.25Å
46	D	87.6	Confident	88	Confident	94 Å²	94	51.4 Å²	51.4	50%	0.503	27%	0.27	S	S	.	.	H	α-helix	trans	-67	-39.4	178.4	-68.2	-79	0	0	0	112.1	L48 C49 E50 K56	D46-L48 VanDerWaalsContact C-N 3.34Å; D46-L48 PolarHBondContact O-N 2.89Å; D46-C49 WeakPolarHBondContact O-CA 3.47Å; D46-C49 WeakPolarHBondContact O-CB 3.42Å; D46-C49 PolarHBondContact O-N 3.17Å; D46-C49 VanDerWaalsContact O-N 3.08Å; D46-E50 PolarHBondContact O-N 2.82Å; D46-K56 WeakPolarHBondContact OD1-CE 3.13Å; D46-K56 IonicContact OD1-NZ 3.72Å; D46-K56 PolarHBondContact OD1-NZ 2.85Å; D46-K56 WeakPolarHBondContact OD2-CE 3.38Å; D46-K56 IonicContact OD2-NZ 2.66Å; D46-K56 PolarHBondContact OD2-NZ 3.43Å
47	G	85.7	Confident	88.2	Confident	24 Å²	24	50.9 Å²	50.9	25%	0.247	28%	0.283	C	S	.	.	H	α-helix	trans	-58	-42	177.6	0	0	0	0	0	113.2	E27 N28 C49 E50 L51	E27-G47 WeakPolarHBondContact O-CA 3.48Å; N28-G47 PolarHBondContact OD1-O 2.67Å; G47-C49 VanDerWaalsContact C-N 3.33Å; G47-C49 PolarHBondContact O-N 2.9Å; G47-E50 PolarHBondContact O-N 2.85Å; G47-L51 WeakPolarHBondContact O-CB 3.48Å; G47-L51 PolarHBondContact O-N 2.94Å
48	L	88.4	Confident	88.4	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-67.6	-35.8	176.9	-170.7	66.5	0	0	0	111.9	N28 I30 S45 D46 L52 F129	N28-L48 HydrophobicContact CB-CB 4.4Å; N28-L48 HydrophobicContact CB-CD1 4.26Å; N28-L48 PolarHBondContact OD1-N 2.9Å; N28-L48 VanDerWaalsContact OD1-N 3.09Å; I30-L48 HydrophobicContact CD1-CD2 3.59Å; I30-L48 HydrophobicContact CG1-CD2 3.61Å; S45-L48 PolarHBondContact OG-N 2.82Å; D46-L48 VanDerWaalsContact C-N 3.34Å; D46-L48 PolarHBondContact O-N 2.89Å; L48-L52 HydrophobicContact CD1-CD1 3.74Å; L48-L52 HydrophobicContact CD1-CG 4.04Å; L48-L52 HydrophobicContact CD2-CD1 4.33Å; L48-L52 HydrophobicContact CG-CD1 3.77Å; L48-L52 HydrophobicContact CG-CG 4.31Å; L48-L52 WeakPolarHBondContact O-CB 3.4Å; L48-L52 WeakPolarHBondContact O-CG 3.48Å; L48-L52 PolarHBondContact O-N 3.01Å; L48-F129 HydrophobicContact CD1-CB 3.77Å; L48-F129 HydrophobicContact CD1-CD1 4.1Å; L48-F129 HydrophobicContact CD1-CD2 3.96Å; L48-F129 HydrophobicContact CD1-CG 3.68Å; L48-F129 HydrophobicContact CD2-CD2 3.66Å; L48-F129 HydrophobicContact CD2-CE2 3.73Å; L48-F129 HydrophobicContact CD2-CG 4.23Å; L48-F129 HydrophobicContact CD2-CZ 4.33Å; L48-F129 HydrophobicContact CG-CD2 4.48Å
49	C	89.8	Confident	88.7	Confident	12 Å²	12	44.5 Å²	44.5	8%	0.081	24%	0.235	C	C	.	.	H	α-helix	trans	-65.4	-38.7	174.3	-78.2	0	0	0	0	112.4	S45 D46 G47 R53 Y54 K56	S45-C49 PolarHBondContact O-N 3.25Å; D46-C49 WeakPolarHBondContact O-CA 3.47Å; D46-C49 WeakPolarHBondContact O-CB 3.42Å; D46-C49 PolarHBondContact O-N 3.17Å; D46-C49 VanDerWaalsContact O-N 3.08Å; G47-C49 VanDerWaalsContact C-N 3.33Å; G47-C49 PolarHBondContact O-N 2.9Å; C49-R53 CarbonylContact O-C 3.6Å; C49-R53 VanDerWaalsContact O-CA 3.23Å; C49-R53 WeakPolarHBondContact O-CA 3.27Å; C49-R53 PolarHBondContact O-N 2.81Å; C49-Y54 WeakPolarHBondContact CA-O 3.41Å; C49-Y54 WeakPolarHBondContact CB-O 3.31Å; C49-Y54 PolarHBondContact O-N 2.87Å; C49-Y54 PolarHBondContact SG-O 2.86Å; C49-K56 VanDerWaalsContact SG-CG 3.5Å
50	E	87.6	Confident	88.6	Confident	155 Å²	155	45.6 Å²	45.6	72%	0.724	24%	0.243	S	C	*	.	H	α-helix	trans	-68.4	-45.3	174.5	-68.6	-172	175.2	0	0	111.8	D46 G47 R53	D46-E50 PolarHBondContact O-N 2.82Å; G47-E50 PolarHBondContact O-N 2.85Å; E50-R53 WeakPolarHBondContact O-CG 3.42Å; E50-R53 PolarHBondContact O-N 2.85Å
51	L	87.1	Confident	88.4	Confident	42 Å²	42	50.6 Å²	50.6	22%	0.22	27%	0.268	C	S	.	.	H	α-helix	trans	-63.1	-47.8	179.7	-176.2	59.7	0	0	0	112.6	G47 R53 I106 F108	G47-L51 WeakPolarHBondContact O-CB 3.48Å; G47-L51 PolarHBondContact O-N 2.94Å; L51-R53 VanDerWaalsContact C-N 3.33Å; L51-I106 HydrophobicContact CD1-CD1 4.11Å; L51-I106 HydrophobicContact CG-CD1 4.19Å; L51-F108 HydrophobicContact CD2-CE1 3.63Å; L51-F108 HydrophobicContact CD2-CZ 3.7Å; L51-F108 HydrophobicContact CG-CZ 4.19Å
52	L	89.1	Confident	88.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-81.1	-12.4	178.1	-60.6	177.7	0	0	0	113	L48 Y54 F69 S100 R101 I106 F108	L48-L52 HydrophobicContact CD1-CD1 3.74Å; L48-L52 HydrophobicContact CD1-CG 4.04Å; L48-L52 HydrophobicContact CD2-CD1 4.33Å; L48-L52 HydrophobicContact CG-CD1 3.77Å; L48-L52 HydrophobicContact CG-CG 4.31Å; L48-L52 WeakPolarHBondContact O-CB 3.4Å; L48-L52 WeakPolarHBondContact O-CG 3.48Å; L48-L52 PolarHBondContact O-N 3.01Å; L52-Y54 VanDerWaalsContact C-N 3.28Å; L52-Y54 HydrophobicContact CB-CD2 4.09Å; L52-Y54 WeakPolarHBondContact O-CD2 3.45Å; L52-Y54 PolarHBondContact O-N 2.89Å; L52-F69 HydrophobicContact CB-CE1 4.04Å; L52-F69 HydrophobicContact CD1-CD1 4.21Å; L52-F69 HydrophobicContact CD1-CE1 3.56Å; L52-F69 HydrophobicContact CD1-CE2 4.04Å; L52-F69 HydrophobicContact CD1-CZ 3.44Å; L52-F69 VanDerWaalsContact CD1-CZ 3.44Å; L52-F69 HydrophobicContact CG-CE1 4.28Å; L52-S100 PolarHBondContact O-OG 2.96Å; L52-S100 VanDerWaalsContact O-OG 3.09Å; L52-R101 PolarHBondContact O-N 2.92Å; L52-I106 HydrophobicContact CD2-CD1 4.45Å; L52-F108 HydrophobicContact CD2-CE2 3.64Å; L52-F108 HydrophobicContact CD2-CZ 3.7Å
53	R	87.5	Confident	88.6	Confident	144 Å²	144	54.2 Å²	54.2	54%	0.543	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	22.6	-178.3	-56.7	-178.5	178.8	-157.2	-2.2	115.5	C49 E50 L51 R101 D102	C49-R53 CarbonylContact O-C 3.6Å; C49-R53 VanDerWaalsContact O-CA 3.23Å; C49-R53 WeakPolarHBondContact O-CA 3.27Å; C49-R53 PolarHBondContact O-N 2.81Å; E50-R53 WeakPolarHBondContact O-CG 3.42Å; E50-R53 PolarHBondContact O-N 2.85Å; L51-R53 VanDerWaalsContact C-N 3.33Å; R53-R101 HydrophobicContact CB-CB 3.97Å; R53-R101 WeakPolarHBondContact O-CD 3.24Å; R53-D102 WeakPolarHBondContact CD-OD2 3.39Å; R53-D102 IonicContact CZ-OD2 3.76Å; R53-D102 IonicContact NE-OD2 2.69Å; R53-D102 IonicContact NH1-OD2 3.13Å; R53-D102 PolarHBondContact NH1-OD2 2.82Å
54	Y	89.7	Confident	88.6	Confident	36 Å²	36	52.5 Å²	52.5	14%	0.141	28%	0.28	C	S	.	.			trans	-100.9	144	171.5	-71.8	-104.3	0	0	0	110.5	C49 L52 Q58 L59 I68 F69 R101	C49-Y54 WeakPolarHBondContact CA-O 3.41Å; C49-Y54 WeakPolarHBondContact CB-O 3.31Å; C49-Y54 PolarHBondContact O-N 2.87Å; C49-Y54 PolarHBondContact SG-O 2.86Å; L52-Y54 VanDerWaalsContact C-N 3.28Å; L52-Y54 HydrophobicContact CB-CD2 4.09Å; L52-Y54 WeakPolarHBondContact O-CD2 3.45Å; L52-Y54 PolarHBondContact O-N 2.89Å; Y54-Q58 HydrophobicContact CD1-CB 4.08Å; Y54-L59 HydrophobicContact CD1-CD2 3.91Å; Y54-L59 HydrophobicContact CD2-CD2 4.45Å; Y54-L59 HydrophobicContact CG-CD2 3.75Å; Y54-I68 HydrophobicContact CD1-CD1 4.39Å; Y54-I68 HydrophobicContact CE1-CD1 3.93Å; Y54-I68 HydrophobicContact CE1-CG1 4.09Å; Y54-F69 HydrophobicContact CD2-CD1 4.22Å; Y54-F69 AromaticContact CD2-CE1 3.56Å; Y54-F69 HydrophobicContact CD2-CE1 3.56Å; Y54-F69 AromaticContact CE2-CD1 3.74Å; Y54-F69 HydrophobicContact CE2-CD1 3.74Å; Y54-F69 AromaticContact CE2-CE1 3.55Å; Y54-F69 HydrophobicContact CE2-CE1 3.55Å; Y54-F69 HydrophobicContact CG-CE1 4.19Å; Y54-R101 HydrophobicContact CD2-CB 3.88Å; Y54-R101 HydrophobicContact CE2-CB 3.6Å; Y54-R101 HydrophobicContact CE2-CG 4.33Å
55	T	90.3	Very high	88.7	Confident	82 Å²	82	53 Å²	53	50%	0.503	28%	0.283	S	S	.	.			trans	-77	152.5	171.3	73	0	0	0	0	110.4	G57 Q58 L59	T55-G57 PolarHBondContact O-N 3.04Å; T55-G57 VanDerWaalsContact O-N 3.12Å; T55-Q58 WeakPolarHBondContact O-CB 3.33Å; T55-Q58 PolarHBondContact O-N 3.29Å; T55-L59 PolarHBondContact O-N 2.86Å
56	K	88.4	Confident	88.7	Confident	54 Å²	54	52.9 Å²	52.9	24%	0.235	28%	0.283	C	S	.	.	H	α-helix	trans	-48.9	-43.5	177.8	-67	-167	178.8	-171.6	0	112.3	Y43 C44 D46 C49 Q58 L59 M60	Y43-K56 PolarHBondContact OH-NZ 3.47Å; Y43-K56 VanDerWaalsContact OH-NZ 3.12Å; C44-K56 WeakPolarHBondContact O-CD 3.42Å; C44-K56 WeakPolarHBondContact O-CE 3.33Å; C44-K56 PolarHBondContact O-NZ 2.98Å; D46-K56 WeakPolarHBondContact OD1-CE 3.13Å; D46-K56 IonicContact OD1-NZ 3.72Å; D46-K56 PolarHBondContact OD1-NZ 2.85Å; D46-K56 WeakPolarHBondContact OD2-CE 3.38Å; D46-K56 IonicContact OD2-NZ 2.66Å; D46-K56 PolarHBondContact OD2-NZ 3.43Å; C49-K56 VanDerWaalsContact SG-CG 3.5Å; K56-Q58 PolarHBondContact O-N 3.49Å; K56-Q58 VanDerWaalsContact O-N 3.17Å; K56-L59 PolarHBondContact O-N 2.78Å; K56-M60 VanDerWaalsContact O-CG 3.28Å; K56-M60 WeakPolarHBondContact O-CG 3.36Å; K56-M60 PolarHBondContact O-N 3.44Å
57	G	87.7	Confident	88.7	Confident	68 Å²	68	52 Å²	52	70%	0.701	28%	0.284	S	S	*	.	H	α-helix	trans	-64.7	-13.8	177.7	0	0	0	0	0	116.2	T55	T55-G57 PolarHBondContact O-N 3.04Å; T55-G57 VanDerWaalsContact O-N 3.12Å
58	Q	89.2	Confident	88.8	Confident	67 Å²	67	53.4 Å²	53.4	31%	0.313	29%	0.285	S	S	.	.	H	α-helix	trans	-88.8	-23.6	171.7	-65.2	176.2	-66.4	0	0	112.8	Y54 T55 K56 K62	Y54-Q58 HydrophobicContact CD1-CB 4.08Å; T55-Q58 WeakPolarHBondContact O-CB 3.33Å; T55-Q58 PolarHBondContact O-N 3.29Å; K56-Q58 PolarHBondContact O-N 3.49Å; K56-Q58 VanDerWaalsContact O-N 3.17Å; Q58-K62 WeakPolarHBondContact O-CG 3.33Å
59	L	89.7	Confident	88.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-95.7	-31.8	-177.7	-57.5	-170.5	0	0	0	113	C44 Y54 T55 K56 L61 K62 F69	C44-L59 HydrophobicContact CB-CD1 4.43Å; Y54-L59 HydrophobicContact CD1-CD2 3.91Å; Y54-L59 HydrophobicContact CD2-CD2 4.45Å; Y54-L59 HydrophobicContact CG-CD2 3.75Å; T55-L59 PolarHBondContact O-N 2.86Å; K56-L59 PolarHBondContact O-N 2.78Å; L59-L61 PolarHBondContact O-N 2.89Å; L59-K62 WeakPolarHBondContact O-CB 3.36Å; L59-K62 WeakPolarHBondContact O-CG 3.41Å; L59-K62 PolarHBondContact O-N 3.21Å; L59-K62 VanDerWaalsContact O-N 3.14Å; L59-F69 HydrophobicContact CD1-CZ 4.04Å; L59-F69 HydrophobicContact CD2-CE1 3.84Å; L59-F69 HydrophobicContact CD2-CE2 4.34Å; L59-F69 HydrophobicContact CD2-CZ 3.37Å; L59-F69 HydrophobicContact CG-CZ 4.33Å
60	M	87.3	Confident	89	Confident	74 Å²	74	55.6 Å²	55.6	37%	0.365	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	138.7	173.3	-73.4	-65.5	-65.9	0	0	111.5	I42 K56 K62	I42-M60 VanDerWaalsContact C-SD 3.53Å; I42-M60 WeakPolarHBondContact O-CE 3.29Å; I42-M60 VanDerWaalsContact O-SD 3.41Å; K56-M60 VanDerWaalsContact O-CG 3.28Å; K56-M60 WeakPolarHBondContact O-CG 3.36Å; K56-M60 PolarHBondContact O-N 3.44Å; M60-K62 PolarHBondContact O-N 2.85Å; M60-K62 VanDerWaalsContact O-N 3.09Å
61	L	88.2	Confident	89	Confident	115 Å²	115	49.5 Å²	49.5	60%	0.602	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	2.1	-177.6	-51.3	178.2	0	0	0	116.2	P40 I41 L59	P40-L61 HydrophobicContact CB-CD2 4.47Å; I41-L61 PolarHBondContact O-N 3.11Å; L59-L61 PolarHBondContact O-N 2.89Å
62	K	91.6	Very high	89	Confident	97 Å²	97	53.5 Å²	53.5	42%	0.422	30%	0.299	S	S	.	.	S	Bend	trans	-72.7	156.9	164.7	-57.4	-60.5	177.4	-178.6	0	110	P40 I41 Q58 L59 M60 I68	P40-K62 CarbonylContact C-O 3.58Å; P40-K62 WeakPolarHBondContact CA-O 3.49Å; I41-K62 HydrophobicContact CD1-CB 4.32Å; I41-K62 WeakPolarHBondContact CG1-O 3.4Å; I41-K62 PolarHBondContact N-O 2.75Å; Q58-K62 WeakPolarHBondContact O-CG 3.33Å; L59-K62 WeakPolarHBondContact O-CB 3.36Å; L59-K62 WeakPolarHBondContact O-CG 3.41Å; L59-K62 PolarHBondContact O-N 3.21Å; L59-K62 VanDerWaalsContact O-N 3.14Å; M60-K62 PolarHBondContact O-N 2.85Å; M60-K62 VanDerWaalsContact O-N 3.09Å; K62-I68 HydrophobicContact CD-CD1 4.23Å; K62-I68 HydrophobicContact CG-CD1 4.1Å
63	S	91.5	Very high	88.8	Confident	36 Å²	36	57.6 Å²	57.6	25%	0.252	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-69.2	140.9	179.2	-172.2	0	0	0	0	111.2	S38 A65 L66	S38-S63 WeakPolarHBondContact O-CB 3.16Å; S38-S63 PolarHBondContact O-OG 3.29Å; S63-A65 PolarHBondContact O-N 3.5Å; S63-A65 VanDerWaalsContact O-N 3.15Å; S63-A65 PolarHBondContact OG-N 2.88Å; S63-L66 PolarHBondContact O-N 3.25Å
64	S	88.7	Confident	88.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-9.1	168.6	51.1	0	0	0	0	114.1	R39 L66	R39-S64 WeakPolarHBondContact CB-OG 3.47Å; R39-S64 WeakPolarHBondContact O-CB 3.48Å; R39-S64 PolarHBondContact O-N 3.21Å; R39-S64 PolarHBondContact O-OG 3.08Å; S64-L66 WeakPolarHBondContact O-CG 3.43Å; S64-L66 PolarHBondContact O-N 3.24Å
65	A	89.9	Confident	88.9	Confident	10 Å²	10	53.3 Å²	53.3	8%	0.083	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	11.3	165	0	0	0	0	0	113.7	S63 S67 Y70 L83 L86	S63-A65 PolarHBondContact O-N 3.5Å; S63-A65 VanDerWaalsContact O-N 3.15Å; S63-A65 PolarHBondContact OG-N 2.88Å; A65-S67 PolarHBondContact O-N 3.44Å; A65-Y70 PolarHBondContact O-OH 2.83Å; A65-L83 HydrophobicContact CB-CD2 3.62Å; A65-L83 HydrophobicContact CB-CG 4.5Å; A65-L86 HydrophobicContact CB-CD1 4.16Å
66	L	89	Confident	88.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	32%	0.316	C	S	.	.			trans	58	15.8	164.1	-55.7	-175.7	0	0	0	117.3	I30 S63 S64 I68 F69 Y70 L82 L98 I110 F129	I30-L66 HydrophobicContact CD1-CD2 4.22Å; S63-L66 PolarHBondContact O-N 3.25Å; S64-L66 WeakPolarHBondContact O-CG 3.43Å; S64-L66 PolarHBondContact O-N 3.24Å; L66-I68 PolarHBondContact O-N 3.23Å; L66-F69 HydrophobicContact CB-CD2 4.03Å; L66-F69 HydrophobicContact CD2-CD2 4.19Å; L66-F69 HydrophobicContact CD2-CE2 4.06Å; L66-F69 WeakPolarHBondContact O-CD2 3.47Å; L66-F69 PolarHBondContact O-N 3.23Å; L66-Y70 HydrophobicContact CB-CE1 4.4Å; L66-L82 HydrophobicContact CB-CD2 4.13Å; L66-L82 HydrophobicContact CD1-CD2 3.86Å; L66-L82 HydrophobicContact CG-CD2 3.95Å; L66-L98 HydrophobicContact CD1-CD1 3.94Å; L66-I110 HydrophobicContact CD1-CD1 3.61Å; L66-F129 HydrophobicContact CD1-CE1 3.64Å; L66-F129 HydrophobicContact CD1-CZ 3.68Å; L66-F129 HydrophobicContact CD2-CZ 3.97Å; L66-F129 HydrophobicContact CG-CZ 4.49Å
67	S	86.7	Confident	88.9	Confident	76 Å²	76	56 Å²	56	53%	0.531	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-62	-11.7	-172.3	58	0	0	0	0	116.3	A65 F69	A65-S67 PolarHBondContact O-N 3.44Å; S67-F69 VanDerWaalsContact C-N 3.28Å
68	I	88.3	Confident	89	Confident	53 Å²	53	53 Å²	53	27%	0.272	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-73.3	-18.1	170.9	-169.4	167.3	0	0	0	113.4	Y54 K62 L66	Y54-I68 HydrophobicContact CD1-CD1 4.39Å; Y54-I68 HydrophobicContact CE1-CD1 3.93Å; Y54-I68 HydrophobicContact CE1-CG1 4.09Å; K62-I68 HydrophobicContact CD-CD1 4.23Å; K62-I68 HydrophobicContact CG-CD1 4.1Å; L66-I68 PolarHBondContact O-N 3.23Å
69	F	90.3	Very high	89.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-109	5.2	-175.7	-52.3	-69	0	0	0	113.5	L52 Y54 L59 L66 S67 L98 Y99	L52-F69 HydrophobicContact CB-CE1 4.04Å; L52-F69 HydrophobicContact CD1-CD1 4.21Å; L52-F69 HydrophobicContact CD1-CE1 3.56Å; L52-F69 HydrophobicContact CD1-CE2 4.04Å; L52-F69 HydrophobicContact CD1-CZ 3.44Å; L52-F69 VanDerWaalsContact CD1-CZ 3.44Å; L52-F69 HydrophobicContact CG-CE1 4.28Å; Y54-F69 HydrophobicContact CD2-CD1 4.22Å; Y54-F69 AromaticContact CD2-CE1 3.56Å; Y54-F69 HydrophobicContact CD2-CE1 3.56Å; Y54-F69 AromaticContact CE2-CD1 3.74Å; Y54-F69 HydrophobicContact CE2-CD1 3.74Å; Y54-F69 AromaticContact CE2-CE1 3.55Å; Y54-F69 HydrophobicContact CE2-CE1 3.55Å; Y54-F69 HydrophobicContact CG-CE1 4.19Å; L59-F69 HydrophobicContact CD1-CZ 4.04Å; L59-F69 HydrophobicContact CD2-CE1 3.84Å; L59-F69 HydrophobicContact CD2-CE2 4.34Å; L59-F69 HydrophobicContact CD2-CZ 3.37Å; L59-F69 HydrophobicContact CG-CZ 4.33Å; L66-F69 HydrophobicContact CB-CD2 4.03Å; L66-F69 HydrophobicContact CD2-CD2 4.19Å; L66-F69 HydrophobicContact CD2-CE2 4.06Å; L66-F69 WeakPolarHBondContact O-CD2 3.47Å; L66-F69 PolarHBondContact O-N 3.23Å; S67-F69 VanDerWaalsContact C-N 3.28Å; F69-L98 HydrophobicContact CB-CB 4.1Å; F69-L98 HydrophobicContact CB-CD1 4.34Å; F69-L98 HydrophobicContact CB-CD2 3.86Å; F69-L98 HydrophobicContact CB-CG 4.33Å; F69-Y99 PolarHBondContact O-N 2.96Å
70	Y	91.1	Very high	89.1	Confident	59 Å²	59	59.5 Å²	59.5	23%	0.231	34%	0.335	C	S	.	.			trans	-76.3	144.5	180	-66.7	-13.6	0	0	0	111.9	A65 L66 T74 M79 M96 L98	A65-Y70 PolarHBondContact O-OH 2.83Å; L66-Y70 HydrophobicContact CB-CE1 4.4Å; Y70-T74 HydrophobicContact CD1-CG2 3.77Å; Y70-T74 HydrophobicContact CE1-CG2 4.16Å; Y70-T74 HydrophobicContact CG-CG2 4.3Å; Y70-M79 HydrophobicContact CD1-CG 4.47Å; Y70-M79 HydrophobicContact CD2-CE 3.82Å; Y70-M79 HydrophobicContact CD2-CG 4.4Å; Y70-M79 HydrophobicContact CD2-SD 4Å; Y70-M79 HydrophobicContact CE1-CG 3.93Å; Y70-M79 HydrophobicContact CE2-CB 4.42Å; Y70-M79 HydrophobicContact CE2-CE 3.57Å; Y70-M79 HydrophobicContact CE2-CG 3.89Å; Y70-M79 HydrophobicContact CE2-SD 3.97Å; Y70-M79 HydrophobicContact CG-SD 4.36Å; Y70-M96 HydrophobicContact CE1-CE 4.14Å; Y70-M96 HydrophobicContact CE1-SD 3.87Å; Y70-L98 HydrophobicContact CD1-CD2 4.18Å; Y70-L98 HydrophobicContact CE1-CD2 4.44Å
71	G	87.6	Confident	89.3	Confident	26 Å²	26	58.8 Å²	58.8	27%	0.268	34%	0.335	S	S	.	.			trans	-163.4	-168.2	175	0	0	0	0	0	112.7	E73 T74 Y99	G71-E73 VanDerWaalsContact C-N 3.32Å; G71-E73 PolarHBondContact O-N 2.91Å; G71-E73 VanDerWaalsContact O-N 3.14Å; G71-T74 PolarHBondContact N-OG1 2.94Å; G71-T74 VanDerWaalsContact O-CB 3.32Å; G71-T74 WeakPolarHBondContact O-CB 3.37Å; G71-T74 PolarHBondContact O-N 2.93Å; G71-T74 PolarHBondContact O-OG1 2.84Å; G71-Y99 VanDerWaalsContact CA-CD2 3.48Å
72	P	86.8	Confident	89.4	Confident	127 Å²	127	53.3 Å²	53.3	83%	0.825	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-32.8	-169.3	-31	36.3	0	0	0	117.5	Y99	P72-Y99 WeakPolarHBondContact CD-OH 3.4Å
73	E	85.9	Confident	89.4	Confident	86 Å²	86	52.4 Å²	52.4	40%	0.402	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-4.4	176.6	-74.8	-173.8	-138.3	0	0	114.1	G71 T75 N97 Y99 V105 Y107	G71-E73 VanDerWaalsContact C-N 3.32Å; G71-E73 PolarHBondContact O-N 2.91Å; G71-E73 VanDerWaalsContact O-N 3.14Å; E73-T75 PolarHBondContact O-N 3.09Å; E73-N97 HydrophobicContact CB-CB 4.28Å; E73-N97 WeakPolarHBondContact O-CB 3.43Å; E73-N97 PolarHBondContact O-ND2 2.85Å; E73-Y99 HydrophobicContact CB-CE2 4.36Å; E73-Y99 WeakPolarHBondContact CB-OH 3.33Å; E73-Y99 PolarHBondContact N-OH 3.15Å; E73-V105 HydrophobicContact CB-CG1 4.39Å; E73-V105 HydrophobicContact CB-CG2 4.35Å; E73-V105 HydrophobicContact CG-CG2 4.42Å; E73-Y107 PolarHBondContact OE2-OH 3.41Å
74	T	88.7	Confident	89.3	Confident	15 Å²	15	52.4 Å²	52.4	9%	0.092	31%	0.308	C	S	.	.			trans	-76.2	112.7	175.9	-47.5	0	0	0	0	109.5	Y70 G71 M79 M96 N97	Y70-T74 HydrophobicContact CD1-CG2 3.77Å; Y70-T74 HydrophobicContact CE1-CG2 4.16Å; Y70-T74 HydrophobicContact CG-CG2 4.3Å; G71-T74 PolarHBondContact N-OG1 2.94Å; G71-T74 VanDerWaalsContact O-CB 3.32Å; G71-T74 WeakPolarHBondContact O-CB 3.37Å; G71-T74 PolarHBondContact O-N 2.93Å; G71-T74 PolarHBondContact O-OG1 2.84Å; T74-M79 HydrophobicContact CG2-CG 3.77Å; T74-M79 HydrophobicContact CG2-SD 3.98Å; T74-M96 HydrophobicContact CG2-CG 4.15Å; T74-N97 WeakPolarHBondContact CB-O 3.14Å; T74-N97 PolarHBondContact OG1-O 3.49Å
75	T	90	Very high	89.2	Confident	74 Å²	74	52.5 Å²	52.5	45%	0.454	31%	0.309	S	S	.	.			trans	-75.6	137.6	-178.9	61.4	0	0	0	0	111.3	E73 D77 S78 M79	E73-T75 PolarHBondContact O-N 3.09Å; T75-D77 PolarHBondContact O-N 3.35Å; T75-S78 PolarHBondContact O-N 3.29Å; T75-S78 PolarHBondContact O-OG 3.39Å; T75-S78 WeakPolarHBondContact OG1-CB 3.38Å; T75-S78 PolarHBondContact OG1-N 2.95Å; T75-S78 PolarHBondContact OG1-OG 2.94Å; T75-M79 WeakPolarHBondContact O-CG 3.49Å; T75-M79 PolarHBondContact O-N 2.87Å
76	A	89.4	Confident	89.1	Confident	72 Å²	72	52.1 Å²	52.1	60%	0.595	31%	0.305	S	S	*	.	H	α-helix	trans	-57.1	-35.4	176.9	0	0	0	0	0	112.6	S78 M79 E80	A76-S78 PolarHBondContact O-N 3.35Å; A76-M79 WeakPolarHBondContact O-CB 3.04Å; A76-M79 PolarHBondContact O-N 3.36Å; A76-M79 VanDerWaalsContact O-N 3.14Å; A76-E80 PolarHBondContact O-N 2.68Å
77	D	90.3	Very high	88.9	Confident	122 Å²	122	57 Å²	57	65%	0.652	33%	0.331	S	S	*	.	H	α-helix	trans	-58.9	-43	173.7	-176.5	55.6	0	0	0	112.6	T75 M79 T81	T75-D77 PolarHBondContact O-N 3.35Å; D77-M79 VanDerWaalsContact C-N 3.33Å; D77-M79 PolarHBondContact O-N 2.72Å; D77-T81 VanDerWaalsContact O-CB 3.27Å; D77-T81 WeakPolarHBondContact O-CB 3.37Å; D77-T81 PolarHBondContact O-N 3.22Å; D77-T81 PolarHBondContact O-OG1 3.28Å
78	S	89.5	Confident	88.5	Confident	4 Å²	4	57.6 Å²	57.6	3%	0.028	33%	0.326	C	S	.	.	H	α-helix	trans	-66.2	-35.5	173.7	71.3	0	0	0	0	112.4	T75 A76 T81 L82 L95 M96	T75-S78 PolarHBondContact O-N 3.29Å; T75-S78 PolarHBondContact O-OG 3.39Å; T75-S78 WeakPolarHBondContact OG1-CB 3.38Å; T75-S78 PolarHBondContact OG1-N 2.95Å; T75-S78 PolarHBondContact OG1-OG 2.94Å; A76-S78 PolarHBondContact O-N 3.35Å; S78-T81 PolarHBondContact O-N 3.13Å; S78-L82 WeakPolarHBondContact O-CB 3.5Å; S78-L82 PolarHBondContact O-N 2.96Å; S78-L95 VanDerWaalsContact CB-O 3.24Å; S78-L95 WeakPolarHBondContact CB-O 3.34Å; S78-M96 WeakPolarHBondContact O-CE 3.08Å
79	M	90.4	Very high	87.7	Confident	57 Å²	57	58.1 Å²	58.1	28%	0.281	33%	0.331	S	S	.	.	H	α-helix	trans	-68.4	-44.5	178.4	-61.7	168.4	37.8	0	0	111.6	Y70 T74 T75 A76 D77 L82 L83 M96	Y70-M79 HydrophobicContact CD1-CG 4.47Å; Y70-M79 HydrophobicContact CD2-CE 3.82Å; Y70-M79 HydrophobicContact CD2-CG 4.4Å; Y70-M79 HydrophobicContact CD2-SD 4Å; Y70-M79 HydrophobicContact CE1-CG 3.93Å; Y70-M79 HydrophobicContact CE2-CB 4.42Å; Y70-M79 HydrophobicContact CE2-CE 3.57Å; Y70-M79 HydrophobicContact CE2-CG 3.89Å; Y70-M79 HydrophobicContact CE2-SD 3.97Å; Y70-M79 HydrophobicContact CG-SD 4.36Å; T74-M79 HydrophobicContact CG2-CG 3.77Å; T74-M79 HydrophobicContact CG2-SD 3.98Å; T75-M79 WeakPolarHBondContact O-CG 3.49Å; T75-M79 PolarHBondContact O-N 2.87Å; A76-M79 WeakPolarHBondContact O-CB 3.04Å; A76-M79 PolarHBondContact O-N 3.36Å; A76-M79 VanDerWaalsContact O-N 3.14Å; D77-M79 VanDerWaalsContact C-N 3.33Å; D77-M79 PolarHBondContact O-N 2.72Å; M79-L82 PolarHBondContact O-N 3.42Å; M79-L83 WeakPolarHBondContact O-CG 3.17Å; M79-L83 PolarHBondContact O-N 3.43Å; M79-M96 HydrophobicContact CG-CE 4.26Å
80	E	90	Very high	87	Confident	147 Å²	147	63.1 Å²	63.1	69%	0.687	36%	0.358	S	S	*	.	H	α-helix	trans	-66.4	-40.4	174.8	-172.6	165.8	-175.8	0	0	111	A76 L82 L83 A84	A76-E80 PolarHBondContact O-N 2.68Å; E80-L82 PolarHBondContact O-N 3.06Å; E80-L83 PolarHBondContact O-N 2.65Å; E80-A84 WeakPolarHBondContact O-CB 3.45Å; E80-A84 PolarHBondContact O-N 3.35Å
81	T	91	Very high	86.5	Confident	58 Å²	58	63.1 Å²	63.1	36%	0.356	36%	0.36	S	S	.	.	H	α-helix	trans	-62	-39.8	174.2	-57.4	0	0	0	0	112.1	D77 S78 A84 A85 V94	D77-T81 VanDerWaalsContact O-CB 3.27Å; D77-T81 WeakPolarHBondContact O-CB 3.37Å; D77-T81 PolarHBondContact O-N 3.22Å; D77-T81 PolarHBondContact O-OG1 3.28Å; S78-T81 PolarHBondContact O-N 3.13Å; T81-A84 PolarHBondContact O-N 2.93Å; T81-A85 VanDerWaalsContact O-CB 3.31Å; T81-A85 WeakPolarHBondContact O-CB 3.28Å; T81-A85 PolarHBondContact O-N 3.46Å; T81-V94 HydrophobicContact CG2-CG1 4.06Å; T81-V94 HydrophobicContact CG2-CG2 4Å
82	L	91.3	Very high	86.4	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-67.5	-38.8	174.6	-176.9	63.7	0	0	0	112.4	L66 S78 M79 E80 A85 L86 V94 M96 V112 L127	L66-L82 HydrophobicContact CB-CD2 4.13Å; L66-L82 HydrophobicContact CD1-CD2 3.86Å; L66-L82 HydrophobicContact CG-CD2 3.95Å; S78-L82 WeakPolarHBondContact O-CB 3.5Å; S78-L82 PolarHBondContact O-N 2.96Å; M79-L82 PolarHBondContact O-N 3.42Å; E80-L82 PolarHBondContact O-N 3.06Å; L82-A85 WeakPolarHBondContact O-CB 3.3Å; L82-A85 PolarHBondContact O-N 2.78Å; L82-L86 HydrophobicContact CD1-CD1 4.46Å; L82-L86 HydrophobicContact CG-CD1 4.23Å; L82-L86 WeakPolarHBondContact O-CB 3.23Å; L82-L86 VanDerWaalsContact O-CG 3.32Å; L82-L86 WeakPolarHBondContact O-CG 3.37Å; L82-L86 PolarHBondContact O-N 2.85Å; L82-V94 HydrophobicContact CB-CG1 4.36Å; L82-V94 HydrophobicContact CD1-CG2 4.45Å; L82-M96 HydrophobicContact CB-CE 3.73Å; L82-M96 HydrophobicContact CD2-CE 3.72Å; L82-M96 HydrophobicContact CD2-SD 3.95Å; L82-M96 HydrophobicContact CG-CE 4.35Å; L82-V112 HydrophobicContact CD1-CG2 3.78Å; L82-L127 HydrophobicContact CD1-CD2 4.37Å
83	L	90.3	Very high	86.4	Confident	79 Å²	79	62.6 Å²	62.6	41%	0.414	34%	0.342	S	S	.	.	H	α-helix	trans	-67.4	-37.5	174.3	-73.6	168.8	0	0	0	111.8	A65 M79 E80 L86 N87	A65-L83 HydrophobicContact CB-CD2 3.62Å; A65-L83 HydrophobicContact CB-CG 4.5Å; M79-L83 WeakPolarHBondContact O-CG 3.17Å; M79-L83 PolarHBondContact O-N 3.43Å; E80-L83 PolarHBondContact O-N 2.65Å; L83-L86 PolarHBondContact O-N 3.11Å; L83-N87 VanDerWaalsContact O-CG 3.22Å; L83-N87 PolarHBondContact O-N 2.96Å; L83-N87 VanDerWaalsContact O-N 3.1Å; L83-N87 PolarHBondContact O-ND2 3Å
84	A	89.1	Confident	86.5	Confident	36 Å²	36	58.7 Å²	58.7	30%	0.298	32%	0.324	S	S	.	.	H	α-helix	trans	-65.9	-43.7	172.9	0	0	0	0	0	111.4	E80 T81 L86 N87 Q88	E80-A84 WeakPolarHBondContact O-CB 3.45Å; E80-A84 PolarHBondContact O-N 3.35Å; T81-A84 PolarHBondContact O-N 2.93Å; A84-L86 PolarHBondContact O-N 2.92Å; A84-N87 CarbonylContact O-C 3.54Å; A84-N87 PolarHBondContact O-N 3.48Å; A84-Q88 WeakPolarHBondContact O-CB 3.17Å; A84-Q88 VanDerWaalsContact O-CG 3.28Å; A84-Q88 WeakPolarHBondContact O-CG 3.45Å; A84-Q88 PolarHBondContact O-N 3.47Å
85	A	88	Confident	86.6	Confident	2 Å²	2	62.8 Å²	62.8	2%	0.017	35%	0.345	C	S	.	.	H	α-helix	trans	-56.1	-46.7	172.9	0	0	0	0	0	111.9	T81 L82 N87 Q88 T92 V94 V112	T81-A85 VanDerWaalsContact O-CB 3.31Å; T81-A85 WeakPolarHBondContact O-CB 3.28Å; T81-A85 PolarHBondContact O-N 3.46Å; L82-A85 WeakPolarHBondContact O-CB 3.3Å; L82-A85 PolarHBondContact O-N 2.78Å; A85-N87 PolarHBondContact O-N 3.42Å; A85-Q88 PolarHBondContact O-N 3.11Å; A85-T92 WeakPolarHBondContact CB-OG1 3.42Å; A85-V94 HydrophobicContact CB-CG2 4.13Å; A85-V112 HydrophobicContact CB-CB 4.23Å; A85-V112 HydrophobicContact CB-CG1 4.42Å; A85-V112 HydrophobicContact CB-CG2 4.07Å
86	L	87.7	Confident	86.5	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-8.9	176.3	-67.6	167.1	0	0	0	114.1	R39 A65 L82 L83 A84 V112 Y125 L127	R39-L86 PolarHBondContact NE-O 2.95Å; R39-L86 PolarHBondContact NH1-O 2.9Å; R39-L86 VanDerWaalsContact NH1-O 3.08Å; R39-L86 PolarHBondContact NH2-O 2.92Å; R39-L86 VanDerWaalsContact NH2-O 3.16Å; A65-L86 HydrophobicContact CB-CD1 4.16Å; L82-L86 HydrophobicContact CD1-CD1 4.46Å; L82-L86 HydrophobicContact CG-CD1 4.23Å; L82-L86 WeakPolarHBondContact O-CB 3.23Å; L82-L86 VanDerWaalsContact O-CG 3.32Å; L82-L86 WeakPolarHBondContact O-CG 3.37Å; L82-L86 PolarHBondContact O-N 2.85Å; L83-L86 PolarHBondContact O-N 3.11Å; A84-L86 PolarHBondContact O-N 2.92Å; L86-V112 HydrophobicContact CD2-CG1 3.92Å; L86-V112 HydrophobicContact CG-CG1 4.49Å; L86-Y125 HydrophobicContact CD2-CD1 4.17Å; L86-Y125 HydrophobicContact CD2-CD2 3.94Å; L86-Y125 HydrophobicContact CD2-CE1 4.5Å; L86-Y125 HydrophobicContact CD2-CE2 4.28Å; L86-Y125 HydrophobicContact CD2-CG 3.9Å; L86-Y125 WeakPolarHBondContact O-CE2 3.34Å; L86-Y125 PolarHBondContact O-OH 2.91Å; L86-L127 HydrophobicContact CD2-CD1 4.33Å
87	N	84.9	Confident	86.6	Confident	102 Å²	102	57.8 Å²	57.8	55%	0.545	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-23.3	169.4	-71	-26.1	0	0	0	112.5	R39 L83 A84 A85	R39-N87 VanDerWaalsContact CZ-OD1 3.24Å; R39-N87 PolarHBondContact NH1-OD1 2.79Å; R39-N87 PolarHBondContact NH2-OD1 2.94Å; L83-N87 VanDerWaalsContact O-CG 3.22Å; L83-N87 PolarHBondContact O-N 2.96Å; L83-N87 VanDerWaalsContact O-N 3.1Å; L83-N87 PolarHBondContact O-ND2 3Å; A84-N87 CarbonylContact O-C 3.54Å; A84-N87 PolarHBondContact O-N 3.48Å; A85-N87 PolarHBondContact O-N 3.42Å
88	Q	77.2	Confident	86.6	Confident	90 Å²	90	52 Å²	52	42%	0.421	27%	0.274	S	S	.	.	S	Bend	trans	-80.5	158.3	177.3	-74.2	173.2	51.7	0	0	111.1	A84 A85 Y125	A84-Q88 WeakPolarHBondContact O-CB 3.17Å; A84-Q88 VanDerWaalsContact O-CG 3.28Å; A84-Q88 WeakPolarHBondContact O-CG 3.45Å; A84-Q88 PolarHBondContact O-N 3.47Å; A85-Q88 PolarHBondContact O-N 3.11Å; Q88-Y125 PolarHBondContact O-OH 2.84Å
89	T	71.8	Confident	86.6	Confident	63 Å²	63	53.1 Å²	53.1	39%	0.387	28%	0.278	S	S	.	.	S	Bend	trans	-114.4	20.8	-179.7	69.1	0	0	0	0	112.6	P114 R116	T89-P114 VanDerWaalsContact C-CG 3.49Å; T89-P114 WeakPolarHBondContact O-CG 3.04Å; T89-R116 PolarHBondContact O-NH2 2.95Å; T89-R116 PolarHBondContact OG1-NH2 3.5Å
90	N	76.8	Confident	86.5	Confident	106 Å²	106	50.5 Å²	50.5	57%	0.567	27%	0.265	S	S	*	.	S	Bend	trans	-112.7	156.1	173.5	-64.1	-13.1	0	0	0	109.4
91	E	80.2	Confident	86.4	Confident	58 Å²	58	49.3 Å²	49.3	27%	0.271	25%	0.254	S	S	.	.			trans	-70.9	133.9	172.7	-171.5	162.3	-171.7	0	0	110.7	V111 V112 T113 T339	E91-V111 HydrophobicContact CG-CG1 3.92Å; E91-V111 VanDerWaalsContact OE1-CG1 3.29Å; E91-V111 WeakPolarHBondContact OE1-CG1 3.42Å; E91-V112 WeakPolarHBondContact CA-O 3.24Å; E91-T113 HydrophobicContact CG-CG2 4.27Å; E91-T113 PolarHBondContact OE1-OG1 3.45Å; E91-T339 HydrophobicContact CB-CG2 4.39Å; E91-T339 VanDerWaalsContact CD-CG2 3.42Å; E91-T339 HydrophobicContact CG-CG2 3.96Å; E91-T339 VanDerWaalsContact OE2-CG2 3.31Å; E91-T339 WeakPolarHBondContact OE2-CG2 3.3Å
92	T	85	Confident	86.2	Confident	30 Å²	30	50.8 Å²	50.8	18%	0.184	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	136.7	-172.3	42.3	0	0	0	0	111.2	A85 V112	A85-T92 WeakPolarHBondContact CB-OG1 3.42Å; T92-V112 PolarHBondContact N-O 2.9Å; T92-V112 VanDerWaalsContact N-O 3.11Å; T92-V112 PolarHBondContact O-N 2.83Å
93	E	86.6	Confident	85.7	Confident	113 Å²	113	57 Å²	57	53%	0.528	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.4	172.7	-59.3	-165.7	172	0	0	110.3	R109 I110 V111	E93-R109 WeakPolarHBondContact OE2-CD 3.37Å; E93-R109 IonicContact OE2-CZ 3.58Å; E93-R109 IonicContact OE2-NE 3.55Å; E93-R109 IonicContact OE2-NH1 2.67Å; E93-R109 PolarHBondContact OE2-NH1 3.41Å; E93-I110 CarbonylContact C-O 3.56Å; E93-I110 WeakPolarHBondContact CA-O 3.46Å; E93-V111 HydrophobicContact CG-CG1 4.43Å; E93-V111 HydrophobicContact CG-CG2 4.2Å
94	V	88.5	Confident	85.6	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.018	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127	177.2	-170.5	0	0	0	0	109	T81 L82 A85 I110	T81-V94 HydrophobicContact CG2-CG1 4.06Å; T81-V94 HydrophobicContact CG2-CG2 4Å; L82-V94 HydrophobicContact CB-CG1 4.36Å; L82-V94 HydrophobicContact CD1-CG2 4.45Å; A85-V94 HydrophobicContact CB-CG2 4.13Å; V94-I110 PolarHBondContact N-O 2.91Å; V94-I110 PolarHBondContact O-N 2.61Å
95	L	90.1	Very high	85.5	Confident	101 Å²	101	56.7 Å²	56.7	53%	0.529	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	123	170.3	-68	170.3	0	0	0	108.6	S78 F108 R109	S78-L95 VanDerWaalsContact CB-O 3.24Å; S78-L95 WeakPolarHBondContact CB-O 3.34Å; L95-F108 WeakPolarHBondContact CA-O 3.49Å; L95-R109 HydrophobicContact CD2-CB 3.83Å; L95-R109 HydrophobicContact CD2-CG 4.12Å
96	M	89.3	Confident	85.5	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	135.7	-174	-176.9	175.5	-81.6	0	0	111.8	Y70 T74 S78 M79 L82 L98 F108 I110	Y70-M96 HydrophobicContact CE1-CE 4.14Å; Y70-M96 HydrophobicContact CE1-SD 3.87Å; T74-M96 HydrophobicContact CG2-CG 4.15Å; S78-M96 WeakPolarHBondContact O-CE 3.08Å; M79-M96 HydrophobicContact CG-CE 4.26Å; L82-M96 HydrophobicContact CB-CE 3.73Å; L82-M96 HydrophobicContact CD2-CE 3.72Å; L82-M96 HydrophobicContact CD2-SD 3.95Å; L82-M96 HydrophobicContact CG-CE 4.35Å; M96-L98 HydrophobicContact CG-CD2 3.69Å; M96-L98 HydrophobicContact CG-CG 4.08Å; M96-L98 HydrophobicContact SD-CD2 3.49Å; M96-L98 WeakPolarHBondContact SD-CD2 3.29Å; M96-L98 HydrophobicContact SD-CG 4.25Å; M96-F108 PolarHBondContact N-O 3.09Å; M96-F108 PolarHBondContact O-N 3.14Å; M96-I110 HydrophobicContact CB-CD1 3.95Å; M96-I110 HydrophobicContact SD-CD1 4.15Å
97	N	89.9	Confident	85.6	Confident	39 Å²	39	59.5 Å²	59.5	21%	0.209	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	117	175.8	-53.6	-15.7	0	0	0	108.2	E73 T74 V105 Y107	E73-N97 HydrophobicContact CB-CB 4.28Å; E73-N97 WeakPolarHBondContact O-CB 3.43Å; E73-N97 PolarHBondContact O-ND2 2.85Å; T74-N97 WeakPolarHBondContact CB-O 3.14Å; T74-N97 PolarHBondContact OG1-O 3.49Å; N97-V105 HydrophobicContact CB-CG1 4.11Å; N97-Y107 HydrophobicContact CB-CD1 4.45Å; N97-Y107 HydrophobicContact CB-CE1 4.45Å; N97-Y107 WeakPolarHBondContact OD1-CD1 3.39Å
98	L	90.5	Very high	85.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	149.1	-177.9	-65.4	-176	0	0	0	111.5	L66 F69 Y70 M96 I106 F108 I110 F129	L66-L98 HydrophobicContact CD1-CD1 3.94Å; F69-L98 HydrophobicContact CB-CB 4.1Å; F69-L98 HydrophobicContact CB-CD1 4.34Å; F69-L98 HydrophobicContact CB-CD2 3.86Å; F69-L98 HydrophobicContact CB-CG 4.33Å; Y70-L98 HydrophobicContact CD1-CD2 4.18Å; Y70-L98 HydrophobicContact CE1-CD2 4.44Å; M96-L98 HydrophobicContact CG-CD2 3.69Å; M96-L98 HydrophobicContact CG-CG 4.08Å; M96-L98 HydrophobicContact SD-CD2 3.49Å; M96-L98 WeakPolarHBondContact SD-CD2 3.29Å; M96-L98 HydrophobicContact SD-CG 4.25Å; L98-I106 PolarHBondContact N-O 2.86Å; L98-I106 PolarHBondContact O-N 3.01Å; L98-F108 HydrophobicContact CB-CD2 3.87Å; L98-F108 HydrophobicContact CB-CE2 4.06Å; L98-F108 HydrophobicContact CD1-CD2 3.9Å; L98-F108 HydrophobicContact CD1-CE2 4.29Å; L98-F108 HydrophobicContact CG-CD2 4.07Å; L98-I110 HydrophobicContact CD1-CD1 4.08Å; L98-F129 HydrophobicContact CD1-CE1 4.07Å
99	Y	90.8	Very high	86.4	Confident	28 Å²	28	53.1 Å²	53.1	11%	0.11	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	123.5	178	-73.8	-101.5	0	0	0	110.7	F69 G71 P72 E73 N103 V105	F69-Y99 PolarHBondContact O-N 2.96Å; G71-Y99 VanDerWaalsContact CA-CD2 3.48Å; P72-Y99 WeakPolarHBondContact CD-OH 3.4Å; E73-Y99 HydrophobicContact CB-CE2 4.36Å; E73-Y99 WeakPolarHBondContact CB-OH 3.33Å; E73-Y99 PolarHBondContact N-OH 3.15Å; Y99-N103 WeakPolarHBondContact CD1-O 3.21Å; Y99-V105 HydrophobicContact CD1-CG2 4.14Å; Y99-V105 HydrophobicContact CE1-CG2 3.48Å; Y99-V105 VanDerWaalsContact CE1-CG2 3.48Å; Y99-V105 HydrophobicContact CE2-CG2 4.1Å; Y99-V105 VanDerWaalsContact CZ-CG2 3.45Å
100	S	88.5	Confident	87.2	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.014	25%	0.251	C	S	.	.			trans	-63.8	159.3	162.5	-171.9	0	0	0	0	110	L52 D102 N103 C104	L52-S100 PolarHBondContact O-OG 2.96Å; L52-S100 VanDerWaalsContact O-OG 3.09Å; S100-D102 PolarHBondContact O-N 3.49Å; S100-N103 WeakPolarHBondContact O-CA 3.44Å; S100-N103 PolarHBondContact O-N 3.05Å; S100-C104 WeakPolarHBondContact CB-O 3.34Å; S100-C104 PolarHBondContact N-O 2.85Å
101	R	87.6	Confident	87.8	Confident	122 Å²	122	46.3 Å²	46.3	46%	0.46	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-27.6	-179.3	-172	179.5	172.1	178.3	-3.1	114.2	L52 R53 Y54 N103	L52-R101 PolarHBondContact O-N 2.92Å; R53-R101 HydrophobicContact CB-CB 3.97Å; R53-R101 WeakPolarHBondContact O-CD 3.24Å; Y54-R101 HydrophobicContact CD2-CB 3.88Å; Y54-R101 HydrophobicContact CE2-CB 3.6Å; Y54-R101 HydrophobicContact CE2-CG 4.33Å; R101-N103 PolarHBondContact O-N 3.49Å
102	D	85.5	Confident	88.1	Confident	90 Å²	90	43.6 Å²	43.6	48%	0.481	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	16.2	178.1	-61.7	-20.7	0	0	0	112.6	R53 S100 C104	R53-D102 WeakPolarHBondContact CD-OD2 3.39Å; R53-D102 IonicContact CZ-OD2 3.76Å; R53-D102 IonicContact NE-OD2 2.69Å; R53-D102 IonicContact NH1-OD2 3.13Å; R53-D102 PolarHBondContact NH1-OD2 2.82Å; S100-D102 PolarHBondContact O-N 3.49Å; D102-C104 PolarHBondContact O-N 3.17Å
103	N	82.2	Confident	88	Confident	129 Å²	129	42.4 Å²	42.4	69%	0.69	21%	0.211	S	C	*	.	S	Bend	trans	61.8	17	-176	-59.5	-37.2	0	0	0	115.8	Y99 S100 R101	Y99-N103 WeakPolarHBondContact CD1-O 3.21Å; S100-N103 WeakPolarHBondContact O-CA 3.44Å; S100-N103 PolarHBondContact O-N 3.05Å; R101-N103 PolarHBondContact O-N 3.49Å
104	C	86.9	Confident	87.9	Confident	72 Å²	72	37.8 Å²	37.8	49%	0.486	19%	0.191	S	C	.	.			trans	-72.6	130.7	168.8	-58.2	0	0	0	0	110.5	S100 D102	S100-C104 WeakPolarHBondContact CB-O 3.34Å; S100-C104 PolarHBondContact N-O 2.85Å; D102-C104 PolarHBondContact O-N 3.17Å
105	V	87.5	Confident	87.2	Confident	37 Å²	37	38.7 Å²	38.7	22%	0.224	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	132.1	170.5	-176.2	0	0	0	0	109.6	E73 N97 Y99 Y107	E73-V105 HydrophobicContact CB-CG1 4.39Å; E73-V105 HydrophobicContact CB-CG2 4.35Å; E73-V105 HydrophobicContact CG-CG2 4.42Å; N97-V105 HydrophobicContact CB-CG1 4.11Å; Y99-V105 HydrophobicContact CD1-CG2 4.14Å; Y99-V105 HydrophobicContact CE1-CG2 3.48Å; Y99-V105 VanDerWaalsContact CE1-CG2 3.48Å; Y99-V105 HydrophobicContact CE2-CG2 4.1Å; Y99-V105 VanDerWaalsContact CZ-CG2 3.45Å; V105-Y107 HydrophobicContact CG1-CE1 3.94Å; V105-Y107 HydrophobicContact CG1-CE2 4.07Å
106	I	88	Confident	86.2	Confident	14 Å²	14	39.4 Å²	39.4	7%	0.072	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128.6	172.1	-54.1	175.9	0	0	0	107.7	L51 L52 L98 F108 E131	L51-I106 HydrophobicContact CD1-CD1 4.11Å; L51-I106 HydrophobicContact CG-CD1 4.19Å; L52-I106 HydrophobicContact CD2-CD1 4.45Å; L98-I106 PolarHBondContact N-O 2.86Å; L98-I106 PolarHBondContact O-N 3.01Å; I106-F108 HydrophobicContact CB-CD2 4.17Å; I106-F108 HydrophobicContact CB-CE2 3.59Å; I106-F108 HydrophobicContact CB-CZ 4.09Å; I106-F108 HydrophobicContact CD1-CZ 4.47Å; I106-F108 HydrophobicContact CG2-CD2 3.95Å; I106-F108 HydrophobicContact CG2-CE1 4.07Å; I106-F108 HydrophobicContact CG2-CE2 3.43Å; I106-F108 VanDerWaalsContact CG2-CE2 3.43Å; I106-F108 HydrophobicContact CG2-CG 4.49Å; I106-F108 HydrophobicContact CG2-CZ 3.5Å; I106-F108 VanDerWaalsContact CG2-CZ 3.5Å; I106-E131 HydrophobicContact CG2-CG 3.97Å
107	Y	90	Very high	84.9	Confident	49 Å²	49	42.2 Å²	42.2	19%	0.192	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	109	-177	-59.8	-83.5	0	0	0	108.8	E73 N97 V105 E131 E132 N134	E73-Y107 PolarHBondContact OE2-OH 3.41Å; N97-Y107 HydrophobicContact CB-CD1 4.45Å; N97-Y107 HydrophobicContact CB-CE1 4.45Å; N97-Y107 WeakPolarHBondContact OD1-CD1 3.39Å; V105-Y107 HydrophobicContact CG1-CE1 3.94Å; V105-Y107 HydrophobicContact CG1-CE2 4.07Å; Y107-E131 CarbonylContact O-C 3.4Å; Y107-E131 WeakPolarHBondContact O-CA 3.39Å; Y107-E132 PolarHBondContact O-N 3.18Å; Y107-N134 HydrophobicContact CD2-CB 4.07Å; Y107-N134 WeakPolarHBondContact CE1-ND2 3.28Å; Y107-N134 HydrophobicContact CE2-CB 4.26Å; Y107-N134 WeakPolarHBondContact CE2-ND2 3.34Å
108	F	89.6	Confident	82.9	Confident	3 Å²	3	43.3 Å²	43.3	1%	0.013	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	135.5	-176.7	-73.3	-77.7	0	0	0	113	L51 L52 L95 M96 L98 I106 I110 F129 R130	L51-F108 HydrophobicContact CD2-CE1 3.63Å; L51-F108 HydrophobicContact CD2-CZ 3.7Å; L51-F108 HydrophobicContact CG-CZ 4.19Å; L52-F108 HydrophobicContact CD2-CE2 3.64Å; L52-F108 HydrophobicContact CD2-CZ 3.7Å; L95-F108 WeakPolarHBondContact CA-O 3.49Å; M96-F108 PolarHBondContact N-O 3.09Å; M96-F108 PolarHBondContact O-N 3.14Å; L98-F108 HydrophobicContact CB-CD2 3.87Å; L98-F108 HydrophobicContact CB-CE2 4.06Å; L98-F108 HydrophobicContact CD1-CD2 3.9Å; L98-F108 HydrophobicContact CD1-CE2 4.29Å; L98-F108 HydrophobicContact CG-CD2 4.07Å; I106-F108 HydrophobicContact CB-CD2 4.17Å; I106-F108 HydrophobicContact CB-CE2 3.59Å; I106-F108 HydrophobicContact CB-CZ 4.09Å; I106-F108 HydrophobicContact CD1-CZ 4.47Å; I106-F108 HydrophobicContact CG2-CD2 3.95Å; I106-F108 HydrophobicContact CG2-CE1 4.07Å; I106-F108 HydrophobicContact CG2-CE2 3.43Å; I106-F108 VanDerWaalsContact CG2-CE2 3.43Å; I106-F108 HydrophobicContact CG2-CG 4.49Å; I106-F108 HydrophobicContact CG2-CZ 3.5Å; I106-F108 VanDerWaalsContact CG2-CZ 3.5Å; F108-I110 HydrophobicContact CB-CD1 4.38Å; F108-I110 HydrophobicContact CB-CG1 3.81Å; F108-F129 HydrophobicContact CD1-CB 3.87Å; F108-F129 AromaticContact CD1-CD1 3.99Å; F108-F129 HydrophobicContact CD1-CD1 3.99Å; F108-F129 HydrophobicContact CD1-CG 4.45Å; F108-F129 HydrophobicContact CE1-CB 3.93Å; F108-F129 HydrophobicContact CE1-CD1 4.24Å; F108-F129 HydrophobicContact CG-CD1 4.19Å; F108-R130 CarbonylContact C-O 3.59Å; F108-R130 WeakPolarHBondContact CA-O 3.14Å
109	R	88.7	Confident	81.6	Confident	55 Å²	55	48.5 Å²	48.5	21%	0.208	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	113.4	150.4	-175	-177.2	-63.4	-94.9	-10.9	107.7	E93 L95 R130 E132	E93-R109 WeakPolarHBondContact OE2-CD 3.37Å; E93-R109 IonicContact OE2-CZ 3.58Å; E93-R109 IonicContact OE2-NE 3.55Å; E93-R109 IonicContact OE2-NH1 2.67Å; E93-R109 PolarHBondContact OE2-NH1 3.41Å; L95-R109 HydrophobicContact CD2-CB 3.83Å; L95-R109 HydrophobicContact CD2-CG 4.12Å; R109-R130 PolarHBondContact N-O 3.31Å; R109-R130 PolarHBondContact O-N 3.09Å; R109-E132 HydrophobicContact CB-CG 4.38Å; R109-E132 IonicContact CZ-OE1 3.74Å; R109-E132 IonicContact NE-OE1 2.79Å; R109-E132 PolarHBondContact NE-OE1 3.49Å; R109-E132 IonicContact NH2-OE1 2.8Å; R109-E132 PolarHBondContact NH2-OE1 2.73Å; R109-E132 IonicContact NH2-OE2 3.68Å
110	I	89.7	Confident	80.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	122	179.9	-51.4	178.3	0	0	0	107.8	L66 E93 V94 M96 L98 F108 V112 L127 F128 F129	L66-I110 HydrophobicContact CD1-CD1 3.61Å; E93-I110 CarbonylContact C-O 3.56Å; E93-I110 WeakPolarHBondContact CA-O 3.46Å; V94-I110 PolarHBondContact N-O 2.91Å; V94-I110 PolarHBondContact O-N 2.61Å; M96-I110 HydrophobicContact CB-CD1 3.95Å; M96-I110 HydrophobicContact SD-CD1 4.15Å; L98-I110 HydrophobicContact CD1-CD1 4.08Å; F108-I110 HydrophobicContact CB-CD1 4.38Å; F108-I110 HydrophobicContact CB-CG1 3.81Å; I110-V112 HydrophobicContact CG2-CG2 4.35Å; I110-L127 HydrophobicContact CG2-CB 4.38Å; I110-L127 HydrophobicContact CG2-CD2 4.25Å; I110-F128 CarbonylContact C-O 3.6Å; I110-F128 WeakPolarHBondContact CA-O 3.23Å; I110-F129 HydrophobicContact CD1-CD1 4.26Å; I110-F129 HydrophobicContact CD1-CE1 3.83Å; I110-F129 HydrophobicContact CG1-CD1 4.01Å; I110-F129 HydrophobicContact CG1-CE1 4.03Å; I110-F129 HydrophobicContact CG2-CE1 4.29Å; I110-F129 HydrophobicContact CG2-CZ 4.35Å
111	V	87.9	Confident	79.5	Confident	25 Å²	25	50.3 Å²	50.3	15%	0.152	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	118.1	174.7	-168.5	0	0	0	0	108.4	E91 E93 L127 F128	E91-V111 HydrophobicContact CG-CG1 3.92Å; E91-V111 VanDerWaalsContact OE1-CG1 3.29Å; E91-V111 WeakPolarHBondContact OE1-CG1 3.42Å; E93-V111 HydrophobicContact CG-CG1 4.43Å; E93-V111 HydrophobicContact CG-CG2 4.2Å; V111-L127 WeakPolarHBondContact O-CA 3.27Å; V111-F128 HydrophobicContact CB-CB 4.32Å; V111-F128 PolarHBondContact N-O 3.35Å; V111-F128 PolarHBondContact O-N 3.08Å
112	V	87.3	Confident	78.9	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	107.1	180	-173.9	0	0	0	0	108.6	L82 A85 L86 E91 T92 I110 P114 Y125 L127	L82-V112 HydrophobicContact CD1-CG2 3.78Å; A85-V112 HydrophobicContact CB-CB 4.23Å; A85-V112 HydrophobicContact CB-CG1 4.42Å; A85-V112 HydrophobicContact CB-CG2 4.07Å; L86-V112 HydrophobicContact CD2-CG1 3.92Å; L86-V112 HydrophobicContact CG-CG1 4.49Å; E91-V112 WeakPolarHBondContact CA-O 3.24Å; T92-V112 PolarHBondContact N-O 2.9Å; T92-V112 VanDerWaalsContact N-O 3.11Å; T92-V112 PolarHBondContact O-N 2.83Å; I110-V112 HydrophobicContact CG2-CG2 4.35Å; V112-P114 WeakPolarHBondContact O-CD 3.4Å; V112-Y125 HydrophobicContact CG1-CD1 4.04Å; V112-L127 HydrophobicContact CG1-CG 4.48Å; V112-L127 HydrophobicContact CG2-CD2 4.36Å; V112-L127 HydrophobicContact CG2-CG 4.27Å
113	T	84	Confident	78.3	Confident	5 Å²	5	43 Å²	43	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	107.3	-176.6	-43.2	0	0	0	0	109.9	E91 L126 F342	E91-T113 HydrophobicContact CG-CG2 4.27Å; E91-T113 PolarHBondContact OE1-OG1 3.45Å; T113-L126 PolarHBondContact N-O 2.59Å; T113-L126 PolarHBondContact O-N 3.45Å; T113-F342 HydrophobicContact CG2-CD1 4.41Å
114	P	83	Confident	78.3	Confident	16 Å²	16	37.1 Å²	37.1	10%	0.104	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	125.1	175.1	22.2	-26.8	0	0	0	111.9	T89 V112 L122 Y125	T89-P114 VanDerWaalsContact C-CG 3.49Å; T89-P114 WeakPolarHBondContact O-CG 3.04Å; V112-P114 WeakPolarHBondContact O-CD 3.4Å; P114-L122 HydrophobicContact CB-CD1 3.53Å; P114-L122 HydrophobicContact CB-CD2 4.24Å; P114-Y125 HydrophobicContact CB-CD1 4.12Å; P114-Y125 HydrophobicContact CB-CE1 3.84Å
115	V	74	Confident	78.2	Confident	22 Å²	22	34 Å²	34	13%	0.133	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	117.5	177.8	179.6	0	0	0	0	109.9	L122 P123 L124 L126	V115-L122 VanDerWaalsContact O-CD1 3.3Å; V115-L122 WeakPolarHBondContact O-CD1 3.23Å; V115-P123 VanDerWaalsContact O-CD 3.23Å; V115-P123 WeakPolarHBondContact O-CD 3.3Å; V115-L124 HydrophobicContact CB-CB 4.18Å; V115-L124 PolarHBondContact N-O 2.86Å; V115-L126 HydrophobicContact CG2-CD1 3.51Å; V115-L126 HydrophobicContact CG2-CG 3.65Å
116	R	69.1	Low	78.2	Confident	116 Å²	116	32.3 Å²	32.3	44%	0.438	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-93.9	159.5	-178.8	-60.9	178.8	-172	-99.9	8.9	112.7	T89 G121 L122	T89-R116 PolarHBondContact O-NH2 2.95Å; T89-R116 PolarHBondContact OG1-NH2 3.5Å; R116-G121 CarbonylContact C-O 3.57Å; R116-G121 WeakPolarHBondContact CA-O 3.39Å; R116-G121 WeakPolarHBondContact CB-O 3.36Å; R116-L122 HydrophobicContact CG-CD1 3.89Å
117	D	61.7	Low	78.2	Confident	61 Å²	61	31.6 Å²	31.6	33%	0.326	17%	0.174	S	C	.	.			trans	-100.5	175	169.3	64	49.1	0	0	0	112.9	T119 G120 G121 P123	D117-T119 PolarHBondContact O-N 3.27Å; D117-T119 VanDerWaalsContact O-N 3.08Å; D117-T119 VanDerWaalsContact OD1-CA 3.27Å; D117-T119 WeakPolarHBondContact OD1-CA 3.42Å; D117-T119 WeakPolarHBondContact OD1-CB 3.19Å; D117-T119 PolarHBondContact OD1-N 3.22Å; D117-T119 PolarHBondContact OD1-OG1 2.92Å; D117-G120 PolarHBondContact O-N 2.93Å; D117-G120 PolarHBondContact OD1-N 2.78Å; D117-G121 PolarHBondContact N-O 3.25Å; D117-G121 PolarHBondContact OD1-N 3.44Å; D117-P123 HydrophobicContact CB-CG 4.18Å
118	E	48.5	Very low	78.1	Confident	63 Å²	63	30.2 Å²	30.2	29%	0.294	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-18.8	178.2	-64.3	-173.2	151.3	0	0	114.2	G120 H353 V354 E355 H356	E118-G120 VanDerWaalsContact C-N 3.35Å; E118-H353 HydrophobicContact CG-CB 4.14Å; E118-H353 VanDerWaalsContact OE1-C 3.31Å; E118-H353 WeakPolarHBondContact OE1-CA 3.4Å; E118-V354 PolarHBondContact OE1-N 3.12Å; E118-E355 PolarHBondContact OE1-N 3.31Å; E118-E355 PolarHBondContact OE2-N 3.48Å; E118-H356 HydrophobicContact CG-CB 4.41Å; E118-H356 IonicContact OE1-CD2 2.71Å; E118-H356 PolarHBondContact OE1-CD2 3.48Å; E118-H356 IonicContact OE1-CG 3.82Å; E118-H356 PolarHBondContact OE1-N 3.35Å; E118-H356 VanDerWaalsContact OE1-N 3.08Å; E118-H356 WeakPolarHBondContact OE2-CB 3.29Å; E118-H356 PolarHBondContact OE2-N 2.91Å
119	T	62.5	Low	78.1	Confident	109 Å²	109	30.5 Å²	30.5	67%	0.669	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	5.2	177.2	68.8	0	0	0	0	112.9	D117 G121	D117-T119 PolarHBondContact O-N 3.27Å; D117-T119 VanDerWaalsContact O-N 3.08Å; D117-T119 VanDerWaalsContact OD1-CA 3.27Å; D117-T119 WeakPolarHBondContact OD1-CA 3.42Å; D117-T119 WeakPolarHBondContact OD1-CB 3.19Å; D117-T119 PolarHBondContact OD1-N 3.22Å; D117-T119 PolarHBondContact OD1-OG1 2.92Å; T119-G121 PolarHBondContact O-N 3.31Å
120	G	64.8	Low	78	Confident	42 Å²	42	36.6 Å²	36.6	43%	0.433	19%	0.193	S	C	.	.	S	Bend	trans	74.5	-0.9	-173.1	0	0	0	0	0	113.8	D117 E118	D117-G120 PolarHBondContact O-N 2.93Å; D117-G120 PolarHBondContact OD1-N 2.78Å; E118-G120 VanDerWaalsContact C-N 3.35Å
121	G	70.3	Confident	77.7	Confident	25 Å²	25	41.7 Å²	41.7	26%	0.258	22%	0.217	S	C	.	.			trans	-65.2	161.7	173.5	0	0	0	0	0	111.4	R116 D117 T119 P123	R116-G121 CarbonylContact C-O 3.57Å; R116-G121 WeakPolarHBondContact CA-O 3.39Å; R116-G121 WeakPolarHBondContact CB-O 3.36Å; D117-G121 PolarHBondContact N-O 3.25Å; D117-G121 PolarHBondContact OD1-N 3.44Å; T119-G121 PolarHBondContact O-N 3.31Å; G121-P123 VanDerWaalsContact O-CD 3.28Å; G121-P123 WeakPolarHBondContact O-CD 3.5Å
122	L	74.9	Confident	77.3	Confident	37 Å²	37	44.1 Å²	44.1	19%	0.194	23%	0.227	C	C	.	.			trans	-115.7	90.7	-176.1	-165	75.3	0	0	0	110.5	A34 P114 V115 R116 Y125	A34-L122 HydrophobicContact CB-CD2 4.03Å; A34-L122 HydrophobicContact CB-CG 3.99Å; A34-L122 WeakPolarHBondContact CB-O 3.43Å; P114-L122 HydrophobicContact CB-CD1 3.53Å; P114-L122 HydrophobicContact CB-CD2 4.24Å; V115-L122 VanDerWaalsContact O-CD1 3.3Å; V115-L122 WeakPolarHBondContact O-CD1 3.23Å; R116-L122 HydrophobicContact CG-CD1 3.89Å; L122-Y125 HydrophobicContact CD2-CE1 3.81Å; L122-Y125 HydrophobicContact CD2-CE2 3.96Å; L122-Y125 VanDerWaalsContact CD2-CZ 3.41Å; L122-Y125 VanDerWaalsContact CD2-OH 3.27Å; L122-Y125 WeakPolarHBondContact CD2-OH 3.41Å
123	P	73.3	Confident	76.4	Confident	23 Å²	23	49.8 Å²	49.8	15%	0.149	26%	0.261	C	S	.	.			trans	-73.6	-36.5	177.2	27.7	-37.1	0	0	0	113.6	N33 A34 V115 D117 G121	N33-P123 PolarHBondContact OD1-O 2.98Å; A34-P123 PolarHBondContact N-O 3.41Å; V115-P123 VanDerWaalsContact O-CD 3.23Å; V115-P123 WeakPolarHBondContact O-CD 3.3Å; D117-P123 HydrophobicContact CB-CG 4.18Å; G121-P123 VanDerWaalsContact O-CD 3.28Å; G121-P123 WeakPolarHBondContact O-CD 3.5Å
124	L	83.3	Confident	75.1	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.026	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151	-167.8	-61.2	174.9	0	0	0	113.4	Y14 I15 V31 A32 I42 V115	Y14-L124 HydrophobicContact CE2-CD1 4.11Å; I15-L124 HydrophobicContact CG1-CD1 4.49Å; V31-L124 HydrophobicContact CG1-CD1 4.18Å; V31-L124 HydrophobicContact CG1-CD2 4.17Å; A32-L124 WeakPolarHBondContact O-CA 3.38Å; I42-L124 HydrophobicContact CD1-CD2 3.56Å; V115-L124 HydrophobicContact CB-CB 4.18Å; V115-L124 PolarHBondContact N-O 2.86Å
125	Y	85	Confident	73	Confident	6 Å²	6	57.6 Å²	57.6	2%	0.024	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	139.6	160.3	-75.5	-72	0	0	0	110	V31 A32 A34 L86 Q88 V112 P114 L122	V31-Y125 WeakPolarHBondContact CA-O 3.48Å; A32-Y125 PolarHBondContact N-O 2.96Å; A32-Y125 PolarHBondContact O-N 3.24Å; A34-Y125 HydrophobicContact CB-CD2 3.5Å; A34-Y125 HydrophobicContact CB-CE2 3.55Å; A34-Y125 HydrophobicContact CB-CG 4.37Å; L86-Y125 HydrophobicContact CD2-CD1 4.17Å; L86-Y125 HydrophobicContact CD2-CD2 3.94Å; L86-Y125 HydrophobicContact CD2-CE1 4.5Å; L86-Y125 HydrophobicContact CD2-CE2 4.28Å; L86-Y125 HydrophobicContact CD2-CG 3.9Å; L86-Y125 WeakPolarHBondContact O-CE2 3.34Å; L86-Y125 PolarHBondContact O-OH 2.91Å; Q88-Y125 PolarHBondContact O-OH 2.84Å; V112-Y125 HydrophobicContact CG1-CD1 4.04Å; P114-Y125 HydrophobicContact CB-CD1 4.12Å; P114-Y125 HydrophobicContact CB-CE1 3.84Å; L122-Y125 HydrophobicContact CD2-CE1 3.81Å; L122-Y125 HydrophobicContact CD2-CE2 3.96Å; L122-Y125 VanDerWaalsContact CD2-CZ 3.41Å; L122-Y125 VanDerWaalsContact CD2-OH 3.27Å; L122-Y125 WeakPolarHBondContact CD2-OH 3.41Å
126	L	85.9	Confident	71.5	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.9	164.3	-60	171.8	0	0	0	108.7	L18 F22 I30 V31 T113 V115 F128 F342	L18-L126 HydrophobicContact CD2-CD2 4.25Å; F22-L126 HydrophobicContact CE2-CD1 3.58Å; F22-L126 HydrophobicContact CE2-CD2 4.3Å; F22-L126 HydrophobicContact CZ-CD1 4.01Å; I30-L126 WeakPolarHBondContact O-CA 3.29Å; V31-L126 HydrophobicContact CB-CD2 4.25Å; V31-L126 HydrophobicContact CG1-CD2 4.02Å; V31-L126 HydrophobicContact CG2-CD2 3.73Å; T113-L126 PolarHBondContact N-O 2.59Å; T113-L126 PolarHBondContact O-N 3.45Å; V115-L126 HydrophobicContact CG2-CD1 3.51Å; V115-L126 HydrophobicContact CG2-CG 3.65Å; L126-F128 HydrophobicContact CB-CD2 4.48Å; L126-F128 HydrophobicContact CB-CE2 3.72Å; L126-F128 HydrophobicContact CB-CZ 4.07Å; L126-F128 HydrophobicContact CD1-CE2 4.24Å; L126-F128 HydrophobicContact CD1-CZ 4.06Å; L126-F342 HydrophobicContact CD1-CE1 4.24Å; L126-F342 HydrophobicContact CD1-CZ 4.4Å
127	L	88.4	Confident	70.2	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	114.2	173.8	-71.3	83.7	0	0	0	108.4	F29 I30 L82 L86 I110 V111 V112 F129	F29-L127 CarbonylContact C-O 3.6Å; F29-L127 VanDerWaalsContact CA-O 3.23Å; F29-L127 WeakPolarHBondContact CA-O 3.36Å; I30-L127 HydrophobicContact CB-CB 4.31Å; I30-L127 HydrophobicContact CG2-CD1 4.38Å; I30-L127 PolarHBondContact N-O 2.79Å; I30-L127 PolarHBondContact O-N 3.08Å; L82-L127 HydrophobicContact CD1-CD2 4.37Å; L86-L127 HydrophobicContact CD2-CD1 4.33Å; I110-L127 HydrophobicContact CG2-CB 4.38Å; I110-L127 HydrophobicContact CG2-CD2 4.25Å; V111-L127 WeakPolarHBondContact O-CA 3.27Å; V112-L127 HydrophobicContact CG1-CG 4.48Å; V112-L127 HydrophobicContact CG2-CD2 4.36Å; V112-L127 HydrophobicContact CG2-CG 4.27Å; L127-F129 HydrophobicContact CB-CE2 3.79Å; L127-F129 HydrophobicContact CB-CZ 4.27Å; L127-F129 WeakPolarHBondContact O-CD2 3.48Å; L127-F129 WeakPolarHBondContact O-CE2 3.09Å
128	F	88.5	Confident	69	Low	20 Å²	20	62.6 Å²	62.6	9%	0.088	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	135.2	177.5	-61	-82.9	0	0	0	110.3	Y26 F29 I110 V111 L126 F342	Y26-F128 AromaticContact CD1-CD1 3.97Å; Y26-F128 HydrophobicContact CD1-CD1 3.97Å; Y26-F128 HydrophobicContact CD1-CE1 4.18Å; Y26-F128 HydrophobicContact CD2-CE1 4.13Å; Y26-F128 HydrophobicContact CG-CD1 4.06Å; Y26-F128 AromaticContact CG-CE1 3.95Å; Y26-F128 HydrophobicContact CG-CE1 3.95Å; F29-F128 HydrophobicContact CB-CD1 3.65Å; F29-F128 HydrophobicContact CB-CE1 3.91Å; F29-F128 HydrophobicContact CB-CG 4.46Å; F29-F128 HydrophobicContact CG-CD1 4.49Å; F29-F128 HydrophobicContact CG-CE1 4.32Å; I110-F128 CarbonylContact C-O 3.6Å; I110-F128 WeakPolarHBondContact CA-O 3.23Å; V111-F128 HydrophobicContact CB-CB 4.32Å; V111-F128 PolarHBondContact N-O 3.35Å; V111-F128 PolarHBondContact O-N 3.08Å; L126-F128 HydrophobicContact CB-CD2 4.48Å; L126-F128 HydrophobicContact CB-CE2 3.72Å; L126-F128 HydrophobicContact CB-CZ 4.07Å; L126-F128 HydrophobicContact CD1-CE2 4.24Å; L126-F128 HydrophobicContact CD1-CZ 4.06Å; F128-F342 HydrophobicContact CE2-CE2 4.36Å; F128-F342 HydrophobicContact CE2-CZ 4.04Å; F128-F342 HydrophobicContact CZ-CE2 4.13Å; F128-F342 AromaticContact CZ-CZ 3.72Å; F128-F342 HydrophobicContact CZ-CZ 3.72Å
129	F	88.7	Confident	68.2	Low	9 Å²	9	66.3 Å²	66.3	4%	0.039	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	119.8	-173.2	-68.7	-101	0	0	0	110.9	N28 I30 L48 L66 L98 F108 I110 L127	N28-F129 HydrophobicContact CB-CB 4.1Å; N28-F129 WeakPolarHBondContact CB-O 3.23Å; N28-F129 PolarHBondContact O-N 3.18Å; I30-F129 HydrophobicContact CB-CE2 4.15Å; I30-F129 HydrophobicContact CD1-CE2 3.84Å; I30-F129 HydrophobicContact CD1-CZ 3.97Å; I30-F129 HydrophobicContact CG1-CE2 4.17Å; L48-F129 HydrophobicContact CD1-CB 3.77Å; L48-F129 HydrophobicContact CD1-CD1 4.1Å; L48-F129 HydrophobicContact CD1-CD2 3.96Å; L48-F129 HydrophobicContact CD1-CG 3.68Å; L48-F129 HydrophobicContact CD2-CD2 3.66Å; L48-F129 HydrophobicContact CD2-CE2 3.73Å; L48-F129 HydrophobicContact CD2-CG 4.23Å; L48-F129 HydrophobicContact CD2-CZ 4.33Å; L48-F129 HydrophobicContact CG-CD2 4.48Å; L66-F129 HydrophobicContact CD1-CE1 3.64Å; L66-F129 HydrophobicContact CD1-CZ 3.68Å; L66-F129 HydrophobicContact CD2-CZ 3.97Å; L66-F129 HydrophobicContact CG-CZ 4.49Å; L98-F129 HydrophobicContact CD1-CE1 4.07Å; F108-F129 HydrophobicContact CD1-CB 3.87Å; F108-F129 AromaticContact CD1-CD1 3.99Å; F108-F129 HydrophobicContact CD1-CD1 3.99Å; F108-F129 HydrophobicContact CD1-CG 4.45Å; F108-F129 HydrophobicContact CE1-CB 3.93Å; F108-F129 HydrophobicContact CE1-CD1 4.24Å; F108-F129 HydrophobicContact CG-CD1 4.19Å; I110-F129 HydrophobicContact CD1-CD1 4.26Å; I110-F129 HydrophobicContact CD1-CE1 3.83Å; I110-F129 HydrophobicContact CG1-CD1 4.01Å; I110-F129 HydrophobicContact CG1-CE1 4.03Å; I110-F129 HydrophobicContact CG2-CE1 4.29Å; I110-F129 HydrophobicContact CG2-CZ 4.35Å; L127-F129 HydrophobicContact CB-CE2 3.79Å; L127-F129 HydrophobicContact CB-CZ 4.27Å; L127-F129 WeakPolarHBondContact O-CD2 3.48Å; L127-F129 WeakPolarHBondContact O-CE2 3.09Å
130	R	86.5	Confident	66.9	Low	182 Å²	182	65.8 Å²	65.8	69%	0.687	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122	123.4	174.9	-172.9	174.5	-174.3	163.1	2.8	110.2	F108 R109	F108-R130 CarbonylContact C-O 3.59Å; F108-R130 WeakPolarHBondContact CA-O 3.14Å; R109-R130 PolarHBondContact N-O 3.31Å; R109-R130 PolarHBondContact O-N 3.09Å
131	E	84.1	Confident	65.6	Low	107 Å²	107	71 Å²	71	50%	0.5	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	137.8	174.3	-174.5	172.8	-162.7	0	0	110.7	I106 Y107	I106-E131 HydrophobicContact CG2-CG 3.97Å; Y107-E131 CarbonylContact O-C 3.4Å; Y107-E131 WeakPolarHBondContact O-CA 3.39Å
132	E	78.4	Confident	63.9	Low	77 Å²	77	75.5 Å²	75.5	36%	0.36	39%	0.392	S	S	.	.			trans	-109.9	126.7	170.1	-66.3	-151.6	168	0	0	111.4	Y107 R109 N134	Y107-E132 PolarHBondContact O-N 3.18Å; R109-E132 HydrophobicContact CB-CG 4.38Å; R109-E132 IonicContact CZ-OE1 3.74Å; R109-E132 IonicContact NE-OE1 2.79Å; R109-E132 PolarHBondContact NE-OE1 3.49Å; R109-E132 IonicContact NH2-OE1 2.8Å; R109-E132 PolarHBondContact NH2-OE1 2.73Å; R109-E132 IonicContact NH2-OE2 3.68Å; E132-N134 PolarHBondContact O-N 3.41Å
133	V	70.2	Confident	61.8	Low	120 Å²	120	81.5 Å²	81.5	73%	0.727	42%	0.424	S	S	*	.			trans	-76.3	112.7	-179.7	-179.1	0	0	0	0	109.8	N135	V133-N135 PolarHBondContact O-N 3.15Å
134	N	54.9	Low	59.9	Low	63 Å²	63	90.3 Å²	90.3	34%	0.337	46%	0.46	S	S	.	.			trans	-77.4	85.2	-171.9	-146.5	-14.8	0	0	0	111.7	Y107 E132 T136	Y107-N134 HydrophobicContact CD2-CB 4.07Å; Y107-N134 WeakPolarHBondContact CE1-ND2 3.28Å; Y107-N134 HydrophobicContact CE2-CB 4.26Å; Y107-N134 WeakPolarHBondContact CE2-ND2 3.34Å; E132-N134 PolarHBondContact O-N 3.41Å; N134-T136 PolarHBondContact O-N 2.89Å; N134-T136 PolarHBondContact OD1-OG1 3.12Å
135	N	40.8	Very low	57.4	Low	121 Å²	121	93.3 Å²	93.3	65%	0.647	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	4.5	-177.4	-83.8	-29.6	0	0	0	115.7	V133 T138	V133-N135 PolarHBondContact O-N 3.15Å; N135-T138 PolarHBondContact O-OG1 3.43Å
136	T	41.6	Very low	54.8	Low	102 Å²	102	99.6 Å²	99.6	63%	0.626	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-17.8	-176.4	51.6	0	0	0	0	114.2	N134	N134-T136 PolarHBondContact O-N 2.89Å; N134-T136 PolarHBondContact OD1-OG1 3.12Å
137	Q	41.1	Very low	52.1	Low	114 Å²	114	102.7 Å²	102.7	53%	0.533	57%	0.566	S	S	.	*	S	Bend	trans	-97	-19.8	177.6	-64.6	-165.3	14.3	0	0	114.3	L139 S140	Q137-L139 VanDerWaalsContact C-N 3.3Å; Q137-L139 PolarHBondContact O-N 2.81Å; Q137-S140 PolarHBondContact O-OG 2.93Å
138	T	36.7	Very low	49.4	Very low	88 Å²	88	110.6 Å²	110.6	54%	0.54	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.2	-19.9	-178.4	42.1	0	0	0	0	113.8	N135 I142	N135-T138 PolarHBondContact O-OG1 3.43Å; T138-I142 WeakPolarHBondContact O-CD1 3.46Å; T138-I142 WeakPolarHBondContact O-CG1 3.42Å
139	L	32.4	Very low	46.6	Very low	141 Å²	141	121 Å²	121	74%	0.738	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-15.1	-179	-98.1	160.9	0	0	0	115.1	Q137	Q137-L139 VanDerWaalsContact C-N 3.3Å; Q137-L139 PolarHBondContact O-N 2.81Å
140	S	34.2	Very low	44	Very low	99 Å²	99	126.3 Å²	126.3	69%	0.692	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-12.1	-177.2	59.3	0	0	0	0	114.5	Q137	Q137-S140 PolarHBondContact O-OG 2.93Å
141	Q	38.5	Very low	41	Very low	152 Å²	152	126.6 Å²	126.6	71%	0.71	68%	0.68	S	S	*	*	S	Bend	trans	-88.3	-9.5	169.8	-60.8	-158.3	18.5	0	0	113.5	N143	Q141-N143 PolarHBondContact O-N 3.02Å
142	I	34	Very low	38.4	Very low	119 Å²	119	130.7 Å²	130.7	61%	0.61	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	64.3	171.2	-51.4	169.4	0	0	0	109.6	T138	T138-I142 WeakPolarHBondContact O-CD1 3.46Å; T138-I142 WeakPolarHBondContact O-CG1 3.42Å
143	N	31.4	Very low	35.8	Very low	162 Å²	162	134.7 Å²	134.7	87%	0.866	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-178.3	37.5	155.1	-95	-37.6	0	0	0	114.2	Q141	Q141-N143 PolarHBondContact O-N 3.02Å
144	K	34	Very low	33.7	Very low	209 Å²	209	135.5 Å²	135.5	91%	0.909	71%	0.709	S	S	*	*			trans	-107.6	133.1	145.1	-64.8	178.1	-176.3	174.5	0	105.8
145	G	30	Very low	32.3	Very low	67 Å²	67	141.3 Å²	141.3	69%	0.691	73%	0.732	S	S	*	*			cis	153.1	101.4	14.9	0	0	0	0	0	104.2
146	P	31.2	Very low	31.6	Very low	138 Å²	138	140 Å²	140	90%	0.896	73%	0.732	S	S	*	*			trans	-93.9	138.9	-145.1	32.9	-36.5	0	0	0	115.7
147	G	28.6	Very low	30.9	Very low	66 Å²	66	144.9 Å²	144.9	68%	0.68	75%	0.745	S	S	*	*			trans	122.1	121.6	150.6	0	0	0	0	0	116.6
148	L	32	Very low	30.1	Very low	167 Å²	167	149.1 Å²	149.1	87%	0.874	76%	0.756	S	S	*	*			trans	160.5	90.7	159.9	-94.8	165.1	0	0	0	106
149	R	29.8	Very low	29.7	Very low	239 Å²	239	151.5 Å²	151.5	90%	0.902	77%	0.77	S	S	*	*			cis	82.7	40.7	18.1	-140.5	-173.1	-167	-160.1	4.7	117.9
150	T	33.5	Very low	29.4	Very low	120 Å²	120	150.7 Å²	150.7	74%	0.736	77%	0.767	S	S	*	*			trans	-126.6	113	153.9	46.2	0	0	0	0	108.4
151	R	24	Very low	29.2	Very low	187 Å²	187	156.3 Å²	156.3	71%	0.706	78%	0.778	S	S	*	*			cis	92.6	147.4	39.7	-168.5	-179	179	169.9	2.5	111.5
152	W	28.1	Very low	28.7	Very low	194 Å²	194	154 Å²	154	74%	0.735	78%	0.779	S	S	*	*			trans	76.8	131.7	-179.3	-40.3	106.1	0	0	0	113.4
153	Q	24.6	Very low	28.8	Very low	160 Å²	160	153.1 Å²	153.1	75%	0.748	78%	0.781	S	S	*	*			cis	122.7	143.1	11.3	-87.6	-102	-27.8	0	0	109.3
154	L	26.7	Very low	28.7	Very low	137 Å²	137	151.9 Å²	151.9	72%	0.717	77%	0.774	S	S	*	*			trans	68.2	149.3	-173.3	-73.4	65.1	0	0	0	113.8
155	K	25.4	Very low	28.6	Very low	186 Å²	186	150.3 Å²	150.3	81%	0.809	77%	0.77	S	S	*	*			cis	-143.5	164.9	5.1	-133.1	162.1	-175.2	173.6	0	110.9
156	S	24.8	Very low	28.5	Very low	93 Å²	93	154.9 Å²	154.9	65%	0.65	78%	0.776	S	S	*	*			trans	-60.4	154.6	176.2	56.6	0	0	0	0	112.7
157	F	28.1	Very low	28.6	Very low	204 Å²	204	152.5 Å²	152.5	90%	0.895	76%	0.76	S	S	*	*				-138	136	85.8	-110.8	-91.9	0	0	0	114.9
158	R	23.8	Very low	28.8	Very low	203 Å²	203	159 Å²	159	77%	0.766	77%	0.769	S	S	*	*			trans	-66.2	156.5	157.1	-131	170.1	-82.9	169.2	-7.3	107.5
159	V	29	Very low	28.7	Very low	138 Å²	138	157 Å²	157	84%	0.836	77%	0.765	S	S	*	*				-150.5	144.3	78.2	169.4	0	0	0	0	111
160	N	24.9	Very low	29	Very low	125 Å²	125	150.7 Å²	150.7	67%	0.668	75%	0.754	S	S	*	*			trans	-53.2	147	178.8	-48.3	-12.3	0	0	0	114.9
161	K	31.3	Very low	28.8	Very low	216 Å²	216	151.9 Å²	151.9	94%	0.939	75%	0.754	S	S	*	*				-145.4	125.9	121.9	-118.6	174	-176.3	178.2	0	111.1
162	S	28.4	Very low	29.1	Very low	105 Å²	105	153.2 Å²	153.2	73%	0.734	76%	0.76	S	S	*	*			trans	-175	153	-171.5	175.9	0	0	0	0	107.5
163	P	35.8	Very low	29.1	Very low	100 Å²	100	149.4 Å²	149.4	65%	0.649	76%	0.758	S	S	*	*			cis	-121.8	-140.7	-19.4	27.8	-5	0	0	0	109.7
164	N	29.2	Very low	29.3	Very low	135 Å²	135	148 Å²	148	72%	0.722	76%	0.755	S	S	*	*			trans	87	133.1	166.5	-51.8	-19.4	0	0	0	115.8
165	H	31.6	Very low	29.5	Very low	177 Å²	177	148 Å²	148	82%	0.819	75%	0.754	S	S	*	*			cis	-141.6	142.4	0.8	-141.8	-72.8	0	0	0	113.9
166	M	27.2	Very low	29.6	Very low	163 Å²	163	143.8 Å²	143.8	80%	0.803	75%	0.749	S	S	*	*			trans	-90	178.2	176.4	-155.3	-158.2	176.6	0	0	110
167	P	34.7	Very low	29.7	Very low	87 Å²	87	149.2 Å²	149.2	57%	0.565	76%	0.761	S	S	*	*				-117.4	-168.5	-74.1	38.3	-25.1	0	0	0	112.3
168	K	32.3	Very low	29.6	Very low	203 Å²	203	144.5 Å²	144.5	88%	0.883	75%	0.753	S	S	*	*				-168.7	146	119.3	-101.1	154	-172.3	176.8	0	114.4
169	T	29.8	Very low	30	Very low	126 Å²	126	141 Å²	141	77%	0.773	75%	0.754	S	S	*	*			trans	-115.5	-165.9	174.9	53.4	0	0	0	0	108.6
170	P	35.5	Very low	29.7	Very low	105 Å²	105	143.6 Å²	143.6	68%	0.682	76%	0.755	S	S	*	*				-120.1	-163.9	-57.1	27.2	-7.2	0	0	0	110.5
171	I	30.5	Very low	30	Very low	145 Å²	145	143 Å²	143	74%	0.744	76%	0.757	S	S	*	*				157.3	118.8	125.1	-81.4	163.5	0	0	0	114.5
172	R	28.5	Very low	29.8	Very low	216 Å²	216	137.5 Å²	137.5	82%	0.815	75%	0.746	S	S	*	*			trans	47.6	129.5	145.1	-73.5	-175.2	155.8	177.2	-5.8	124.2
173	T	29.2	Very low	29.6	Very low	113 Å²	113	139.7 Å²	139.7	69%	0.693	75%	0.749	S	S	*	*			trans	71.2	150.8	130.8	63.3	0	0	0	0	119.3
174	N	28.3	Very low	29.2	Very low	130 Å²	130	142.6 Å²	142.6	70%	0.695	76%	0.758	S	S	*	*			cis	-160.3	165.6	-1.4	-125.4	-9.7	0	0	0	113.1
175	I	30.3	Very low	29	Very low	137 Å²	137	143 Å²	143	70%	0.703	76%	0.76	S	S	*	*			trans	74.1	139.8	145.3	-70.2	162.5	0	0	0	120.9
176	S	29.3	Very low	28.9	Very low	99 Å²	99	140.9 Å²	140.9	69%	0.692	76%	0.76	S	S	*	*			trans	72.8	105.8	156.9	62	0	0	0	0	122.9
177	K	26.5	Very low	29	Very low	206 Å²	206	136 Å²	136	90%	0.896	75%	0.751	S	S	*	*				46.6	135.8	118.6	-64.7	-177.4	177.7	179.8	0	121.7
178	S	26.5	Very low	28.7	Very low	106 Å²	106	141.2 Å²	141.2	74%	0.741	77%	0.765	S	S	*	*			trans	99.1	149.8	141.7	-163.4	0	0	0	0	119.1
179	T	30.6	Very low	28.4	Very low	128 Å²	128	138.7 Å²	138.7	79%	0.785	76%	0.756	S	S	*	*			trans	73.1	109.6	157.1	5.6	0	0	0	0	118.9
180	K	24.6	Very low	28.4	Very low	194 Å²	194	142.3 Å²	142.3	84%	0.843	76%	0.761	S	S	*	*			trans	-65.6	169.1	144.8	-61.7	178.8	176.8	178.3	0	108.9
181	P	31	Very low	27.9	Very low	111 Å²	111	146.3 Å²	146.3	72%	0.721	76%	0.762	S	S	*	*			cis	-141.2	-178.4	14.1	38.2	-16.5	0	0	0	117.1
182	S	25.5	Very low	27.6	Very low	102 Å²	102	144.3 Å²	144.3	71%	0.713	75%	0.754	S	S	*	*			trans	63.8	132.5	138.5	65.3	0	0	0	0	123.7
183	L	25.5	Very low	27.5	Very low	151 Å²	151	142.4 Å²	142.4	79%	0.791	75%	0.751	S	S	*	*			trans	85	136.1	141.1	-133.7	79.6	0	0	0	119
184	L	26	Very low	27.4	Very low	161 Å²	161	146.1 Å²	146.1	84%	0.843	75%	0.754	S	S	*	*			trans	66.4	147.8	175.9	-50.4	169	0	0	0	112.6
185	D	26.7	Very low	27.3	Very low	142 Å²	142	145.9 Å²	145.9	76%	0.759	75%	0.752	S	S	*	*			cis	-149	179	5.9	-166.5	4.3	0	0	0	109.3
186	V	28.8	Very low	27.2	Very low	134 Å²	134	144.6 Å²	144.6	81%	0.812	75%	0.751	S	S	*	*			trans	69.8	140.6	170	-164.6	0	0	0	0	115
187	G	30	Very low	27.1	Very low	60 Å²	60	144 Å²	144	62%	0.619	75%	0.747	S	S	*	*			cis	-165.9	142.7	-7.2	0	0	0	0	0	109.1
188	K	27.3	Very low	27.3	Very low	197 Å²	197	140.7 Å²	140.7	86%	0.857	74%	0.739	S	S	*	*				53.9	116.6	96.5	-80.8	-175.2	176.2	175.8	0	116.7
189	H	26.9	Very low	27.5	Very low	150 Å²	150	142.8 Å²	142.8	69%	0.694	74%	0.741	S	S	*	*			trans	64.8	98.7	149.3	-74.8	-88.5	0	0	0	121.5
190	F	29.4	Very low	27.3	Very low	202 Å²	202	145.4 Å²	145.4	89%	0.886	74%	0.742	S	S	*	*				-164.2	120.9	123.9	-89	-77.9	0	0	0	105
191	R	24.7	Very low	27.7	Very low	188 Å²	188	143.7 Å²	143.7	71%	0.709	74%	0.741	S	S	*	*			cis	59.2	112.7	4.2	-162	168.7	-175.1	160.1	11.1	117.7
192	D	24.7	Very low	27.6	Very low	104 Å²	104	141.4 Å²	141.4	56%	0.556	74%	0.737	S	S	*	*			trans	34.4	132.7	156.2	-42.9	-13.3	0	0	0	118.9
193	K	25.9	Very low	28.1	Very low	175 Å²	175	142.1 Å²	142.1	76%	0.761	74%	0.74	S	S	*	*				-164.8	100.9	128.3	-89.1	-127.8	168.5	-170.5	0	115.8
194	Y	26.4	Very low	28.4	Very low	192 Å²	192	141.6 Å²	141.6	75%	0.753	74%	0.742	S	S	*	*			trans	64.5	165.2	142.2	-63.5	-90.5	0	0	0	117.9
195	N	27.7	Very low	28.7	Very low	124 Å²	124	136.7 Å²	136.7	66%	0.663	73%	0.731	S	S	*	*			cis	-152.3	155.2	16.9	-144.6	12	0	0	0	114.1
196	T	28	Very low	29	Very low	111 Å²	111	139.5 Å²	139.5	68%	0.681	74%	0.74	S	S	*	*			trans	27	143.8	145.5	51.9	0	0	0	0	122.5
197	S	27.5	Very low	29	Very low	87 Å²	87	136.4 Å²	136.4	61%	0.608	74%	0.735	S	S	*	*			cis	-173.7	175.4	-6	49.8	0	0	0	0	110.7
198	D	29.6	Very low	29.1	Very low	135 Å²	135	140.1 Å²	140.1	72%	0.722	75%	0.746	S	S	*	*			trans	71.6	139.8	160.9	-53.9	-57.6	0	0	0	118.1
199	L	30.2	Very low	29.1	Very low	151 Å²	151	136.2 Å²	136.2	79%	0.791	74%	0.738	S	S	*	*			cis	-141.9	160.6	7.2	-153.9	77	0	0	0	112.6
200	K	27.5	Very low	29	Very low	182 Å²	182	134.4 Å²	134.4	79%	0.791	74%	0.738	S	S	*	*			trans	-62	170.1	179.1	-51.1	154.8	176.2	171.7	0	113.1
201	L	31.5	Very low	28.9	Very low	158 Å²	158	129.9 Å²	129.9	83%	0.827	73%	0.727	S	S	*	*			cis	-134.3	-176.1	6.2	-52.5	73.9	0	0	0	108.7
202	G	29.6	Very low	29	Very low	63 Å²	63	129.7 Å²	129.7	65%	0.649	73%	0.734	S	S	*	*			cis	96.1	149.5	-0.8	0	0	0	0	0	116.1
203	P	36.7	Very low	29.1	Very low	117 Å²	117	129.7 Å²	129.7	76%	0.76	74%	0.743	S	S	*	*			cis	-140.6	-152.9	-20.3	37.4	-14.1	0	0	0	113.4
204	V	32.1	Very low	29	Very low	140 Å²	140	129.3 Å²	129.3	85%	0.848	75%	0.748	S	S	*	*			trans	79.5	134.4	169.1	-165.3	0	0	0	0	116.4
205	G	32.4	Very low	29.1	Very low	59 Å²	59	124.8 Å²	124.8	61%	0.608	75%	0.75	S	S	*	*			cis	168.8	166.4	-9.2	0	0	0	0	0	114.3
206	E	33	Very low	29.4	Very low	200 Å²	200	127.8 Å²	127.8	94%	0.935	76%	0.76	S	S	*	*			trans	64.3	145.8	170.1	-64.6	164.5	-158.6	0	0	115.6
207	G	28.7	Very low	29.5	Very low	70 Å²	70	127.5 Å²	127.5	72%	0.722	76%	0.76	S	S	*	*			cis	120.6	135.9	20.8	0	0	0	0	0	107.4
208	V	30.3	Very low	29.4	Very low	138 Å²	138	132.3 Å²	132.3	84%	0.836	77%	0.773	S	S	*	*			cis	-156.5	166.8	25.7	157.8	0	0	0	0	109.7
209	T	27.5	Very low	29.3	Very low	114 Å²	114	131.2 Å²	131.2	70%	0.699	78%	0.776	S	S	*	*			trans	-54	172.2	171.8	54.6	0	0	0	0	115
210	T	25.8	Very low	29	Very low	113 Å²	113	131.9 Å²	131.9	69%	0.693	78%	0.779	S	S	*	*			cis	-168.2	171.5	15.3	-6.2	0	0	0	0	112.1
211	T	26.9	Very low	28.9	Very low	107 Å²	107	127.8 Å²	127.8	66%	0.656	77%	0.774	S	S	*	*			trans	59.8	137.5	147.3	49.1	0	0	0	0	123.2
212	E	26.2	Very low	28.6	Very low	183 Å²	183	124.5 Å²	124.5	86%	0.855	76%	0.764	S	S	*	*			trans	71.1	149.9	141.6	-78.4	170.2	-151.3	0	0	119.3
213	S	27.2	Very low	28.4	Very low	105 Å²	105	126.7 Å²	126.7	73%	0.734	77%	0.769	S	S	*	*			cis	-152.6	-164.1	-3.8	57.2	0	0	0	0	111.8
214	L	23.6	Very low	28	Very low	166 Å²	166	127 Å²	127	87%	0.869	76%	0.764	S	S	*	*			trans	-63.8	146.4	177.9	-73.3	61.3	0	0	0	113.5
215	A	29.5	Very low	27.6	Very low	97 Å²	97	128 Å²	128	80%	0.802	76%	0.757	S	S	*	*			trans	-169.3	136.2	135.6	0	0	0	0	0	113.9
216	H	32.8	Very low	27.2	Very low	187 Å²	187	131.7 Å²	131.7	87%	0.866	76%	0.762	S	S	*	*			trans	-99.6	141.1	147.9	-99.6	-53.8	0	0	0	107.6
217	P	30.3	Very low	26.8	Very low	105 Å²	105	129.2 Å²	129.2	68%	0.682	75%	0.75	S	S	*	*				-132.3	161.8	107.4	9.6	13.1	0	0	0	111.2
218	Q	26.3	Very low	26.6	Very low	189 Å²	189	134.4 Å²	134.4	88%	0.883	75%	0.753	S	S	*	*			cis	71.2	90.8	46	-74.4	-163.9	-8.9	0	0	116.9
219	S	26.4	Very low	26.3	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	75%	0.745	S	S	*	*			trans	-166.7	135.4	143.4	29.9	0	0	0	0	107.6
220	L	24.1	Very low	26.3	Very low	165 Å²	165	135.7 Å²	135.7	86%	0.864	75%	0.745	S	S	*	*				57.7	130.2	77.1	-92.2	70.6	0	0	0	113.2
221	S	26.4	Very low	26.3	Very low	96 Å²	96	136.9 Å²	136.9	67%	0.671	75%	0.748	S	S	*	*			cis	-158.5	178.1	8.5	59	0	0	0	0	113.4
222	S	24.5	Very low	26.4	Very low	89 Å²	89	140.8 Å²	140.8	62%	0.622	75%	0.752	S	S	*	*			trans	50.2	120.2	147.3	54.4	0	0	0	0	119.4
223	S	25.2	Very low	26.5	Very low	108 Å²	108	138 Å²	138	76%	0.755	75%	0.749	S	S	*	*				51.2	114.1	82.8	-51.7	0	0	0	0	111.7
224	D	28.5	Very low	26.4	Very low	123 Å²	123	139.2 Å²	139.2	66%	0.658	75%	0.748	S	S	*	*				-148	152.7	55.9	-97.9	-39.6	0	0	0	111
225	K	24.7	Very low	26.6	Very low	162 Å²	162	140.1 Å²	140.1	70%	0.704	75%	0.747	S	S	*	*				76.2	145.4	63	-154.6	-156.5	-86.4	115.8	0	112.2
226	I	23.9	Very low	26.5	Very low	137 Å²	137	140.5 Å²	140.5	70%	0.703	74%	0.742	S	S	*	*			trans	75.6	134.1	172.4	-55.7	159.7	0	0	0	113.8
227	Q	24.7	Very low	26.1	Very low	147 Å²	147	138.2 Å²	138.2	69%	0.687	74%	0.74	S	S	*	*			cis	-145	167.5	-19.1	-141.1	83.7	-48.6	0	0	106.5
228	F	23.5	Very low	25.8	Very low	179 Å²	179	138.8 Å²	138.8	79%	0.785	75%	0.747	S	S	*	*				21.7	143.4	105.1	-62	-116.4	0	0	0	115.9
229	L	24.4	Very low	25.7	Very low	127 Å²	127	133.2 Å²	133.2	67%	0.665	74%	0.74	S	S	*	*			cis	-162.5	-167.8	37.7	-128.9	140.7	0	0	0	110.7
230	E	26.6	Very low	25.6	Very low	153 Å²	153	136.8 Å²	136.8	72%	0.715	74%	0.744	S	S	*	*			trans	68	138.1	151.4	-76.6	136.2	-138.3	0	0	120.6
231	D	26	Very low	25.5	Very low	138 Å²	138	133.5 Å²	133.5	74%	0.738	74%	0.735	S	S	*	*			cis	-158.9	166	-20.8	-140.6	-8.8	0	0	0	114
232	Y	29.7	Very low	25.6	Very low	189 Å²	189	137.8 Å²	137.8	74%	0.741	74%	0.742	S	S	*	*			trans	-75.9	153.4	156.9	-91.8	-103.1	0	0	0	110.1
233	P	28.9	Very low	25.6	Very low	124 Å²	124	138.5 Å²	138.5	81%	0.805	74%	0.735	S	S	*	*			trans	-120.3	140.7	135	-5.1	25.3	0	0	0	112.9
234	N	24.9	Very low	25.6	Very low	131 Å²	131	136.6 Å²	136.6	70%	0.701	72%	0.721	S	S	*	*			trans	-96	159.9	164.6	-66.4	-61.9	0	0	0	110.1
235	E	26.3	Very low	25.4	Very low	184 Å²	184	142.5 Å²	142.5	86%	0.86	73%	0.734	S	S	*	*			trans	65.5	168.5	155.6	-84.5	-174.2	-138.9	0	0	118.9
236	P	29.2	Very low	25.7	Very low	106 Å²	106	140.3 Å²	140.3	69%	0.688	74%	0.737	S	S	*	*			cis	-130.4	-179.8	-26.6	29.9	-10.6	0	0	0	114.3	S238	P236-S238 PolarHBondContact O-N 3.18Å
237	V	24	Very low	26	Very low	138 Å²	138	140.7 Å²	140.7	84%	0.836	75%	0.745	S	S	*	*			trans	-22.3	119.8	162.2	-177.5	0	0	0	0	116.8
238	S	23.7	Very low	26.1	Very low	118 Å²	118	137.7 Å²	137.7	83%	0.825	74%	0.741	S	S	*	*				-179	154.6	120.3	48.3	0	0	0	0	110.6	P236	P236-S238 PolarHBondContact O-N 3.18Å
239	G	23.5	Very low	26.3	Very low	71 Å²	71	137.1 Å²	137.1	73%	0.732	75%	0.745	S	S	*	*			trans	-111.8	148.8	-176.6	0	0	0	0	0	113.2
240	Q	24.8	Very low	26.4	Very low	188 Å²	188	139.1 Å²	139.1	88%	0.879	75%	0.749	S	S	*	*			trans	-152.2	138.7	152.5	-119.9	171.6	66.8	0	0	112
241	S	23	Very low	26.5	Very low	95 Å²	95	139.4 Å²	139.4	66%	0.664	75%	0.754	S	S	*	*			trans	-77.8	143.6	179.8	50.8	0	0	0	0	112.9
242	K	27.2	Very low	26.7	Very low	187 Å²	187	137.6 Å²	137.6	81%	0.813	75%	0.75	S	S	*	*			trans	-166.2	85.3	147.5	-104.1	144.7	-171	172.9	0	113.1
243	E	24.2	Very low	26.5	Very low	103 Å²	103	138.5 Å²	138.5	48%	0.481	76%	0.758	S	S	.	*				46.5	139.6	115.1	-154.1	151.6	-111.1	0	0	121.4	T873 T874	E243-T873 HydrophobicContact CG-CG2 4.19Å; E243-T874 WeakPolarHBondContact OE1-CA 2.88Å; E243-T874 PolarHBondContact OE1-N 3.44Å; E243-T874 PolarHBondContact OE1-OG1 3.16Å
244	C	24.9	Very low	26.4	Very low	69 Å²	69	136.9 Å²	136.9	47%	0.466	75%	0.75	S	S	.	*			trans	-80.9	168.8	-175.5	-49.4	0	0	0	0	114.4
245	R	25.9	Very low	26.5	Very low	246 Å²	246	138.3 Å²	138.3	93%	0.928	75%	0.752	S	S	*	*			trans	-156.8	124.1	135.8	-113	170.3	-156.8	-154.1	3.9	113.5
246	P	31	Very low	26.4	Very low	117 Å²	117	135.4 Å²	135.4	76%	0.76	74%	0.743	S	S	*	*			trans	-90.5	161.8	161.8	36.6	-32.3	0	0	0	110.9
247	T	29.2	Very low	26.3	Very low	144 Å²	144	137.4 Å²	137.4	88%	0.883	75%	0.747	S	S	*	*			trans	-123.6	129.8	165	-56.5	0	0	0	0	109.3
248	S	27.3	Very low	26.3	Very low	85 Å²	85	137.2 Å²	137.2	59%	0.594	74%	0.741	S	S	*	*			trans	-85.9	172.4	-178.8	55.6	0	0	0	0	112.3
249	L	28.4	Very low	26.5	Very low	167 Å²	167	139 Å²	139	87%	0.874	73%	0.734	S	S	*	*				-151.6	126.6	126.3	-111	163.3	0	0	0	111.6
250	F	26.2	Very low	26.6	Very low	168 Å²	168	142.1 Å²	142.1	74%	0.737	73%	0.727	S	S	*	*			trans	-75.3	171.6	165.6	-77.2	-106.6	0	0	0	108.4
251	L	28.4	Very low	26.7	Very low	159 Å²	159	142.8 Å²	142.8	83%	0.832	72%	0.722	S	S	*	*			cis	-157.5	168.7	49.6	-101.9	95.7	0	0	0	112.9
252	P	29.7	Very low	27	Very low	100 Å²	100	144.7 Å²	144.7	65%	0.649	73%	0.725	S	S	*	*			trans	-102.6	168.5	-177.2	40.3	-34.9	0	0	0	113.8
253	K	26.4	Very low	27.1	Very low	208 Å²	208	140 Å²	140	90%	0.904	72%	0.716	S	S	*	*				-168.3	176.9	125.5	-109.3	169.7	-174.3	-178.7	0	114.1
254	S	26.5	Very low	27.3	Very low	91 Å²	91	142.9 Å²	142.9	64%	0.636	73%	0.734	S	S	*	*			trans	-93.7	173.8	-170.2	51.4	0	0	0	0	114.2
255	Q	26.5	Very low	27.6	Very low	160 Å²	160	145 Å²	145	75%	0.748	75%	0.749	S	S	*	*			trans	81.4	122.9	159.9	-76.4	-177.2	-97.2	0	0	119.4
256	D	25.5	Very low	27.7	Very low	124 Å²	124	142.5 Å²	142.5	66%	0.663	75%	0.745	S	S	*	*				71.8	121.5	129.1	-49.1	-16	0	0	0	121.7
257	D	25.8	Very low	27.8	Very low	147 Å²	147	143.2 Å²	143.2	79%	0.786	75%	0.748	S	S	*	*			trans	76.3	136.1	144.2	-84.7	-26.9	0	0	0	124.7
258	L	25.2	Very low	27.7	Very low	134 Å²	134	142.6 Å²	142.6	70%	0.702	74%	0.739	S	S	*	*			trans	59.5	132.5	150.6	-88.7	73.8	0	0	0	123
259	F	26.5	Very low	27.8	Very low	156 Å²	156	145.1 Å²	145.1	68%	0.684	75%	0.75	S	S	*	*			trans	76.3	99.8	141.1	-90.1	-132.6	0	0	0	121.5
260	K	26.9	Very low	28	Very low	136 Å²	136	142.5 Å²	142.5	59%	0.591	75%	0.746	S	S	*	*				64.4	119.7	118.6	-75.7	-178.8	-174.4	152.8	0	121
261	R	26.2	Very low	28	Very low	202 Å²	202	143.1 Å²	143.1	76%	0.762	75%	0.751	S	S	*	*				93.7	135.1	122.8	-80	178.7	176.8	166.2	-4.7	120.2
262	N	29.2	Very low	28.1	Very low	135 Å²	135	141.4 Å²	141.4	72%	0.722	75%	0.752	S	S	*	*			trans	68.4	119	142.1	-63.9	22.2	0	0	0	117.1
263	S	29.8	Very low	27.9	Very low	90 Å²	90	144.6 Å²	144.6	63%	0.629	76%	0.759	S	S	*	*			cis	100.3	154.3	37.5	71	0	0	0	0	112.9
264	L	28	Very low	28.1	Very low	163 Å²	163	144.2 Å²	144.2	85%	0.853	76%	0.76	S	S	*	*			trans	83.3	145.4	-166.1	-75.5	68.2	0	0	0	113.1
265	S	30.1	Very low	28.2	Very low	114 Å²	114	143.3 Å²	143.3	80%	0.797	77%	0.765	S	S	*	*			cis	-158.7	164.6	-10.3	39.5	0	0	0	0	111.6
266	K	29.3	Very low	28	Very low	192 Å²	192	142.1 Å²	142.1	84%	0.835	77%	0.769	S	S	*	*			trans	-86	152.5	172	-73.8	-177.4	171.4	-173	0	112.6
267	T	31.9	Very low	28.1	Very low	133 Å²	133	142.2 Å²	142.2	82%	0.816	78%	0.776	S	S	*	*			trans	-170.8	170.6	142.9	31.5	0	0	0	0	108
268	D	27.8	Very low	28	Very low	130 Å²	130	144.9 Å²	144.9	70%	0.695	78%	0.781	S	S	*	*				-165.9	163.7	-63.8	-103.9	-41.7	0	0	0	109
269	V	30.6	Very low	27.9	Very low	138 Å²	138	144.2 Å²	144.2	84%	0.836	79%	0.786	S	S	*	*			trans	64.4	149	174.9	-128.4	0	0	0	0	113.9
270	S	31.7	Very low	27.9	Very low	112 Å²	112	141.1 Å²	141.1	78%	0.783	78%	0.784	S	S	*	*			cis	-148.2	163.1	19.4	-50.1	0	0	0	0	113.9
271	E	25.5	Very low	27.8	Very low	181 Å²	181	141 Å²	141	85%	0.846	79%	0.789	S	S	*	*			trans	-80.8	152.7	176.2	-66.7	173.3	89.6	0	0	114.6
272	S	30.3	Very low	27.8	Very low	123 Å²	123	140.2 Å²	140.2	86%	0.86	79%	0.792	S	S	*	*			trans	-154.2	147.7	137.6	54	0	0	0	0	109.9
273	Q	26.5	Very low	27.7	Very low	168 Å²	168	138.9 Å²	138.9	79%	0.785	79%	0.793	S	S	*	*			trans	-95.7	139.9	-171	-58.1	172.4	-0.4	0	0	111.9
274	H	29.6	Very low	27.7	Very low	199 Å²	199	144.1 Å²	144.1	92%	0.921	80%	0.804	S	S	*	*			trans	-156.5	155.2	139.5	-111.7	49.1	0	0	0	111.7
275	G	28.5	Very low	27.6	Very low	72 Å²	72	148.4 Å²	148.4	74%	0.742	81%	0.809	S	S	*	*			trans	-82	157	-157.9	0	0	0	0	0	117.1
276	T	23.7	Very low	27.5	Very low	135 Å²	135	153.9 Å²	153.9	83%	0.828	81%	0.812	S	S	*	*			trans	-78.5	147	174.3	57.8	0	0	0	0	113.1
277	P	28.1	Very low	27.3	Very low	127 Å²	127	150.3 Å²	150.3	83%	0.825	81%	0.808	S	S	*	*			trans	-119.1	132.6	135.6	33.9	-27.3	0	0	0	111.4
278	K	22.6	Very low	27	Very low	203 Å²	203	148 Å²	148	88%	0.883	80%	0.798	S	S	*	*			trans	-90.2	123.3	168.1	-72.5	178.2	177.4	175.1	0	109.4
279	C	23	Very low	27.2	Very low	119 Å²	119	148 Å²	148	80%	0.804	80%	0.803	S	S	*	*			trans	-159.1	145.9	153.2	-146.6	0	0	0	0	114.4
280	S	26.1	Very low	27	Very low	92 Å²	92	152.5 Å²	152.5	64%	0.643	81%	0.805	S	S	*	*			trans	58	142.4	146.6	57.1	0	0	0	0	123.2
281	D	24.5	Very low	26.7	Very low	132 Å²	132	157 Å²	157	71%	0.706	81%	0.806	S	S	*	*			trans	70.2	100.4	142	-70.9	15	0	0	0	121.6
282	K	27.2	Very low	26.8	Very low	187 Å²	187	160.1 Å²	160.1	81%	0.813	81%	0.81	S	S	*	*				-176	139.5	90.3	-99.4	138.1	-164.9	165.7	0	116.3
283	S	26.1	Very low	26.7	Very low	106 Å²	106	157.4 Å²	157.4	74%	0.741	80%	0.801	S	S	*	*			trans	12.2	119.6	152	60.1	0	0	0	0	120.7
284	K	29.9	Very low	26.7	Very low	200 Å²	200	160.6 Å²	160.6	87%	0.87	81%	0.808	S	S	*	*			trans	-137.7	117.7	140.7	-74.9	-162.2	174.4	-172.7	0	111
285	R	26.2	Very low	26.7	Very low	254 Å²	254	155.2 Å²	155.2	96%	0.958	80%	0.798	S	S	*	*			trans	-63.7	145.9	165.6	-66.6	177	174.7	178.4	-4.1	109.1
286	R	28	Very low	26.8	Very low	229 Å²	229	160.9 Å²	160.9	86%	0.864	81%	0.805	S	S	*	*			trans	-140.5	137	164.7	-76.2	-169.8	170.4	-171.2	-3.3	109.9
287	P	26.4	Very low	27	Very low	116 Å²	116	162.6 Å²	162.6	75%	0.753	81%	0.809	S	S	*	*			trans	-75.6	160.6	177.9	32.6	-35.6	0	0	0	111.9
288	S	25.7	Very low	27.1	Very low	85 Å²	85	166 Å²	166	59%	0.594	81%	0.814	S	S	*	*			trans	-83.1	112.1	-175.3	41.1	0	0	0	0	113
289	T	30.1	Very low	27.4	Very low	130 Å²	130	161.4 Å²	161.4	80%	0.798	81%	0.808	S	S	*	*			trans	-131.1	74.6	172.5	43.3	0	0	0	0	111.5	Y291	T289-Y291 VanDerWaalsContact C-N 3.3Å; T289-Y291 PolarHBondContact O-N 3.11Å
290	W	26.5	Very low	27.7	Very low	232 Å²	232	160.7 Å²	160.7	88%	0.879	80%	0.804	S	S	*	*			trans	-73.3	74	177.5	-82.9	90.9	0	0	0	112.7
291	Y	25.6	Very low	27.9	Very low	208 Å²	208	165.7 Å²	165.7	82%	0.816	82%	0.817	S	S	*	*			trans	-156.7	72.2	166.6	-113.6	-73.5	0	0	0	112.4	T289	T289-Y291 VanDerWaalsContact C-N 3.3Å; T289-Y291 PolarHBondContact O-N 3.11Å
292	R	27.4	Very low	28.1	Very low	245 Å²	245	166.5 Å²	166.5	93%	0.925	82%	0.82	S	S	*	*			trans	-157.3	132.3	167.1	-174.6	166.2	-72.3	-136.1	-1.9	113.4
293	G	28.8	Very low	28.3	Very low	66 Å²	66	165.4 Å²	165.4	68%	0.68	82%	0.821	S	S	*	*			trans	65.3	94.2	145.2	0	0	0	0	0	119.1
294	Y	26.5	Very low	28.4	Very low	236 Å²	236	169 Å²	169	93%	0.925	83%	0.826	S	S	*	*			trans	-99.2	96.4	142.8	-98.5	-88.8	0	0	0	107.4
295	A	28.7	Very low	28.3	Very low	86 Å²	86	163.2 Å²	163.2	71%	0.711	82%	0.823	S	S	*	*			trans	-163.7	161.3	171.9	0	0	0	0	0	109.3
296	E	31.8	Very low	28.3	Very low	190 Å²	190	157.3 Å²	157.3	89%	0.888	82%	0.821	S	S	*	*			trans	68.1	77.2	168.7	-65	167.1	-162	0	0	116.6
297	D	27.2	Very low	28.4	Very low	172 Å²	172	150.2 Å²	150.2	92%	0.92	82%	0.819	S	S	*	*			trans	-75.7	109.5	140.3	-89	-36.6	0	0	0	107.9
298	E	31.3	Very low	28.3	Very low	199 Å²	199	155.8 Å²	155.8	93%	0.93	83%	0.825	S	S	*	*			trans	-141.2	145.3	148.9	-85.8	-145.5	134.7	0	0	110.8
299	S	27.5	Very low	28.2	Very low	106 Å²	106	161 Å²	161	74%	0.741	84%	0.837	S	S	*	*			trans	-108.2	170.7	-179.6	58.5	0	0	0	0	111.3
300	S	31.1	Very low	28.1	Very low	103 Å²	103	159.4 Å²	159.4	72%	0.72	83%	0.831	S	S	*	*			trans	92	102.1	165.9	-43.7	0	0	0	0	117
301	E	29.7	Very low	28.1	Very low	198 Å²	198	159.4 Å²	159.4	93%	0.925	83%	0.831	S	S	*	*			trans	68.7	132.7	137.6	-55	-164	129.2	0	0	121.6
302	I	27.6	Very low	28.1	Very low	149 Å²	149	159 Å²	159	76%	0.764	84%	0.836	S	S	*	*			trans	-93.4	134.4	-176.2	-62.6	154.5	0	0	0	108.8
303	I	31.4	Very low	28	Very low	164 Å²	164	155.2 Å²	155.2	84%	0.841	83%	0.833	S	S	*	*				-166.5	142.4	129.6	-97.7	149.9	0	0	0	111
304	H	29.2	Very low	28	Very low	180 Å²	180	159.9 Å²	159.9	83%	0.833	84%	0.837	S	S	*	*			trans	-60.4	144.5	-169.1	-64.8	-112.3	0	0	0	116.1
305	G	27.6	Very low	28.2	Very low	79 Å²	79	153.3 Å²	153.3	81%	0.814	82%	0.823	S	S	*	*			trans	-170.6	123.2	160.8	0	0	0	0	0	112.7
306	S	27.1	Very low	28.3	Very low	131 Å²	131	153.9 Å²	153.9	92%	0.916	82%	0.818	S	S	*	*			trans	-90.4	132.6	-175.6	51.1	0	0	0	0	113.2
307	G	28.5	Very low	28.4	Very low	79 Å²	79	149.1 Å²	149.1	81%	0.814	81%	0.805	S	S	*	*			trans	-145.4	126.6	177.7	0	0	0	0	0	112.4
308	R	25.5	Very low	28.9	Very low	234 Å²	234	148.8 Å²	148.8	88%	0.883	80%	0.798	S	S	*	*			trans	-99.2	134.3	-177.5	-100.6	177.9	169.5	169.8	-2.6	111.8
309	K	24.1	Very low	29.1	Very low	194 Å²	194	146.5 Å²	146.5	84%	0.843	79%	0.788	S	S	*	*			trans	56.6	119.7	152.3	-58.3	178.3	176.7	-174.3	0	118.3
310	S	27.7	Very low	29.5	Very low	97 Å²	97	144.1 Å²	144.1	68%	0.678	77%	0.771	S	S	*	*				-166.7	126.2	116.3	-167.8	0	0	0	0	112.4
311	R	25.7	Very low	29.8	Very low	232 Å²	232	145.3 Å²	145.3	88%	0.875	77%	0.765	S	S	*	*			trans	35.1	132.8	147.3	-58.1	172.1	-172.5	160.6	3	120	L313	R311-L313 PolarHBondContact O-N 3.06Å
312	H	26.1	Very low	30	Very low	198 Å²	198	138.6 Å²	138.6	92%	0.917	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-48.9	131.2	155.7	-75	-102.1	0	0	0	110.1
313	L	25.6	Very low	30.3	Very low	167 Å²	167	137.1 Å²	137.1	87%	0.874	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-85.4	117.6	176.7	-155.5	75	0	0	0	108.7	R311	R311-L313 PolarHBondContact O-N 3.06Å
314	H	27.4	Very low	30.6	Very low	164 Å²	164	136 Å²	136	76%	0.759	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-62	139.5	170.9	-135.9	-88.9	0	0	0	109.1	T316	H314-T316 PolarHBondContact O-N 2.78Å
315	P	31.5	Very low	30.8	Very low	98 Å²	98	133.6 Å²	133.6	64%	0.636	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-59.1	135.9	166.6	26.1	-32.9	0	0	0	109.2
316	T	30.3	Very low	31.3	Very low	97 Å²	97	134.6 Å²	134.6	60%	0.595	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-68.4	130.6	-170.4	35.4	0	0	0	0	112	H314 E318 E319	H314-T316 PolarHBondContact O-N 2.78Å; T316-E318 PolarHBondContact O-N 2.92Å; T316-E319 PolarHBondContact O-N 2.77Å
317	S	34.2	Very low	31.6	Very low	90 Å²	90	135.1 Å²	135.1	63%	0.629	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	14.2	-166.3	60.8	0	0	0	0	116.3
318	E	37.1	Very low	31.9	Very low	166 Å²	166	135.6 Å²	135.6	78%	0.776	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	-29.9	179	-63.7	-174.5	147.9	0	0	112.5	T316	T316-E318 PolarHBondContact O-N 2.92Å
319	E	35.7	Very low	32.3	Very low	150 Å²	150	128.5 Å²	128.5	70%	0.701	68%	0.68	S	S	*	*	H	α-helix	trans	-81.3	-32.1	173.8	-65.7	-169.5	129.1	0	0	112	T316 A322 L323	T316-E319 PolarHBondContact O-N 2.77Å; E319-A322 PolarHBondContact O-N 2.76Å; E319-L323 PolarHBondContact O-N 3.25Å
320	S	36.7	Very low	32.7	Very low	57 Å²	57	127.4 Å²	127.4	40%	0.399	68%	0.677	S	S	.	*	H	α-helix	trans	-64.5	-46.3	176.5	-58	0	0	0	0	112.2	A322 L323 Q324	S320-A322 VanDerWaalsContact C-N 3.31Å; S320-A322 PolarHBondContact O-N 3.01Å; S320-L323 PolarHBondContact O-N 3.33Å; S320-Q324 VanDerWaalsContact O-CB 3.29Å; S320-Q324 WeakPolarHBondContact O-CB 3.37Å; S320-Q324 PolarHBondContact O-N 3.4Å
321	E	36.7	Very low	32.8	Very low	127 Å²	127	127.5 Å²	127.5	59%	0.593	68%	0.684	S	S	*	*	H	α-helix	trans	-62.7	-37.9	178.6	-74	-166.7	156.8	0	0	111.8	L323 Q324 L325	E321-L323 PolarHBondContact O-N 3.12Å; E321-Q324 PolarHBondContact O-N 3.46Å; E321-L325 WeakPolarHBondContact O-CB 3.47Å; E321-L325 PolarHBondContact O-N 2.89Å
322	A	35.2	Very low	33	Very low	58 Å²	58	125.6 Å²	125.6	48%	0.479	69%	0.685	S	S	.	*	H	α-helix	trans	-62	-41.4	178.5	0	0	0	0	0	112.7	E319 S320 V326	E319-A322 PolarHBondContact O-N 2.76Å; S320-A322 VanDerWaalsContact C-N 3.31Å; S320-A322 PolarHBondContact O-N 3.01Å; A322-V326 WeakPolarHBondContact O-CG2 2.98Å; A322-V326 PolarHBondContact O-N 3.21Å
323	L	33.3	Very low	33.2	Very low	118 Å²	118	121.4 Å²	121.4	62%	0.618	68%	0.675	S	S	*	*	H	α-helix	trans	-73.1	-36.2	174.4	-73.9	169.7	0	0	0	112.2	E319 S320 E321 V326 L327	E319-L323 PolarHBondContact O-N 3.25Å; S320-L323 PolarHBondContact O-N 3.33Å; E321-L323 PolarHBondContact O-N 3.12Å; L323-V326 PolarHBondContact O-N 3.34Å; L323-L327 WeakPolarHBondContact O-CB 3.47Å; L323-L327 PolarHBondContact O-N 2.69Å
324	Q	37.5	Very low	33.4	Very low	139 Å²	139	119.2 Å²	119.2	65%	0.65	67%	0.671	S	S	*	*	H	α-helix	trans	-71	-30.3	-179.2	-157	161.3	26.6	0	0	112.7	S320 E321 S328	S320-Q324 VanDerWaalsContact O-CB 3.29Å; S320-Q324 WeakPolarHBondContact O-CB 3.37Å; S320-Q324 PolarHBondContact O-N 3.4Å; E321-Q324 PolarHBondContact O-N 3.46Å; Q324-S328 WeakPolarHBondContact O-CB 3.28Å; Q324-S328 PolarHBondContact O-N 3.21Å; Q324-S328 PolarHBondContact O-OG 2.66Å
325	L	34.2	Very low	33.6	Very low	130 Å²	130	120.9 Å²	120.9	68%	0.681	68%	0.676	S	S	*	*	H	α-helix	trans	-72.9	-29.2	170	-102.2	159.6	0	0	0	113.7	E321 S328	E321-L325 WeakPolarHBondContact O-CB 3.47Å; E321-L325 PolarHBondContact O-N 2.89Å; L325-S328 WeakPolarHBondContact CA-OG 3.4Å; L325-S328 PolarHBondContact O-OG 2.77Å
326	V	37.3	Very low	33.9	Very low	100 Å²	100	119.2 Å²	119.2	61%	0.606	67%	0.666	S	S	*	*	H	α-helix	trans	-75.8	-43.7	174.5	171.2	0	0	0	0	110.8	A322 L323 S328 S329	A322-V326 WeakPolarHBondContact O-CG2 2.98Å; A322-V326 PolarHBondContact O-N 3.21Å; L323-V326 PolarHBondContact O-N 3.34Å; V326-S328 VanDerWaalsContact C-N 3.35Å; V326-S328 PolarHBondContact O-N 2.92Å; V326-S329 PolarHBondContact O-OG 3.14Å
327	L	33.8	Very low	34.7	Very low	142 Å²	142	117.5 Å²	117.5	74%	0.743	66%	0.658	S	S	*	*	H	α-helix	trans	-72.7	-19.9	-177.7	-77.6	162.7	0	0	0	114.7	L323 S329	L323-L327 WeakPolarHBondContact O-CB 3.47Å; L323-L327 PolarHBondContact O-N 2.69Å; L327-S329 VanDerWaalsContact C-N 3.26Å; L327-S329 PolarHBondContact O-N 2.74Å
328	S	34.5	Very low	35.2	Very low	90 Å²	90	117.1 Å²	117.1	63%	0.629	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	7.8	179	45.9	0	0	0	0	114.7	Q324 L325 V326	Q324-S328 WeakPolarHBondContact O-CB 3.28Å; Q324-S328 PolarHBondContact O-N 3.21Å; Q324-S328 PolarHBondContact O-OG 2.66Å; L325-S328 WeakPolarHBondContact CA-OG 3.4Å; L325-S328 PolarHBondContact O-OG 2.77Å; V326-S328 VanDerWaalsContact C-N 3.35Å; V326-S328 PolarHBondContact O-N 2.92Å
329	S	33.4	Very low	35.7	Very low	84 Å²	84	112.3 Å²	112.3	59%	0.587	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	7.3	-170.9	69.5	0	0	0	0	116	V326 L327	V326-S329 PolarHBondContact O-OG 3.14Å; L327-S329 VanDerWaalsContact C-N 3.26Å; L327-S329 PolarHBondContact O-N 2.74Å
330	H	32.7	Very low	36.1	Very low	172 Å²	172	110.7 Å²	110.7	80%	0.796	63%	0.627	S	S	*	*	S	Bend	trans	-124.4	133.6	176.6	-84.2	11	0	0	0	112.2
331	A	30.8	Very low	36.3	Very low	98 Å²	98	113.9 Å²	113.9	81%	0.81	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-70.4	146.5	-171.6	0	0	0	0	0	113	P333	A331-P333 WeakPolarHBondContact O-CD 3.07Å
332	E	28.9	Very low	36.7	Very low	192 Å²	192	108.9 Å²	108.9	90%	0.897	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-66.9	124.5	-178.3	-59.6	-173.4	129.4	0	0	112.4
333	P	29.7	Very low	37.1	Very low	110 Å²	110	108.9 Å²	108.9	71%	0.714	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-75.6	152.5	155.5	33.1	-32.4	0	0	0	110	A331	A331-P333 WeakPolarHBondContact O-CD 3.07Å
334	P	31.2	Very low	37.4	Very low	121 Å²	121	108.8 Å²	108.8	79%	0.786	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-66.1	161.2	-175.4	26.6	-34.7	0	0	0	113.9	S336	P334-S336 PolarHBondContact O-N 3.31Å
335	K	31.8	Very low	37.5	Very low	200 Å²	200	108 Å²	108	87%	0.87	60%	0.6	S	S	*	*	S	Bend	trans	-68.3	104.1	-168.9	-58.1	174.9	-178	-179.8	0	113.2
336	S	36.3	Very low	37.8	Very low	62 Å²	62	105.1 Å²	105.1	43%	0.434	59%	0.586	S	S	.	*			trans	-140	-18.7	162.7	77.4	0	0	0	0	115.7	P334 V338 T339 E340	P334-S336 PolarHBondContact O-N 3.31Å; S336-V338 PolarHBondContact O-N 3.38Å; S336-T339 PolarHBondContact O-OG1 2.97Å; S336-E340 WeakPolarHBondContact O-CB 3.39Å; S336-E340 PolarHBondContact O-N 3.46Å; S336-E340 PolarHBondContact OG-OE2 3.21Å; S336-E340 VanDerWaalsContact OG-OE2 3.08Å
337	S	48.6	Very low	37.9	Very low	61 Å²	61	103.3 Å²	103.3	43%	0.427	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	24.2	-152.2	81.3	0	0	0	0	118	K341	S337-K341 WeakPolarHBondContact O-CD 3.43Å; S337-K341 WeakPolarHBondContact O-CG 3.22Å; S337-K341 PolarHBondContact O-NZ 3.35Å; S337-K341 PolarHBondContact OG-NZ 2.82Å
338	V	43.4	Very low	38.1	Very low	83 Å²	83	103 Å²	103	50%	0.503	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.1	-66.4	171	-177.8	0	0	0	0	109.7	S336 E340 K341 F342	S336-V338 PolarHBondContact O-N 3.38Å; V338-E340 PolarHBondContact O-N 2.9Å; V338-K341 CarbonylContact O-C 3.05Å; V338-K341 PolarHBondContact O-N 3.08Å; V338-F342 PolarHBondContact O-N 3.19Å
339	T	47.2	Very low	38.3	Very low	64 Å²	64	101.5 Å²	101.5	39%	0.393	56%	0.559	S	S	.	*	H	α-helix	trans	-42.7	-50.8	166.9	40	0	0	0	0	111.8	E91 S336 K341 F342 A343	E91-T339 HydrophobicContact CB-CG2 4.39Å; E91-T339 VanDerWaalsContact CD-CG2 3.42Å; E91-T339 HydrophobicContact CG-CG2 3.96Å; E91-T339 VanDerWaalsContact OE2-CG2 3.31Å; E91-T339 WeakPolarHBondContact OE2-CG2 3.3Å; S336-T339 PolarHBondContact O-OG1 2.97Å; T339-K341 PolarHBondContact O-N 3.08Å; T339-F342 PolarHBondContact O-N 2.92Å; T339-A343 VanDerWaalsContact O-CB 3.24Å; T339-A343 WeakPolarHBondContact O-CB 3.4Å; T339-A343 PolarHBondContact O-N 3.38Å
340	E	45.5	Very low	38.5	Very low	116 Å²	116	104.5 Å²	104.5	54%	0.542	56%	0.564	S	S	.	*	H	α-helix	trans	-69.2	-31.5	-177.5	-166.4	168.8	-141.9	0	0	112.7	S336 V338 Q344	S336-E340 WeakPolarHBondContact O-CB 3.39Å; S336-E340 PolarHBondContact O-N 3.46Å; S336-E340 PolarHBondContact OG-OE2 3.21Å; S336-E340 VanDerWaalsContact OG-OE2 3.08Å; V338-E340 PolarHBondContact O-N 2.9Å; E340-Q344 WeakPolarHBondContact O-CB 3.37Å; E340-Q344 PolarHBondContact O-N 2.91Å
341	K	41.1	Very low	38.5	Very low	125 Å²	125	102.9 Å²	102.9	54%	0.543	56%	0.561	S	S	.	*	H	α-helix	trans	-76.6	-32.2	171.5	-73.9	-168.8	-160.1	101.6	0	112.7	S337 V338 T339 Q344 F345	S337-K341 WeakPolarHBondContact O-CD 3.43Å; S337-K341 WeakPolarHBondContact O-CG 3.22Å; S337-K341 PolarHBondContact O-NZ 3.35Å; S337-K341 PolarHBondContact OG-NZ 2.82Å; V338-K341 CarbonylContact O-C 3.05Å; V338-K341 PolarHBondContact O-N 3.08Å; T339-K341 PolarHBondContact O-N 3.08Å; K341-Q344 CarbonylContact O-C 3.5Å; K341-F345 VanDerWaalsContact O-CB 3.24Å; K341-F345 WeakPolarHBondContact O-CB 3.23Å; K341-F345 PolarHBondContact O-N 2.96Å
342	F	43.5	Very low	38.8	Very low	21 Å²	21	101.5 Å²	101.5	9%	0.092	54%	0.539	C	S	.	.	H	α-helix	trans	-70.5	-46.9	175.6	-120.9	-89	0	0	0	110.7	F22 Y26 T113 L126 F128 V338 T339 Q344 F345 L346	F22-F342 HydrophobicContact CE1-CE1 4.24Å; F22-F342 HydrophobicContact CE1-CE2 4.06Å; F22-F342 AromaticContact CE1-CZ 3.42Å; F22-F342 HydrophobicContact CE1-CZ 3.42Å; F22-F342 VanDerWaalsContact CE1-CZ 3.42Å; F22-F342 HydrophobicContact CE2-CZ 4.37Å; F22-F342 AromaticContact CZ-CE1 3.78Å; F22-F342 HydrophobicContact CZ-CE1 3.78Å; F22-F342 HydrophobicContact CZ-CE2 4.38Å; F22-F342 AromaticContact CZ-CZ 3.33Å; F22-F342 HydrophobicContact CZ-CZ 3.33Å; Y26-F342 HydrophobicContact CE2-CE2 4.42Å; T113-F342 HydrophobicContact CG2-CD1 4.41Å; L126-F342 HydrophobicContact CD1-CE1 4.24Å; L126-F342 HydrophobicContact CD1-CZ 4.4Å; F128-F342 HydrophobicContact CE2-CE2 4.36Å; F128-F342 HydrophobicContact CE2-CZ 4.04Å; F128-F342 HydrophobicContact CZ-CE2 4.13Å; F128-F342 AromaticContact CZ-CZ 3.72Å; F128-F342 HydrophobicContact CZ-CZ 3.72Å; V338-F342 PolarHBondContact O-N 3.19Å; T339-F342 PolarHBondContact O-N 2.92Å; F342-Q344 VanDerWaalsContact C-N 3.32Å; F342-Q344 PolarHBondContact O-N 3.49Å; F342-F345 WeakPolarHBondContact O-CB 3.39Å; F342-F345 PolarHBondContact O-N 3.49Å; F342-F345 VanDerWaalsContact O-N 3.11Å; F342-L346 HydrophobicContact CD1-CD1 4.29Å; F342-L346 WeakPolarHBondContact O-CB 3.11Å; F342-L346 VanDerWaalsContact O-CG 3.3Å; F342-L346 WeakPolarHBondContact O-CG 3.24Å; F342-L346 PolarHBondContact O-N 2.82Å
343	A	44.1	Very low	39	Very low	58 Å²	58	96 Å²	96	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-59.8	-42	170.9	0	0	0	0	0	110.9	T339 F345 L346 S347	T339-A343 VanDerWaalsContact O-CB 3.24Å; T339-A343 WeakPolarHBondContact O-CB 3.4Å; T339-A343 PolarHBondContact O-N 3.38Å; A343-F345 VanDerWaalsContact C-N 3.33Å; A343-F345 PolarHBondContact O-N 3.16Å; A343-L346 PolarHBondContact O-N 3.33Å; A343-S347 WeakPolarHBondContact O-CA 3.04Å; A343-S347 WeakPolarHBondContact O-CB 3.43Å; A343-S347 PolarHBondContact O-N 3.4Å; A343-S347 PolarHBondContact O-OG 2.87Å; A343-S347 VanDerWaalsContact O-OG 3.13Å
344	Q	40.7	Very low	39.1	Very low	117 Å²	117	96 Å²	96	55%	0.547	51%	0.511	S	S	.	.	H	α-helix	trans	-71.8	-21.3	174.3	-174.7	166.7	90.8	0	0	113.8	E340 K341 F342 M348	E340-Q344 WeakPolarHBondContact O-CB 3.37Å; E340-Q344 PolarHBondContact O-N 2.91Å; K341-Q344 CarbonylContact O-C 3.5Å; F342-Q344 VanDerWaalsContact C-N 3.32Å; F342-Q344 PolarHBondContact O-N 3.49Å; Q344-M348 WeakPolarHBondContact O-CB 3.33Å; Q344-M348 WeakPolarHBondContact O-CG 3.26Å; Q344-M348 PolarHBondContact O-N 3.39Å
345	F	39.6	Very low	39	Very low	121 Å²	121	93.3 Å²	93.3	53%	0.531	49%	0.488	S	S	.	.	H	α-helix	trans	-77.4	-46.4	171.7	-167.1	-98.8	0	0	0	110.2	K341 F342 A343 S347 M348 D349	K341-F345 VanDerWaalsContact O-CB 3.24Å; K341-F345 WeakPolarHBondContact O-CB 3.23Å; K341-F345 PolarHBondContact O-N 2.96Å; F342-F345 WeakPolarHBondContact O-CB 3.39Å; F342-F345 PolarHBondContact O-N 3.49Å; F342-F345 VanDerWaalsContact O-N 3.11Å; A343-F345 VanDerWaalsContact C-N 3.33Å; A343-F345 PolarHBondContact O-N 3.16Å; F345-S347 VanDerWaalsContact C-N 3.34Å; F345-S347 PolarHBondContact O-N 3.46Å; F345-M348 PolarHBondContact O-N 2.84Å; F345-D349 PolarHBondContact O-N 3.43Å
346	L	40.4	Very low	39.1	Very low	71 Å²	71	89.7 Å²	89.7	37%	0.372	47%	0.474	S	S	.	.	H	α-helix	trans	-66.8	-31.3	174.5	-66.7	167.2	0	0	0	112.6	F342 A343 D349 E350	F342-L346 HydrophobicContact CD1-CD1 4.29Å; F342-L346 WeakPolarHBondContact O-CB 3.11Å; F342-L346 VanDerWaalsContact O-CG 3.3Å; F342-L346 WeakPolarHBondContact O-CG 3.24Å; F342-L346 PolarHBondContact O-N 2.82Å; A343-L346 PolarHBondContact O-N 3.33Å; L346-D349 CarbonylContact O-C 3.49Å; L346-D349 PolarHBondContact O-N 3.13Å; L346-E350 PolarHBondContact O-N 3.15Å
347	S	39	Very low	39	Very low	62 Å²	62	92.7 Å²	92.7	43%	0.434	48%	0.476	S	S	.	.	H	α-helix	trans	-92.9	-16.5	176.6	86.1	0	0	0	0	113.7	A343 F345 E350	A343-S347 WeakPolarHBondContact O-CA 3.04Å; A343-S347 WeakPolarHBondContact O-CB 3.43Å; A343-S347 PolarHBondContact O-N 3.4Å; A343-S347 PolarHBondContact O-OG 2.87Å; A343-S347 VanDerWaalsContact O-OG 3.13Å; F345-S347 VanDerWaalsContact C-N 3.34Å; F345-S347 PolarHBondContact O-N 3.46Å; S347-E350 VanDerWaalsContact O-CB 3.23Å; S347-E350 WeakPolarHBondContact O-CB 3.34Å; S347-E350 PolarHBondContact O-N 3.08Å
348	M	37.1	Very low	38.4	Very low	134 Å²	134	96.4 Å²	96.4	66%	0.66	49%	0.485	S	S	*	.	H	α-helix	trans	-64.2	-30.5	157	-86.8	173.1	49.5	0	0	110.8	Q344 F345 E350	Q344-M348 WeakPolarHBondContact O-CB 3.33Å; Q344-M348 WeakPolarHBondContact O-CG 3.26Å; Q344-M348 PolarHBondContact O-N 3.39Å; F345-M348 PolarHBondContact O-N 2.84Å; M348-E350 VanDerWaalsContact C-N 3.33Å
349	D	40.5	Very low	37.8	Very low	59 Å²	59	96.9 Å²	96.9	32%	0.316	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-87	10.3	170.2	-79.9	-15.6	0	0	0	113.9	F345 L346 D351 L352 H353	F345-D349 PolarHBondContact O-N 3.43Å; L346-D349 CarbonylContact O-C 3.49Å; L346-D349 PolarHBondContact O-N 3.13Å; D349-D351 PolarHBondContact O-N 3.31Å; D349-L352 HydrophobicContact CB-CB 3.8Å; D349-L352 HydrophobicContact CB-CD2 4.39Å; D349-L352 CarbonylContact O-C 3.59Å; D349-L352 VanDerWaalsContact O-CA 3.24Å; D349-L352 WeakPolarHBondContact O-CA 3.17Å; D349-L352 WeakPolarHBondContact O-CB 3.49Å; D349-L352 PolarHBondContact O-N 3.44Å; D349-H353 PolarHBondContact O-CD2 3.11Å; D349-H353 PolarHBondContact O-N 3.45Å
350	E	36.7	Very low	37.5	Very low	148 Å²	148	96.2 Å²	96.2	69%	0.692	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-66.6	-27.9	168.4	-150.8	162	-154.4	0	0	110.8	L346 S347 M348 L352	L346-E350 PolarHBondContact O-N 3.15Å; S347-E350 VanDerWaalsContact O-CB 3.23Å; S347-E350 WeakPolarHBondContact O-CB 3.34Å; S347-E350 PolarHBondContact O-N 3.08Å; M348-E350 VanDerWaalsContact C-N 3.33Å; E350-L352 PolarHBondContact O-N 2.68Å
351	D	33.6	Very low	37.5	Very low	137 Å²	137	93.8 Å²	93.8	73%	0.733	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-78.6	8	166.9	-131.5	13.9	0	0	0	112.4	D349 R362	D349-D351 PolarHBondContact O-N 3.31Å; D351-R362 PolarHBondContact O-NH1 2.87Å
352	L	37	Very low	37.8	Very low	70 Å²	70	92.2 Å²	92.2	37%	0.366	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	-33.1	176.3	-140.9	80.6	0	0	0	113.5	D349 E350 V354 R362	D349-L352 HydrophobicContact CB-CB 3.8Å; D349-L352 HydrophobicContact CB-CD2 4.39Å; D349-L352 CarbonylContact O-C 3.59Å; D349-L352 VanDerWaalsContact O-CA 3.24Å; D349-L352 WeakPolarHBondContact O-CA 3.17Å; D349-L352 WeakPolarHBondContact O-CB 3.49Å; D349-L352 PolarHBondContact O-N 3.44Å; E350-L352 PolarHBondContact O-N 2.68Å; L352-V354 PolarHBondContact O-N 2.68Å; L352-V354 VanDerWaalsContact O-N 3.08Å; L352-R362 PolarHBondContact O-NH1 3.3Å; L352-R362 VanDerWaalsContact O-NH1 3.14Å; L352-R362 PolarHBondContact O-NH2 3.28Å
353	H	32.7	Very low	38.5	Very low	75 Å²	75	93.7 Å²	93.7	35%	0.347	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	66.5	-172.6	-78.5	-67.3	0	0	0	116.1	E118 D349	E118-H353 HydrophobicContact CG-CB 4.14Å; E118-H353 VanDerWaalsContact OE1-C 3.31Å; E118-H353 WeakPolarHBondContact OE1-CA 3.4Å; D349-H353 PolarHBondContact O-CD2 3.11Å; D349-H353 PolarHBondContact O-N 3.45Å
354	V	31.9	Very low	39.4	Very low	110 Å²	110	96 Å²	96	67%	0.667	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.4	8.2	164.9	-146	0	0	0	0	114.6	E118 L352 R362	E118-V354 PolarHBondContact OE1-N 3.12Å; L352-V354 PolarHBondContact O-N 2.68Å; L352-V354 VanDerWaalsContact O-N 3.08Å; V354-R362 VanDerWaalsContact CB-NH2 3.3Å; V354-R362 VanDerWaalsContact N-NH2 3.19Å
355	E	29.5	Very low	40.8	Very low	66 Å²	66	98.3 Å²	98.3	31%	0.308	48%	0.481	S	S	.	.			trans	-142	16.7	-164.7	-83.1	-177.9	151	0	0	115.4	E118 R357 Q359 R362	E118-E355 PolarHBondContact OE1-N 3.31Å; E118-E355 PolarHBondContact OE2-N 3.48Å; E355-R357 PolarHBondContact O-N 3.01Å; E355-Q359 HydrophobicContact CB-CB 3.73Å; E355-Q359 HydrophobicContact CB-CG 4.18Å; E355-Q359 VanDerWaalsContact CD-CG 3.5Å; E355-Q359 HydrophobicContact CG-CB 4.03Å; E355-Q359 HydrophobicContact CG-CG 3.92Å; E355-Q359 WeakPolarHBondContact O-CB 3.09Å; E355-Q359 WeakPolarHBondContact OE1-CG 3.02Å; E355-Q359 PolarHBondContact OE1-NE2 3.42Å; E355-R362 VanDerWaalsContact CG-NH2 3.34Å; E355-R362 VanDerWaalsContact OE2-CG 3.28Å; E355-R362 WeakPolarHBondContact OE2-CG 3.42Å; E355-R362 IonicContact OE2-CZ 3.21Å; E355-R362 IonicContact OE2-NE 3.31Å; E355-R362 PolarHBondContact OE2-NE 2.95Å; E355-R362 IonicContact OE2-NH2 2.68Å; E355-R362 PolarHBondContact OE2-NH2 3.45Å
356	H	33.5	Very low	42.6	Very low	124 Å²	124	101.2 Å²	101.2	57%	0.574	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	12	179.6	-79.2	-135.8	0	0	0	114.8	E118	E118-H356 HydrophobicContact CG-CB 4.41Å; E118-H356 IonicContact OE1-CD2 2.71Å; E118-H356 PolarHBondContact OE1-CD2 3.48Å; E118-H356 IonicContact OE1-CG 3.82Å; E118-H356 PolarHBondContact OE1-N 3.35Å; E118-H356 VanDerWaalsContact OE1-N 3.08Å; E118-H356 WeakPolarHBondContact OE2-CB 3.29Å; E118-H356 PolarHBondContact OE2-N 2.91Å
357	R	32.6	Very low	44.7	Very low	125 Å²	125	98.8 Å²	98.8	47%	0.472	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	109.6	159.8	-57.4	-157.9	-172.8	178.3	3.8	110	E355 Q359 E1032	E355-R357 PolarHBondContact O-N 3.01Å; R357-Q359 PolarHBondContact O-N 3.49Å; R357-E1032 WeakPolarHBondContact CD-OE1 3.43Å; R357-E1032 IonicContact CZ-OE1 3.46Å; R357-E1032 IonicContact NE-OE1 3.72Å; R357-E1032 IonicContact NH1-OE1 2.73Å; R357-E1032 PolarHBondContact NH1-OE1 3.34Å; R357-E1032 IonicContact NH1-OE2 3.91Å
358	F	37.1	Very low	47	Very low	138 Å²	138	97.5 Å²	97.5	61%	0.605	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	-17.8	171.8	-80.3	-57.7	0	0	0	120.3	S360 R1036	F358-S360 PolarHBondContact O-N 2.95Å; F358-R1036 HydrophobicContact CE2-CG 3.53Å; F358-R1036 HydrophobicContact CZ-CB 4.5Å; F358-R1036 VanDerWaalsContact CZ-CD 3.45Å; F358-R1036 HydrophobicContact CZ-CG 3.53Å
359	Q	30	Very low	49.3	Very low	94 Å²	94	94 Å²	94	44%	0.439	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-61.7	131	-169.7	-136.8	85.6	-51.1	0	0	112.1	E355 R357	E355-Q359 HydrophobicContact CB-CB 3.73Å; E355-Q359 HydrophobicContact CB-CG 4.18Å; E355-Q359 VanDerWaalsContact CD-CG 3.5Å; E355-Q359 HydrophobicContact CG-CB 4.03Å; E355-Q359 HydrophobicContact CG-CG 3.92Å; E355-Q359 WeakPolarHBondContact O-CB 3.09Å; E355-Q359 WeakPolarHBondContact OE1-CG 3.02Å; E355-Q359 PolarHBondContact OE1-NE2 3.42Å; R357-Q359 PolarHBondContact O-N 3.49Å
360	S	41.1	Very low	51.4	Low	49 Å²	49	92.2 Å²	92.2	34%	0.343	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-57.9	137.1	171.9	69.3	0	0	0	0	109.3	F358 R362 K369	F358-S360 PolarHBondContact O-N 2.95Å; S360-R362 PolarHBondContact O-N 3.23Å; S360-K369 PolarHBondContact OG-NZ 3.44Å
361	P	44.9	Very low	53.5	Low	65 Å²	65	88.2 Å²	88.2	42%	0.422	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-50	133.5	-162	17.9	-33.4	0	0	0	112.9	I8 M363	I8-P361 HydrophobicContact CG2-CG 4.17Å; P361-M363 WeakPolarHBondContact O-CG 3.22Å; P361-M363 PolarHBondContact O-N 3.17Å
362	R	48.8	Very low	55.9	Low	92 Å²	92	83.3 Å²	83.3	35%	0.347	40%	0.396	S	S	.	.			trans	-49.5	101	-177	-77.7	-172.3	176	179.3	11.4	111	D351 L352 V354 E355 S360	D351-R362 PolarHBondContact O-NH1 2.87Å; L352-R362 PolarHBondContact O-NH1 3.3Å; L352-R362 VanDerWaalsContact O-NH1 3.14Å; L352-R362 PolarHBondContact O-NH2 3.28Å; V354-R362 VanDerWaalsContact CB-NH2 3.3Å; V354-R362 VanDerWaalsContact N-NH2 3.19Å; E355-R362 VanDerWaalsContact CG-NH2 3.34Å; E355-R362 VanDerWaalsContact OE2-CG 3.28Å; E355-R362 WeakPolarHBondContact OE2-CG 3.42Å; E355-R362 IonicContact OE2-CZ 3.21Å; E355-R362 IonicContact OE2-NE 3.31Å; E355-R362 PolarHBondContact OE2-NE 2.95Å; E355-R362 IonicContact OE2-NH2 2.68Å; E355-R362 PolarHBondContact OE2-NH2 3.45Å; S360-R362 PolarHBondContact O-N 3.23Å
363	M	58.2	Low	58.3	Low	52 Å²	52	84 Å²	84	26%	0.256	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-83.4	137.1	178.7	-73.9	179.7	60.9	0	0	109.7	P361 K365 T367 K369 T487	P361-M363 WeakPolarHBondContact O-CG 3.22Å; P361-M363 PolarHBondContact O-N 3.17Å; M363-K365 PolarHBondContact O-N 3.44Å; M363-T367 HydrophobicContact CE-CG2 3.47Å; M363-T367 VanDerWaalsContact CE-CG2 3.47Å; M363-T367 WeakPolarHBondContact CE-O 3.41Å; M363-K369 HydrophobicContact CE-CG 3.84Å; M363-K369 HydrophobicContact SD-CD 4Å; M363-K369 WeakPolarHBondContact SD-CE 3.41Å; M363-K369 HydrophobicContact SD-CG 3.34Å; M363-K369 WeakPolarHBondContact SD-CG 3.47Å; M363-T487 HydrophobicContact CE-CG2 3.45Å; M363-T487 VanDerWaalsContact CE-CG2 3.45Å
364	H	61.9	Low	61	Low	108 Å²	108	86 Å²	86	50%	0.5	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-49.3	134.6	173.3	-174.1	-66.1	0	0	0	110.5	F366 T367	H364-F366 PolarHBondContact O-N 3.31Å; H364-T367 WeakPolarHBondContact O-CB 3.36Å; H364-T367 PolarHBondContact O-N 3Å; H364-T367 PolarHBondContact O-OG1 3.43Å
365	K	70	Confident	63.7	Low	164 Å²	164	81.4 Å²	81.4	71%	0.713	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	129.6	177.7	-65.6	169.6	-177.9	165.6	0	109.4	M363	M363-K365 PolarHBondContact O-N 3.44Å
366	F	79	Confident	66.4	Low	183 Å²	183	79.1 Å²	79.1	80%	0.803	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	41.9	-171.4	-45.7	-82.9	0	0	0	116.3	H364 R485	H364-F366 PolarHBondContact O-N 3.31Å; F366-R485 WeakPolarHBondContact O-CD 3.26Å; F366-R485 PolarHBondContact O-NH1 3.43Å
367	T	84.2	Confident	69	Low	20 Å²	20	76.9 Å²	76.9	12%	0.123	37%	0.369	C	S	.	.			trans	-115.8	135	161.6	-59.7	0	0	0	0	109.7	M363 H364 R485 T487 I502	M363-T367 HydrophobicContact CE-CG2 3.47Å; M363-T367 VanDerWaalsContact CE-CG2 3.47Å; M363-T367 WeakPolarHBondContact CE-O 3.41Å; H364-T367 WeakPolarHBondContact O-CB 3.36Å; H364-T367 PolarHBondContact O-N 3Å; H364-T367 PolarHBondContact O-OG1 3.43Å; T367-R485 CarbonylContact C-O 3.56Å; T367-R485 WeakPolarHBondContact CA-O 3.34Å; T367-R485 VanDerWaalsContact CG2-O 3.28Å; T367-R485 WeakPolarHBondContact CG2-O 3.47Å; T367-T487 HydrophobicContact CG2-CG2 3.82Å; T367-I502 HydrophobicContact CG2-CD1 3.92Å
368	L	87.1	Confident	71.7	Confident	35 Å²	35	72.3 Å²	72.3	18%	0.183	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-103.8	133.3	-175.5	-179.6	61.1	0	0	0	111.8	F374 K375 I482 R485 T486 T487	L368-F374 HydrophobicContact CD1-CD1 4.17Å; L368-F374 HydrophobicContact CD2-CD1 3.93Å; L368-F374 HydrophobicContact CD2-CE1 4.23Å; L368-K375 HydrophobicContact CD2-CB 4.06Å; L368-K375 HydrophobicContact CD2-CD 4.14Å; L368-K375 HydrophobicContact CD2-CG 4.46Å; L368-K375 HydrophobicContact CG-CB 4.41Å; L368-I482 HydrophobicContact CD2-CG2 3.9Å; L368-R485 PolarHBondContact N-O 3.26Å; L368-T486 HydrophobicContact CB-CG2 4.13Å; L368-T486 HydrophobicContact CD2-CG2 3.91Å; L368-T486 HydrophobicContact CG-CG2 4.2Å; L368-T486 CarbonylContact O-C 3.6Å; L368-T486 WeakPolarHBondContact O-CA 3.43Å; L368-T487 PolarHBondContact O-N 2.72Å
369	K	85.8	Confident	74.1	Confident	60 Å²	60	66 Å²	66	26%	0.261	32%	0.324	S	S	.	.			trans	-70	129.2	174.9	-64.9	169.1	-180	177	0	110.3	S360 M363 Y371 S372	S360-K369 PolarHBondContact OG-NZ 3.44Å; M363-K369 HydrophobicContact CE-CG 3.84Å; M363-K369 HydrophobicContact SD-CD 4Å; M363-K369 WeakPolarHBondContact SD-CE 3.41Å; M363-K369 HydrophobicContact SD-CG 3.34Å; M363-K369 WeakPolarHBondContact SD-CG 3.47Å; K369-Y371 HydrophobicContact CB-CD2 4.42Å; K369-Y371 HydrophobicContact CB-CE1 4.33Å; K369-Y371 HydrophobicContact CB-CE2 4.23Å; K369-Y371 HydrophobicContact CD-CE2 3.82Å; K369-Y371 HydrophobicContact CG-CE2 4.42Å; K369-Y371 PolarHBondContact O-N 3.03Å; K369-S372 WeakPolarHBondContact O-CB 3.48Å; K369-S372 PolarHBondContact O-N 3.41Å
370	H	83.8	Confident	76.8	Confident	21 Å²	21	67.7 Å²	67.7	10%	0.097	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.3	176.3	62.9	-93.6	0	0	0	114.3	T487 V489	H370-T487 WeakPolarHBondContact CB-O 3.47Å; H370-T487 PolarHBondContact N-OG1 3.16Å; H370-T487 VanDerWaalsContact N-OG1 3.14Å; H370-T487 PolarHBondContact ND1-OG1 3.34Å; H370-V489 VanDerWaalsContact CE1-CG2 3.41Å; H370-V489 WeakPolarHBondContact CE1-CG2 3.28Å
371	Y	81.4	Confident	79.1	Confident	65 Å²	65	69 Å²	69	26%	0.255	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	8.5	174.3	61.9	-101.5	0	0	0	113.7	K369	K369-Y371 HydrophobicContact CB-CD2 4.42Å; K369-Y371 HydrophobicContact CB-CE1 4.33Å; K369-Y371 HydrophobicContact CB-CE2 4.23Å; K369-Y371 HydrophobicContact CD-CE2 3.82Å; K369-Y371 HydrophobicContact CG-CE2 4.42Å; K369-Y371 PolarHBondContact O-N 3.03Å
372	S	84.3	Confident	81.3	Confident	34 Å²	34	66 Å²	66	24%	0.238	31%	0.31	C	S	.	.			trans	-64.4	139.6	175.7	-178.9	0	0	0	0	111.2	K369 F374 K375 A376	K369-S372 WeakPolarHBondContact O-CB 3.48Å; K369-S372 PolarHBondContact O-N 3.41Å; S372-F374 PolarHBondContact O-N 2.89Å; S372-F374 PolarHBondContact OG-N 2.75Å; S372-K375 PolarHBondContact O-N 3.26Å; S372-A376 PolarHBondContact O-N 2.84Å
373	V	87.1	Confident	83	Confident	85 Å²	85	62.4 Å²	62.4	52%	0.515	30%	0.298	S	S	.	.	H	α-helix	trans	-54.6	-41.2	172.6	-177	0	0	0	0	110.4	K375 A376 V377	V373-K375 PolarHBondContact O-N 2.88Å; V373-A376 PolarHBondContact O-N 3Å; V373-V377 HydrophobicContact CG1-CG2 4.47Å; V373-V377 WeakPolarHBondContact O-CG2 3.46Å; V373-V377 PolarHBondContact O-N 2.68Å
374	F	89.6	Confident	84.4	Confident	115 Å²	115	62.8 Å²	62.8	50%	0.504	31%	0.309	S	S	.	.	H	α-helix	trans	-59.3	-43.5	175.2	177.2	-97.1	0	0	0	112.5	L368 S372 A376 V377 W378	L368-F374 HydrophobicContact CD1-CD1 4.17Å; L368-F374 HydrophobicContact CD2-CD1 3.93Å; L368-F374 HydrophobicContact CD2-CE1 4.23Å; S372-F374 PolarHBondContact O-N 2.89Å; S372-F374 PolarHBondContact OG-N 2.75Å; F374-A376 VanDerWaalsContact C-N 3.33Å; F374-A376 PolarHBondContact O-N 3.34Å; F374-V377 PolarHBondContact O-N 3.28Å; F374-W378 HydrophobicContact CZ-CE3 4.34Å; F374-W378 VanDerWaalsContact O-CB 3.26Å; F374-W378 WeakPolarHBondContact O-CB 3.34Å; F374-W378 PolarHBondContact O-N 3.42Å
375	K	88	Confident	85.7	Confident	15 Å²	15	59.1 Å²	59.1	7%	0.065	29%	0.293	C	S	.	.	H	α-helix	trans	-67.6	-34.8	177.4	-173.3	54.4	167.2	81.2	0	111.5	L368 S372 V373 D379 I482 T486	L368-K375 HydrophobicContact CD2-CB 4.06Å; L368-K375 HydrophobicContact CD2-CD 4.14Å; L368-K375 HydrophobicContact CD2-CG 4.46Å; L368-K375 HydrophobicContact CG-CB 4.41Å; S372-K375 PolarHBondContact O-N 3.26Å; V373-K375 PolarHBondContact O-N 2.88Å; K375-D379 IonicContact NZ-OD1 3.47Å; K375-D379 PolarHBondContact NZ-OD1 2.71Å; K375-D379 IonicContact NZ-OD2 3.12Å; K375-D379 PolarHBondContact NZ-OD2 2.93Å; K375-D379 VanDerWaalsContact O-CB 3.26Å; K375-D379 WeakPolarHBondContact O-CB 3.3Å; K375-D379 VanDerWaalsContact O-CG 3.25Å; K375-D379 PolarHBondContact O-N 2.72Å; K375-I482 HydrophobicContact CD-CG2 4.24Å; K375-T486 HydrophobicContact CD-CG2 3.93Å; K375-T486 VanDerWaalsContact CE-CG2 3.48Å; K375-T486 HydrophobicContact CG-CG2 4.38Å
376	A	85	Confident	86.6	Confident	18 Å²	18	51.4 Å²	51.4	15%	0.149	26%	0.259	C	S	.	.	H	α-helix	trans	-66.1	-44.5	174.9	0	0	0	0	0	112.4	S372 V373 F374 D379 W380	S372-A376 PolarHBondContact O-N 2.84Å; V373-A376 PolarHBondContact O-N 3Å; F374-A376 VanDerWaalsContact C-N 3.33Å; F374-A376 PolarHBondContact O-N 3.34Å; A376-D379 PolarHBondContact O-N 3.03Å; A376-W380 PolarHBondContact O-N 3.45Å
377	V	88.5	Confident	87	Confident	77 Å²	77	46.4 Å²	46.4	47%	0.467	24%	0.24	S	C	.	.	H	α-helix	trans	-63.9	-45.9	174.8	173.4	0	0	0	0	111	V373 F374 D379 W380 I381	V373-V377 HydrophobicContact CG1-CG2 4.47Å; V373-V377 WeakPolarHBondContact O-CG2 3.46Å; V373-V377 PolarHBondContact O-N 2.68Å; F374-V377 PolarHBondContact O-N 3.28Å; V377-D379 VanDerWaalsContact C-N 3.28Å; V377-D379 PolarHBondContact O-N 3.14Å; V377-W380 WeakPolarHBondContact O-CB 3.44Å; V377-W380 PolarHBondContact O-N 3.35Å; V377-I381 HydrophobicContact CG1-CD1 4.13Å; V377-I381 WeakPolarHBondContact O-CG1 3.21Å; V377-I381 PolarHBondContact O-N 2.96Å
378	W	90.8	Very high	87.3	Confident	28 Å²	28	47.5 Å²	47.5	11%	0.106	24%	0.242	C	C	.	.	H	α-helix	trans	-59.2	-39.3	174.3	-174.6	-93.1	0	0	0	112.1	F374 W380 I381 I382 M475 I478 D479 I482	F374-W378 HydrophobicContact CZ-CE3 4.34Å; F374-W378 VanDerWaalsContact O-CB 3.26Å; F374-W378 WeakPolarHBondContact O-CB 3.34Å; F374-W378 PolarHBondContact O-N 3.42Å; W378-W380 VanDerWaalsContact C-N 3.3Å; W378-W380 PolarHBondContact O-N 3.4Å; W378-I381 PolarHBondContact O-N 3.18Å; W378-I382 HydrophobicContact CZ2-CD1 3.97Å; W378-I382 HydrophobicContact CZ2-CG1 4.34Å; W378-I382 WeakPolarHBondContact O-CG1 3.36Å; W378-I382 PolarHBondContact O-N 3.15Å; W378-M475 HydrophobicContact CH2-SD 3.88Å; W378-M475 HydrophobicContact CZ3-SD 4.48Å; W378-I478 HydrophobicContact CH2-CB 4.22Å; W378-I478 HydrophobicContact CH2-CG2 3.6Å; W378-I478 HydrophobicContact CZ2-CB 4.2Å; W378-I478 HydrophobicContact CZ2-CG2 3.71Å; W378-D479 HydrophobicContact CZ2-CB 4.48Å; W378-D479 PolarHBondContact NE1-OD1 3.41Å; W378-I482 HydrophobicContact CD2-CD1 3.84Å; W378-I482 VanDerWaalsContact CE2-CD1 3.47Å; W378-I482 HydrophobicContact CE3-CD1 4.33Å; W378-I482 HydrophobicContact CG-CD1 4.34Å; W378-I482 HydrophobicContact CH2-CD1 4.22Å; W378-I482 HydrophobicContact CZ2-CD1 3.69Å
379	D	87.2	Confident	87.4	Confident	5 Å²	5	46 Å²	46	3%	0.027	23%	0.234	C	C	.	.	H	α-helix	trans	-64.6	-32.3	177.9	-84.1	-34.9	0	0	0	113.6	K375 A376 V377 L383 K554 R557	K375-D379 IonicContact NZ-OD1 3.47Å; K375-D379 PolarHBondContact NZ-OD1 2.71Å; K375-D379 IonicContact NZ-OD2 3.12Å; K375-D379 PolarHBondContact NZ-OD2 2.93Å; K375-D379 VanDerWaalsContact O-CB 3.26Å; K375-D379 WeakPolarHBondContact O-CB 3.3Å; K375-D379 VanDerWaalsContact O-CG 3.25Å; K375-D379 PolarHBondContact O-N 2.72Å; A376-D379 PolarHBondContact O-N 3.03Å; V377-D379 VanDerWaalsContact C-N 3.28Å; V377-D379 PolarHBondContact O-N 3.14Å; D379-L383 WeakPolarHBondContact O-CB 3.04Å; D379-L383 PolarHBondContact O-N 2.92Å; D379-L383 VanDerWaalsContact O-N 3.08Å; D379-K554 HydrophobicContact CB-CD 4.45Å; D379-K554 PolarHBondContact O-NZ 3.18Å; D379-K554 WeakPolarHBondContact OD1-CE 3.3Å; D379-K554 IonicContact OD1-NZ 3.56Å; D379-K554 PolarHBondContact OD1-NZ 3.42Å; D379-R557 IonicContact OD2-CZ 2.74Å; D379-R557 IonicContact OD2-NH1 2.76Å; D379-R557 PolarHBondContact OD2-NH1 2.92Å; D379-R557 IonicContact OD2-NH2 3.73Å
380	W	86.2	Confident	87.6	Confident	130 Å²	130	43.1 Å²	43.1	49%	0.492	22%	0.222	S	C	.	.	H	α-helix	trans	-71.5	-42.7	170.3	-78.4	113.5	0	0	0	113	M1 A376 V377 W378 I382 L383 A384 Y558	M1-W380 HydrophobicContact CE-CZ2 3.98Å; A376-W380 PolarHBondContact O-N 3.45Å; V377-W380 WeakPolarHBondContact O-CB 3.44Å; V377-W380 PolarHBondContact O-N 3.35Å; W378-W380 VanDerWaalsContact C-N 3.3Å; W378-W380 PolarHBondContact O-N 3.4Å; W380-I382 PolarHBondContact O-N 2.77Å; W380-L383 HydrophobicContact CE3-CD2 3.95Å; W380-L383 HydrophobicContact CZ3-CD2 3.95Å; W380-L383 WeakPolarHBondContact O-CB 3.35Å; W380-L383 PolarHBondContact O-N 3.02Å; W380-L383 VanDerWaalsContact O-N 3.16Å; W380-A384 PolarHBondContact O-N 3.21Å; W380-Y558 HydrophobicContact CE3-CE1 4.47Å; W380-Y558 HydrophobicContact CH2-CD1 4.27Å; W380-Y558 AromaticContact CH2-CE1 3.58Å; W380-Y558 HydrophobicContact CH2-CE1 3.58Å; W380-Y558 HydrophobicContact CZ2-CD1 4.45Å; W380-Y558 AromaticContact CZ2-CE1 3.61Å; W380-Y558 HydrophobicContact CZ2-CE1 3.61Å; W380-Y558 HydrophobicContact CZ3-CE1 4.02Å
381	I	90.1	Very high	87.9	Confident	77 Å²	77	45.2 Å²	45.2	40%	0.395	23%	0.233	S	C	.	.	H	α-helix	trans	-58.2	-50.2	175.8	-67.4	167.4	0	0	0	109.6	V377 W378 L383 A384 L385	V377-I381 HydrophobicContact CG1-CD1 4.13Å; V377-I381 WeakPolarHBondContact O-CG1 3.21Å; V377-I381 PolarHBondContact O-N 2.96Å; W378-I381 PolarHBondContact O-N 3.18Å; I381-L383 VanDerWaalsContact C-N 3.31Å; I381-L383 PolarHBondContact O-N 2.93Å; I381-A384 PolarHBondContact O-N 3.07Å; I381-L385 HydrophobicContact CG2-CD1 4.48Å; I381-L385 WeakPolarHBondContact O-CG 3.37Å; I381-L385 PolarHBondContact O-N 3.11Å
382	I	89.5	Confident	88.2	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.015	24%	0.237	C	C	.	.	H	α-helix	trans	-62.5	-36.3	176.9	-65.1	-63.5	0	0	0	111.6	W378 W380 L385 I386 F476 D479	W378-I382 HydrophobicContact CZ2-CD1 3.97Å; W378-I382 HydrophobicContact CZ2-CG1 4.34Å; W378-I382 WeakPolarHBondContact O-CG1 3.36Å; W378-I382 PolarHBondContact O-N 3.15Å; W380-I382 PolarHBondContact O-N 2.77Å; I382-L385 HydrophobicContact CD1-CD1 4.46Å; I382-L385 PolarHBondContact O-N 3.09Å; I382-I386 HydrophobicContact CG2-CD1 4Å; I382-I386 HydrophobicContact CG2-CG1 4.39Å; I382-I386 VanDerWaalsContact O-CG1 3.22Å; I382-I386 WeakPolarHBondContact O-CG1 2.82Å; I382-I386 PolarHBondContact O-N 3.15Å; I382-F476 HydrophobicContact CG2-CE1 4.07Å; I382-D479 HydrophobicContact CD1-CB 3.89Å; I382-D479 HydrophobicContact CG1-CB 4.26Å
383	L	85.5	Confident	88.3	Confident	16 Å²	16	44.8 Å²	44.8	8%	0.084	23%	0.229	C	C	.	.	H	α-helix	trans	-62.4	-44.7	173.9	179.4	62.3	0	0	0	111.9	D379 W380 I381 L385 I386 I387 I551 Y558	D379-L383 WeakPolarHBondContact O-CB 3.04Å; D379-L383 PolarHBondContact O-N 2.92Å; D379-L383 VanDerWaalsContact O-N 3.08Å; W380-L383 HydrophobicContact CE3-CD2 3.95Å; W380-L383 HydrophobicContact CZ3-CD2 3.95Å; W380-L383 WeakPolarHBondContact O-CB 3.35Å; W380-L383 PolarHBondContact O-N 3.02Å; W380-L383 VanDerWaalsContact O-N 3.16Å; I381-L383 VanDerWaalsContact C-N 3.31Å; I381-L383 PolarHBondContact O-N 2.93Å; L383-L385 VanDerWaalsContact C-N 3.33Å; L383-L385 PolarHBondContact O-N 3.44Å; L383-I386 PolarHBondContact O-N 3.43Å; L383-I387 HydrophobicContact CD1-CD1 4.33Å; L383-I387 HydrophobicContact CG-CD1 4.13Å; L383-I387 WeakPolarHBondContact O-CG1 3.29Å; L383-I387 PolarHBondContact O-N 2.99Å; L383-I551 HydrophobicContact CD1-CD1 3.86Å; L383-I551 HydrophobicContact CD1-CG1 3.82Å; L383-I551 HydrophobicContact CD1-CG2 4.35Å; L383-Y558 HydrophobicContact CD2-CE2 3.83Å
384	A	87.1	Confident	88.4	Confident	60 Å²	60	41.6 Å²	41.6	50%	0.496	21%	0.21	S	C	.	.	H	α-helix	trans	-62.5	-39.4	175.9	0	0	0	0	0	112.1	W380 I381 I387 Y388	W380-A384 PolarHBondContact O-N 3.21Å; I381-A384 PolarHBondContact O-N 3.07Å; A384-I387 PolarHBondContact O-N 3.29Å; A384-Y388 PolarHBondContact O-N 2.92Å
385	L	89.8	Confident	88.3	Confident	31 Å²	31	38.8 Å²	38.8	16%	0.162	20%	0.197	C	C	.	.	H	α-helix	trans	-66.9	-37.1	174.3	-65.9	-171.4	0	0	0	112.8	I381 I382 L383 Y388 T389 V472 M475 F476	I381-L385 HydrophobicContact CG2-CD1 4.48Å; I381-L385 WeakPolarHBondContact O-CG 3.37Å; I381-L385 PolarHBondContact O-N 3.11Å; I382-L385 HydrophobicContact CD1-CD1 4.46Å; I382-L385 PolarHBondContact O-N 3.09Å; L383-L385 VanDerWaalsContact C-N 3.33Å; L383-L385 PolarHBondContact O-N 3.44Å; L385-Y388 PolarHBondContact O-N 3.32Å; L385-T389 WeakPolarHBondContact O-CG2 3.48Å; L385-T389 PolarHBondContact O-N 3.35Å; L385-T389 PolarHBondContact O-OG1 3.33Å; L385-V472 HydrophobicContact CD2-CG2 4.06Å; L385-M475 HydrophobicContact CD1-CB 3.51Å; L385-M475 HydrophobicContact CD1-CG 3.93Å; L385-F476 HydrophobicContact CB-CE2 4.11Å; L385-F476 HydrophobicContact CB-CZ 4.07Å
386	I	88.9	Confident	88.1	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-47.1	172.8	-65.2	162	0	0	0	109.8	I382 L383 Y388 T389 A390 F476 R547 L548 I551	I382-I386 HydrophobicContact CG2-CD1 4Å; I382-I386 HydrophobicContact CG2-CG1 4.39Å; I382-I386 VanDerWaalsContact O-CG1 3.22Å; I382-I386 WeakPolarHBondContact O-CG1 2.82Å; I382-I386 PolarHBondContact O-N 3.15Å; L383-I386 PolarHBondContact O-N 3.43Å; I386-Y388 PolarHBondContact O-N 2.87Å; I386-T389 PolarHBondContact O-N 3.38Å; I386-T389 VanDerWaalsContact O-N 3.15Å; I386-T389 PolarHBondContact O-OG1 3.14Å; I386-A390 WeakPolarHBondContact O-CB 3.46Å; I386-A390 PolarHBondContact O-N 3.03Å; I386-F476 HydrophobicContact CG1-CE1 3.78Å; I386-F476 HydrophobicContact CG1-CZ 3.72Å; I386-R547 WeakPolarHBondContact CD1-O 3.26Å; I386-R547 HydrophobicContact CG1-CB 4.28Å; I386-R547 HydrophobicContact CG2-CB 4.38Å; I386-L548 HydrophobicContact CG2-CD2 3.76Å; I386-L548 HydrophobicContact CG2-CG 4.16Å; I386-I551 HydrophobicContact CB-CG1 4.48Å; I386-I551 HydrophobicContact CD1-CG1 4.13Å; I386-I551 HydrophobicContact CG2-CD1 3.81Å; I386-I551 HydrophobicContact CG2-CG1 3.84Å
387	I	87.1	Confident	87.9	Confident	78 Å²	78	39.5 Å²	39.5	40%	0.4	20%	0.201	S	C	.	.	H	α-helix	trans	-59.9	-44.3	177.6	-66.6	165.1	0	0	0	111	L383 A384 T389 A390 I391	L383-I387 HydrophobicContact CD1-CD1 4.33Å; L383-I387 HydrophobicContact CG-CD1 4.13Å; L383-I387 WeakPolarHBondContact O-CG1 3.29Å; L383-I387 PolarHBondContact O-N 2.99Å; A384-I387 PolarHBondContact O-N 3.29Å; I387-T389 PolarHBondContact O-N 3.28Å; I387-A390 PolarHBondContact O-N 3.03Å; I387-I391 HydrophobicContact CG2-CD1 3.94Å; I387-I391 WeakPolarHBondContact O-CG1 3.28Å; I387-I391 PolarHBondContact O-N 3Å
388	Y	90.1	Very high	87.7	Confident	43 Å²	43	37.5 Å²	37.5	17%	0.169	19%	0.189	C	C	.	.	H	α-helix	trans	-54.5	-52.2	171.8	169.1	-90.7	0	0	0	111.2	A384 L385 I386 A390 I391 F392 V468 D469 V472	A384-Y388 PolarHBondContact O-N 2.92Å; L385-Y388 PolarHBondContact O-N 3.32Å; I386-Y388 PolarHBondContact O-N 2.87Å; Y388-A390 VanDerWaalsContact C-N 3.29Å; Y388-A390 PolarHBondContact O-N 2.82Å; Y388-I391 PolarHBondContact O-N 3.12Å; Y388-F392 AromaticContact CD2-CD2 3.35Å; Y388-F392 HydrophobicContact CD2-CD2 3.35Å; Y388-F392 AromaticContact CD2-CE2 3.62Å; Y388-F392 HydrophobicContact CD2-CE2 3.62Å; Y388-F392 HydrophobicContact CD2-CG 4.04Å; Y388-F392 HydrophobicContact CD2-CZ 4.49Å; Y388-F392 HydrophobicContact CE1-CB 4.31Å; Y388-F392 HydrophobicContact CE2-CB 4.16Å; Y388-F392 HydrophobicContact CE2-CD1 4.03Å; Y388-F392 AromaticContact CE2-CD2 3.3Å; Y388-F392 HydrophobicContact CE2-CD2 3.3Å; Y388-F392 HydrophobicContact CE2-CE1 4.26Å; Y388-F392 AromaticContact CE2-CE2 3.58Å; Y388-F392 HydrophobicContact CE2-CE2 3.58Å; Y388-F392 AromaticContact CE2-CG 3.54Å; Y388-F392 HydrophobicContact CE2-CG 3.54Å; Y388-F392 HydrophobicContact CE2-CZ 4.06Å; Y388-F392 HydrophobicContact CG-CD2 4.11Å; Y388-F392 AromaticContact CZ-CG 3.82Å; Y388-F392 PolarHBondContact O-N 3.44Å; Y388-V468 HydrophobicContact CE1-CG1 4.27Å; Y388-V468 HydrophobicContact CE2-CG1 4.23Å; Y388-V468 WeakPolarHBondContact OH-CG1 3.22Å; Y388-D469 PolarHBondContact OH-OD1 2.75Å; Y388-V472 HydrophobicContact CD1-CG1 4.39Å; Y388-V472 HydrophobicContact CD1-CG2 4.02Å; Y388-V472 HydrophobicContact CE1-CG2 3.96Å
389	T	89.2	Confident	87.3	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.018	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-33.9	-178.6	58.4	0	0	0	0	113.1	L385 I386 I387 I391 T393 V472 F476	L385-T389 WeakPolarHBondContact O-CG2 3.48Å; L385-T389 PolarHBondContact O-N 3.35Å; L385-T389 PolarHBondContact O-OG1 3.33Å; I386-T389 PolarHBondContact O-N 3.38Å; I386-T389 VanDerWaalsContact O-N 3.15Å; I386-T389 PolarHBondContact O-OG1 3.14Å; I387-T389 PolarHBondContact O-N 3.28Å; T389-I391 VanDerWaalsContact C-N 3.32Å; T389-I391 PolarHBondContact O-N 3.36Å; T389-T393 WeakPolarHBondContact O-CB 3.29Å; T389-T393 PolarHBondContact O-N 3.13Å; T389-T393 PolarHBondContact O-OG1 2.89Å; T389-V472 HydrophobicContact CG2-CG1 3.66Å; T389-F476 HydrophobicContact CG2-CE2 4.14Å
390	A	89.4	Confident	86.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-72.1	-24.5	-179.9	0	0	0	0	0	113.4	I386 I387 Y388 P394 L548 L575 W579	I386-A390 WeakPolarHBondContact O-CB 3.46Å; I386-A390 PolarHBondContact O-N 3.03Å; I387-A390 PolarHBondContact O-N 3.03Å; Y388-A390 VanDerWaalsContact C-N 3.29Å; Y388-A390 PolarHBondContact O-N 2.82Å; A390-P394 VanDerWaalsContact O-CD 3.29Å; A390-P394 WeakPolarHBondContact O-CD 3.43Å; A390-P394 WeakPolarHBondContact O-CG 3.33Å; A390-L548 HydrophobicContact CB-CD1 4.11Å; A390-L548 HydrophobicContact CB-CD2 3.95Å; A390-L548 HydrophobicContact CB-CG 4.24Å; A390-L575 HydrophobicContact CB-CD1 3.82Å; A390-L575 HydrophobicContact CB-CD2 4.02Å; A390-W579 PolarHBondContact O-NE1 3.15Å
391	I	90.8	Very high	85.7	Confident	65 Å²	65	35.7 Å²	35.7	33%	0.333	19%	0.189	S	C	.	.	H	α-helix	trans	-91.7	-49.2	175	-62.2	168	0	0	0	110.7	I387 Y388 T389 P394 L575 H578	I387-I391 HydrophobicContact CG2-CD1 3.94Å; I387-I391 WeakPolarHBondContact O-CG1 3.28Å; I387-I391 PolarHBondContact O-N 3Å; Y388-I391 PolarHBondContact O-N 3.12Å; T389-I391 VanDerWaalsContact C-N 3.32Å; T389-I391 PolarHBondContact O-N 3.36Å; I391-P394 WeakPolarHBondContact O-CD 3.48Å; I391-L575 HydrophobicContact CG1-CD1 3.91Å; I391-H578 PolarHBondContact O-NE2 2.93Å
392	F	88.2	Confident	84	Confident	79 Å²	79	35 Å²	35	35%	0.346	19%	0.186	S	C	.	.	H	α-helix	trans	-75.4	-31.7	-173.6	-80.9	-96.7	0	0	0	113.5	Y388 Y395 V396 L465	Y388-F392 AromaticContact CD2-CD2 3.35Å; Y388-F392 HydrophobicContact CD2-CD2 3.35Å; Y388-F392 AromaticContact CD2-CE2 3.62Å; Y388-F392 HydrophobicContact CD2-CE2 3.62Å; Y388-F392 HydrophobicContact CD2-CG 4.04Å; Y388-F392 HydrophobicContact CD2-CZ 4.49Å; Y388-F392 HydrophobicContact CE1-CB 4.31Å; Y388-F392 HydrophobicContact CE2-CB 4.16Å; Y388-F392 HydrophobicContact CE2-CD1 4.03Å; Y388-F392 AromaticContact CE2-CD2 3.3Å; Y388-F392 HydrophobicContact CE2-CD2 3.3Å; Y388-F392 HydrophobicContact CE2-CE1 4.26Å; Y388-F392 AromaticContact CE2-CE2 3.58Å; Y388-F392 HydrophobicContact CE2-CE2 3.58Å; Y388-F392 AromaticContact CE2-CG 3.54Å; Y388-F392 HydrophobicContact CE2-CG 3.54Å; Y388-F392 HydrophobicContact CE2-CZ 4.06Å; Y388-F392 HydrophobicContact CG-CD2 4.11Å; Y388-F392 AromaticContact CZ-CG 3.82Å; Y388-F392 PolarHBondContact O-N 3.44Å; F392-Y395 PolarHBondContact O-N 3.35Å; F392-V396 WeakPolarHBondContact O-CB 3.4Å; F392-V396 VanDerWaalsContact O-CG2 3.24Å; F392-V396 WeakPolarHBondContact O-CG2 3.43Å; F392-V396 PolarHBondContact O-N 3.28Å; F392-L465 HydrophobicContact CD1-CD1 4.3Å
393	T	85.9	Confident	82.2	Confident	11 Å²	11	37.1 Å²	37.1	7%	0.067	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-51	-178.3	-51.1	0	0	0	0	112.6	T389 Y395 V396 T397 K541 R544	T389-T393 WeakPolarHBondContact O-CB 3.29Å; T389-T393 PolarHBondContact O-N 3.13Å; T389-T393 PolarHBondContact O-OG1 2.89Å; T393-Y395 PolarHBondContact O-N 3.43Å; T393-V396 PolarHBondContact O-N 2.7Å; T393-T397 WeakPolarHBondContact O-CB 3.26Å; T393-T397 PolarHBondContact O-N 3.37Å; T393-T397 PolarHBondContact O-OG1 3.38Å; T393-K541 HydrophobicContact CG2-CB 4.38Å; T393-K541 VanDerWaalsContact CG2-O 3.31Å; T393-K541 WeakPolarHBondContact CG2-O 3.41Å; T393-R544 HydrophobicContact CG2-CB 4.25Å
394	P	88.6	Confident	80.4	Confident	18 Å²	18	38 Å²	38	12%	0.117	21%	0.212	C	C	.	.	H	α-helix	trans	-62.7	-41.8	177.2	-21.8	34.8	0	0	0	112.2	A390 I391 T397 V398 L545 C582	A390-P394 VanDerWaalsContact O-CD 3.29Å; A390-P394 WeakPolarHBondContact O-CD 3.43Å; A390-P394 WeakPolarHBondContact O-CG 3.33Å; I391-P394 WeakPolarHBondContact O-CD 3.48Å; P394-T397 PolarHBondContact O-N 3.49Å; P394-V398 WeakPolarHBondContact O-CG2 3.3Å; P394-V398 PolarHBondContact O-N 2.86Å; P394-L545 HydrophobicContact CG-CD2 4.28Å; P394-C582 HydrophobicContact CB-CB 4.19Å
395	Y	88.8	Confident	78.4	Confident	57 Å²	57	39.1 Å²	39.1	22%	0.224	21%	0.21	C	C	.	.	H	α-helix	trans	-58	-52.2	177.7	-179	-100.2	0	0	0	112.2	F392 T393 T397 F399 L400 Y627	F392-Y395 PolarHBondContact O-N 3.35Å; T393-Y395 PolarHBondContact O-N 3.43Å; Y395-T397 PolarHBondContact O-N 3.04Å; Y395-F399 HydrophobicContact CD2-CB 4.42Å; Y395-F399 AromaticContact CD2-CD2 3.6Å; Y395-F399 HydrophobicContact CD2-CD2 3.6Å; Y395-F399 HydrophobicContact CD2-CE2 4.1Å; Y395-F399 HydrophobicContact CD2-CG 4.14Å; Y395-F399 HydrophobicContact CE2-CB 4.19Å; Y395-F399 AromaticContact CE2-CD2 3.92Å; Y395-F399 HydrophobicContact CE2-CD2 3.92Å; Y395-F399 HydrophobicContact CE2-CE2 4.48Å; Y395-F399 HydrophobicContact CE2-CG 4.01Å; Y395-F399 HydrophobicContact CG-CD2 4.34Å; Y395-F399 WeakPolarHBondContact O-CB 3.47Å; Y395-F399 PolarHBondContact O-N 3.17Å; Y395-L400 HydrophobicContact CE1-CD1 4.19Å; Y395-Y627 AromaticContact CD2-CD2 3.97Å; Y395-Y627 HydrophobicContact CD2-CD2 3.97Å; Y395-Y627 HydrophobicContact CD2-CE2 4.06Å; Y395-Y627 AromaticContact CE2-CD2 3.91Å; Y395-Y627 HydrophobicContact CE2-CD2 3.91Å; Y395-Y627 HydrophobicContact CE2-CE2 4.35Å; Y395-Y627 HydrophobicContact CE2-CG 4.07Å
396	V	83.3	Confident	76.1	Confident	16 Å²	16	42 Å²	42	10%	0.097	22%	0.221	C	C	.	.	I	π-helix	trans	-63.9	-42.2	179.8	172.9	0	0	0	0	111.5	F392 T393 L400 M401 L465	F392-V396 WeakPolarHBondContact O-CB 3.4Å; F392-V396 VanDerWaalsContact O-CG2 3.24Å; F392-V396 WeakPolarHBondContact O-CG2 3.43Å; F392-V396 PolarHBondContact O-N 3.28Å; T393-V396 PolarHBondContact O-N 2.7Å; V396-L400 HydrophobicContact CB-CD1 4.48Å; V396-L400 HydrophobicContact CG2-CD1 4.04Å; V396-L400 WeakPolarHBondContact O-CB 3.48Å; V396-L400 PolarHBondContact O-N 3.06Å; V396-M401 PolarHBondContact O-N 2.9Å; V396-L465 HydrophobicContact CG2-CD2 4.05Å
397	T	80.5	Confident	73.5	Confident	32 Å²	32	47.8 Å²	47.8	20%	0.196	24%	0.244	C	C	.	.	I	π-helix	trans	-65.4	-39.5	-178.3	-65.5	0	0	0	0	112.8	T393 P394 Y395 M401	T393-T397 WeakPolarHBondContact O-CB 3.26Å; T393-T397 PolarHBondContact O-N 3.37Å; T393-T397 PolarHBondContact O-OG1 3.38Å; P394-T397 PolarHBondContact O-N 3.49Å; Y395-T397 PolarHBondContact O-N 3.04Å; T397-M401 HydrophobicContact CG2-SD 3.98Å; T397-M401 WeakPolarHBondContact O-CB 3.36Å; T397-M401 WeakPolarHBondContact O-CG 3.44Å
398	V	83.8	Confident	71.1	Confident	35 Å²	35	46.8 Å²	46.8	21%	0.212	25%	0.247	C	C	.	.	I	π-helix	trans	-90.6	-47.4	-179	-167.8	0	0	0	0	112.6	P394 C582 Y585 A586	P394-V398 WeakPolarHBondContact O-CG2 3.3Å; P394-V398 PolarHBondContact O-N 2.86Å; V398-C582 HydrophobicContact CG2-CB 4.19Å; V398-Y585 HydrophobicContact CG1-CD1 3.62Å; V398-Y585 HydrophobicContact CG1-CE1 4.14Å; V398-A586 HydrophobicContact CG1-CB 3.7Å
399	F	83.8	Confident	68.5	Low	5 Å²	5	52.1 Å²	52.1	2%	0.022	27%	0.271	C	S	.	.	I	π-helix	trans	-84.9	-30.9	-169.5	-69.8	-89	0	0	0	114.4	Y395 C582 Y585 L623 Y627	Y395-F399 HydrophobicContact CD2-CB 4.42Å; Y395-F399 AromaticContact CD2-CD2 3.6Å; Y395-F399 HydrophobicContact CD2-CD2 3.6Å; Y395-F399 HydrophobicContact CD2-CE2 4.1Å; Y395-F399 HydrophobicContact CD2-CG 4.14Å; Y395-F399 HydrophobicContact CE2-CB 4.19Å; Y395-F399 AromaticContact CE2-CD2 3.92Å; Y395-F399 HydrophobicContact CE2-CD2 3.92Å; Y395-F399 HydrophobicContact CE2-CE2 4.48Å; Y395-F399 HydrophobicContact CE2-CG 4.01Å; Y395-F399 HydrophobicContact CG-CD2 4.34Å; Y395-F399 WeakPolarHBondContact O-CB 3.47Å; Y395-F399 PolarHBondContact O-N 3.17Å; F399-C582 HydrophobicContact CE2-CB 4.48Å; F399-Y585 HydrophobicContact CB-CE1 4.48Å; F399-Y585 AromaticContact CD1-CD1 3.3Å; F399-Y585 HydrophobicContact CD1-CD1 3.3Å; F399-Y585 AromaticContact CD1-CE1 3.39Å; F399-Y585 HydrophobicContact CD1-CE1 3.39Å; F399-Y585 AromaticContact CD1-CG 3.95Å; F399-Y585 HydrophobicContact CD1-CG 3.95Å; F399-Y585 HydrophobicContact CD2-CD1 4.14Å; F399-Y585 AromaticContact CE1-CD1 3.14Å; F399-Y585 HydrophobicContact CE1-CD1 3.14Å; F399-Y585 AromaticContact CE1-CD2 3.95Å; F399-Y585 HydrophobicContact CE1-CD2 3.95Å; F399-Y585 AromaticContact CE1-CE1 3.69Å; F399-Y585 HydrophobicContact CE1-CE1 3.69Å; F399-Y585 HydrophobicContact CE1-CE2 4.41Å; F399-Y585 AromaticContact CE1-CG 3.32Å; F399-Y585 HydrophobicContact CE1-CG 3.32Å; F399-Y585 AromaticContact CE2-CD1 4Å; F399-Y585 HydrophobicContact CE2-CD1 4Å; F399-Y585 HydrophobicContact CE2-CG 4.45Å; F399-Y585 AromaticContact CG-CD1 3.83Å; F399-Y585 HydrophobicContact CG-CD1 3.83Å; F399-Y585 AromaticContact CG-CE1 3.95Å; F399-Y585 HydrophobicContact CG-CE1 3.95Å; F399-Y585 AromaticContact CZ-CD1 3.51Å; F399-Y585 HydrophobicContact CZ-CD1 3.51Å; F399-Y585 HydrophobicContact CZ-CE1 4.44Å; F399-Y585 AromaticContact CZ-CG 3.61Å; F399-Y585 HydrophobicContact CZ-CG 3.61Å; F399-L623 HydrophobicContact CB-CD1 3.81Å; F399-L623 HydrophobicContact CD1-CD1 3.46Å; F399-L623 VanDerWaalsContact CD1-CD1 3.46Å; F399-L623 HydrophobicContact CE1-CD1 4.42Å; F399-L623 HydrophobicContact CG-CD1 4.02Å; F399-Y627 HydrophobicContact CE1-CD2 4.31Å; F399-Y627 AromaticContact CE2-CD2 3.83Å; F399-Y627 HydrophobicContact CE2-CD2 3.83Å; F399-Y627 HydrophobicContact CE2-CE2 4.49Å; F399-Y627 AromaticContact CZ-CD2 3.68Å; F399-Y627 HydrophobicContact CZ-CD2 3.68Å; F399-Y627 HydrophobicContact CZ-CG 4.44Å
400	L	74.8	Confident	65.9	Low	63 Å²	63	57.4 Å²	57.4	33%	0.33	30%	0.299	S	S	.	.	I	π-helix	trans	-101.1	-20.6	-174	-76.3	162.5	0	0	0	114.3	Y395 V396 N402 T403 G404 L465	Y395-L400 HydrophobicContact CE1-CD1 4.19Å; V396-L400 HydrophobicContact CB-CD1 4.48Å; V396-L400 HydrophobicContact CG2-CD1 4.04Å; V396-L400 WeakPolarHBondContact O-CB 3.48Å; V396-L400 PolarHBondContact O-N 3.06Å; L400-N402 PolarHBondContact O-N 3.37Å; L400-T403 PolarHBondContact O-OG1 2.96Å; L400-T403 VanDerWaalsContact O-OG1 3.06Å; L400-G404 PolarHBondContact O-N 3.33Å; L400-L465 HydrophobicContact CD1-CD2 4.29Å
401	M	63.4	Low	63.7	Low	56 Å²	56	63.8 Å²	63.8	28%	0.276	33%	0.332	S	S	.	.	H	α-helix	trans	-66.9	-33.2	178.5	-77.9	-177.6	38.9	0	0	113.6	V396 T397 G404 T534 G538	V396-M401 PolarHBondContact O-N 2.9Å; T397-M401 HydrophobicContact CG2-SD 3.98Å; T397-M401 WeakPolarHBondContact O-CB 3.36Å; T397-M401 WeakPolarHBondContact O-CG 3.44Å; M401-G404 PolarHBondContact O-N 3.27Å; M401-T534 WeakPolarHBondContact CE-O 3.34Å; M401-G538 WeakPolarHBondContact SD-CA 3.19Å
402	N	54.7	Low	61.4	Low	64 Å²	64	64.9 Å²	64.9	34%	0.342	35%	0.345	S	S	.	.	H	α-helix	trans	-72.2	-30.6	-178.8	-161.1	10	0	0	0	112.5	L400 N589	L400-N402 PolarHBondContact O-N 3.37Å; N402-N589 PolarHBondContact ND2-ND2 2.85Å; N402-N589 PolarHBondContact ND2-OD1 3.1Å
403	T	53	Low	59.2	Low	46 Å²	46	65.7 Å²	65.7	28%	0.282	36%	0.36	S	S	.	.	H	α-helix	trans	-72.2	-36.1	171.8	20.8	0	0	0	0	112.2	L400 N405 K406 Y407	L400-T403 PolarHBondContact O-OG1 2.96Å; L400-T403 VanDerWaalsContact O-OG1 3.06Å; T403-N405 VanDerWaalsContact C-N 3.34Å; T403-N405 PolarHBondContact O-N 3.24Å; T403-K406 PolarHBondContact O-N 3.13Å; T403-Y407 HydrophobicContact CG2-CE2 3.97Å; T403-Y407 WeakPolarHBondContact O-CD2 3.16Å; T403-Y407 PolarHBondContact O-N 2.86Å; T403-Y407 VanDerWaalsContact O-N 3.11Å
404	G	47.6	Very low	56.8	Low	35 Å²	35	67.5 Å²	67.5	36%	0.361	38%	0.381	S	S	.	.	H	α-helix	trans	-52.2	-45.5	-180	0	0	0	0	0	114.1	L400 M401 K406 Y407 A408	L400-G404 PolarHBondContact O-N 3.33Å; M401-G404 PolarHBondContact O-N 3.27Å; G404-K406 VanDerWaalsContact C-N 3.33Å; G404-K406 PolarHBondContact O-N 3.38Å; G404-Y407 PolarHBondContact O-N 3.03Å; G404-A408 WeakPolarHBondContact O-CB 3.4Å; G404-A408 PolarHBondContact O-N 2.85Å
405	N	43.7	Very low	53.9	Low	84 Å²	84	73.9 Å²	73.9	45%	0.449	41%	0.414	S	S	.	.	H	α-helix	trans	-67.3	-29	179	-82.6	-7.2	0	0	0	113.7	T403 K409 T534	T403-N405 VanDerWaalsContact C-N 3.34Å; T403-N405 PolarHBondContact O-N 3.24Å; N405-K409 WeakPolarHBondContact O-CB 3.39Å; N405-K409 PolarHBondContact O-N 3.38Å; N405-T534 PolarHBondContact ND2-OG1 2.93Å; N405-T534 WeakPolarHBondContact OD1-CG2 3.32Å
406	K	42	Very low	51.2	Low	91 Å²	91	78.4 Å²	78.4	40%	0.396	44%	0.441	S	S	.	.	H	α-helix	trans	-72.3	-43	174.1	-77.6	170.8	170.5	174.4	0	111.1	T403 G404 K409 L410 P617	T403-K406 PolarHBondContact O-N 3.13Å; G404-K406 VanDerWaalsContact C-N 3.33Å; G404-K406 PolarHBondContact O-N 3.38Å; K406-K409 PolarHBondContact O-N 3.45Å; K406-L410 WeakPolarHBondContact O-CG 3.29Å; K406-L410 PolarHBondContact O-N 2.9Å; K406-P617 HydrophobicContact CD-CB 4.02Å; K406-P617 PolarHBondContact NZ-O 2.6Å
407	Y	35.7	Very low	48.6	Very low	123 Å²	123	83.1 Å²	83.1	48%	0.482	47%	0.47	S	S	.	.	H	α-helix	trans	-69	-41.6	176.8	-68.7	-63.4	0	0	0	113.1	T403 G404 K409 L410 I411	T403-Y407 HydrophobicContact CG2-CE2 3.97Å; T403-Y407 WeakPolarHBondContact O-CD2 3.16Å; T403-Y407 PolarHBondContact O-N 2.86Å; T403-Y407 VanDerWaalsContact O-N 3.11Å; G404-Y407 PolarHBondContact O-N 3.03Å; Y407-K409 VanDerWaalsContact C-N 3.31Å; Y407-K409 PolarHBondContact O-N 2.95Å; Y407-L410 HydrophobicContact CD1-CD1 4.46Å; Y407-L410 PolarHBondContact O-N 2.99Å; Y407-I411 WeakPolarHBondContact O-CG1 3.46Å; Y407-I411 PolarHBondContact O-N 2.67Å
408	A	36.1	Very low	46.3	Very low	57 Å²	57	88 Å²	88	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-58.4	-43.4	174.4	0	0	0	0	0	111.6	G404 I411 S412	G404-A408 WeakPolarHBondContact O-CB 3.4Å; G404-A408 PolarHBondContact O-N 2.85Å; A408-I411 PolarHBondContact O-N 2.97Å; A408-S412 PolarHBondContact O-N 2.98Å; A408-S412 PolarHBondContact O-OG 3.16Å
409	K	35.4	Very low	43.9	Very low	154 Å²	154	92.1 Å²	92.1	67%	0.67	53%	0.525	S	S	*	.	H	α-helix	trans	-66.8	-39	178.8	-160.9	169.9	-172.8	178	0	112.5	N405 K406 Y407 S412 S413	N405-K409 WeakPolarHBondContact O-CB 3.39Å; N405-K409 PolarHBondContact O-N 3.38Å; K406-K409 PolarHBondContact O-N 3.45Å; Y407-K409 VanDerWaalsContact C-N 3.31Å; Y407-K409 PolarHBondContact O-N 2.95Å; K409-S412 WeakPolarHBondContact CA-OG 3.37Å; K409-S412 PolarHBondContact O-N 2.9Å; K409-S412 PolarHBondContact O-OG 3.48Å; K409-S413 PolarHBondContact O-N 2.84Å; K409-S413 VanDerWaalsContact O-N 3.1Å; K409-S413 PolarHBondContact O-OG 3.14Å
410	L	35	Very low	41.4	Very low	115 Å²	115	97.7 Å²	97.7	60%	0.602	56%	0.56	S	S	*	*	H	α-helix	trans	-63.9	-41	173.4	-73.6	167.3	0	0	0	112.2	K406 Y407 S413 G414	K406-L410 WeakPolarHBondContact O-CG 3.29Å; K406-L410 PolarHBondContact O-N 2.9Å; Y407-L410 HydrophobicContact CD1-CD1 4.46Å; Y407-L410 PolarHBondContact O-N 2.99Å; L410-S413 PolarHBondContact O-N 3.04Å; L410-G414 PolarHBondContact O-N 3.22Å
411	I	43.6	Very low	39.3	Very low	134 Å²	134	100.6 Å²	100.6	69%	0.687	58%	0.582	S	S	*	*	H	α-helix	trans	-67.1	-42	176.3	-66.5	165.3	0	0	0	110.7	Y407 A408 S413 G414	Y407-I411 WeakPolarHBondContact O-CG1 3.46Å; Y407-I411 PolarHBondContact O-N 2.67Å; A408-I411 PolarHBondContact O-N 2.97Å; I411-S413 PolarHBondContact O-N 3.2Å; I411-G414 PolarHBondContact O-N 3Å
412	S	40.7	Very low	37.9	Very low	87 Å²	87	105.8 Å²	105.8	61%	0.608	61%	0.606	S	S	*	*	H	α-helix	trans	-66.6	-20.8	176.2	65.5	0	0	0	0	114.5	A408 K409	A408-S412 PolarHBondContact O-N 2.98Å; A408-S412 PolarHBondContact O-OG 3.16Å; K409-S412 WeakPolarHBondContact CA-OG 3.37Å; K409-S412 PolarHBondContact O-N 2.9Å; K409-S412 PolarHBondContact O-OG 3.48Å
413	S	42.7	Very low	36.8	Very low	96 Å²	96	110.3 Å²	110.3	67%	0.671	63%	0.629	S	S	*	*	H	α-helix	trans	-88	-12.5	172.6	-64.4	0	0	0	0	113.1	K409 L410 I411 N415	K409-S413 PolarHBondContact O-N 2.84Å; K409-S413 VanDerWaalsContact O-N 3.1Å; K409-S413 PolarHBondContact O-OG 3.14Å; L410-S413 PolarHBondContact O-N 3.04Å; I411-S413 PolarHBondContact O-N 3.2Å; S413-N415 PolarHBondContact O-N 3.35Å; S413-N415 VanDerWaalsContact O-N 3.13Å
414	G	35	Very low	35.9	Very low	49 Å²	49	112 Å²	112	51%	0.505	65%	0.647	S	S	.	*			trans	-83.6	71.2	175.9	0	0	0	0	0	112.4	L410 I411 I416	L410-G414 PolarHBondContact O-N 3.22Å; I411-G414 PolarHBondContact O-N 3Å; G414-I416 VanDerWaalsContact C-N 3.31Å; G414-I416 PolarHBondContact O-N 2.91Å
415	N	28.5	Very low	35.2	Very low	153 Å²	153	116 Å²	116	82%	0.818	67%	0.665	S	S	*	*			trans	-65.4	84.4	175.8	-100	-11.9	0	0	0	112	S413	S413-N415 PolarHBondContact O-N 3.35Å; S413-N415 VanDerWaalsContact O-N 3.13Å
416	I	31	Very low	34.6	Very low	151 Å²	151	118 Å²	118	77%	0.774	68%	0.68	S	S	*	*			trans	-104.7	105.3	158.6	-62.8	178.8	0	0	0	106.9	G414 T418	G414-I416 VanDerWaalsContact C-N 3.31Å; G414-I416 PolarHBondContact O-N 2.91Å; I416-T418 PolarHBondContact O-N 2.82Å; I416-T418 VanDerWaalsContact O-N 3.1Å
417	T	30.5	Very low	34.1	Very low	116 Å²	116	122.8 Å²	122.8	71%	0.712	70%	0.701	S	S	*	*			trans	-70.5	100.1	175.9	37.5	0	0	0	0	110.2	T419	T417-T419 VanDerWaalsContact C-N 3.3Å; T417-T419 PolarHBondContact O-N 2.85Å
418	T	32.2	Very low	34	Very low	133 Å²	133	123.7 Å²	123.7	82%	0.816	71%	0.714	S	S	*	*			trans	-69.3	84.3	174.2	-35.8	0	0	0	0	110.5	I416	I416-T418 PolarHBondContact O-N 2.82Å; I416-T418 VanDerWaalsContact O-N 3.1Å
419	T	31.7	Very low	34.1	Very low	123 Å²	123	127.4 Å²	127.4	76%	0.755	73%	0.725	S	S	*	*			trans	-67.7	134	175.4	38.4	0	0	0	0	111.1	T417	T417-T419 VanDerWaalsContact C-N 3.3Å; T417-T419 PolarHBondContact O-N 2.85Å
420	T	32.3	Very low	34.1	Very low	122 Å²	122	127 Å²	127	75%	0.748	73%	0.73	S	S	*	*			trans	-65.7	135.1	179	-43.2	0	0	0	0	110.6	Q422	T420-Q422 PolarHBondContact O-N 3.11Å
421	P	30.3	Very low	34.1	Very low	124 Å²	124	132.8 Å²	132.8	81%	0.805	74%	0.744	S	S	*	*			trans	-78.7	104.1	-177.8	30.3	-34.3	0	0	0	111.7
422	Q	35.2	Very low	33.8	Very low	165 Å²	165	131.7 Å²	131.7	77%	0.771	74%	0.744	S	S	*	*			trans	-138	117	162.4	-71.7	-159.3	2.5	0	0	113	T420	T420-Q422 PolarHBondContact O-N 3.11Å
423	I	31.3	Very low	33.7	Very low	159 Å²	159	135.5 Å²	135.5	82%	0.815	75%	0.752	S	S	*	*				40.9	116.4	127.1	-56.7	171.7	0	0	0	118.3
424	A	32.6	Very low	33.4	Very low	80 Å²	80	136.8 Å²	136.8	66%	0.661	75%	0.751	S	S	*	*			trans	82.4	123.8	147.5	0	0	0	0	0	122.1
425	T	34.3	Very low	33.5	Very low	121 Å²	121	142.7 Å²	142.7	74%	0.742	76%	0.763	S	S	*	*			trans	60.7	94.1	137.3	56.4	0	0	0	0	121.4
426	T	30.8	Very low	33.9	Very low	124 Å²	124	139.7 Å²	139.7	76%	0.761	75%	0.754	S	S	*	*				41.6	116	118.5	57.7	0	0	0	0	120.6
427	F	31.9	Very low	34.2	Very low	192 Å²	192	136.7 Å²	136.7	84%	0.842	75%	0.746	S	S	*	*				-166.5	155.7	108.4	-125.8	-97.9	0	0	0	112.4
428	D	33.5	Very low	34.6	Very low	142 Å²	142	136.9 Å²	136.9	76%	0.759	75%	0.747	S	S	*	*			trans	-88.4	172.4	-177.5	-61.9	-83.7	0	0	0	114.5
429	I	36.8	Very low	34.9	Very low	136 Å²	136	136.6 Å²	136.6	70%	0.697	74%	0.741	S	S	*	*				166.1	115.4	121.9	-85	157.3	0	0	0	113.7
430	N	36.6	Very low	35.2	Very low	145 Å²	145	136.5 Å²	136.5	78%	0.775	74%	0.736	S	S	*	*			trans	56.2	160	151.2	-63.4	-30.3	0	0	0	120.8
431	R	33.9	Very low	35.6	Very low	236 Å²	236	138.1 Å²	138.1	89%	0.891	74%	0.735	S	S	*	*			cis	-147.3	168.2	9.5	-150.7	169.7	-178	158	1.1	113.3
432	T	37.1	Very low	36	Very low	112 Å²	112	136.6 Å²	136.6	69%	0.687	73%	0.727	S	S	*	*			trans	-104.2	174.2	-158.6	52.2	0	0	0	0	118.6
433	Q	38.9	Very low	36.1	Very low	167 Å²	167	137.1 Å²	137.1	78%	0.78	73%	0.729	S	S	*	*			trans	97.9	145.1	157.8	-57.3	-163.2	19.1	0	0	116.7
434	N	37.9	Very low	36.4	Very low	122 Å²	122	134.8 Å²	134.8	65%	0.652	73%	0.727	S	S	*	*			cis	-164.3	167.9	-4.3	-122.8	-43.8	0	0	0	107.7
435	K	36.4	Very low	36.6	Very low	174 Å²	174	135.5 Å²	135.5	76%	0.757	73%	0.727	S	S	*	*			cis	-144.1	179.6	6.5	-99.4	177.1	-179.7	172.1	0	107.9
436	S	36.4	Very low	36.7	Very low	90 Å²	90	135.9 Å²	135.9	63%	0.629	73%	0.725	S	S	*	*			cis	82.4	136.9	30.7	121.1	0	0	0	0	115.3
437	S	38.2	Very low	37.1	Very low	88 Å²	88	137.1 Å²	137.1	62%	0.615	73%	0.725	S	S	*	*			cis	-160.4	152.7	8.1	-58.7	0	0	0	0	115.2
438	T	39	Very low	37.2	Very low	120 Å²	120	132 Å²	132	74%	0.736	71%	0.713	S	S	*	*			trans	60.8	154.7	138.6	55.8	0	0	0	0	122.4
439	N	38	Very low	37.4	Very low	126 Å²	126	133 Å²	133	67%	0.674	71%	0.713	S	S	*	*			cis	-170.8	160.3	-7.6	-109	8	0	0	0	114.5
440	N	37.9	Very low	37.2	Very low	121 Å²	121	132.8 Å²	132.8	65%	0.647	72%	0.718	S	S	*	*			trans	67.2	159.6	144.4	-64.9	6.1	0	0	0	121.2
441	H	41	Very low	37	Very low	157 Å²	157	130.8 Å²	130.8	73%	0.727	72%	0.722	S	S	*	*			cis	-160.9	163.1	-3.6	-119.1	-49.5	0	0	0	112.2
442	S	39.2	Very low	37.1	Very low	92 Å²	92	128.6 Å²	128.6	64%	0.643	72%	0.721	S	S	*	*			trans	60.4	150.3	148.9	55.3	0	0	0	0	122.3
443	E	36.1	Very low	37.2	Very low	176 Å²	176	128.6 Å²	128.6	82%	0.822	72%	0.723	S	S	*	*			cis	-167.2	165.5	-12.9	-111.3	168.1	152	0	0	112.3
444	S	37.4	Very low	36.9	Very low	109 Å²	109	126.5 Å²	126.5	76%	0.762	73%	0.727	S	S	*	*			trans	25	152.8	154.4	60.6	0	0	0	0	123.4
445	S	38.4	Very low	36.7	Very low	96 Å²	96	128 Å²	128	67%	0.671	73%	0.733	S	S	*	*			cis	-166.8	178.9	-13.4	55.3	0	0	0	0	106.4
446	D	36.1	Very low	36.3	Very low	129 Å²	129	125.5 Å²	125.5	69%	0.69	73%	0.733	S	S	*	*			cis	-172.3	167.6	34.2	-124	-50.3	0	0	0	111.6
447	I	38.7	Very low	36	Very low	150 Å²	150	127.3 Å²	127.3	77%	0.769	74%	0.74	S	S	*	*			trans	59.6	128.5	153.1	-67	164.6	0	0	0	118.6
448	S	34.3	Very low	35.9	Very low	85 Å²	85	128.6 Å²	128.6	59%	0.594	75%	0.749	S	S	*	*			cis	-171.5	179.5	-1.8	52.4	0	0	0	0	113
449	H	37.5	Very low	36.1	Very low	163 Å²	163	128 Å²	128	76%	0.755	75%	0.75	S	S	*	*			trans	78.9	75.3	160.6	-66.3	-59.5	0	0	0	122.7
450	T	33.1	Very low	36.4	Very low	130 Å²	130	125.2 Å²	125.2	80%	0.798	74%	0.741	S	S	*	*				48.2	100.4	118.4	56.7	0	0	0	0	121.5
451	A	32.3	Very low	37.4	Very low	104 Å²	104	123.6 Å²	123.6	86%	0.86	74%	0.739	S	S	*	*			trans	-159.4	132.6	138.9	0	0	0	0	0	112.6
452	H	35.1	Very low	38.3	Very low	189 Å²	189	120.1 Å²	120.1	88%	0.875	73%	0.73	S	S	*	*			trans	-135.5	165.1	169.5	-82.8	-59.1	0	0	0	108
453	P	38.6	Very low	39.7	Very low	113 Å²	113	119.8 Å²	119.8	73%	0.734	72%	0.724	S	S	*	*			cis	-133.6	171.9	-44.9	38.9	-24.5	0	0	0	111.4
454	S	32.9	Very low	41.8	Very low	122 Å²	122	116.6 Å²	116.6	85%	0.853	71%	0.712	S	S	*	*			trans	-151.1	139.3	160.1	49.2	0	0	0	0	112.3
455	I	33.2	Very low	43.7	Very low	153 Å²	153	114 Å²	114	79%	0.785	69%	0.69	S	S	*	*			trans	-120.2	152.8	-179.6	-62.8	171.7	0	0	0	107.6
456	T	28.6	Very low	45.5	Very low	122 Å²	122	112.9 Å²	112.9	75%	0.748	68%	0.682	S	S	*	*			trans	87.8	160.5	177.7	78.2	0	0	0	0	117.8
457	T	31	Very low	47.8	Very low	129 Å²	129	110.9 Å²	110.9	79%	0.791	67%	0.674	S	S	*	*			trans	65.2	83.6	175.5	65.5	0	0	0	0	118.4
458	S	36.2	Very low	50	Low	114 Å²	114	106.8 Å²	106.8	80%	0.797	66%	0.656	S	S	*	*			trans	-149.4	4	165.2	61.9	0	0	0	0	116.8
459	S	42.3	Very low	52.3	Low	109 Å²	109	103.7 Å²	103.7	76%	0.762	63%	0.633	S	S	*	*	S	Bend	trans	-105	-4	-174.5	53.9	0	0	0	0	115.9
460	S	45.7	Very low	54.6	Low	67 Å²	67	100.6 Å²	100.6	47%	0.469	62%	0.621	S	S	.	*			trans	-92.4	-10.1	-171.4	51.5	0	0	0	0	115.6	T463	S460-T463 PolarHBondContact O-OG1 2.9Å; S460-T463 VanDerWaalsContact O-OG1 3.06Å
461	S	57.2	Low	57.2	Low	87 Å²	87	99 Å²	99	61%	0.608	61%	0.607	S	S	*	*	H	α-helix	trans	-62.6	-40.2	-172.4	48.6	0	0	0	0	116.4
462	P	60.2	Low	59.9	Low	84 Å²	84	94.2 Å²	94.2	55%	0.545	57%	0.567	S	S	.	*	H	α-helix	trans	-73.3	-32.8	-177.2	28.4	-34.5	0	0	0	113	L464 S466	P462-L464 VanDerWaalsContact C-N 3.35Å; P462-L464 PolarHBondContact O-N 3.2Å; P462-S466 PolarHBondContact O-N 2.81Å
463	T	69.5	Low	62.5	Low	85 Å²	85	85.4 Å²	85.4	52%	0.521	53%	0.526	S	S	.	.	H	α-helix	trans	-70.7	-32.4	-177.3	58.8	0	0	0	0	112.1	S460 T467	S460-T463 PolarHBondContact O-OG1 2.9Å; S460-T463 VanDerWaalsContact O-OG1 3.06Å; T463-T467 WeakPolarHBondContact O-CB 3.29Å; T463-T467 PolarHBondContact O-N 3.17Å; T463-T467 PolarHBondContact O-OG1 3.47Å
464	L	79.3	Confident	64.9	Low	108 Å²	108	83.4 Å²	83.4	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-63.2	-45.9	176.8	-68.6	174.1	0	0	0	112	P462 T467 V468	P462-L464 VanDerWaalsContact C-N 3.35Å; P462-L464 PolarHBondContact O-N 3.2Å; L464-T467 WeakPolarHBondContact O-CB 3.48Å; L464-T467 PolarHBondContact O-N 2.99Å; L464-V468 WeakPolarHBondContact O-CG2 3.49Å; L464-V468 PolarHBondContact O-N 3.1Å
465	L	77.5	Confident	67.7	Low	56 Å²	56	80.3 Å²	80.3	29%	0.293	48%	0.484	S	S	.	.	H	α-helix	trans	-63.7	-44.4	179.6	-177	60.5	0	0	0	111.8	F392 V396 L400 T467 V468 D469	F392-L465 HydrophobicContact CD1-CD1 4.3Å; V396-L465 HydrophobicContact CG2-CD2 4.05Å; L400-L465 HydrophobicContact CD1-CD2 4.29Å; L465-T467 VanDerWaalsContact C-N 3.28Å; L465-T467 PolarHBondContact O-N 2.86Å; L465-V468 PolarHBondContact O-N 2.77Å; L465-D469 PolarHBondContact O-N 3.29Å
466	S	76.4	Confident	70.5	Confident	72 Å²	72	73.8 Å²	73.8	50%	0.503	45%	0.451	S	S	.	.	H	α-helix	trans	-63.3	-33.5	174.4	-60.9	0	0	0	0	112.9	P462 I470	P462-S466 PolarHBondContact O-N 2.81Å; S466-I470 WeakPolarHBondContact O-CD1 3.35Å; S466-I470 VanDerWaalsContact O-CG1 3.29Å; S466-I470 WeakPolarHBondContact O-CG1 3.42Å; S466-I470 PolarHBondContact O-N 3.18Å; S466-I470 VanDerWaalsContact O-N 3.1Å
467	T	83.4	Confident	73.4	Confident	86 Å²	86	71.6 Å²	71.6	53%	0.528	43%	0.433	S	S	.	.	H	α-helix	trans	-66.9	-40	175.1	-56.6	0	0	0	0	111.5	T463 L464 L465 L471	T463-T467 WeakPolarHBondContact O-CB 3.29Å; T463-T467 PolarHBondContact O-N 3.17Å; T463-T467 PolarHBondContact O-OG1 3.47Å; L464-T467 WeakPolarHBondContact O-CB 3.48Å; L464-T467 PolarHBondContact O-N 2.99Å; L465-T467 VanDerWaalsContact C-N 3.28Å; L465-T467 PolarHBondContact O-N 2.86Å; T467-L471 WeakPolarHBondContact O-CB 3.28Å; T467-L471 PolarHBondContact O-N 3.31Å
468	V	85.8	Confident	76.4	Confident	64 Å²	64	68.4 Å²	68.4	39%	0.388	41%	0.411	S	S	.	.	H	α-helix	trans	-65.3	-47.6	174.7	175.1	0	0	0	0	111	Y388 L464 L465 I470 L471 V472	Y388-V468 HydrophobicContact CE1-CG1 4.27Å; Y388-V468 HydrophobicContact CE2-CG1 4.23Å; Y388-V468 WeakPolarHBondContact OH-CG1 3.22Å; L464-V468 WeakPolarHBondContact O-CG2 3.49Å; L464-V468 PolarHBondContact O-N 3.1Å; L465-V468 PolarHBondContact O-N 2.77Å; V468-I470 VanDerWaalsContact C-N 3.3Å; V468-I470 PolarHBondContact O-N 2.86Å; V468-L471 PolarHBondContact O-N 2.68Å; V468-L471 VanDerWaalsContact O-N 3.11Å; V468-V472 HydrophobicContact CG1-CG2 4.22Å; V468-V472 WeakPolarHBondContact O-CG2 3.44Å; V468-V472 PolarHBondContact O-N 3.46Å
469	D	83.2	Confident	79	Confident	21 Å²	21	63.7 Å²	63.7	11%	0.112	38%	0.377	C	S	.	.	H	α-helix	trans	-56.4	-43	177.5	-92.5	20	0	0	0	112.1	Y388 L465 V472 D473 R544	Y388-D469 PolarHBondContact OH-OD1 2.75Å; L465-D469 PolarHBondContact O-N 3.29Å; D469-V472 PolarHBondContact O-N 2.73Å; D469-D473 WeakPolarHBondContact O-CB 3.45Å; D469-D473 VanDerWaalsContact O-CG 3.31Å; D469-D473 PolarHBondContact O-N 2.91Å; D469-R544 IonicContact OD2-CZ 3.97Å; D469-R544 IonicContact OD2-NH1 2.69Å; D469-R544 PolarHBondContact OD2-NH1 2.76Å; D469-R544 IonicContact OD2-NH2 3.22Å
470	I	84.4	Confident	81.4	Confident	98 Å²	98	59.3 Å²	59.3	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-64.2	-43.4	175.7	-69	165.9	0	0	0	111.4	S466 V468 V472 D473 V474	S466-I470 WeakPolarHBondContact O-CD1 3.35Å; S466-I470 VanDerWaalsContact O-CG1 3.29Å; S466-I470 WeakPolarHBondContact O-CG1 3.42Å; S466-I470 PolarHBondContact O-N 3.18Å; S466-I470 VanDerWaalsContact O-N 3.1Å; V468-I470 VanDerWaalsContact C-N 3.3Å; V468-I470 PolarHBondContact O-N 2.86Å; I470-V472 VanDerWaalsContact C-N 3.32Å; I470-V472 PolarHBondContact O-N 3.36Å; I470-D473 PolarHBondContact O-N 3.1Å; I470-V474 WeakPolarHBondContact O-CG2 3.37Å; I470-V474 PolarHBondContact O-N 3.49Å
471	L	89.2	Confident	83.6	Confident	96 Å²	96	61.4 Å²	61.4	50%	0.503	35%	0.35	S	S	.	.	H	α-helix	trans	-62.8	-39.6	177.2	-177.3	150.7	0	0	0	111.6	T467 V468 V474 M475	T467-L471 WeakPolarHBondContact O-CB 3.28Å; T467-L471 PolarHBondContact O-N 3.31Å; V468-L471 PolarHBondContact O-N 2.68Å; V468-L471 VanDerWaalsContact O-N 3.11Å; L471-V474 PolarHBondContact O-N 3.45Å; L471-M475 HydrophobicContact CD2-CE 4.4Å; L471-M475 HydrophobicContact CD2-CG 4.28Å; L471-M475 WeakPolarHBondContact O-CG 3.1Å; L471-M475 PolarHBondContact O-N 3.02Å
472	V	89.4	Confident	85.3	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.024	33%	0.328	C	S	.	.	H	α-helix	trans	-66	-45.8	175.8	174.1	0	0	0	0	110.9	L385 Y388 T389 V468 D469 I470 V474 M475 F476	L385-V472 HydrophobicContact CD2-CG2 4.06Å; Y388-V472 HydrophobicContact CD1-CG1 4.39Å; Y388-V472 HydrophobicContact CD1-CG2 4.02Å; Y388-V472 HydrophobicContact CE1-CG2 3.96Å; T389-V472 HydrophobicContact CG2-CG1 3.66Å; V468-V472 HydrophobicContact CG1-CG2 4.22Å; V468-V472 WeakPolarHBondContact O-CG2 3.44Å; V468-V472 PolarHBondContact O-N 3.46Å; D469-V472 PolarHBondContact O-N 2.73Å; I470-V472 VanDerWaalsContact C-N 3.32Å; I470-V472 PolarHBondContact O-N 3.36Å; V472-V474 VanDerWaalsContact C-N 3.29Å; V472-V474 PolarHBondContact O-N 3.47Å; V472-M475 PolarHBondContact O-N 3.42Å; V472-M475 VanDerWaalsContact O-N 3.12Å; V472-F476 HydrophobicContact CG1-CD2 4Å; V472-F476 HydrophobicContact CG1-CE2 3.65Å; V472-F476 VanDerWaalsContact O-CD2 3.24Å; V472-F476 WeakPolarHBondContact O-CD2 3.31Å; V472-F476 PolarHBondContact O-N 3.13Å
473	D	88	Confident	86.7	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-59.2	-39.7	175.9	-72.1	-7.5	0	0	0	111.2	D469 I470 F476 I477 P520 R544 R547	D469-D473 WeakPolarHBondContact O-CB 3.45Å; D469-D473 VanDerWaalsContact O-CG 3.31Å; D469-D473 PolarHBondContact O-N 2.91Å; I470-D473 PolarHBondContact O-N 3.1Å; D473-F476 PolarHBondContact O-N 3.41Å; D473-I477 WeakPolarHBondContact O-CG1 3.44Å; D473-I477 PolarHBondContact O-N 3.35Å; D473-P520 HydrophobicContact CB-CB 4.39Å; D473-R544 IonicContact OD1-NE 3.24Å; D473-R544 PolarHBondContact OD1-NE 2.76Å; D473-R544 IonicContact OD1-NH2 2.78Å; D473-R544 IonicContact OD2-CZ 3.89Å; D473-R544 IonicContact OD2-NE 3.93Å; D473-R544 IonicContact OD2-NH2 3.49Å; D473-R544 PolarHBondContact OD2-NH2 3.11Å; D473-R547 IonicContact OD1-CZ 3.98Å; D473-R547 IonicContact OD1-NH1 2.86Å; D473-R547 PolarHBondContact OD1-NH1 2.81Å; D473-R547 IonicContact OD1-NH2 3.31Å; D473-R547 PolarHBondContact OD1-NH2 3.49Å
474	V	90.5	Very high	87.8	Confident	70 Å²	70	53.8 Å²	53.8	42%	0.424	29%	0.292	S	S	.	.	H	α-helix	trans	-63.1	-40.9	172.8	168.1	0	0	0	0	112.7	I470 L471 V472 F476 I477 I478	I470-V474 WeakPolarHBondContact O-CG2 3.37Å; I470-V474 PolarHBondContact O-N 3.49Å; L471-V474 PolarHBondContact O-N 3.45Å; V472-V474 VanDerWaalsContact C-N 3.29Å; V472-V474 PolarHBondContact O-N 3.47Å; V474-F476 VanDerWaalsContact C-N 3.32Å; V474-F476 PolarHBondContact O-N 3.15Å; V474-I477 WeakPolarHBondContact O-CB 3.41Å; V474-I477 PolarHBondContact O-N 2.87Å; V474-I477 VanDerWaalsContact O-N 3.17Å; V474-I478 HydrophobicContact CG1-CD1 4Å; V474-I478 WeakPolarHBondContact O-CG1 3.36Å; V474-I478 PolarHBondContact O-N 3.36Å
475	M	91.5	Very high	88.3	Confident	57 Å²	57	53.4 Å²	53.4	28%	0.281	28%	0.283	S	S	.	.	H	α-helix	trans	-64.5	-34.1	178.7	-71.8	-68.6	175.4	0	0	112.7	W378 L385 L471 V472 I478 D479	W378-M475 HydrophobicContact CH2-SD 3.88Å; W378-M475 HydrophobicContact CZ3-SD 4.48Å; L385-M475 HydrophobicContact CD1-CB 3.51Å; L385-M475 HydrophobicContact CD1-CG 3.93Å; L471-M475 HydrophobicContact CD2-CE 4.4Å; L471-M475 HydrophobicContact CD2-CG 4.28Å; L471-M475 WeakPolarHBondContact O-CG 3.1Å; L471-M475 PolarHBondContact O-N 3.02Å; V472-M475 PolarHBondContact O-N 3.42Å; V472-M475 VanDerWaalsContact O-N 3.12Å; M475-I478 PolarHBondContact O-N 3.03Å; M475-I478 HydrophobicContact SD-CD1 4.25Å; M475-D479 PolarHBondContact O-N 3.09Å
476	F	90.5	Very high	88.9	Confident	17 Å²	17	51.6 Å²	51.6	8%	0.075	28%	0.275	C	S	.	.	H	α-helix	trans	-68.9	-35.1	172.7	-76.9	-73.7	0	0	0	112.7	I382 L385 I386 T389 V472 D473 V474 I478 D479 I480 A518 R547	I382-F476 HydrophobicContact CG2-CE1 4.07Å; L385-F476 HydrophobicContact CB-CE2 4.11Å; L385-F476 HydrophobicContact CB-CZ 4.07Å; I386-F476 HydrophobicContact CG1-CE1 3.78Å; I386-F476 HydrophobicContact CG1-CZ 3.72Å; T389-F476 HydrophobicContact CG2-CE2 4.14Å; V472-F476 HydrophobicContact CG1-CD2 4Å; V472-F476 HydrophobicContact CG1-CE2 3.65Å; V472-F476 VanDerWaalsContact O-CD2 3.24Å; V472-F476 WeakPolarHBondContact O-CD2 3.31Å; V472-F476 PolarHBondContact O-N 3.13Å; D473-F476 PolarHBondContact O-N 3.41Å; V474-F476 VanDerWaalsContact C-N 3.32Å; V474-F476 PolarHBondContact O-N 3.15Å; F476-I478 VanDerWaalsContact C-N 3.31Å; F476-I478 PolarHBondContact O-N 3.03Å; F476-D479 PolarHBondContact O-N 3.48Å; F476-I480 PolarHBondContact O-N 3.32Å; F476-A518 HydrophobicContact CB-CB 4.34Å; F476-R547 HydrophobicContact CD1-CG 4.43Å; F476-R547 HydrophobicContact CE1-CB 4.3Å; F476-R547 HydrophobicContact CE1-CG 4.14Å; F476-R547 HydrophobicContact CE2-CG 4.38Å; F476-R547 HydrophobicContact CZ-CB 4.25Å; F476-R547 HydrophobicContact CZ-CG 4.12Å
477	I	91	Very high	89.6	Confident	75 Å²	75	48.5 Å²	48.5	39%	0.385	25%	0.252	S	S	.	.	H	α-helix	trans	-63.7	-39	172.2	-64.4	167.1	0	0	0	110.7	D473 V474 I480 L481 A518	D473-I477 WeakPolarHBondContact O-CG1 3.44Å; D473-I477 PolarHBondContact O-N 3.35Å; V474-I477 WeakPolarHBondContact O-CB 3.41Å; V474-I477 PolarHBondContact O-N 2.87Å; V474-I477 VanDerWaalsContact O-N 3.17Å; I477-I480 PolarHBondContact O-N 3.36Å; I477-L481 PolarHBondContact O-N 2.93Å; I477-A518 HydrophobicContact CG1-CB 4.17Å
478	I	92.6	Very high	89.8	Confident	62 Å²	62	46.8 Å²	46.8	32%	0.318	24%	0.237	S	C	.	.	H	α-helix	trans	-66.4	-38.7	175.1	-64.5	167.2	0	0	0	111.4	W378 V474 M475 F476 I480 L481 I482	W378-I478 HydrophobicContact CH2-CB 4.22Å; W378-I478 HydrophobicContact CH2-CG2 3.6Å; W378-I478 HydrophobicContact CZ2-CB 4.2Å; W378-I478 HydrophobicContact CZ2-CG2 3.71Å; V474-I478 HydrophobicContact CG1-CD1 4Å; V474-I478 WeakPolarHBondContact O-CG1 3.36Å; V474-I478 PolarHBondContact O-N 3.36Å; M475-I478 PolarHBondContact O-N 3.03Å; M475-I478 HydrophobicContact SD-CD1 4.25Å; F476-I478 VanDerWaalsContact C-N 3.31Å; F476-I478 PolarHBondContact O-N 3.03Å; I478-I480 VanDerWaalsContact C-N 3.34Å; I478-I480 PolarHBondContact O-N 3.01Å; I478-L481 PolarHBondContact O-N 2.91Å; I478-I482 HydrophobicContact CG2-CD1 3.83Å; I478-I482 HydrophobicContact CG2-CG1 4.39Å; I478-I482 WeakPolarHBondContact O-CG1 3.2Å; I478-I482 PolarHBondContact O-N 3.49Å
479	D	92	Very high	89.7	Confident	15 Å²	15	46 Å²	46	8%	0.08	23%	0.232	C	C	.	.	H	α-helix	trans	-61.1	-40.8	176.2	-166.7	62.1	0	0	0	112.3	W378 I382 M475 F476 L481 I482 N483	W378-D479 HydrophobicContact CZ2-CB 4.48Å; W378-D479 PolarHBondContact NE1-OD1 3.41Å; I382-D479 HydrophobicContact CD1-CB 3.89Å; I382-D479 HydrophobicContact CG1-CB 4.26Å; M475-D479 PolarHBondContact O-N 3.09Å; F476-D479 PolarHBondContact O-N 3.48Å; D479-L481 VanDerWaalsContact C-N 3.34Å; D479-L481 PolarHBondContact O-N 3.48Å; D479-I482 PolarHBondContact O-N 3.1Å; D479-N483 WeakPolarHBondContact O-CB 3.41Å; D479-N483 PolarHBondContact O-N 3.07Å; D479-N483 PolarHBondContact O-ND2 3.4Å; D479-N483 VanDerWaalsContact O-ND2 3.1Å; D479-N483 PolarHBondContact OD2-ND2 2.74Å
480	I	92	Very high	89.6	Confident	17 Å²	17	47.7 Å²	47.7	9%	0.087	24%	0.241	C	C	.	.	H	α-helix	trans	-57.4	-47	173.9	-66.8	169.4	0	0	0	110.8	F476 I477 I478 I482 N483 F484 Y506 F511 D514 A518	F476-I480 PolarHBondContact O-N 3.32Å; I477-I480 PolarHBondContact O-N 3.36Å; I478-I480 VanDerWaalsContact C-N 3.34Å; I478-I480 PolarHBondContact O-N 3.01Å; I480-I482 VanDerWaalsContact C-N 3.33Å; I480-I482 PolarHBondContact O-N 3.02Å; I480-N483 PolarHBondContact O-N 3.18Å; I480-F484 HydrophobicContact CG2-CD2 3.95Å; I480-F484 HydrophobicContact CG2-CE2 3.83Å; I480-F484 VanDerWaalsContact O-CD2 3.28Å; I480-F484 WeakPolarHBondContact O-CD2 3.43Å; I480-F484 PolarHBondContact O-N 2.71Å; I480-Y506 HydrophobicContact CG2-CE1 4.32Å; I480-F511 HydrophobicContact CG2-CD2 4.2Å; I480-F511 HydrophobicContact CG2-CE2 4.03Å; I480-D514 HydrophobicContact CD1-CB 4.11Å; I480-D514 HydrophobicContact CG1-CB 3.88Å; I480-A518 HydrophobicContact CD1-CB 3.71Å
481	L	92.6	Very high	89.5	Confident	112 Å²	112	52.6 Å²	52.6	59%	0.586	26%	0.259	S	S	*	.	H	α-helix	trans	-63.8	-36.7	178.6	-64.9	174.8	0	0	0	112.5	I477 I478 D479	I477-L481 PolarHBondContact O-N 2.93Å; I478-L481 PolarHBondContact O-N 2.91Å; D479-L481 VanDerWaalsContact C-N 3.34Å; D479-L481 PolarHBondContact O-N 3.48Å
482	I	91.9	Very high	88.9	Confident	29 Å²	29	53.2 Å²	53.2	15%	0.149	26%	0.263	C	S	.	.	H	α-helix	trans	-68.3	-44.9	174.6	-71.3	169.2	0	0	0	110.6	L368 K375 W378 I478 D479 I480 F484 R485 T486	L368-I482 HydrophobicContact CD2-CG2 3.9Å; K375-I482 HydrophobicContact CD-CG2 4.24Å; W378-I482 HydrophobicContact CD2-CD1 3.84Å; W378-I482 VanDerWaalsContact CE2-CD1 3.47Å; W378-I482 HydrophobicContact CE3-CD1 4.33Å; W378-I482 HydrophobicContact CG-CD1 4.34Å; W378-I482 HydrophobicContact CH2-CD1 4.22Å; W378-I482 HydrophobicContact CZ2-CD1 3.69Å; I478-I482 HydrophobicContact CG2-CD1 3.83Å; I478-I482 HydrophobicContact CG2-CG1 4.39Å; I478-I482 WeakPolarHBondContact O-CG1 3.2Å; I478-I482 PolarHBondContact O-N 3.49Å; D479-I482 PolarHBondContact O-N 3.1Å; I480-I482 VanDerWaalsContact C-N 3.33Å; I480-I482 PolarHBondContact O-N 3.02Å; I482-F484 VanDerWaalsContact C-N 3.29Å; I482-F484 PolarHBondContact O-N 3.2Å; I482-R485 CarbonylContact O-C 3.5Å; I482-R485 WeakPolarHBondContact O-CA 3.46Å; I482-R485 PolarHBondContact O-N 3.12Å; I482-T486 HydrophobicContact CG2-CG2 3.89Å; I482-T486 WeakPolarHBondContact O-CG2 3.28Å; I482-T486 PolarHBondContact O-N 3.02Å
483	N	90.3	Very high	87.9	Confident	22 Å²	22	56.5 Å²	56.5	12%	0.118	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-33.7	-179.7	-69.3	-33.7	0	0	0	112.2	D479 I480 R485 T486 Y506	D479-N483 WeakPolarHBondContact O-CB 3.41Å; D479-N483 PolarHBondContact O-N 3.07Å; D479-N483 PolarHBondContact O-ND2 3.4Å; D479-N483 VanDerWaalsContact O-ND2 3.1Å; D479-N483 PolarHBondContact OD2-ND2 2.74Å; I480-N483 PolarHBondContact O-N 3.18Å; N483-R485 PolarHBondContact O-N 3.15Å; N483-T486 WeakPolarHBondContact CA-OG1 3.35Å; N483-T486 PolarHBondContact O-N 3.14Å; N483-T486 PolarHBondContact O-OG1 2.86Å; N483-T486 VanDerWaalsContact O-OG1 3.06Å; N483-Y506 HydrophobicContact CB-CD1 4.47Å; N483-Y506 HydrophobicContact CB-CE1 3.91Å; N483-Y506 HydrophobicContact CB-CE2 4.12Å
484	F	92.1	Very high	87.1	Confident	44 Å²	44	61.3 Å²	61.3	19%	0.193	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-16.6	169.1	-90.4	-66.3	0	0	0	114.7	I480 I482 I502 A503 Y506 I507 F511	I480-F484 HydrophobicContact CG2-CD2 3.95Å; I480-F484 HydrophobicContact CG2-CE2 3.83Å; I480-F484 VanDerWaalsContact O-CD2 3.28Å; I480-F484 WeakPolarHBondContact O-CD2 3.43Å; I480-F484 PolarHBondContact O-N 2.71Å; I482-F484 VanDerWaalsContact C-N 3.29Å; I482-F484 PolarHBondContact O-N 3.2Å; F484-I502 WeakPolarHBondContact O-CG2 3.4Å; F484-A503 HydrophobicContact CD1-CB 3.79Å; F484-A503 HydrophobicContact CE1-CB 4Å; F484-Y506 AromaticContact CD1-CD1 3.86Å; F484-Y506 HydrophobicContact CD1-CD1 3.86Å; F484-Y506 AromaticContact CD2-CD1 3.95Å; F484-Y506 HydrophobicContact CD2-CD1 3.95Å; F484-Y506 AromaticContact CD2-CE1 3.81Å; F484-Y506 HydrophobicContact CD2-CE1 3.81Å; F484-Y506 AromaticContact CE1-CD1 3.82Å; F484-Y506 HydrophobicContact CE1-CD1 3.82Å; F484-Y506 AromaticContact CE2-CD1 3.9Å; F484-Y506 HydrophobicContact CE2-CD1 3.9Å; F484-Y506 AromaticContact CE2-CE1 3.76Å; F484-Y506 HydrophobicContact CE2-CE1 3.76Å; F484-Y506 AromaticContact CG-CD1 3.92Å; F484-Y506 HydrophobicContact CG-CD1 3.92Å; F484-Y506 HydrophobicContact CG-CE1 4.21Å; F484-Y506 AromaticContact CZ-CD1 3.83Å; F484-Y506 HydrophobicContact CZ-CD1 3.83Å; F484-Y506 HydrophobicContact CZ-CE1 4.12Å; F484-I507 HydrophobicContact CE1-CD1 3.87Å; F484-I507 HydrophobicContact CE1-CG1 3.77Å; F484-I507 HydrophobicContact CZ-CD1 4.25Å; F484-I507 HydrophobicContact CZ-CG1 3.93Å; F484-F511 AromaticContact CE2-CD2 3.64Å; F484-F511 HydrophobicContact CE2-CD2 3.64Å; F484-F511 AromaticContact CE2-CE2 3.61Å; F484-F511 HydrophobicContact CE2-CE2 3.61Å; F484-F511 HydrophobicContact CE2-CZ 4.45Å; F484-F511 AromaticContact CZ-CD2 3.69Å; F484-F511 HydrophobicContact CZ-CD2 3.69Å; F484-F511 AromaticContact CZ-CE2 3.82Å; F484-F511 HydrophobicContact CZ-CE2 3.82Å; F484-F511 HydrophobicContact CZ-CG 4.13Å; F484-F511 HydrophobicContact CZ-CZ 4.34Å
485	R	91.1	Very high	86.5	Confident	101 Å²	101	60 Å²	60	38%	0.381	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-1	-179	-66.1	-56.1	-171.2	133.6	-6.5	114.2	F366 T367 L368 I482 N483	F366-R485 WeakPolarHBondContact O-CD 3.26Å; F366-R485 PolarHBondContact O-NH1 3.43Å; T367-R485 CarbonylContact C-O 3.56Å; T367-R485 WeakPolarHBondContact CA-O 3.34Å; T367-R485 VanDerWaalsContact CG2-O 3.28Å; T367-R485 WeakPolarHBondContact CG2-O 3.47Å; L368-R485 PolarHBondContact N-O 3.26Å; I482-R485 CarbonylContact O-C 3.5Å; I482-R485 WeakPolarHBondContact O-CA 3.46Å; I482-R485 PolarHBondContact O-N 3.12Å; N483-R485 PolarHBondContact O-N 3.15Å
486	T	90.4	Very high	86.1	Confident	18 Å²	18	58 Å²	58	11%	0.11	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-82.7	133.6	174.8	49.5	0	0	0	0	111.9	L368 K375 I482 N483 I502	L368-T486 HydrophobicContact CB-CG2 4.13Å; L368-T486 HydrophobicContact CD2-CG2 3.91Å; L368-T486 HydrophobicContact CG-CG2 4.2Å; L368-T486 CarbonylContact O-C 3.6Å; L368-T486 WeakPolarHBondContact O-CA 3.43Å; K375-T486 HydrophobicContact CD-CG2 3.93Å; K375-T486 VanDerWaalsContact CE-CG2 3.48Å; K375-T486 HydrophobicContact CG-CG2 4.38Å; I482-T486 HydrophobicContact CG2-CG2 3.89Å; I482-T486 WeakPolarHBondContact O-CG2 3.28Å; I482-T486 PolarHBondContact O-N 3.02Å; N483-T486 WeakPolarHBondContact CA-OG1 3.35Å; N483-T486 PolarHBondContact O-N 3.14Å; N483-T486 PolarHBondContact O-OG1 2.86Å; N483-T486 VanDerWaalsContact O-OG1 3.06Å; T486-I502 WeakPolarHBondContact O-CG2 3.46Å
487	T	90	Very high	85.6	Confident	6 Å²	6	59 Å²	59	4%	0.037	30%	0.295	C	S	.	.			trans	-59.2	156.1	169.7	62.7	0	0	0	0	111.4	M363 T367 L368 H370 V495 V496	M363-T487 HydrophobicContact CE-CG2 3.45Å; M363-T487 VanDerWaalsContact CE-CG2 3.45Å; T367-T487 HydrophobicContact CG2-CG2 3.82Å; L368-T487 PolarHBondContact O-N 2.72Å; H370-T487 WeakPolarHBondContact CB-O 3.47Å; H370-T487 PolarHBondContact N-OG1 3.16Å; H370-T487 VanDerWaalsContact N-OG1 3.14Å; H370-T487 PolarHBondContact ND1-OG1 3.34Å; T487-V495 HydrophobicContact CG2-CG1 4.38Å; T487-V496 WeakPolarHBondContact CA-O 3.06Å; T487-V496 WeakPolarHBondContact CB-O 3.32Å
488	Y	86.9	Confident	85.2	Confident	50 Å²	50	60.5 Å²	60.5	20%	0.196	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	163.3	167.4	72.3	-82.2	0	0	0	110.2	V496 I502 H505	Y488-V496 HydrophobicContact CD1-CB 4.13Å; Y488-V496 HydrophobicContact CE1-CB 3.71Å; Y488-V496 HydrophobicContact CE1-CG1 3.79Å; Y488-V496 HydrophobicContact CE1-CG2 4.18Å; Y488-V496 HydrophobicContact CE2-CB 4.49Å; Y488-V496 HydrophobicContact CE2-CG2 4.15Å; Y488-V496 PolarHBondContact O-N 2.81Å; Y488-I502 HydrophobicContact CD1-CG1 4.18Å; Y488-I502 HydrophobicContact CE1-CG1 4.34Å; Y488-H505 HydrophobicContact CD1-CB 4.37Å; Y488-H505 AromaticContact CD1-ND1 3.96Å; Y488-H505 AromaticContact CD2-CE1 3.76Å; Y488-H505 AromaticContact CD2-ND1 3.86Å; Y488-H505 HydrophobicContact CE1-CB 3.73Å; Y488-H505 AromaticContact CE1-CG 3.85Å; Y488-H505 HydrophobicContact CE2-CB 4.47Å; Y488-H505 AromaticContact CE2-CD2 3.76Å; Y488-H505 AromaticContact CE2-CE1 3.97Å; Y488-H505 AromaticContact CE2-CG 3.83Å; Y488-H505 AromaticContact CE2-ND1 3.97Å; Y488-H505 AromaticContact CE2-NE2 3.86Å; Y488-H505 AromaticContact CG-ND1 3.87Å; Y488-H505 AromaticContact CZ-CD2 3.89Å; Y488-H505 AromaticContact CZ-CG 3.64Å
489	V	84.9	Confident	85	Confident	48 Å²	48	58.9 Å²	58.9	29%	0.291	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	128.1	173.5	-175.4	0	0	0	0	107.9	H370 E494	H370-V489 VanDerWaalsContact CE1-CG2 3.41Å; H370-V489 WeakPolarHBondContact CE1-CG2 3.28Å; V489-E494 WeakPolarHBondContact CA-O 3.36Å
490	N	81.2	Confident	84.9	Confident	57 Å²	57	67 Å²	67	31%	0.305	33%	0.328	S	S	.	.			trans	-78	169.3	176.6	-170.1	25.2	0	0	0	111	N492 D493 E494 V496	N490-N492 PolarHBondContact O-N 2.76Å; N490-N492 VanDerWaalsContact O-N 3.13Å; N490-D493 PolarHBondContact O-N 3.2Å; N490-E494 PolarHBondContact N-O 3.47Å; N490-V496 HydrophobicContact CB-CG2 4.14Å
491	K	82.7	Confident	84.8	Confident	201 Å²	201	73.7 Å²	73.7	87%	0.874	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-31.6	174.2	-70.2	-170	175.1	-170	0	113.4	D493	K491-D493 PolarHBondContact O-N 2.98Å
492	N	76.4	Confident	84.7	Confident	109 Å²	109	68.5 Å²	68.5	58%	0.583	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	13.8	179.3	-52	29.9	0	0	0	113.1	N490 E494	N490-N492 PolarHBondContact O-N 2.76Å; N490-N492 VanDerWaalsContact O-N 3.13Å; N492-E494 HydrophobicContact CB-CG 4.21Å; N492-E494 PolarHBondContact O-N 2.97Å
493	D	67.9	Low	84.7	Confident	72 Å²	72	68.2 Å²	68.2	39%	0.385	33%	0.327	S	S	.	.	S	Bend	trans	54.6	11.8	-169	-82.2	-46.3	0	0	0	115.7	G6 H7 N490 K491	G6-D493 CarbonylContact C-O 3.55Å; G6-D493 WeakPolarHBondContact CA-O 3.32Å; H7-D493 PolarHBondContact N-O 3.3Å; N490-D493 PolarHBondContact O-N 3.2Å; K491-D493 PolarHBondContact O-N 2.98Å
494	E	71.1	Confident	84.8	Confident	105 Å²	105	70 Å²	70	49%	0.491	35%	0.345	S	S	.	.			trans	-78	141	175	-64.2	-178.4	143	0	0	112.6	V489 N490 N492	V489-E494 WeakPolarHBondContact CA-O 3.36Å; N490-E494 PolarHBondContact N-O 3.47Å; N492-E494 HydrophobicContact CB-CG 4.21Å; N492-E494 PolarHBondContact O-N 2.97Å
495	V	78.5	Confident	84.8	Confident	42 Å²	42	72.8 Å²	72.8	26%	0.255	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	111.8	177.5	-175.6	0	0	0	0	111.2	T487	T487-V495 HydrophobicContact CG2-CG1 4.38Å
496	V	82	Confident	84.8	Confident	17 Å²	17	68.9 Å²	68.9	10%	0.103	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	117.6	-179.1	-177.3	0	0	0	0	111	T487 Y488 N490 R501	T487-V496 WeakPolarHBondContact CA-O 3.06Å; T487-V496 WeakPolarHBondContact CB-O 3.32Å; Y488-V496 HydrophobicContact CD1-CB 4.13Å; Y488-V496 HydrophobicContact CE1-CB 3.71Å; Y488-V496 HydrophobicContact CE1-CG1 3.79Å; Y488-V496 HydrophobicContact CE1-CG2 4.18Å; Y488-V496 HydrophobicContact CE2-CB 4.49Å; Y488-V496 HydrophobicContact CE2-CG2 4.15Å; Y488-V496 PolarHBondContact O-N 2.81Å; N490-V496 HydrophobicContact CB-CG2 4.14Å; V496-R501 HydrophobicContact CG1-CB 3.7Å
497	S	80.9	Confident	85	Confident	37 Å²	37	72.1 Å²	72.1	26%	0.259	36%	0.359	S	S	.	.			trans	-103.6	-22.8	-175.6	62	0	0	0	0	115.4
498	H	83.1	Confident	85	Confident	106 Å²	106	81 Å²	81	49%	0.491	40%	0.397	S	S	.	.			trans	-72.1	125.1	-174.1	-61.3	-70.8	0	0	0	112.1	K500 R501 I502	H498-K500 VanDerWaalsContact C-N 3.31Å; H498-K500 PolarHBondContact O-N 3.48Å; H498-R501 HydrophobicContact CB-CB 4.5Å; H498-R501 HydrophobicContact CB-CG 4.39Å; H498-R501 PolarHBondContact O-N 2.85Å; H498-I502 PolarHBondContact O-N 3.48Å; H498-I502 VanDerWaalsContact O-N 3.1Å
499	P	88	Confident	85	Confident	28 Å²	28	80.7 Å²	80.7	18%	0.182	41%	0.409	C	S	.	.	H	α-helix	trans	-62.7	-32.1	-172.4	22.9	-33.4	0	0	0	113.7	R501 I502 A503	P499-R501 PolarHBondContact O-N 3.07Å; P499-I502 PolarHBondContact O-N 3.39Å; P499-A503 VanDerWaalsContact O-CB 3.31Å; P499-A503 WeakPolarHBondContact O-CB 3.35Å; P499-A503 PolarHBondContact O-N 3.01Å
500	K	89.6	Confident	85.1	Confident	185 Å²	185	83.7 Å²	83.7	80%	0.804	42%	0.415	S	S	*	.	H	α-helix	trans	-64.1	-37.8	174.9	-68.1	-177.6	-179.9	176.2	0	112.7	H498 A504	H498-K500 VanDerWaalsContact C-N 3.31Å; H498-K500 PolarHBondContact O-N 3.48Å; K500-A504 WeakPolarHBondContact O-CB 3.33Å; K500-A504 PolarHBondContact O-N 2.89Å; K500-A504 VanDerWaalsContact O-N 3.12Å
501	R	89	Confident	85.5	Confident	158 Å²	158	83.2 Å²	83.2	60%	0.596	41%	0.41	S	S	*	.	H	α-helix	trans	-73.7	-42.2	177.9	-66.6	-174	-178.7	174.9	1.8	111	V496 H498 P499 A504 H505	V496-R501 HydrophobicContact CG1-CB 3.7Å; H498-R501 HydrophobicContact CB-CB 4.5Å; H498-R501 HydrophobicContact CB-CG 4.39Å; H498-R501 PolarHBondContact O-N 2.85Å; P499-R501 PolarHBondContact O-N 3.07Å; R501-A504 PolarHBondContact O-N 3.31Å; R501-H505 WeakPolarHBondContact O-CB 3.43Å; R501-H505 PolarHBondContact O-N 3.07Å
502	I	90.9	Very high	85.7	Confident	4 Å²	4	78.9 Å²	78.9	2%	0.021	40%	0.396	C	S	.	.	H	α-helix	trans	-56.3	-51.8	173	-66.2	165.5	0	0	0	110.8	T367 F484 T486 Y488 H498 P499 A504 H505 Y506	T367-I502 HydrophobicContact CG2-CD1 3.92Å; F484-I502 WeakPolarHBondContact O-CG2 3.4Å; T486-I502 WeakPolarHBondContact O-CG2 3.46Å; Y488-I502 HydrophobicContact CD1-CG1 4.18Å; Y488-I502 HydrophobicContact CE1-CG1 4.34Å; H498-I502 PolarHBondContact O-N 3.48Å; H498-I502 VanDerWaalsContact O-N 3.1Å; P499-I502 PolarHBondContact O-N 3.39Å; I502-A504 PolarHBondContact O-N 2.59Å; I502-H505 PolarHBondContact O-N 3.21Å; I502-Y506 PolarHBondContact O-N 2.96Å
503	A	92.5	Very high	86.2	Confident	23 Å²	23	76.5 Å²	76.5	19%	0.19	38%	0.383	C	S	.	.	H	α-helix	trans	-61.4	-45.4	-180	0	0	0	0	0	112.6	F484 P499 H505 Y506 I507	F484-A503 HydrophobicContact CD1-CB 3.79Å; F484-A503 HydrophobicContact CE1-CB 4Å; P499-A503 VanDerWaalsContact O-CB 3.31Å; P499-A503 WeakPolarHBondContact O-CB 3.35Å; P499-A503 PolarHBondContact O-N 3.01Å; A503-H505 VanDerWaalsContact C-N 3.34Å; A503-H505 PolarHBondContact O-N 3.06Å; A503-Y506 PolarHBondContact O-N 3.29Å; A503-I507 WeakPolarHBondContact O-CB 3.46Å; A503-I507 WeakPolarHBondContact O-CD1 3.33Å; A503-I507 VanDerWaalsContact O-CG1 3.23Å; A503-I507 WeakPolarHBondContact O-CG1 3.19Å; A503-I507 PolarHBondContact O-N 2.96Å
504	A	92.2	Very high	87.2	Confident	60 Å²	60	74 Å²	74	50%	0.496	37%	0.369	S	S	.	.	H	α-helix	trans	-62.1	-39.7	177.4	0	0	0	0	0	112.6	K500 R501 I502 K508	K500-A504 WeakPolarHBondContact O-CB 3.33Å; K500-A504 PolarHBondContact O-N 2.89Å; K500-A504 VanDerWaalsContact O-N 3.12Å; R501-A504 PolarHBondContact O-N 3.31Å; I502-A504 PolarHBondContact O-N 2.59Å; A504-K508 WeakPolarHBondContact O-CB 3.33Å; A504-K508 PolarHBondContact O-N 3.22Å; A504-K508 VanDerWaalsContact O-N 3.1Å
505	H	91.2	Very high	88	Confident	102 Å²	102	73 Å²	73	47%	0.472	37%	0.367	S	S	.	.	H	α-helix	trans	-65.1	-46.1	175.6	-178	-101.5	0	0	0	112.1	Y488 R501 I502 A503 K508 G509	Y488-H505 HydrophobicContact CD1-CB 4.37Å; Y488-H505 AromaticContact CD1-ND1 3.96Å; Y488-H505 AromaticContact CD2-CE1 3.76Å; Y488-H505 AromaticContact CD2-ND1 3.86Å; Y488-H505 HydrophobicContact CE1-CB 3.73Å; Y488-H505 AromaticContact CE1-CG 3.85Å; Y488-H505 HydrophobicContact CE2-CB 4.47Å; Y488-H505 AromaticContact CE2-CD2 3.76Å; Y488-H505 AromaticContact CE2-CE1 3.97Å; Y488-H505 AromaticContact CE2-CG 3.83Å; Y488-H505 AromaticContact CE2-ND1 3.97Å; Y488-H505 AromaticContact CE2-NE2 3.86Å; Y488-H505 AromaticContact CG-ND1 3.87Å; Y488-H505 AromaticContact CZ-CD2 3.89Å; Y488-H505 AromaticContact CZ-CG 3.64Å; R501-H505 WeakPolarHBondContact O-CB 3.43Å; R501-H505 PolarHBondContact O-N 3.07Å; I502-H505 PolarHBondContact O-N 3.21Å; A503-H505 VanDerWaalsContact C-N 3.34Å; A503-H505 PolarHBondContact O-N 3.06Å; H505-K508 PolarHBondContact O-N 2.82Å; H505-G509 PolarHBondContact O-N 2.92Å
506	Y	92.4	Very high	88.3	Confident	19 Å²	19	73.8 Å²	73.8	8%	0.075	37%	0.371	C	S	.	.	H	α-helix	trans	-66.5	-41.6	179.4	-177.7	-135	0	0	0	112.5	I480 N483 F484 I502 A503 G509 W510 F511 D514	I480-Y506 HydrophobicContact CG2-CE1 4.32Å; N483-Y506 HydrophobicContact CB-CD1 4.47Å; N483-Y506 HydrophobicContact CB-CE1 3.91Å; N483-Y506 HydrophobicContact CB-CE2 4.12Å; F484-Y506 AromaticContact CD1-CD1 3.86Å; F484-Y506 HydrophobicContact CD1-CD1 3.86Å; F484-Y506 AromaticContact CD2-CD1 3.95Å; F484-Y506 HydrophobicContact CD2-CD1 3.95Å; F484-Y506 AromaticContact CD2-CE1 3.81Å; F484-Y506 HydrophobicContact CD2-CE1 3.81Å; F484-Y506 AromaticContact CE1-CD1 3.82Å; F484-Y506 HydrophobicContact CE1-CD1 3.82Å; F484-Y506 AromaticContact CE2-CD1 3.9Å; F484-Y506 HydrophobicContact CE2-CD1 3.9Å; F484-Y506 AromaticContact CE2-CE1 3.76Å; F484-Y506 HydrophobicContact CE2-CE1 3.76Å; F484-Y506 AromaticContact CG-CD1 3.92Å; F484-Y506 HydrophobicContact CG-CD1 3.92Å; F484-Y506 HydrophobicContact CG-CE1 4.21Å; F484-Y506 AromaticContact CZ-CD1 3.83Å; F484-Y506 HydrophobicContact CZ-CD1 3.83Å; F484-Y506 HydrophobicContact CZ-CE1 4.12Å; I502-Y506 PolarHBondContact O-N 2.96Å; A503-Y506 PolarHBondContact O-N 3.29Å; Y506-G509 PolarHBondContact O-N 3.34Å; Y506-W510 HydrophobicContact CD2-CB 4.16Å; Y506-W510 HydrophobicContact CE2-CB 3.99Å; Y506-W510 PolarHBondContact O-N 3.04Å; Y506-W510 VanDerWaalsContact O-N 3.15Å; Y506-F511 HydrophobicContact CD1-CB 4.14Å; Y506-F511 HydrophobicContact CD1-CD2 4.45Å; Y506-F511 HydrophobicContact CD2-CB 4.38Å; Y506-F511 HydrophobicContact CE1-CB 4.11Å; Y506-F511 AromaticContact CE1-CD2 3.93Å; Y506-F511 HydrophobicContact CE1-CD2 3.93Å; Y506-F511 HydrophobicContact CE1-CG 4.46Å; Y506-F511 HydrophobicContact CE2-CB 4.33Å; Y506-F511 HydrophobicContact CG-CB 4.28Å; Y506-F511 WeakPolarHBondContact O-CB 3.38Å; Y506-F511 PolarHBondContact O-N 2.85Å; Y506-D514 WeakPolarHBondContact CE2-OD2 3.4Å; Y506-D514 PolarHBondContact OH-OD2 2.94Å
507	I	93.1	Very high	88.4	Confident	85 Å²	85	73.2 Å²	73.2	44%	0.436	37%	0.369	S	S	.	.	H	α-helix	trans	-62.9	-40.8	176.1	-70.7	166.1	0	0	0	111.8	F484 A503 G509 F511	F484-I507 HydrophobicContact CE1-CD1 3.87Å; F484-I507 HydrophobicContact CE1-CG1 3.77Å; F484-I507 HydrophobicContact CZ-CD1 4.25Å; F484-I507 HydrophobicContact CZ-CG1 3.93Å; A503-I507 WeakPolarHBondContact O-CB 3.46Å; A503-I507 WeakPolarHBondContact O-CD1 3.33Å; A503-I507 VanDerWaalsContact O-CG1 3.23Å; A503-I507 WeakPolarHBondContact O-CG1 3.19Å; A503-I507 PolarHBondContact O-N 2.96Å; I507-G509 PolarHBondContact O-N 3.35Å; I507-F511 HydrophobicContact CG1-CD1 4.14Å; I507-F511 HydrophobicContact CG1-CG 4.4Å
508	K	90.9	Very high	88.6	Confident	193 Å²	193	71.8 Å²	71.8	84%	0.839	36%	0.359	S	S	*	.	H	α-helix	trans	-67.8	-21.4	-179.5	-176.2	171	178.4	179	0	113.5	A504 H505	A504-K508 WeakPolarHBondContact O-CB 3.33Å; A504-K508 PolarHBondContact O-N 3.22Å; A504-K508 VanDerWaalsContact O-N 3.1Å; H505-K508 PolarHBondContact O-N 2.82Å
509	G	86.2	Confident	88.6	Confident	43 Å²	43	69.2 Å²	69.2	44%	0.443	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-92.4	-178.4	0	0	0	0	0	113.2	H505 Y506 I507	H505-G509 PolarHBondContact O-N 2.92Å; Y506-G509 PolarHBondContact O-N 3.34Å; I507-G509 PolarHBondContact O-N 3.35Å
510	W	86.6	Confident	88.3	Confident	112 Å²	112	70.1 Å²	70.1	42%	0.424	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-21.1	-158.7	-69.4	116.6	0	0	0	115.8	Y506 I512 I513 D514 V549 R553	Y506-W510 HydrophobicContact CD2-CB 4.16Å; Y506-W510 HydrophobicContact CE2-CB 3.99Å; Y506-W510 PolarHBondContact O-N 3.04Å; Y506-W510 VanDerWaalsContact O-N 3.15Å; W510-I512 VanDerWaalsContact C-N 3.28Å; W510-I512 PolarHBondContact O-N 2.93Å; W510-I513 HydrophobicContact CE3-CD1 3.95Å; W510-I513 HydrophobicContact CZ3-CD1 3.94Å; W510-I513 PolarHBondContact O-N 2.94Å; W510-I513 VanDerWaalsContact O-N 3.11Å; W510-D514 PolarHBondContact O-N 3.41Å; W510-V549 HydrophobicContact CE3-CG1 4.38Å; W510-V549 HydrophobicContact CH2-CG1 4.33Å; W510-V549 HydrophobicContact CZ3-CG1 3.6Å; W510-R553 HydrophobicContact CD2-CG 4.12Å; W510-R553 HydrophobicContact CE3-CG 4.48Å; W510-R553 HydrophobicContact CH2-CG 4.16Å; W510-R553 HydrophobicContact CZ2-CG 3.77Å; W510-R553 HydrophobicContact CZ3-CG 4.5Å
511	F	90	Very high	87.5	Confident	46 Å²	46	63.1 Å²	63.1	20%	0.202	32%	0.324	C	S	.	.	H	α-helix	trans	-53	-40.1	-174.5	170.4	-115.6	0	0	0	114	I480 F484 Y506 I507 I513 D514 L515	I480-F511 HydrophobicContact CG2-CD2 4.2Å; I480-F511 HydrophobicContact CG2-CE2 4.03Å; F484-F511 AromaticContact CE2-CD2 3.64Å; F484-F511 HydrophobicContact CE2-CD2 3.64Å; F484-F511 AromaticContact CE2-CE2 3.61Å; F484-F511 HydrophobicContact CE2-CE2 3.61Å; F484-F511 HydrophobicContact CE2-CZ 4.45Å; F484-F511 AromaticContact CZ-CD2 3.69Å; F484-F511 HydrophobicContact CZ-CD2 3.69Å; F484-F511 AromaticContact CZ-CE2 3.82Å; F484-F511 HydrophobicContact CZ-CE2 3.82Å; F484-F511 HydrophobicContact CZ-CG 4.13Å; F484-F511 HydrophobicContact CZ-CZ 4.34Å; Y506-F511 HydrophobicContact CD1-CB 4.14Å; Y506-F511 HydrophobicContact CD1-CD2 4.45Å; Y506-F511 HydrophobicContact CD2-CB 4.38Å; Y506-F511 HydrophobicContact CE1-CB 4.11Å; Y506-F511 AromaticContact CE1-CD2 3.93Å; Y506-F511 HydrophobicContact CE1-CD2 3.93Å; Y506-F511 HydrophobicContact CE1-CG 4.46Å; Y506-F511 HydrophobicContact CE2-CB 4.33Å; Y506-F511 HydrophobicContact CG-CB 4.28Å; Y506-F511 WeakPolarHBondContact O-CB 3.38Å; Y506-F511 PolarHBondContact O-N 2.85Å; I507-F511 HydrophobicContact CG1-CD1 4.14Å; I507-F511 HydrophobicContact CG1-CG 4.4Å; F511-I513 VanDerWaalsContact C-N 3.31Å; F511-I513 PolarHBondContact O-N 3.25Å; F511-D514 PolarHBondContact O-N 2.88Å; F511-L515 HydrophobicContact CE1-CD2 4.12Å; F511-L515 HydrophobicContact CE2-CB 4.27Å; F511-L515 HydrophobicContact CZ-CB 4.35Å; F511-L515 HydrophobicContact CZ-CD1 4.37Å; F511-L515 HydrophobicContact CZ-CD2 3.91Å; F511-L515 HydrophobicContact CZ-CG 4.45Å; F511-L515 VanDerWaalsContact O-CB 3.26Å; F511-L515 WeakPolarHBondContact O-CB 3.49Å; F511-L515 PolarHBondContact O-N 3.46Å
512	I	88.1	Confident	86.4	Confident	111 Å²	111	58 Å²	58	57%	0.569	31%	0.308	S	S	*	.	H	α-helix	trans	-62.3	-40.1	-177.4	-60.3	173.4	0	0	0	111.1	W510 V516	W510-I512 VanDerWaalsContact C-N 3.28Å; W510-I512 PolarHBondContact O-N 2.93Å; I512-V516 WeakPolarHBondContact O-CG2 3.47Å; I512-V516 PolarHBondContact O-N 3.3Å
513	I	86.3	Confident	85.3	Confident	59 Å²	59	63.1 Å²	63.1	30%	0.303	34%	0.335	S	S	.	.	H	α-helix	trans	-71.1	-42.3	-179.4	-59.8	-180	0	0	0	110.2	W510 F511 A517 V549	W510-I513 HydrophobicContact CE3-CD1 3.95Å; W510-I513 HydrophobicContact CZ3-CD1 3.94Å; W510-I513 PolarHBondContact O-N 2.94Å; W510-I513 VanDerWaalsContact O-N 3.11Å; F511-I513 VanDerWaalsContact C-N 3.31Å; F511-I513 PolarHBondContact O-N 3.25Å; I513-A517 VanDerWaalsContact O-CB 3.24Å; I513-A517 WeakPolarHBondContact O-CB 3.22Å; I513-A517 PolarHBondContact O-N 3.24Å; I513-V549 HydrophobicContact CD1-CG1 4.3Å; I513-V549 HydrophobicContact CG2-CB 4.05Å; I513-V549 HydrophobicContact CG2-CG1 4.1Å; I513-V549 HydrophobicContact CG2-CG2 4.33Å
514	D	88.2	Confident	84.2	Confident	20 Å²	20	66.4 Å²	66.4	11%	0.107	35%	0.349	C	S	.	.	H	α-helix	trans	-65.5	-41.8	177.6	-63.5	-21.5	0	0	0	111.6	I480 Y506 W510 F511 A517 A518 R553	I480-D514 HydrophobicContact CD1-CB 4.11Å; I480-D514 HydrophobicContact CG1-CB 3.88Å; Y506-D514 WeakPolarHBondContact CE2-OD2 3.4Å; Y506-D514 PolarHBondContact OH-OD2 2.94Å; W510-D514 PolarHBondContact O-N 3.41Å; F511-D514 PolarHBondContact O-N 2.88Å; D514-A517 PolarHBondContact O-N 2.89Å; D514-A518 WeakPolarHBondContact O-CB 3.34Å; D514-A518 PolarHBondContact O-N 2.94Å; D514-R553 IonicContact OD1-CZ 3.51Å; D514-R553 IonicContact OD1-NH1 3.18Å; D514-R553 PolarHBondContact OD1-NH1 3.47Å; D514-R553 IonicContact OD1-NH2 4Å; D514-R553 PolarHBondContact OD1-NH2 3Å; D514-R553 IonicContact OD2-CZ 2.95Å; D514-R553 IonicContact OD2-NH1 2.85Å; D514-R553 PolarHBondContact OD2-NH1 3.34Å; D514-R553 IonicContact OD2-NH2 3.56Å
515	L	88.6	Confident	82.9	Confident	84 Å²	84	66.3 Å²	66.3	44%	0.44	34%	0.338	S	S	.	.	H	α-helix	trans	-58.3	-50.1	177.8	179.9	64.5	0	0	0	111.3	F511 A517 A518 I519	F511-L515 HydrophobicContact CE1-CD2 4.12Å; F511-L515 HydrophobicContact CE2-CB 4.27Å; F511-L515 HydrophobicContact CZ-CB 4.35Å; F511-L515 HydrophobicContact CZ-CD1 4.37Å; F511-L515 HydrophobicContact CZ-CD2 3.91Å; F511-L515 HydrophobicContact CZ-CG 4.45Å; F511-L515 VanDerWaalsContact O-CB 3.26Å; F511-L515 WeakPolarHBondContact O-CB 3.49Å; F511-L515 PolarHBondContact O-N 3.46Å; L515-A517 VanDerWaalsContact C-N 3.34Å; L515-A518 PolarHBondContact O-N 3.15Å; L515-I519 WeakPolarHBondContact O-CG1 3.42Å
516	V	85.3	Confident	81.6	Confident	57 Å²	57	70.7 Å²	70.7	35%	0.345	36%	0.356	S	S	.	.	H	α-helix	trans	-64.7	-39.6	177.7	176.4	0	0	0	0	111.2	I512 A518 I519 L546	I512-V516 WeakPolarHBondContact O-CG2 3.47Å; I512-V516 PolarHBondContact O-N 3.3Å; V516-A518 PolarHBondContact O-N 3.35Å; V516-I519 PolarHBondContact O-N 2.98Å; V516-L546 HydrophobicContact CB-CD1 4.46Å; V516-L546 HydrophobicContact CG1-CD1 3.7Å
517	A	84	Confident	80.1	Confident	6 Å²	6	80.5 Å²	80.5	5%	0.05	39%	0.392	C	S	.	.	H	α-helix	trans	-66.3	-21.6	177.6	0	0	0	0	0	113.7	I513 D514 L515 L546 R547	I513-A517 VanDerWaalsContact O-CB 3.24Å; I513-A517 WeakPolarHBondContact O-CB 3.22Å; I513-A517 PolarHBondContact O-N 3.24Å; D514-A517 PolarHBondContact O-N 2.89Å; L515-A517 VanDerWaalsContact C-N 3.34Å; A517-L546 HydrophobicContact CB-CB 4.05Å; A517-R547 HydrophobicContact CB-CG 3.9Å; A517-R547 VanDerWaalsContact O-CZ 3.25Å; A517-R547 PolarHBondContact O-NE 3.39Å; A517-R547 PolarHBondContact O-NH2 3.43Å
518	A	85	Confident	78.6	Confident	6 Å²	6	81.6 Å²	81.6	5%	0.05	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-2.8	-178	0	0	0	0	0	115	F476 I477 I480 D514 L515 V516 P520	F476-A518 HydrophobicContact CB-CB 4.34Å; I477-A518 HydrophobicContact CG1-CB 4.17Å; I480-A518 HydrophobicContact CD1-CB 3.71Å; D514-A518 WeakPolarHBondContact O-CB 3.34Å; D514-A518 PolarHBondContact O-N 2.94Å; L515-A518 PolarHBondContact O-N 3.15Å; V516-A518 PolarHBondContact O-N 3.35Å; A518-P520 WeakPolarHBondContact O-CD 3.43Å
519	I	83.1	Confident	76.6	Confident	53 Å²	53	75 Å²	75	27%	0.272	39%	0.385	S	S	.	.			trans	-73.5	121.1	-177.1	-56.9	177.9	0	0	0	111	L515 V516 F521 L524	L515-I519 WeakPolarHBondContact O-CG1 3.42Å; V516-I519 PolarHBondContact O-N 2.98Å; I519-F521 VanDerWaalsContact C-N 3.29Å; I519-F521 HydrophobicContact CB-CD2 4.21Å; I519-F521 HydrophobicContact CB-CE1 4.17Å; I519-F521 HydrophobicContact CB-CE2 3.77Å; I519-F521 HydrophobicContact CB-CZ 3.76Å; I519-F521 HydrophobicContact CD1-CE1 4.34Å; I519-F521 HydrophobicContact CD1-CZ 3.96Å; I519-F521 HydrophobicContact CG1-CZ 4.39Å; I519-F521 HydrophobicContact CG2-CD1 3.79Å; I519-F521 HydrophobicContact CG2-CD2 4.18Å; I519-F521 HydrophobicContact CG2-CE1 3.66Å; I519-F521 HydrophobicContact CG2-CE2 4.05Å; I519-F521 HydrophobicContact CG2-CG 4.06Å; I519-F521 HydrophobicContact CG2-CZ 3.79Å; I519-F521 WeakPolarHBondContact O-CD2 3.22Å; I519-F521 PolarHBondContact O-N 2.8Å; I519-L524 HydrophobicContact CG2-CD1 3.72Å
520	P	80.7	Confident	74.8	Confident	47 Å²	47	76.4 Å²	76.4	31%	0.305	40%	0.399	S	S	.	.			trans	-81.6	74.3	175.2	34.3	-34.5	0	0	0	110.2	D473 A518 D522 L523	D473-P520 HydrophobicContact CB-CB 4.39Å; A518-P520 WeakPolarHBondContact O-CD 3.43Å; P520-D522 PolarHBondContact O-N 3.28Å; P520-D522 VanDerWaalsContact O-N 3.11Å; P520-L523 PolarHBondContact O-N 3.17Å
521	F	72.4	Confident	73.3	Confident	37 Å²	37	78.6 Å²	78.6	16%	0.162	42%	0.419	C	S	.	.	H	α-helix	trans	-52.6	-35.1	-176.6	-68.5	-74	0	0	0	113.3	I519 L523 L524 F525 L540 A543	I519-F521 VanDerWaalsContact C-N 3.29Å; I519-F521 HydrophobicContact CB-CD2 4.21Å; I519-F521 HydrophobicContact CB-CE1 4.17Å; I519-F521 HydrophobicContact CB-CE2 3.77Å; I519-F521 HydrophobicContact CB-CZ 3.76Å; I519-F521 HydrophobicContact CD1-CE1 4.34Å; I519-F521 HydrophobicContact CD1-CZ 3.96Å; I519-F521 HydrophobicContact CG1-CZ 4.39Å; I519-F521 HydrophobicContact CG2-CD1 3.79Å; I519-F521 HydrophobicContact CG2-CD2 4.18Å; I519-F521 HydrophobicContact CG2-CE1 3.66Å; I519-F521 HydrophobicContact CG2-CE2 4.05Å; I519-F521 HydrophobicContact CG2-CG 4.06Å; I519-F521 HydrophobicContact CG2-CZ 3.79Å; I519-F521 WeakPolarHBondContact O-CD2 3.22Å; I519-F521 PolarHBondContact O-N 2.8Å; F521-L523 VanDerWaalsContact C-N 3.25Å; F521-L523 PolarHBondContact O-N 3.23Å; F521-L524 HydrophobicContact CD1-CD1 4.42Å; F521-L524 WeakPolarHBondContact O-CB 3.43Å; F521-L524 PolarHBondContact O-N 2.77Å; F521-F525 HydrophobicContact CB-CD2 4.28Å; F521-F525 HydrophobicContact CB-CE2 4.35Å; F521-F525 HydrophobicContact CD1-CE2 4.25Å; F521-F525 VanDerWaalsContact O-CD2 3.29Å; F521-F525 WeakPolarHBondContact O-CD2 3.44Å; F521-F525 PolarHBondContact O-N 2.9Å; F521-L540 HydrophobicContact CG-CB 4.42Å; F521-A543 HydrophobicContact CD2-CB 4.44Å; F521-A543 HydrophobicContact CE2-CB 3.81Å
522	D	67	Low	71.6	Confident	52 Å²	52	84.4 Å²	84.4	28%	0.278	45%	0.447	S	S	.	.	H	α-helix	trans	-50.9	-43.4	176.7	-65.5	-21	0	0	0	112.9	P520 F526 K541 R544	P520-D522 PolarHBondContact O-N 3.28Å; P520-D522 VanDerWaalsContact O-N 3.11Å; D522-F526 VanDerWaalsContact O-CB 3.22Å; D522-F526 WeakPolarHBondContact O-CB 3.4Å; D522-F526 PolarHBondContact O-N 3.22Å; D522-K541 WeakPolarHBondContact OD1-CE 3.46Å; D522-K541 IonicContact OD1-NZ 3.85Å; D522-K541 VanDerWaalsContact OD2-CE 3.32Å; D522-K541 WeakPolarHBondContact OD2-CE 3.38Å; D522-K541 IonicContact OD2-NZ 2.76Å; D522-R544 IonicContact OD2-CZ 3.93Å; D522-R544 IonicContact OD2-NH1 3.64Å; D522-R544 PolarHBondContact OD2-NH1 3.48Å; D522-R544 IonicContact OD2-NH2 3.74Å; D522-R544 PolarHBondContact OD2-NH2 3.26Å
523	L	68.5	Low	69.9	Low	111 Å²	111	82.7 Å²	82.7	58%	0.581	44%	0.443	S	S	*	.	H	α-helix	trans	-78.5	-21.9	-177.6	-167	137.1	0	0	0	112.7	P520 F521	P520-L523 PolarHBondContact O-N 3.17Å; F521-L523 VanDerWaalsContact C-N 3.25Å; F521-L523 PolarHBondContact O-N 3.23Å
524	L	69.3	Low	68.6	Low	92 Å²	92	83 Å²	83	48%	0.482	45%	0.447	S	S	.	.	H	α-helix	trans	-76.6	-44.3	172.5	-67.2	171.3	0	0	0	111.5	I519 F521 R527 T528	I519-L524 HydrophobicContact CG2-CD1 3.72Å; F521-L524 HydrophobicContact CD1-CD1 4.42Å; F521-L524 WeakPolarHBondContact O-CB 3.43Å; F521-L524 PolarHBondContact O-N 2.77Å; L524-R527 PolarHBondContact O-N 3.43Å; L524-T528 PolarHBondContact O-OG1 3.16Å
525	F	64.6	Low	67.4	Low	58 Å²	58	85.5 Å²	85.5	25%	0.254	47%	0.471	S	S	.	.	H	α-helix	trans	-76.8	-37.2	-178.9	-75	-73.8	0	0	0	113.1	F521 R527 T528 A529 T537 L540	F521-F525 HydrophobicContact CB-CD2 4.28Å; F521-F525 HydrophobicContact CB-CE2 4.35Å; F521-F525 HydrophobicContact CD1-CE2 4.25Å; F521-F525 VanDerWaalsContact O-CD2 3.29Å; F521-F525 WeakPolarHBondContact O-CD2 3.44Å; F521-F525 PolarHBondContact O-N 2.9Å; F525-R527 PolarHBondContact O-N 2.82Å; F525-R527 VanDerWaalsContact O-N 3.08Å; F525-T528 WeakPolarHBondContact CA-OG1 3.13Å; F525-T528 PolarHBondContact O-N 2.87Å; F525-T528 PolarHBondContact O-OG1 2.96Å; F525-A529 PolarHBondContact O-N 3.18Å; F525-T537 HydrophobicContact CB-CG2 3.76Å; F525-T537 HydrophobicContact CD1-CG2 4.24Å; F525-T537 HydrophobicContact CD2-CG2 4.32Å; F525-T537 HydrophobicContact CG-CG2 3.83Å; F525-L540 HydrophobicContact CD2-CD1 4.38Å; F525-L540 HydrophobicContact CE1-CD1 4.4Å; F525-L540 HydrophobicContact CE2-CD1 3.34Å; F525-L540 HydrophobicContact CZ-CD1 3.35Å
526	F	62.6	Low	66.3	Low	194 Å²	194	85.4 Å²	85.4	85%	0.851	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.6	173.6	-172.4	-95.8	0	0	0	112.9	D522	D522-F526 VanDerWaalsContact O-CB 3.22Å; D522-F526 WeakPolarHBondContact O-CB 3.4Å; D522-F526 PolarHBondContact O-N 3.22Å
527	R	62.3	Low	65.3	Low	225 Å²	225	84.9 Å²	84.9	85%	0.849	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-6.8	177.5	-159.1	173.2	-177.4	-178.3	1.7	114.3	L524 F525	L524-R527 PolarHBondContact O-N 3.43Å; F525-R527 PolarHBondContact O-N 2.82Å; F525-R527 VanDerWaalsContact O-N 3.08Å
528	T	61.3	Low	64.5	Low	108 Å²	108	84.7 Å²	84.7	66%	0.663	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	-15.8	-171.1	48.8	0	0	0	0	115.7	L524 F525	L524-T528 PolarHBondContact O-OG1 3.16Å; F525-T528 WeakPolarHBondContact CA-OG1 3.13Å; F525-T528 PolarHBondContact O-N 2.87Å; F525-T528 PolarHBondContact O-OG1 2.96Å
529	A	49.1	Very low	63.8	Low	54 Å²	54	90 Å²	90	45%	0.446	49%	0.494	S	S	.	.			trans	-119.5	96.9	-177.6	0	0	0	0	0	113.1	F525	F525-A529 PolarHBondContact O-N 3.18Å
530	G	48.8	Very low	63.3	Low	73 Å²	73	89.9 Å²	89.9	75%	0.753	49%	0.493	S	S	*	.	S	Bend	trans	-77.9	136.6	143.6	0	0	0	0	0	108.5
531	D	54	Low	63	Low	158 Å²	158	89.7 Å²	89.7	85%	0.845	49%	0.487	S	S	*	.	S	Bend	trans	54.1	90.7	175	-60.7	-28.1	0	0	0	117.9
532	Q	53.9	Low	63.3	Low	168 Å²	168	90.3 Å²	90.3	79%	0.785	50%	0.497	S	S	*	.			trans	76.2	158.4	162.9	-49.6	-172.5	25.2	0	0	117.3
533	P	52.6	Low	63.8	Low	74 Å²	74	88.8 Å²	88.8	48%	0.481	49%	0.491	S	S	.	.			cis	-110.8	128.3	-7.5	35.3	-22.7	0	0	0	112.9	A535 L536	P533-A535 PolarHBondContact O-N 2.9Å; P533-L536 HydrophobicContact CG-CB 4.03Å; P533-L536 PolarHBondContact O-N 3.14Å; P533-L536 VanDerWaalsContact O-N 3.08Å
534	T	60.2	Low	64.5	Low	65 Å²	65	84.1 Å²	84.1	40%	0.399	47%	0.466	S	S	.	.	H	α-helix	trans	-62.3	-20.3	-177.5	54.7	0	0	0	0	114.7	M401 N405 T537 G538	M401-T534 WeakPolarHBondContact CE-O 3.34Å; N405-T534 PolarHBondContact ND2-OG1 2.93Å; N405-T534 WeakPolarHBondContact OD1-CG2 3.32Å; T534-T537 WeakPolarHBondContact CA-OG1 3.22Å; T534-T537 PolarHBondContact O-OG1 2.97Å; T534-G538 PolarHBondContact O-N 3.44Å
535	A	62.4	Low	65.1	Low	73 Å²	73	82 Å²	82	60%	0.603	45%	0.454	S	S	*	.	H	α-helix	trans	-65.5	-39.7	174.5	0	0	0	0	0	112.6	P533 G538 L539	P533-A535 PolarHBondContact O-N 2.9Å; A535-G538 PolarHBondContact O-N 3.29Å; A535-L539 PolarHBondContact O-N 3.38Å
536	L	65.5	Low	66	Low	82 Å²	82	82.7 Å²	82.7	43%	0.429	46%	0.461	S	S	.	.	H	α-helix	trans	-70	-40.7	-178.4	-177.1	64.3	0	0	0	111.3	P533 G538 L539 L540	P533-L536 HydrophobicContact CG-CB 4.03Å; P533-L536 PolarHBondContact O-N 3.14Å; P533-L536 VanDerWaalsContact O-N 3.08Å; L536-G538 VanDerWaalsContact C-N 3.31Å; L536-G538 PolarHBondContact O-N 3Å; L536-L539 PolarHBondContact O-N 2.93Å; L536-L540 HydrophobicContact CD1-CD1 4.3Å; L536-L540 HydrophobicContact CG-CD1 4.09Å; L536-L540 WeakPolarHBondContact O-CG 3.41Å; L536-L540 PolarHBondContact O-N 2.94Å
537	T	64.9	Low	67	Low	46 Å²	46	73.8 Å²	73.8	28%	0.282	42%	0.421	S	S	.	.	H	α-helix	trans	-63.4	-37.2	174.2	49	0	0	0	0	111.9	F525 T534 L540 K541	F525-T537 HydrophobicContact CB-CG2 3.76Å; F525-T537 HydrophobicContact CD1-CG2 4.24Å; F525-T537 HydrophobicContact CD2-CG2 4.32Å; F525-T537 HydrophobicContact CG-CG2 3.83Å; T534-T537 WeakPolarHBondContact CA-OG1 3.22Å; T534-T537 PolarHBondContact O-OG1 2.97Å; T537-L540 PolarHBondContact O-N 2.9Å; T537-K541 PolarHBondContact O-N 2.86Å
538	G	66.2	Low	68	Low	3 Å²	3	64.9 Å²	64.9	3%	0.031	39%	0.39	C	S	.	.	H	α-helix	trans	-65.8	-41.2	172.8	0	0	0	0	0	113.6	M401 T534 A535 L536 K541	M401-G538 WeakPolarHBondContact SD-CA 3.19Å; T534-G538 PolarHBondContact O-N 3.44Å; A535-G538 PolarHBondContact O-N 3.29Å; L536-G538 VanDerWaalsContact C-N 3.31Å; L536-G538 PolarHBondContact O-N 3Å; G538-K541 WeakPolarHBondContact O-CB 3.14Å; G538-K541 PolarHBondContact O-N 2.91Å
539	L	70.6	Confident	68.9	Low	118 Å²	118	61.9 Å²	61.9	62%	0.618	37%	0.372	S	S	*	.	H	α-helix	trans	-63.9	-41.4	175.3	-175.2	62	0	0	0	111.3	A535 L536 K541 S542	A535-L539 PolarHBondContact O-N 3.38Å; L536-L539 PolarHBondContact O-N 2.93Å; L539-K541 VanDerWaalsContact C-N 3.34Å; L539-K541 PolarHBondContact O-N 3.35Å; L539-S542 VanDerWaalsContact O-CB 3.27Å; L539-S542 WeakPolarHBondContact O-CB 3.33Å; L539-S542 PolarHBondContact O-N 3.01Å; L539-S542 PolarHBondContact O-OG 3.48Å
540	L	72.1	Confident	70.2	Confident	50 Å²	50	59.8 Å²	59.8	26%	0.262	36%	0.356	S	S	.	.	H	α-helix	trans	-71.1	-26	179.1	-68.4	169.9	0	0	0	113.1	F521 F525 L536 T537 S542 A543	F521-L540 HydrophobicContact CG-CB 4.42Å; F525-L540 HydrophobicContact CD2-CD1 4.38Å; F525-L540 HydrophobicContact CE1-CD1 4.4Å; F525-L540 HydrophobicContact CE2-CD1 3.34Å; F525-L540 HydrophobicContact CZ-CD1 3.35Å; L536-L540 HydrophobicContact CD1-CD1 4.3Å; L536-L540 HydrophobicContact CG-CD1 4.09Å; L536-L540 WeakPolarHBondContact O-CG 3.41Å; L536-L540 PolarHBondContact O-N 2.94Å; T537-L540 PolarHBondContact O-N 2.9Å; L540-S542 PolarHBondContact O-N 3.01Å; L540-A543 VanDerWaalsContact O-CB 3.27Å; L540-A543 WeakPolarHBondContact O-CB 3.43Å; L540-A543 PolarHBondContact O-N 3.43Å; L540-A543 VanDerWaalsContact O-N 3.15Å
541	K	75.2	Confident	71.6	Confident	42 Å²	42	57.6 Å²	57.6	18%	0.183	33%	0.327	C	S	.	.	H	α-helix	trans	-58.4	-32.7	166.1	-78.4	-175.9	171.3	-169	0	112.8	T393 D522 T537 G538 L539 A543 R544	T393-K541 HydrophobicContact CG2-CB 4.38Å; T393-K541 VanDerWaalsContact CG2-O 3.31Å; T393-K541 WeakPolarHBondContact CG2-O 3.41Å; D522-K541 WeakPolarHBondContact OD1-CE 3.46Å; D522-K541 IonicContact OD1-NZ 3.85Å; D522-K541 VanDerWaalsContact OD2-CE 3.32Å; D522-K541 WeakPolarHBondContact OD2-CE 3.38Å; D522-K541 IonicContact OD2-NZ 2.76Å; T537-K541 PolarHBondContact O-N 2.86Å; G538-K541 WeakPolarHBondContact O-CB 3.14Å; G538-K541 PolarHBondContact O-N 2.91Å; L539-K541 VanDerWaalsContact C-N 3.34Å; L539-K541 PolarHBondContact O-N 3.35Å; K541-A543 PolarHBondContact O-N 2.95Å; K541-A543 VanDerWaalsContact O-N 3.15Å; K541-R544 WeakPolarHBondContact O-CB 3.35Å; K541-R544 PolarHBondContact O-N 3.1Å
542	S	77.6	Confident	72.7	Confident	51 Å²	51	54.1 Å²	54.1	36%	0.357	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-63	-19.9	178.3	79.3	0	0	0	0	113.5	L539 L540 R544 L545	L539-S542 VanDerWaalsContact O-CB 3.27Å; L539-S542 WeakPolarHBondContact O-CB 3.33Å; L539-S542 PolarHBondContact O-N 3.01Å; L539-S542 PolarHBondContact O-OG 3.48Å; L540-S542 PolarHBondContact O-N 3.01Å; S542-R544 PolarHBondContact O-N 2.64Å; S542-R544 VanDerWaalsContact O-N 3.17Å; S542-L545 VanDerWaalsContact O-CB 3.27Å; S542-L545 WeakPolarHBondContact O-CB 3.46Å; S542-L545 WeakPolarHBondContact O-CG 2.88Å; S542-L545 PolarHBondContact O-N 3.01Å
543	A	79.1	Confident	73.6	Confident	19 Å²	19	49.4 Å²	49.4	16%	0.157	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-60.6	-23.5	172.4	0	0	0	0	0	112.8	F521 L540 K541 L545 L546	F521-A543 HydrophobicContact CD2-CB 4.44Å; F521-A543 HydrophobicContact CE2-CB 3.81Å; L540-A543 VanDerWaalsContact O-CB 3.27Å; L540-A543 WeakPolarHBondContact O-CB 3.43Å; L540-A543 PolarHBondContact O-N 3.43Å; L540-A543 VanDerWaalsContact O-N 3.15Å; K541-A543 PolarHBondContact O-N 2.95Å; K541-A543 VanDerWaalsContact O-N 3.15Å; A543-L545 PolarHBondContact O-N 3.17Å; A543-L545 VanDerWaalsContact O-N 3.17Å; A543-L546 VanDerWaalsContact O-CB 3.31Å; A543-L546 WeakPolarHBondContact O-CB 3.48Å; A543-L546 WeakPolarHBondContact O-CG 3.23Å; A543-L546 PolarHBondContact O-N 3.13Å; A543-L546 VanDerWaalsContact O-N 3.07Å
544	R	81.9	Confident	74.4	Confident	13 Å²	13	47 Å²	47	5%	0.049	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-59	-23.7	170.7	-69.1	-176.1	170.5	148	3.8	112.5	T393 D469 D473 D522 K541 S542 L546 R547	T393-R544 HydrophobicContact CG2-CB 4.25Å; D469-R544 IonicContact OD2-CZ 3.97Å; D469-R544 IonicContact OD2-NH1 2.69Å; D469-R544 PolarHBondContact OD2-NH1 2.76Å; D469-R544 IonicContact OD2-NH2 3.22Å; D473-R544 IonicContact OD1-NE 3.24Å; D473-R544 PolarHBondContact OD1-NE 2.76Å; D473-R544 IonicContact OD1-NH2 2.78Å; D473-R544 IonicContact OD2-CZ 3.89Å; D473-R544 IonicContact OD2-NE 3.93Å; D473-R544 IonicContact OD2-NH2 3.49Å; D473-R544 PolarHBondContact OD2-NH2 3.11Å; D522-R544 IonicContact OD2-CZ 3.93Å; D522-R544 IonicContact OD2-NH1 3.64Å; D522-R544 PolarHBondContact OD2-NH1 3.48Å; D522-R544 IonicContact OD2-NH2 3.74Å; D522-R544 PolarHBondContact OD2-NH2 3.26Å; K541-R544 WeakPolarHBondContact O-CB 3.35Å; K541-R544 PolarHBondContact O-N 3.1Å; S542-R544 PolarHBondContact O-N 2.64Å; S542-R544 VanDerWaalsContact O-N 3.17Å; R544-L546 PolarHBondContact O-N 2.77Å; R544-R547 VanDerWaalsContact O-CB 3.26Å; R544-R547 WeakPolarHBondContact O-CB 3.31Å; R544-R547 VanDerWaalsContact O-CD 3.23Å; R544-R547 WeakPolarHBondContact O-CD 3.31Å; R544-R547 WeakPolarHBondContact O-CG 3.25Å; R544-R547 PolarHBondContact O-N 3.11Å
545	L	82.9	Confident	75	Confident	47 Å²	47	47.1 Å²	47.1	25%	0.246	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-67.7	-17.9	176.5	-60.1	-179.7	0	0	0	113.2	P394 S542 A543 R547 L548 W579	P394-L545 HydrophobicContact CG-CD2 4.28Å; S542-L545 VanDerWaalsContact O-CB 3.27Å; S542-L545 WeakPolarHBondContact O-CB 3.46Å; S542-L545 WeakPolarHBondContact O-CG 2.88Å; S542-L545 PolarHBondContact O-N 3.01Å; A543-L545 PolarHBondContact O-N 3.17Å; A543-L545 VanDerWaalsContact O-N 3.17Å; L545-R547 PolarHBondContact O-N 2.89Å; L545-R547 VanDerWaalsContact O-N 3.09Å; L545-L548 WeakPolarHBondContact O-CB 3.39Å; L545-L548 PolarHBondContact O-N 3.35Å; L545-W579 HydrophobicContact CD1-CZ2 4.32Å; L545-W579 HydrophobicContact CD2-CZ2 4.04Å
546	L	83.4	Confident	75.3	Confident	74 Å²	74	49.4 Å²	49.4	39%	0.387	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-60	-19.2	172.5	-65.5	171.3	0	0	0	112.7	V516 A517 A543 R544 L548 V549	V516-L546 HydrophobicContact CB-CD1 4.46Å; V516-L546 HydrophobicContact CG1-CD1 3.7Å; A517-L546 HydrophobicContact CB-CB 4.05Å; A543-L546 VanDerWaalsContact O-CB 3.31Å; A543-L546 WeakPolarHBondContact O-CB 3.48Å; A543-L546 WeakPolarHBondContact O-CG 3.23Å; A543-L546 PolarHBondContact O-N 3.13Å; A543-L546 VanDerWaalsContact O-N 3.07Å; R544-L546 PolarHBondContact O-N 2.77Å; L546-L548 PolarHBondContact O-N 2.85Å; L546-L548 VanDerWaalsContact O-N 3.15Å; L546-V549 WeakPolarHBondContact O-CB 3.36Å; L546-V549 WeakPolarHBondContact O-CG2 3.46Å; L546-V549 PolarHBondContact O-N 3.27Å
547	R	84.1	Confident	75.4	Confident	7 Å²	7	48 Å²	48	3%	0.026	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-55.8	-26.8	171.9	-65.7	170.1	-174.3	-173.5	1.6	112.7	I386 D473 F476 A517 R544 L545 V549 G550	I386-R547 WeakPolarHBondContact CD1-O 3.26Å; I386-R547 HydrophobicContact CG1-CB 4.28Å; I386-R547 HydrophobicContact CG2-CB 4.38Å; D473-R547 IonicContact OD1-CZ 3.98Å; D473-R547 IonicContact OD1-NH1 2.86Å; D473-R547 PolarHBondContact OD1-NH1 2.81Å; D473-R547 IonicContact OD1-NH2 3.31Å; D473-R547 PolarHBondContact OD1-NH2 3.49Å; F476-R547 HydrophobicContact CD1-CG 4.43Å; F476-R547 HydrophobicContact CE1-CB 4.3Å; F476-R547 HydrophobicContact CE1-CG 4.14Å; F476-R547 HydrophobicContact CE2-CG 4.38Å; F476-R547 HydrophobicContact CZ-CB 4.25Å; F476-R547 HydrophobicContact CZ-CG 4.12Å; A517-R547 HydrophobicContact CB-CG 3.9Å; A517-R547 VanDerWaalsContact O-CZ 3.25Å; A517-R547 PolarHBondContact O-NE 3.39Å; A517-R547 PolarHBondContact O-NH2 3.43Å; R544-R547 VanDerWaalsContact O-CB 3.26Å; R544-R547 WeakPolarHBondContact O-CB 3.31Å; R544-R547 VanDerWaalsContact O-CD 3.23Å; R544-R547 WeakPolarHBondContact O-CD 3.31Å; R544-R547 WeakPolarHBondContact O-CG 3.25Å; R544-R547 PolarHBondContact O-N 3.11Å; L545-R547 PolarHBondContact O-N 2.89Å; L545-R547 VanDerWaalsContact O-N 3.09Å; R547-V549 PolarHBondContact O-N 2.81Å; R547-G550 PolarHBondContact O-N 2.94Å
548	L	81.5	Confident	75.6	Confident	38 Å²	38	46.7 Å²	46.7	20%	0.199	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-63	-25.3	174.9	-73.3	164.3	0	0	0	113.7	I386 A390 L545 L546 G550 I551 L575 W579	I386-L548 HydrophobicContact CG2-CD2 3.76Å; I386-L548 HydrophobicContact CG2-CG 4.16Å; A390-L548 HydrophobicContact CB-CD1 4.11Å; A390-L548 HydrophobicContact CB-CD2 3.95Å; A390-L548 HydrophobicContact CB-CG 4.24Å; L545-L548 WeakPolarHBondContact O-CB 3.39Å; L545-L548 PolarHBondContact O-N 3.35Å; L546-L548 PolarHBondContact O-N 2.85Å; L546-L548 VanDerWaalsContact O-N 3.15Å; L548-G550 PolarHBondContact O-N 2.78Å; L548-I551 HydrophobicContact CD2-CD1 3.67Å; L548-I551 HydrophobicContact CD2-CG1 4.48Å; L548-I551 WeakPolarHBondContact O-CB 3.39Å; L548-I551 PolarHBondContact O-N 2.92Å; L548-L575 HydrophobicContact CD2-CD2 4.38Å; L548-W579 HydrophobicContact CD1-CH2 3.45Å; L548-W579 VanDerWaalsContact CD1-CH2 3.45Å; L548-W579 HydrophobicContact CD1-CZ2 3.49Å; L548-W579 VanDerWaalsContact CD1-CZ2 3.49Å
549	V	81	Confident	75.7	Confident	44 Å²	44	48.9 Å²	48.9	27%	0.267	26%	0.262	S	S	.	.	H	α-helix	trans	-63.1	-24.5	173.1	-175.1	0	0	0	0	111.2	W510 I513 L546 R547 I551 V552	W510-V549 HydrophobicContact CE3-CG1 4.38Å; W510-V549 HydrophobicContact CH2-CG1 4.33Å; W510-V549 HydrophobicContact CZ3-CG1 3.6Å; I513-V549 HydrophobicContact CD1-CG1 4.3Å; I513-V549 HydrophobicContact CG2-CB 4.05Å; I513-V549 HydrophobicContact CG2-CG1 4.1Å; I513-V549 HydrophobicContact CG2-CG2 4.33Å; L546-V549 WeakPolarHBondContact O-CB 3.36Å; L546-V549 WeakPolarHBondContact O-CG2 3.46Å; L546-V549 PolarHBondContact O-N 3.27Å; R547-V549 PolarHBondContact O-N 2.81Å; V549-I551 VanDerWaalsContact C-N 3.25Å; V549-I551 PolarHBondContact O-N 3.46Å; V549-V552 PolarHBondContact O-N 2.89Å
550	G	76.7	Confident	75.5	Confident	11 Å²	11	47 Å²	47	11%	0.113	25%	0.25	C	C	.	.	H	α-helix	trans	-64.3	-23.9	170.7	0	0	0	0	0	114.3	R547 L548	R547-G550 PolarHBondContact O-N 2.94Å; L548-G550 PolarHBondContact O-N 2.78Å
551	I	78.4	Confident	75.3	Confident	27 Å²	27	48.7 Å²	48.7	14%	0.138	25%	0.253	C	S	.	.	H	α-helix	trans	-70.7	-39.9	173.6	-55.7	-172	0	0	0	110.4	L383 I386 L548 V549 R553 K554 L555	L383-I551 HydrophobicContact CD1-CD1 3.86Å; L383-I551 HydrophobicContact CD1-CG1 3.82Å; L383-I551 HydrophobicContact CD1-CG2 4.35Å; I386-I551 HydrophobicContact CB-CG1 4.48Å; I386-I551 HydrophobicContact CD1-CG1 4.13Å; I386-I551 HydrophobicContact CG2-CD1 3.81Å; I386-I551 HydrophobicContact CG2-CG1 3.84Å; L548-I551 HydrophobicContact CD2-CD1 3.67Å; L548-I551 HydrophobicContact CD2-CG1 4.48Å; L548-I551 WeakPolarHBondContact O-CB 3.39Å; L548-I551 PolarHBondContact O-N 2.92Å; V549-I551 VanDerWaalsContact C-N 3.25Å; V549-I551 PolarHBondContact O-N 3.46Å; I551-R553 VanDerWaalsContact C-N 3.26Å; I551-R553 PolarHBondContact O-N 3.41Å; I551-K554 CarbonylContact O-C 3.55Å; I551-K554 WeakPolarHBondContact O-CA 3.39Å; I551-K554 PolarHBondContact O-N 2.88Å; I551-L555 PolarHBondContact O-N 3.17Å
552	V	75.8	Confident	75	Confident	85 Å²	85	47.3 Å²	47.3	52%	0.515	25%	0.251	S	S	.	.	H	α-helix	trans	-56.4	-41.7	-177.2	-175.4	0	0	0	0	111.3	V549 K554 L555	V549-V552 PolarHBondContact O-N 2.89Å; V552-K554 PolarHBondContact O-N 3.29Å; V552-L555 VanDerWaalsContact O-CB 3.28Å; V552-L555 WeakPolarHBondContact O-CB 3.46Å; V552-L555 PolarHBondContact O-N 2.78Å
553	R	73	Confident	74.8	Confident	69 Å²	69	47.8 Å²	47.8	26%	0.26	26%	0.258	S	S	.	.	H	α-helix	trans	-68.9	-17	177.3	-53.1	178.5	-149.9	149.8	5	114.4	W510 D514 I551	W510-R553 HydrophobicContact CD2-CG 4.12Å; W510-R553 HydrophobicContact CE3-CG 4.48Å; W510-R553 HydrophobicContact CH2-CG 4.16Å; W510-R553 HydrophobicContact CZ2-CG 3.77Å; W510-R553 HydrophobicContact CZ3-CG 4.5Å; D514-R553 IonicContact OD1-CZ 3.51Å; D514-R553 IonicContact OD1-NH1 3.18Å; D514-R553 PolarHBondContact OD1-NH1 3.47Å; D514-R553 IonicContact OD1-NH2 4Å; D514-R553 PolarHBondContact OD1-NH2 3Å; D514-R553 IonicContact OD2-CZ 2.95Å; D514-R553 IonicContact OD2-NH1 2.85Å; D514-R553 PolarHBondContact OD2-NH1 3.34Å; D514-R553 IonicContact OD2-NH2 3.56Å; I551-R553 VanDerWaalsContact C-N 3.26Å; I551-R553 PolarHBondContact O-N 3.41Å
554	K	70.4	Confident	74.6	Confident	22 Å²	22	48.8 Å²	48.8	10%	0.096	26%	0.264	C	S	.	.	H	α-helix	trans	-102.3	-14.6	178.5	-61.7	178.8	178	-169.9	0	111.6	D379 I551 V552 D556 R557 Y558	D379-K554 HydrophobicContact CB-CD 4.45Å; D379-K554 PolarHBondContact O-NZ 3.18Å; D379-K554 WeakPolarHBondContact OD1-CE 3.3Å; D379-K554 IonicContact OD1-NZ 3.56Å; D379-K554 PolarHBondContact OD1-NZ 3.42Å; I551-K554 CarbonylContact O-C 3.55Å; I551-K554 WeakPolarHBondContact O-CA 3.39Å; I551-K554 PolarHBondContact O-N 2.88Å; V552-K554 PolarHBondContact O-N 3.29Å; K554-D556 VanDerWaalsContact C-N 3.3Å; K554-D556 PolarHBondContact O-N 2.92Å; K554-R557 WeakPolarHBondContact O-CB 3.48Å; K554-R557 PolarHBondContact O-N 2.91Å; K554-Y558 HydrophobicContact CB-CD2 4.26Å; K554-Y558 HydrophobicContact CB-CE2 3.75Å; K554-Y558 WeakPolarHBondContact O-CD2 3.31Å; K554-Y558 PolarHBondContact O-N 3.01Å
555	L	72.3	Confident	74.3	Confident	68 Å²	68	50.9 Å²	50.9	36%	0.356	28%	0.275	S	S	.	.	H	α-helix	trans	-56.7	-42.9	-177.8	-175	56.2	0	0	0	112	I551 V552 R557 Y558 S559 L568	I551-L555 PolarHBondContact O-N 3.17Å; V552-L555 VanDerWaalsContact O-CB 3.28Å; V552-L555 WeakPolarHBondContact O-CB 3.46Å; V552-L555 PolarHBondContact O-N 2.78Å; L555-R557 PolarHBondContact O-N 2.89Å; L555-R557 VanDerWaalsContact O-N 3.17Å; L555-Y558 CarbonylContact O-C 3.49Å; L555-Y558 PolarHBondContact O-N 2.94Å; L555-S559 WeakPolarHBondContact O-CB 3.32Å; L555-S559 PolarHBondContact O-N 3.42Å; L555-S559 PolarHBondContact O-OG 3.47Å; L555-L568 HydrophobicContact CD1-CD2 3.33Å
556	D	69.3	Low	74	Confident	121 Å²	121	51.1 Å²	51.1	65%	0.647	28%	0.277	S	S	*	.	H	α-helix	trans	-58	-28.2	176.4	-60.7	-21.9	0	0	0	113.4	K554 S559	K554-D556 VanDerWaalsContact C-N 3.3Å; K554-D556 PolarHBondContact O-N 2.92Å; D556-S559 PolarHBondContact O-OG 2.82Å
557	R	67.4	Low	74	Confident	52 Å²	52	53.1 Å²	53.1	20%	0.196	29%	0.287	C	S	.	.	H	α-helix	trans	-80.7	-22.7	176.8	-168.9	-179.6	-64.4	-163.2	0.4	112.5	M1 D379 K554 L555	M1-R557 HydrophobicContact SD-CG 4.26Å; D379-R557 IonicContact OD2-CZ 2.74Å; D379-R557 IonicContact OD2-NH1 2.76Å; D379-R557 PolarHBondContact OD2-NH1 2.92Å; D379-R557 IonicContact OD2-NH2 3.73Å; K554-R557 WeakPolarHBondContact O-CB 3.48Å; K554-R557 PolarHBondContact O-N 2.91Å; L555-R557 PolarHBondContact O-N 2.89Å; L555-R557 VanDerWaalsContact O-N 3.17Å
558	Y	68.5	Low	73.8	Confident	19 Å²	19	55.6 Å²	55.6	8%	0.075	30%	0.3	C	S	.	.	H	α-helix	trans	-97.6	-25.8	-180	-61	-57	0	0	0	112.6	M1 W380 L383 K554 L555 E560 Y561	M1-Y558 HydrophobicContact CE-CE1 4.41Å; W380-Y558 HydrophobicContact CE3-CE1 4.47Å; W380-Y558 HydrophobicContact CH2-CD1 4.27Å; W380-Y558 AromaticContact CH2-CE1 3.58Å; W380-Y558 HydrophobicContact CH2-CE1 3.58Å; W380-Y558 HydrophobicContact CZ2-CD1 4.45Å; W380-Y558 AromaticContact CZ2-CE1 3.61Å; W380-Y558 HydrophobicContact CZ2-CE1 3.61Å; W380-Y558 HydrophobicContact CZ3-CE1 4.02Å; L383-Y558 HydrophobicContact CD2-CE2 3.83Å; K554-Y558 HydrophobicContact CB-CD2 4.26Å; K554-Y558 HydrophobicContact CB-CE2 3.75Å; K554-Y558 WeakPolarHBondContact O-CD2 3.31Å; K554-Y558 PolarHBondContact O-N 3.01Å; L555-Y558 CarbonylContact O-C 3.49Å; L555-Y558 PolarHBondContact O-N 2.94Å; Y558-E560 VanDerWaalsContact C-N 3.32Å; Y558-E560 PolarHBondContact O-N 3.21Å; Y558-Y561 PolarHBondContact O-N 3.21Å
559	S	67.9	Low	73.8	Confident	50 Å²	50	55.2 Å²	55.2	35%	0.35	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-18.9	-178.7	62.5	0	0	0	0	114.5	L555 D556 Y561	L555-S559 WeakPolarHBondContact O-CB 3.32Å; L555-S559 PolarHBondContact O-N 3.42Å; L555-S559 PolarHBondContact O-OG 3.47Å; D556-S559 PolarHBondContact O-OG 2.82Å; S559-Y561 PolarHBondContact O-N 3Å
560	E	67.6	Low	73.9	Confident	79 Å²	79	56.4 Å²	56.4	37%	0.369	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-35.3	169.2	-66.3	-176.2	174.8	0	0	111.9	Y558	Y558-E560 VanDerWaalsContact C-N 3.32Å; Y558-E560 PolarHBondContact O-N 3.21Å
561	Y	66.5	Low	74.4	Confident	84 Å²	84	58.3 Å²	58.3	33%	0.329	32%	0.32	S	S	.	.	S	Bend	trans	-104.3	104.8	-173	-64	-76.8	0	0	0	111.7	M1 P2 Y558 S559 A563 S564 I565	M1-Y561 WeakPolarHBondContact CA-OH 3.27Å; M1-Y561 HydrophobicContact CG-CE2 4.39Å; P2-Y561 WeakPolarHBondContact CD-OH 3.4Å; Y558-Y561 PolarHBondContact O-N 3.21Å; S559-Y561 PolarHBondContact O-N 3Å; Y561-A563 VanDerWaalsContact C-N 3.26Å; Y561-A563 PolarHBondContact O-N 2.97Å; Y561-A563 VanDerWaalsContact O-N 3.14Å; Y561-S564 WeakPolarHBondContact CB-OG 3.29Å; Y561-S564 WeakPolarHBondContact O-CA 3.3Å; Y561-S564 WeakPolarHBondContact O-CB 3.32Å; Y561-S564 PolarHBondContact O-N 3.44Å; Y561-I565 PolarHBondContact O-N 3.42Å
562	G	69.6	Low	74.7	Confident	14 Å²	14	60.9 Å²	60.9	14%	0.144	33%	0.334	C	S	.	.	H	α-helix	trans	-57.1	-32.2	-175.9	0	0	0	0	0	115.3	I565 L566	G562-I565 PolarHBondContact O-N 3.19Å; G562-L566 PolarHBondContact O-N 3.33Å
563	A	73.2	Confident	75.3	Confident	60 Å²	60	58.2 Å²	58.2	50%	0.496	32%	0.315	S	S	.	.	H	α-helix	trans	-69.8	-34.8	174.4	0	0	0	0	0	112.6	Y561 I565 L566 I567	Y561-A563 VanDerWaalsContact C-N 3.26Å; Y561-A563 PolarHBondContact O-N 2.97Å; Y561-A563 VanDerWaalsContact O-N 3.14Å; A563-I565 VanDerWaalsContact C-N 3.3Å; A563-I565 PolarHBondContact O-N 3.1Å; A563-L566 PolarHBondContact O-N 2.82Å; A563-I567 PolarHBondContact O-N 3.36Å; A563-I567 VanDerWaalsContact O-N 3.15Å
564	S	75.1	Confident	76.2	Confident	41 Å²	41	57.1 Å²	57.1	29%	0.287	32%	0.321	S	S	.	.	H	α-helix	trans	-67.6	-31.4	176.3	-54.6	0	0	0	0	112.1	Y561 L566 I567 L568	Y561-S564 WeakPolarHBondContact CB-OG 3.29Å; Y561-S564 WeakPolarHBondContact O-CA 3.3Å; Y561-S564 WeakPolarHBondContact O-CB 3.32Å; Y561-S564 PolarHBondContact O-N 3.44Å; S564-L566 VanDerWaalsContact C-N 3.35Å; S564-I567 PolarHBondContact O-N 2.75Å; S564-L568 WeakPolarHBondContact O-CB 3.46Å; S564-L568 PolarHBondContact O-N 3.13Å
565	I	75	Confident	77.2	Confident	56 Å²	56	57.3 Å²	57.3	29%	0.287	32%	0.323	S	S	.	.	H	α-helix	trans	-61.1	-43.6	170.9	-60.7	175.6	0	0	0	110.6	Y561 G562 A563 L568 L569	Y561-I565 PolarHBondContact O-N 3.42Å; G562-I565 PolarHBondContact O-N 3.19Å; A563-I565 VanDerWaalsContact C-N 3.3Å; A563-I565 PolarHBondContact O-N 3.1Å; I565-L568 PolarHBondContact O-N 3.31Å; I565-L569 VanDerWaalsContact O-CB 3.29Å; I565-L569 WeakPolarHBondContact O-CB 3.17Å; I565-L569 PolarHBondContact O-N 3.43Å
566	L	78.5	Confident	78.1	Confident	52 Å²	52	55.9 Å²	55.9	27%	0.272	32%	0.315	S	S	.	.	H	α-helix	trans	-64.9	-42.7	178.4	179.9	59.6	0	0	0	112.1	G562 A563 S564 L569 T570 V675 L678	G562-L566 PolarHBondContact O-N 3.33Å; A563-L566 PolarHBondContact O-N 2.82Å; S564-L566 VanDerWaalsContact C-N 3.35Å; L566-L569 PolarHBondContact O-N 3.06Å; L566-T570 HydrophobicContact CD1-CG2 4.11Å; L566-T570 WeakPolarHBondContact O-CG2 3.43Å; L566-T570 PolarHBondContact O-N 3.29Å; L566-T570 PolarHBondContact O-OG1 3.41Å; L566-V675 HydrophobicContact CD1-CG2 3.54Å; L566-V675 HydrophobicContact CD2-CG2 4.42Å; L566-L678 HydrophobicContact CB-CD2 4Å; L566-L678 HydrophobicContact CD2-CD2 3.89Å
567	I	81.4	Confident	79.3	Confident	117 Å²	117	50.1 Å²	50.1	60%	0.6	29%	0.285	S	S	*	.	H	α-helix	trans	-63.4	-42	176.1	-63.9	169.5	0	0	0	110.8	A563 S564 T570 A571	A563-I567 PolarHBondContact O-N 3.36Å; A563-I567 VanDerWaalsContact O-N 3.15Å; S564-I567 PolarHBondContact O-N 2.75Å; I567-T570 PolarHBondContact O-OG1 3.03Å; I567-A571 VanDerWaalsContact O-CB 3.26Å; I567-A571 WeakPolarHBondContact O-CB 3.33Å; I567-A571 PolarHBondContact O-N 3.12Å
568	L	80.1	Confident	80.6	Confident	59 Å²	59	48 Å²	48	31%	0.309	28%	0.277	S	S	.	.	H	α-helix	trans	-63.7	-42.1	175.8	179.7	66.2	0	0	0	111.9	L555 S564 I565 A571 L572	L555-L568 HydrophobicContact CD1-CD2 3.33Å; S564-L568 WeakPolarHBondContact O-CB 3.46Å; S564-L568 PolarHBondContact O-N 3.13Å; I565-L568 PolarHBondContact O-N 3.31Å; L568-A571 PolarHBondContact O-N 2.8Å; L568-L572 VanDerWaalsContact O-CB 3.31Å; L568-L572 WeakPolarHBondContact O-CB 3.42Å; L568-L572 PolarHBondContact O-N 3.16Å
569	L	82.1	Confident	81.8	Confident	30 Å²	30	51 Å²	51	16%	0.157	29%	0.288	C	S	.	.	H	α-helix	trans	-71.8	-36.5	-177.3	-170.1	63.7	0	0	0	112.2	I565 L566 L572 F573 I671 N674	I565-L569 VanDerWaalsContact O-CB 3.29Å; I565-L569 WeakPolarHBondContact O-CB 3.17Å; I565-L569 PolarHBondContact O-N 3.43Å; L566-L569 PolarHBondContact O-N 3.06Å; L569-L572 HydrophobicContact CD1-CD2 4.46Å; L569-L572 PolarHBondContact O-N 3.05Å; L569-F573 PolarHBondContact O-N 3.33Å; L569-I671 HydrophobicContact CD2-CB 4.41Å; L569-I671 HydrophobicContact CD2-CG1 3.89Å; L569-I671 HydrophobicContact CG-CG1 3.89Å; L569-N674 HydrophobicContact CD2-CB 3.86Å
570	T	84.1	Confident	83.1	Confident	68 Å²	68	49.4 Å²	49.4	42%	0.417	28%	0.276	S	S	.	.	H	α-helix	trans	-72.7	-35.5	173.1	54.3	0	0	0	0	112.3	L566 I567 F573 A574	L566-T570 HydrophobicContact CD1-CG2 4.11Å; L566-T570 WeakPolarHBondContact O-CG2 3.43Å; L566-T570 PolarHBondContact O-N 3.29Å; L566-T570 PolarHBondContact O-OG1 3.41Å; I567-T570 PolarHBondContact O-OG1 3.03Å; T570-F573 WeakPolarHBondContact O-CB 3.36Å; T570-F573 PolarHBondContact O-N 3.03Å; T570-A574 PolarHBondContact O-N 3.22Å
571	A	85.5	Confident	84.4	Confident	51 Å²	51	45.7 Å²	45.7	42%	0.421	26%	0.258	S	S	.	.	H	α-helix	trans	-63.6	-41	169.9	0	0	0	0	0	112	I567 L568 A574 L575	I567-A571 VanDerWaalsContact O-CB 3.26Å; I567-A571 WeakPolarHBondContact O-CB 3.33Å; I567-A571 PolarHBondContact O-N 3.12Å; L568-A571 PolarHBondContact O-N 2.8Å; A571-A574 PolarHBondContact O-N 2.97Å; A571-L575 WeakPolarHBondContact O-CB 3.45Å; A571-L575 PolarHBondContact O-N 3.07Å
572	L	85.7	Confident	85.6	Confident	81 Å²	81	41.9 Å²	41.9	42%	0.424	24%	0.244	S	C	.	.	H	α-helix	trans	-63.9	-40.3	174.6	-178.8	61.7	0	0	0	111.9	L568 L569 L575 I576	L568-L572 VanDerWaalsContact O-CB 3.31Å; L568-L572 WeakPolarHBondContact O-CB 3.42Å; L568-L572 PolarHBondContact O-N 3.16Å; L569-L572 HydrophobicContact CD1-CD2 4.46Å; L569-L572 PolarHBondContact O-N 3.05Å; L572-L575 PolarHBondContact O-N 3.42Å; L572-I576 HydrophobicContact CD1-CD1 3.84Å; L572-I576 HydrophobicContact CD1-CG1 4.16Å; L572-I576 HydrophobicContact CG-CD1 3.87Å; L572-I576 WeakPolarHBondContact O-CG1 3.26Å; L572-I576 PolarHBondContact O-N 3.15Å
573	F	88.8	Confident	86.7	Confident	29 Å²	29	45.1 Å²	45.1	13%	0.127	26%	0.257	C	S	.	.	H	α-helix	trans	-58.8	-48.5	173.8	-179	-94.8	0	0	0	111.8	L569 T570 L575 I576 A577 F635 L638 T639 M667 I671	L569-F573 PolarHBondContact O-N 3.33Å; T570-F573 WeakPolarHBondContact O-CB 3.36Å; T570-F573 PolarHBondContact O-N 3.03Å; F573-L575 PolarHBondContact O-N 3.44Å; F573-I576 PolarHBondContact O-N 3.32Å; F573-A577 WeakPolarHBondContact O-CB 3.3Å; F573-A577 PolarHBondContact O-N 3.29Å; F573-F635 HydrophobicContact CD1-CE1 4.05Å; F573-F635 AromaticContact CE1-CD1 3.8Å; F573-F635 HydrophobicContact CE1-CD1 3.8Å; F573-F635 AromaticContact CE1-CE1 3.67Å; F573-F635 HydrophobicContact CE1-CE1 3.67Å; F573-F635 HydrophobicContact CZ-CD1 4.43Å; F573-L638 HydrophobicContact CE2-CB 4.09Å; F573-L638 HydrophobicContact CZ-CB 3.96Å; F573-T639 HydrophobicContact CE1-CG2 4.32Å; F573-T639 HydrophobicContact CZ-CG2 3.81Å; F573-M667 HydrophobicContact CB-CE 4.31Å; F573-M667 HydrophobicContact CD2-CE 3.52Å; F573-M667 HydrophobicContact CE2-CE 4.21Å; F573-M667 HydrophobicContact CG-CE 4.24Å; F573-I671 HydrophobicContact CB-CD1 3.97Å; F573-I671 HydrophobicContact CD2-CD1 3.43Å; F573-I671 VanDerWaalsContact CD2-CD1 3.43Å; F573-I671 HydrophobicContact CE2-CD1 4.15Å; F573-I671 HydrophobicContact CG-CD1 3.85Å
574	A	91.1	Very high	87.8	Confident	46 Å²	46	42.2 Å²	42.2	38%	0.38	23%	0.233	S	C	.	.	H	α-helix	trans	-64.4	-37.5	176.9	0	0	0	0	0	112.8	T570 A571 H578 F635	T570-A574 PolarHBondContact O-N 3.22Å; A571-A574 PolarHBondContact O-N 2.97Å; A574-H578 WeakPolarHBondContact O-CB 3.47Å; A574-H578 PolarHBondContact O-N 3.5Å; A574-F635 HydrophobicContact CB-CZ 4.48Å
575	L	91.1	Very high	88.6	Confident	27 Å²	27	40.9 Å²	40.9	14%	0.141	22%	0.222	C	C	.	.	H	α-helix	trans	-66.1	-44.5	177.1	-178.2	62.9	0	0	0	112.1	A390 I391 L548 A571 L572 F573 H578 W579	A390-L575 HydrophobicContact CB-CD1 3.82Å; A390-L575 HydrophobicContact CB-CD2 4.02Å; I391-L575 HydrophobicContact CG1-CD1 3.91Å; L548-L575 HydrophobicContact CD2-CD2 4.38Å; A571-L575 WeakPolarHBondContact O-CB 3.45Å; A571-L575 PolarHBondContact O-N 3.07Å; L572-L575 PolarHBondContact O-N 3.42Å; F573-L575 PolarHBondContact O-N 3.44Å; L575-H578 WeakPolarHBondContact O-CB 3.43Å; L575-H578 PolarHBondContact O-N 2.81Å; L575-W579 HydrophobicContact CD2-CZ2 4.48Å; L575-W579 PolarHBondContact O-N 2.91Å
576	I	91.7	Very high	89.3	Confident	38 Å²	38	40 Å²	40	20%	0.195	22%	0.224	C	C	.	.	H	α-helix	trans	-67.8	-38.8	177.7	-67.9	168	0	0	0	110.7	L572 F573 H578 W579 L580 V663 M667	L572-I576 HydrophobicContact CD1-CD1 3.84Å; L572-I576 HydrophobicContact CD1-CG1 4.16Å; L572-I576 HydrophobicContact CG-CD1 3.87Å; L572-I576 WeakPolarHBondContact O-CG1 3.26Å; L572-I576 PolarHBondContact O-N 3.15Å; F573-I576 PolarHBondContact O-N 3.32Å; I576-H578 VanDerWaalsContact C-N 3.32Å; I576-H578 PolarHBondContact O-N 3.3Å; I576-W579 PolarHBondContact O-N 2.92Å; I576-L580 HydrophobicContact CG2-CD1 3.83Å; I576-L580 HydrophobicContact CG2-CG 4.3Å; I576-L580 WeakPolarHBondContact O-CB 3.46Å; I576-L580 WeakPolarHBondContact O-CG 3.41Å; I576-L580 PolarHBondContact O-N 2.84Å; I576-V663 HydrophobicContact CG2-CG1 4.39Å; I576-M667 HydrophobicContact CB-CE 3.88Å; I576-M667 HydrophobicContact CB-SD 4.25Å; I576-M667 HydrophobicContact CD1-CE 3.82Å; I576-M667 HydrophobicContact CD1-SD 3.71Å; I576-M667 HydrophobicContact CG1-CE 4.45Å; I576-M667 HydrophobicContact CG2-CE 3.9Å; I576-M667 HydrophobicContact CG2-SD 3.73Å
577	A	93.7	Very high	89.9	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-57.7	-45	171.2	0	0	0	0	0	111.6	F573 L580 A581 T634 F635 L638	F573-A577 WeakPolarHBondContact O-CB 3.3Å; F573-A577 PolarHBondContact O-N 3.29Å; A577-L580 PolarHBondContact O-N 3Å; A577-A581 WeakPolarHBondContact O-CB 3.31Å; A577-A581 PolarHBondContact O-N 2.98Å; A577-T634 PolarHBondContact O-OG1 3.11Å; A577-F635 HydrophobicContact CB-CD1 3.77Å; A577-F635 HydrophobicContact CB-CD2 4.4Å; A577-F635 HydrophobicContact CB-CE1 3.42Å; A577-F635 VanDerWaalsContact CB-CE1 3.42Å; A577-F635 HydrophobicContact CB-CE2 4.11Å; A577-F635 HydrophobicContact CB-CG 4.24Å; A577-F635 HydrophobicContact CB-CZ 3.61Å; A577-L638 HydrophobicContact CB-CD1 3.58Å
578	H	94.7	Very high	90.4	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.037	19%	0.192	C	C	.	.	H	α-helix	trans	-62.9	-40.6	175.3	173	74.3	0	0	0	113	I391 A574 L575 I576 A581 C582 Y627 L631	I391-H578 PolarHBondContact O-NE2 2.93Å; A574-H578 WeakPolarHBondContact O-CB 3.47Å; A574-H578 PolarHBondContact O-N 3.5Å; L575-H578 WeakPolarHBondContact O-CB 3.43Å; L575-H578 PolarHBondContact O-N 2.81Å; I576-H578 VanDerWaalsContact C-N 3.32Å; I576-H578 PolarHBondContact O-N 3.3Å; H578-A581 WeakPolarHBondContact O-CB 3.11Å; H578-A581 PolarHBondContact O-N 3.08Å; H578-C582 PolarHBondContact O-N 2.92Å; H578-C582 PolarHBondContact O-SG 3.06Å; H578-Y627 AromaticContact CE1-CE2 3.78Å; H578-Y627 AromaticContact ND1-CE2 3.62Å; H578-Y627 AromaticContact ND1-CZ 3.71Å; H578-Y627 PolarHBondContact ND1-OH 3.39Å; H578-L631 HydrophobicContact CB-CD1 4.38Å
579	W	94	Very high	90.7	Very high	80 Å²	80	32.7 Å²	32.7	30%	0.303	19%	0.186	S	C	.	.	H	α-helix	trans	-64.7	-45.5	176	-73.7	6.8	0	0	0	112.4	A390 L545 L548 L575 I576 A581 C582 I583	A390-W579 PolarHBondContact O-NE1 3.15Å; L545-W579 HydrophobicContact CD1-CZ2 4.32Å; L545-W579 HydrophobicContact CD2-CZ2 4.04Å; L548-W579 HydrophobicContact CD1-CH2 3.45Å; L548-W579 VanDerWaalsContact CD1-CH2 3.45Å; L548-W579 HydrophobicContact CD1-CZ2 3.49Å; L548-W579 VanDerWaalsContact CD1-CZ2 3.49Å; L575-W579 HydrophobicContact CD2-CZ2 4.48Å; L575-W579 PolarHBondContact O-N 2.91Å; I576-W579 PolarHBondContact O-N 2.92Å; W579-A581 VanDerWaalsContact C-N 3.3Å; W579-A581 PolarHBondContact O-N 2.79Å; W579-C582 WeakPolarHBondContact O-CB 3.4Å; W579-C582 PolarHBondContact O-N 2.83Å; W579-I583 WeakPolarHBondContact O-CG1 3.39Å; W579-I583 PolarHBondContact O-N 2.77Å
580	L	94.7	Very high	90.9	Very high	18 Å²	18	33.3 Å²	33.3	9%	0.094	20%	0.196	C	C	.	.	H	α-helix	trans	-63.8	-36.9	175.9	-67.7	170.5	0	0	0	111	I576 A577 C582 I583 W584 T634 L638 F656 V660 V663	I576-L580 HydrophobicContact CG2-CD1 3.83Å; I576-L580 HydrophobicContact CG2-CG 4.3Å; I576-L580 WeakPolarHBondContact O-CB 3.46Å; I576-L580 WeakPolarHBondContact O-CG 3.41Å; I576-L580 PolarHBondContact O-N 2.84Å; A577-L580 PolarHBondContact O-N 3Å; L580-C582 VanDerWaalsContact C-N 3.34Å; L580-C582 PolarHBondContact O-N 3.21Å; L580-I583 HydrophobicContact CD2-CD1 4.47Å; L580-I583 PolarHBondContact O-N 3.48Å; L580-W584 WeakPolarHBondContact O-CB 3.43Å; L580-W584 PolarHBondContact O-N 2.98Å; L580-T634 HydrophobicContact CB-CG2 3.96Å; L580-L638 HydrophobicContact CD1-CD1 4.16Å; L580-L638 HydrophobicContact CD1-CD2 3.95Å; L580-L638 HydrophobicContact CD1-CG 4.4Å; L580-F656 HydrophobicContact CB-CZ 4.14Å; L580-F656 HydrophobicContact CD2-CE2 4.01Å; L580-F656 HydrophobicContact CD2-CZ 3.98Å; L580-F656 WeakPolarHBondContact O-CZ 3.29Å; L580-V660 HydrophobicContact CD1-CG1 4.41Å; L580-V660 HydrophobicContact CD1-CG2 4.24Å; L580-V660 HydrophobicContact CD2-CG2 4.16Å; L580-V663 HydrophobicContact CD1-CG1 4.46Å
581	A	94.9	Very high	91.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.5	-39.2	173.7	0	0	0	0	0	112.4	A577 H578 W579 W584 Y585 A630 L631 T634	A577-A581 WeakPolarHBondContact O-CB 3.31Å; A577-A581 PolarHBondContact O-N 2.98Å; H578-A581 WeakPolarHBondContact O-CB 3.11Å; H578-A581 PolarHBondContact O-N 3.08Å; W579-A581 VanDerWaalsContact C-N 3.3Å; W579-A581 PolarHBondContact O-N 2.79Å; A581-W584 PolarHBondContact O-N 2.87Å; A581-Y585 PolarHBondContact O-N 2.96Å; A581-A630 HydrophobicContact CB-CB 4.26Å; A581-L631 HydrophobicContact CB-CB 4.17Å; A581-L631 HydrophobicContact CB-CD1 3.91Å; A581-T634 HydrophobicContact CB-CG2 4.47Å
582	C	93.1	Very high	91.1	Very high	4 Å²	4	30.4 Å²	30.4	3%	0.027	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-41	174.2	-64.4	0	0	0	0	111.8	P394 V398 F399 H578 W579 L580 Y585 A586	P394-C582 HydrophobicContact CB-CB 4.19Å; V398-C582 HydrophobicContact CG2-CB 4.19Å; F399-C582 HydrophobicContact CE2-CB 4.48Å; H578-C582 PolarHBondContact O-N 2.92Å; H578-C582 PolarHBondContact O-SG 3.06Å; W579-C582 WeakPolarHBondContact O-CB 3.4Å; W579-C582 PolarHBondContact O-N 2.83Å; L580-C582 VanDerWaalsContact C-N 3.34Å; L580-C582 PolarHBondContact O-N 3.21Å; C582-Y585 PolarHBondContact O-N 3.26Å; C582-A586 WeakPolarHBondContact O-CB 3.49Å; C582-A586 PolarHBondContact O-N 3.01Å
583	I	92.8	Very high	90.9	Very high	82 Å²	82	31.7 Å²	31.7	42%	0.421	18%	0.175	S	C	.	.	H	α-helix	trans	-68.1	-41.2	176.9	-62.6	162.9	0	0	0	111.1	W579 L580 Y585 A586 I587 F656	W579-I583 WeakPolarHBondContact O-CG1 3.39Å; W579-I583 PolarHBondContact O-N 2.77Å; L580-I583 HydrophobicContact CD2-CD1 4.47Å; L580-I583 PolarHBondContact O-N 3.48Å; I583-Y585 VanDerWaalsContact C-N 3.32Å; I583-Y585 PolarHBondContact O-N 2.67Å; I583-A586 WeakPolarHBondContact O-CB 3.17Å; I583-A586 PolarHBondContact O-N 2.9Å; I583-A586 VanDerWaalsContact O-N 3.13Å; I583-I587 HydrophobicContact CG2-CD1 4.06Å; I583-I587 WeakPolarHBondContact O-CG1 3.44Å; I583-I587 PolarHBondContact O-N 2.65Å; I583-F656 HydrophobicContact CB-CE2 3.88Å; I583-F656 HydrophobicContact CB-CZ 4.23Å; I583-F656 HydrophobicContact CG2-CD2 3.93Å; I583-F656 HydrophobicContact CG2-CE2 3.43Å; I583-F656 VanDerWaalsContact CG2-CE2 3.43Å; I583-F656 HydrophobicContact CG2-CZ 4.2Å
584	W	94.9	Very high	90.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-41.1	175.7	-179.2	-113.4	0	0	0	112.7	L580 A581 G588 W601 F633 T634 V646 P648 E653 F656	L580-W584 WeakPolarHBondContact O-CB 3.43Å; L580-W584 PolarHBondContact O-N 2.98Å; A581-W584 PolarHBondContact O-N 2.87Å; W584-G588 PolarHBondContact O-N 3.15Å; W584-W601 AromaticContact CD1-CE2 3.5Å; W584-W601 VanDerWaalsContact CD1-CE2 3.5Å; W584-W601 AromaticContact CD1-CZ2 3.48Å; W584-W601 VanDerWaalsContact CD1-CZ2 3.48Å; W584-W601 AromaticContact CD1-NE1 3.71Å; W584-W601 AromaticContact CD2-NE1 3.78Å; W584-W601 AromaticContact CE2-CD1 3.42Å; W584-W601 VanDerWaalsContact CE2-CD1 3.42Å; W584-W601 AromaticContact CE2-CD2 3.8Å; W584-W601 AromaticContact CE2-CE2 3.74Å; W584-W601 AromaticContact CE2-CG 3.62Å; W584-W601 AromaticContact CE2-NE1 3.47Å; W584-W601 HydrophobicContact CG-CZ2 4.37Å; W584-W601 AromaticContact CG-NE1 3.98Å; W584-W601 HydrophobicContact CH2-CB 4.35Å; W584-W601 AromaticContact CH2-CD1 3.98Å; W584-W601 HydrophobicContact CH2-CG 4.29Å; W584-W601 HydrophobicContact CZ2-CB 3.64Å; W584-W601 AromaticContact CZ2-CD1 3.41Å; W584-W601 VanDerWaalsContact CZ2-CD1 3.41Å; W584-W601 HydrophobicContact CZ2-CD2 4.06Å; W584-W601 AromaticContact CZ2-CG 3.43Å; W584-W601 HydrophobicContact CZ2-CG 3.43Å; W584-W601 VanDerWaalsContact CZ2-CG 3.43Å; W584-W601 AromaticContact CZ2-NE1 3.98Å; W584-W601 AromaticContact NE1-CD1 3.71Å; W584-W601 AromaticContact NE1-CD2 3.32Å; W584-W601 VanDerWaalsContact NE1-CD2 3.32Å; W584-W601 AromaticContact NE1-CE2 3.17Å; W584-W601 AromaticContact NE1-CE3 3.82Å; W584-W601 AromaticContact NE1-CG 3.68Å; W584-W601 AromaticContact NE1-CZ2 3.57Å; W584-W601 AromaticContact NE1-NE1 3.39Å; W584-W601 PolarHBondContact O-NE1 2.74Å; W584-W601 VanDerWaalsContact O-NE1 3.08Å; W584-F633 AromaticContact CD1-CD1 3.89Å; W584-F633 AromaticContact CD2-CD1 3.6Å; W584-F633 HydrophobicContact CD2-CD1 3.6Å; W584-F633 AromaticContact CD2-CE1 3.6Å; W584-F633 HydrophobicContact CD2-CE1 3.6Å; W584-F633 AromaticContact CE2-CD1 3.35Å; W584-F633 AromaticContact CE2-CE1 3.53Å; W584-F633 AromaticContact CE2-CG 3.97Å; W584-F633 HydrophobicContact CE3-CD1 4.21Å; W584-F633 AromaticContact CE3-CE1 3.71Å; W584-F633 HydrophobicContact CE3-CE1 3.71Å; W584-F633 AromaticContact CG-CD1 3.91Å; W584-F633 HydrophobicContact CG-CD1 3.91Å; W584-F633 HydrophobicContact CG-CE1 4.31Å; W584-F633 HydrophobicContact CH2-CD1 4.28Å; W584-F633 AromaticContact CH2-CE1 3.63Å; W584-F633 HydrophobicContact CH2-CE1 3.63Å; W584-F633 HydrophobicContact CH2-CE2 4.43Å; W584-F633 AromaticContact CH2-CZ 3.72Å; W584-F633 HydrophobicContact CH2-CZ 3.72Å; W584-F633 AromaticContact CZ2-CD1 3.73Å; W584-F633 HydrophobicContact CZ2-CD1 3.73Å; W584-F633 HydrophobicContact CZ2-CD2 4.39Å; W584-F633 AromaticContact CZ2-CE1 3.56Å; W584-F633 HydrophobicContact CZ2-CE1 3.56Å; W584-F633 HydrophobicContact CZ2-CE2 4.24Å; W584-F633 HydrophobicContact CZ2-CG 4.15Å; W584-F633 AromaticContact CZ2-CZ 3.84Å; W584-F633 HydrophobicContact CZ2-CZ 3.84Å; W584-F633 HydrophobicContact CZ3-CD1 4.49Å; W584-F633 AromaticContact CZ3-CE1 3.7Å; W584-F633 HydrophobicContact CZ3-CE1 3.7Å; W584-F633 HydrophobicContact CZ3-CZ 4.09Å; W584-F633 AromaticContact NE1-CD1 3.54Å; W584-F633 AromaticContact NE1-CG 3.93Å; W584-T634 HydrophobicContact CB-CG2 4.36Å; W584-V646 HydrophobicContact CZ2-CG1 4.25Å; W584-P648 HydrophobicContact CH2-CB 4.05Å; W584-E653 HydrophobicContact CH2-CB 3.76Å; W584-E653 HydrophobicContact CH2-CG 3.82Å; W584-E653 HydrophobicContact CZ3-CB 3.68Å; W584-E653 HydrophobicContact CZ3-CG 3.8Å; W584-F656 HydrophobicContact CB-CE1 3.84Å; W584-F656 HydrophobicContact CB-CZ 4.2Å; W584-F656 HydrophobicContact CD2-CD1 4.36Å; W584-F656 HydrophobicContact CD2-CE1 4.23Å; W584-F656 AromaticContact CE3-CD1 3.35Å; W584-F656 HydrophobicContact CE3-CD1 3.35Å; W584-F656 AromaticContact CE3-CE1 3.64Å; W584-F656 HydrophobicContact CE3-CE1 3.64Å; W584-F656 HydrophobicContact CE3-CG 4.33Å; W584-F656 HydrophobicContact CG-CE1 4.36Å; W584-F656 AromaticContact CZ3-CD1 3.86Å; W584-F656 HydrophobicContact CZ3-CD1 3.86Å; W584-F656 HydrophobicContact CZ3-CE1 4.5Å
585	Y	93.1	Very high	89.8	Confident	12 Å²	12	41.4 Å²	41.4	5%	0.047	20%	0.203	C	C	.	.	H	α-helix	trans	-70.8	-36.1	172.5	178.4	-110.5	0	0	0	113.1	V398 F399 A581 C582 I583 I587 G588 N589 W601 L602 K626	V398-Y585 HydrophobicContact CG1-CD1 3.62Å; V398-Y585 HydrophobicContact CG1-CE1 4.14Å; F399-Y585 HydrophobicContact CB-CE1 4.48Å; F399-Y585 AromaticContact CD1-CD1 3.3Å; F399-Y585 HydrophobicContact CD1-CD1 3.3Å; F399-Y585 AromaticContact CD1-CE1 3.39Å; F399-Y585 HydrophobicContact CD1-CE1 3.39Å; F399-Y585 AromaticContact CD1-CG 3.95Å; F399-Y585 HydrophobicContact CD1-CG 3.95Å; F399-Y585 HydrophobicContact CD2-CD1 4.14Å; F399-Y585 AromaticContact CE1-CD1 3.14Å; F399-Y585 HydrophobicContact CE1-CD1 3.14Å; F399-Y585 AromaticContact CE1-CD2 3.95Å; F399-Y585 HydrophobicContact CE1-CD2 3.95Å; F399-Y585 AromaticContact CE1-CE1 3.69Å; F399-Y585 HydrophobicContact CE1-CE1 3.69Å; F399-Y585 HydrophobicContact CE1-CE2 4.41Å; F399-Y585 AromaticContact CE1-CG 3.32Å; F399-Y585 HydrophobicContact CE1-CG 3.32Å; F399-Y585 AromaticContact CE2-CD1 4Å; F399-Y585 HydrophobicContact CE2-CD1 4Å; F399-Y585 HydrophobicContact CE2-CG 4.45Å; F399-Y585 AromaticContact CG-CD1 3.83Å; F399-Y585 HydrophobicContact CG-CD1 3.83Å; F399-Y585 AromaticContact CG-CE1 3.95Å; F399-Y585 HydrophobicContact CG-CE1 3.95Å; F399-Y585 AromaticContact CZ-CD1 3.51Å; F399-Y585 HydrophobicContact CZ-CD1 3.51Å; F399-Y585 HydrophobicContact CZ-CE1 4.44Å; F399-Y585 AromaticContact CZ-CG 3.61Å; F399-Y585 HydrophobicContact CZ-CG 3.61Å; A581-Y585 PolarHBondContact O-N 2.96Å; C582-Y585 PolarHBondContact O-N 3.26Å; I583-Y585 VanDerWaalsContact C-N 3.32Å; I583-Y585 PolarHBondContact O-N 2.67Å; Y585-I587 VanDerWaalsContact C-N 3.34Å; Y585-I587 PolarHBondContact O-N 3.49Å; Y585-G588 PolarHBondContact O-N 2.78Å; Y585-N589 HydrophobicContact CE1-CB 4.42Å; Y585-N589 HydrophobicContact CE2-CB 4.09Å; Y585-N589 WeakPolarHBondContact O-CB 3.28Å; Y585-N589 PolarHBondContact O-N 3.24Å; Y585-N589 PolarHBondContact OH-OD1 3.14Å; Y585-W601 HydrophobicContact CD2-CZ2 4.25Å; Y585-L602 HydrophobicContact CE2-CD2 4.32Å; Y585-K626 HydrophobicContact CD2-CB 4.49Å; Y585-K626 HydrophobicContact CE2-CB 4.3Å; Y585-K626 HydrophobicContact CE2-CD 4.22Å; Y585-K626 HydrophobicContact CE2-CG 4.44Å
586	A	89.4	Confident	89.2	Confident	39 Å²	39	46.6 Å²	46.6	32%	0.322	23%	0.231	S	C	.	.	H	α-helix	trans	-59.3	-44.2	172.9	0	0	0	0	0	111.9	V398 C582 I583 A590	V398-A586 HydrophobicContact CG1-CB 3.7Å; C582-A586 WeakPolarHBondContact O-CB 3.49Å; C582-A586 PolarHBondContact O-N 3.01Å; I583-A586 WeakPolarHBondContact O-CB 3.17Å; I583-A586 PolarHBondContact O-N 2.9Å; I583-A586 VanDerWaalsContact O-N 3.13Å; A586-A590 VanDerWaalsContact O-CB 3.27Å; A586-A590 WeakPolarHBondContact O-CB 3.39Å; A586-A590 PolarHBondContact O-N 2.88Å
587	I	91.6	Very high	88.8	Confident	36 Å²	36	49.1 Å²	49.1	19%	0.185	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-53	175.9	-66	165.2	0	0	0	110.5	I583 Y585 N589 A590 E591 A652 E653 F656	I583-I587 HydrophobicContact CG2-CD1 4.06Å; I583-I587 WeakPolarHBondContact O-CG1 3.44Å; I583-I587 PolarHBondContact O-N 2.65Å; Y585-I587 VanDerWaalsContact C-N 3.34Å; Y585-I587 PolarHBondContact O-N 3.49Å; I587-N589 PolarHBondContact O-N 2.98Å; I587-A590 PolarHBondContact O-N 2.78Å; I587-A590 VanDerWaalsContact O-N 3.14Å; I587-E591 PolarHBondContact O-N 3.33Å; I587-A652 HydrophobicContact CG2-CB 4.26Å; I587-E653 HydrophobicContact CG2-CG 4.25Å; I587-F656 HydrophobicContact CD1-CB 3.77Å; I587-F656 HydrophobicContact CD1-CD1 4.42Å; I587-F656 HydrophobicContact CD1-CD2 3.72Å; I587-F656 HydrophobicContact CD1-CE2 4.44Å; I587-F656 HydrophobicContact CD1-CG 3.7Å
588	G	91.1	Very high	88.3	Confident	2 Å²	2	54.2 Å²	54.2	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-61.9	-39.1	-178.3	0	0	0	0	0	113.6	W584 Y585 H592	W584-G588 PolarHBondContact O-N 3.15Å; Y585-G588 PolarHBondContact O-N 2.78Å; G588-H592 VanDerWaalsContact O-CB 3.26Å; G588-H592 WeakPolarHBondContact O-CB 3.49Å; G588-H592 PolarHBondContact O-N 2.79Å
589	N	87.4	Confident	88	Confident	36 Å²	36	57.3 Å²	57.3	19%	0.193	29%	0.287	C	S	.	.	H	α-helix	trans	-70.7	-32	175.8	-177.3	95.2	0	0	0	112.4	N402 Y585 I587 L593	N402-N589 PolarHBondContact ND2-ND2 2.85Å; N402-N589 PolarHBondContact ND2-OD1 3.1Å; Y585-N589 HydrophobicContact CE1-CB 4.42Å; Y585-N589 HydrophobicContact CE2-CB 4.09Å; Y585-N589 WeakPolarHBondContact O-CB 3.28Å; Y585-N589 PolarHBondContact O-N 3.24Å; Y585-N589 PolarHBondContact OH-OD1 3.14Å; I587-N589 PolarHBondContact O-N 2.98Å; N589-L593 WeakPolarHBondContact O-CB 3.4Å; N589-L593 PolarHBondContact O-N 3.03Å
590	A	86.4	Confident	87.8	Confident	43 Å²	43	53.6 Å²	53.6	36%	0.355	27%	0.274	S	S	.	.	H	α-helix	trans	-72.6	-46.8	174.9	0	0	0	0	0	111.8	A586 I587 L593 Y594	A586-A590 VanDerWaalsContact O-CB 3.27Å; A586-A590 WeakPolarHBondContact O-CB 3.39Å; A586-A590 PolarHBondContact O-N 2.88Å; I587-A590 PolarHBondContact O-N 2.78Å; I587-A590 VanDerWaalsContact O-N 3.14Å; A590-L593 PolarHBondContact O-N 3.12Å; A590-Y594 VanDerWaalsContact O-CD2 3.28Å; A590-Y594 WeakPolarHBondContact O-CD2 3.06Å; A590-Y594 PolarHBondContact O-N 3.41Å
591	E	88.5	Confident	87.8	Confident	27 Å²	27	53 Å²	53	13%	0.126	27%	0.271	C	S	.	.	H	α-helix	trans	-64.6	-44.4	177.2	-70.6	-161.9	100.8	0	0	111.4	I587 L593 Y594 R595 T650	I587-E591 PolarHBondContact O-N 3.33Å; E591-L593 PolarHBondContact O-N 3.03Å; E591-Y594 PolarHBondContact O-N 3.02Å; E591-Y594 VanDerWaalsContact O-N 3.16Å; E591-R595 HydrophobicContact CB-CB 4.25Å; E591-R595 WeakPolarHBondContact O-CA 3.24Å; E591-R595 WeakPolarHBondContact O-CB 3.34Å; E591-R595 PolarHBondContact O-N 3.17Å; E591-R595 WeakPolarHBondContact OE1-CD 3.42Å; E591-R595 IonicContact OE1-CZ 3.63Å; E591-R595 IonicContact OE1-NE 3.82Å; E591-R595 IonicContact OE1-NH1 2.71Å; E591-R595 PolarHBondContact OE1-NH1 2.85Å; E591-T650 WeakPolarHBondContact OE1-CB 3.3Å; E591-T650 PolarHBondContact OE1-OG1 3.19Å; E591-T650 VanDerWaalsContact OE2-CB 3.3Å; E591-T650 WeakPolarHBondContact OE2-CB 3.3Å; E591-T650 WeakPolarHBondContact OE2-CG2 3.05Å; E591-T650 PolarHBondContact OE2-OG1 2.99Å
592	H	84.7	Confident	87.6	Confident	31 Å²	31	53 Å²	53	14%	0.144	27%	0.271	C	S	.	.	H	α-helix	trans	-55.6	-28.5	175.8	178.1	85.5	0	0	0	114.1	G588 L602 D603 Y613	G588-H592 VanDerWaalsContact O-CB 3.26Å; G588-H592 WeakPolarHBondContact O-CB 3.49Å; G588-H592 PolarHBondContact O-N 2.79Å; H592-L602 HydrophobicContact CB-CD2 4.16Å; H592-D603 IonicContact CE1-OD1 2.66Å; H592-D603 IonicContact CG-OD1 3.84Å; H592-D603 IonicContact ND1-OD1 2.85Å; H592-D603 PolarHBondContact ND1-OD1 3.37Å; H592-Y613 AromaticContact CE1-CD1 3.65Å; H592-Y613 AromaticContact CE1-CD2 3.33Å; H592-Y613 WeakPolarHBondContact CE1-CD2 3.47Å; H592-Y613 AromaticContact CE1-CE1 3.86Å; H592-Y613 AromaticContact CE1-CE2 3.55Å; H592-Y613 AromaticContact CE1-CG 3.38Å; H592-Y613 AromaticContact CE1-CZ 3.82Å; H592-Y613 AromaticContact ND1-CD2 3.92Å; H592-Y613 AromaticContact ND1-CE2 3.79Å; H592-Y613 AromaticContact NE2-CD1 3.67Å; H592-Y613 AromaticContact NE2-CE1 3.8Å; H592-Y613 AromaticContact NE2-CG 3.87Å
593	L	81	Confident	87.5	Confident	107 Å²	107	53.5 Å²	53.5	56%	0.56	27%	0.273	S	S	*	.	H	α-helix	trans	-86.3	-29	-178.9	-175.5	61.1	0	0	0	113.8	N589 A590 E591	N589-L593 WeakPolarHBondContact O-CB 3.4Å; N589-L593 PolarHBondContact O-N 3.03Å; A590-L593 PolarHBondContact O-N 3.12Å; E591-L593 PolarHBondContact O-N 3.03Å
594	Y	79.3	Confident	87.4	Confident	197 Å²	197	51.2 Å²	51.2	77%	0.773	26%	0.263	S	S	*	.	H	α-helix	trans	-122.6	-7.1	-170	-62.8	-63.7	0	0	0	115.1	A590 E591	A590-Y594 VanDerWaalsContact O-CD2 3.28Å; A590-Y594 WeakPolarHBondContact O-CD2 3.06Å; A590-Y594 PolarHBondContact O-N 3.41Å; E591-Y594 PolarHBondContact O-N 3.02Å; E591-Y594 VanDerWaalsContact O-N 3.16Å
595	R	78.5	Confident	87.3	Confident	83 Å²	83	51.9 Å²	51.9	31%	0.313	27%	0.267	S	S	.	.			trans	-116	116	-172.6	-174.3	-169.6	-178.6	106	15.9	111.7	E591	E591-R595 HydrophobicContact CB-CB 4.25Å; E591-R595 WeakPolarHBondContact O-CA 3.24Å; E591-R595 WeakPolarHBondContact O-CB 3.34Å; E591-R595 PolarHBondContact O-N 3.17Å; E591-R595 WeakPolarHBondContact OE1-CD 3.42Å; E591-R595 IonicContact OE1-CZ 3.63Å; E591-R595 IonicContact OE1-NE 3.82Å; E591-R595 IonicContact OE1-NH1 2.71Å; E591-R595 PolarHBondContact OE1-NH1 2.85Å
596	D	78.4	Confident	87.1	Confident	136 Å²	136	51.5 Å²	51.5	73%	0.727	27%	0.266	S	S	*	.	S	Bend	trans	-106.7	140.8	159.4	-67.7	-57.8	0	0	0	109.9
597	P	82.3	Confident	87.1	Confident	90 Å²	90	54.3 Å²	54.3	58%	0.584	28%	0.275	S	S	*	.	S	Bend	cis	-71.1	152.9	-6.9	31.7	-36.2	0	0	0	112.6	I599	P597-I599 HydrophobicContact CB-CG2 4.19Å; P597-I599 HydrophobicContact CG-CG2 4.05Å; P597-I599 PolarHBondContact O-N 2.99Å
598	K	83.1	Confident	86.9	Confident	107 Å²	107	58.7 Å²	58.7	47%	0.465	29%	0.294	S	S	.	.			trans	-75.2	87.4	178.8	-66.1	-171.5	179.5	-170.9	0	111.5	D603	K598-D603 HydrophobicContact CB-CB 4.47Å
599	I	89	Confident	86.8	Confident	73 Å²	73	60.8 Å²	60.8	37%	0.374	31%	0.307	S	S	.	.			trans	-119.6	10.9	-175.2	61.9	163.4	0	0	0	113.4	P597 D603 N649 T650	P597-I599 HydrophobicContact CB-CG2 4.19Å; P597-I599 HydrophobicContact CG-CG2 4.05Å; P597-I599 PolarHBondContact O-N 2.99Å; I599-D603 PolarHBondContact N-OD2 3.37Å; I599-N649 VanDerWaalsContact O-CB 3.31Å; I599-N649 WeakPolarHBondContact O-CB 3.46Å; I599-N649 PolarHBondContact O-ND2 2.95Å; I599-N649 VanDerWaalsContact O-ND2 3.1Å; I599-T650 HydrophobicContact CG1-CG2 4.37Å
600	G	90.7	Very high	86.8	Confident	3 Å²	3	66.7 Å²	66.7	3%	0.031	33%	0.333	C	S	.	.	S	Bend	trans	-72.3	166.6	-176.1	0	0	0	0	0	112.8	L602 D603 T604 E653	G600-L602 PolarHBondContact O-N 2.93Å; G600-L602 VanDerWaalsContact O-N 3.14Å; G600-D603 PolarHBondContact N-OD2 3.3Å; G600-D603 WeakPolarHBondContact O-CB 3.41Å; G600-D603 PolarHBondContact O-N 3.22Å; G600-T604 PolarHBondContact O-N 2.84Å; G600-T604 PolarHBondContact O-OG1 3.2Å; G600-T604 VanDerWaalsContact O-OG1 3.13Å; G600-E653 WeakPolarHBondContact CA-OE1 3.32Å
601	W	93.7	Very high	86.8	Confident	4 Å²	4	68.8 Å²	68.8	2%	0.015	34%	0.335	C	S	.	.	H	α-helix	trans	-55.9	-32.1	175.2	82	-99.8	0	0	0	111.9	W584 Y585 T604 L605 T629 A630 V646 E653	W584-W601 AromaticContact CD1-CE2 3.5Å; W584-W601 VanDerWaalsContact CD1-CE2 3.5Å; W584-W601 AromaticContact CD1-CZ2 3.48Å; W584-W601 VanDerWaalsContact CD1-CZ2 3.48Å; W584-W601 AromaticContact CD1-NE1 3.71Å; W584-W601 AromaticContact CD2-NE1 3.78Å; W584-W601 AromaticContact CE2-CD1 3.42Å; W584-W601 VanDerWaalsContact CE2-CD1 3.42Å; W584-W601 AromaticContact CE2-CD2 3.8Å; W584-W601 AromaticContact CE2-CE2 3.74Å; W584-W601 AromaticContact CE2-CG 3.62Å; W584-W601 AromaticContact CE2-NE1 3.47Å; W584-W601 HydrophobicContact CG-CZ2 4.37Å; W584-W601 AromaticContact CG-NE1 3.98Å; W584-W601 HydrophobicContact CH2-CB 4.35Å; W584-W601 AromaticContact CH2-CD1 3.98Å; W584-W601 HydrophobicContact CH2-CG 4.29Å; W584-W601 HydrophobicContact CZ2-CB 3.64Å; W584-W601 AromaticContact CZ2-CD1 3.41Å; W584-W601 VanDerWaalsContact CZ2-CD1 3.41Å; W584-W601 HydrophobicContact CZ2-CD2 4.06Å; W584-W601 AromaticContact CZ2-CG 3.43Å; W584-W601 HydrophobicContact CZ2-CG 3.43Å; W584-W601 VanDerWaalsContact CZ2-CG 3.43Å; W584-W601 AromaticContact CZ2-NE1 3.98Å; W584-W601 AromaticContact NE1-CD1 3.71Å; W584-W601 AromaticContact NE1-CD2 3.32Å; W584-W601 VanDerWaalsContact NE1-CD2 3.32Å; W584-W601 AromaticContact NE1-CE2 3.17Å; W584-W601 AromaticContact NE1-CE3 3.82Å; W584-W601 AromaticContact NE1-CG 3.68Å; W584-W601 AromaticContact NE1-CZ2 3.57Å; W584-W601 AromaticContact NE1-NE1 3.39Å; W584-W601 PolarHBondContact O-NE1 2.74Å; W584-W601 VanDerWaalsContact O-NE1 3.08Å; Y585-W601 HydrophobicContact CD2-CZ2 4.25Å; W601-T604 PolarHBondContact O-N 3.33Å; W601-L605 HydrophobicContact CE3-CB 4.49Å; W601-L605 HydrophobicContact CZ3-CD2 3.9Å; W601-L605 WeakPolarHBondContact O-CB 3.45Å; W601-L605 PolarHBondContact O-N 3.07Å; W601-T629 HydrophobicContact CE3-CG2 4.37Å; W601-T629 HydrophobicContact CZ3-CG2 3.77Å; W601-A630 HydrophobicContact CH2-CB 3.95Å; W601-A630 HydrophobicContact CZ2-CB 4.25Å; W601-V646 HydrophobicContact CB-CG1 4.35Å; W601-V646 HydrophobicContact CE3-CG1 4.12Å; W601-E653 VanDerWaalsContact CD1-OE1 3.26Å; W601-E653 PolarHBondContact N-OE1 2.98Å
602	L	91.6	Very high	86.6	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-73.7	-30	-180	-174.6	60.1	0	0	0	112.8	Y585 H592 G600 A606 Y613 K626	Y585-L602 HydrophobicContact CE2-CD2 4.32Å; H592-L602 HydrophobicContact CB-CD2 4.16Å; G600-L602 PolarHBondContact O-N 2.93Å; G600-L602 VanDerWaalsContact O-N 3.14Å; L602-A606 PolarHBondContact O-N 2.92Å; L602-Y613 WeakPolarHBondContact CD1-OH 3.2Å; L602-Y613 HydrophobicContact CG-CE2 4.43Å; L602-Y613 VanDerWaalsContact CG-OH 3.31Å; L602-Y613 WeakPolarHBondContact CG-OH 3.27Å; L602-K626 HydrophobicContact CD1-CD 4.37Å; L602-K626 HydrophobicContact CD1-CG 3.96Å
603	D	89.5	Confident	86.5	Confident	15 Å²	15	75.3 Å²	75.3	8%	0.08	36%	0.359	C	S	.	.	H	α-helix	trans	-76.9	-41.7	172.4	-53.4	-55.7	0	0	0	110.2	H592 K598 I599 G600 L605 A606 I607	H592-D603 IonicContact CE1-OD1 2.66Å; H592-D603 IonicContact CG-OD1 3.84Å; H592-D603 IonicContact ND1-OD1 2.85Å; H592-D603 PolarHBondContact ND1-OD1 3.37Å; K598-D603 HydrophobicContact CB-CB 4.47Å; I599-D603 PolarHBondContact N-OD2 3.37Å; G600-D603 PolarHBondContact N-OD2 3.3Å; G600-D603 WeakPolarHBondContact O-CB 3.41Å; G600-D603 PolarHBondContact O-N 3.22Å; D603-L605 VanDerWaalsContact C-N 3.3Å; D603-L605 PolarHBondContact O-N 3.31Å; D603-A606 WeakPolarHBondContact O-CB 3.47Å; D603-A606 PolarHBondContact O-N 3.16Å; D603-A606 VanDerWaalsContact O-N 3.14Å; D603-I607 WeakPolarHBondContact O-CG1 3.47Å; D603-I607 PolarHBondContact O-N 3.36Å; D603-I607 VanDerWaalsContact O-N 3.11Å
604	T	91.2	Very high	86.3	Confident	34 Å²	34	74.1 Å²	74.1	21%	0.209	36%	0.356	C	S	.	.	H	α-helix	trans	-59.5	-40.7	172.9	-53.8	0	0	0	0	111.3	G600 W601 I607 H608 N649	G600-T604 PolarHBondContact O-N 2.84Å; G600-T604 PolarHBondContact O-OG1 3.2Å; G600-T604 VanDerWaalsContact O-OG1 3.13Å; W601-T604 PolarHBondContact O-N 3.33Å; T604-I607 PolarHBondContact O-N 3.49Å; T604-H608 PolarHBondContact O-N 3.44Å; T604-N649 PolarHBondContact OG1-ND2 3.31Å
605	L	92	Very high	86	Confident	14 Å²	14	73.1 Å²	73.1	7%	0.073	36%	0.364	C	S	.	.	H	α-helix	trans	-62	-42.8	173.4	177.5	62.5	0	0	0	112.3	W601 D603 I607 H608 T609 P621 T625 T629	W601-L605 HydrophobicContact CE3-CB 4.49Å; W601-L605 HydrophobicContact CZ3-CD2 3.9Å; W601-L605 WeakPolarHBondContact O-CB 3.45Å; W601-L605 PolarHBondContact O-N 3.07Å; D603-L605 VanDerWaalsContact C-N 3.3Å; D603-L605 PolarHBondContact O-N 3.31Å; L605-I607 VanDerWaalsContact C-N 3.26Å; L605-I607 PolarHBondContact O-N 2.84Å; L605-H608 PolarHBondContact O-N 3.39Å; L605-T609 HydrophobicContact CD1-CG2 3.68Å; L605-T609 HydrophobicContact CG-CG2 4.43Å; L605-T609 WeakPolarHBondContact O-CB 3.43Å; L605-T609 PolarHBondContact O-N 3.27Å; L605-T609 PolarHBondContact O-OG1 3.28Å; L605-P621 HydrophobicContact CD2-CB 4.39Å; L605-P621 HydrophobicContact CD2-CG 3.99Å; L605-P621 HydrophobicContact CG-CB 4.44Å; L605-P621 HydrophobicContact CG-CG 4.04Å; L605-T625 HydrophobicContact CD1-CG2 4.36Å; L605-T625 HydrophobicContact CD2-CG2 4.38Å; L605-T629 HydrophobicContact CD1-CG2 3.98Å; L605-T629 HydrophobicContact CD2-CG2 4.1Å
606	A	89.7	Confident	85.7	Confident	4 Å²	4	75.9 Å²	75.9	3%	0.033	38%	0.381	C	S	.	.	H	α-helix	trans	-59.9	-38.7	178.2	0	0	0	0	0	111.6	L602 D603 E610 Q611 Y613 P621	L602-A606 PolarHBondContact O-N 2.92Å; D603-A606 WeakPolarHBondContact O-CB 3.47Å; D603-A606 PolarHBondContact O-N 3.16Å; D603-A606 VanDerWaalsContact O-N 3.14Å; A606-E610 PolarHBondContact O-N 2.82Å; A606-Q611 WeakPolarHBondContact CB-O 3.34Å; A606-Q611 CarbonylContact O-C 3.53Å; A606-Q611 PolarHBondContact O-N 2.85Å; A606-Y613 HydrophobicContact CB-CD2 3.79Å; A606-Y613 HydrophobicContact CB-CE2 3.75Å; A606-P621 HydrophobicContact CB-CG 4.35Å
607	I	89	Confident	85.1	Confident	98 Å²	98	73 Å²	73	50%	0.503	37%	0.37	S	S	.	.	H	α-helix	trans	-66.9	-50.5	173	-61.7	163	0	0	0	110.9	D603 T604 L605 T609 E610 Y612	D603-I607 WeakPolarHBondContact O-CG1 3.47Å; D603-I607 PolarHBondContact O-N 3.36Å; D603-I607 VanDerWaalsContact O-N 3.11Å; T604-I607 PolarHBondContact O-N 3.49Å; L605-I607 VanDerWaalsContact C-N 3.26Å; L605-I607 PolarHBondContact O-N 2.84Å; I607-T609 PolarHBondContact O-N 3.19Å; I607-E610 PolarHBondContact O-N 2.86Å; I607-Y612 HydrophobicContact CB-CE1 4.36Å; I607-Y612 HydrophobicContact CG1-CD1 4.46Å; I607-Y612 HydrophobicContact CG1-CE1 4.07Å
608	H	89	Confident	84.4	Confident	127 Å²	127	74.4 Å²	74.4	59%	0.588	37%	0.372	S	S	*	.	H	α-helix	trans	-66	-15.4	-178.1	-71.3	179.8	0	0	0	114.8	T604 L605	T604-H608 PolarHBondContact O-N 3.44Å; L605-H608 PolarHBondContact O-N 3.39Å
609	T	89	Confident	84.2	Confident	47 Å²	47	70.6 Å²	70.6	29%	0.288	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	5.5	178.8	53.3	0	0	0	0	113.3	L605 I607 Q611 T625	L605-T609 HydrophobicContact CD1-CG2 3.68Å; L605-T609 HydrophobicContact CG-CG2 4.43Å; L605-T609 WeakPolarHBondContact O-CB 3.43Å; L605-T609 PolarHBondContact O-N 3.27Å; L605-T609 PolarHBondContact O-OG1 3.28Å; I607-T609 PolarHBondContact O-N 3.19Å; T609-Q611 WeakPolarHBondContact O-CG 3.4Å; T609-Q611 PolarHBondContact O-N 2.82Å; T609-T625 HydrophobicContact CG2-CG2 4.15Å
610	E	87	Confident	83.9	Confident	160 Å²	160	67.8 Å²	67.8	75%	0.748	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	14	-175.1	-56.5	179.3	175.5	0	0	113.9	A606 I607 Y612	A606-E610 PolarHBondContact O-N 2.82Å; I607-E610 PolarHBondContact O-N 2.86Å; E610-Y612 HydrophobicContact CB-CE2 4.42Å; E610-Y612 WeakPolarHBondContact O-CD2 3.4Å; E610-Y612 PolarHBondContact O-N 2.66Å
611	Q	86	Confident	83.8	Confident	86 Å²	86	67.8 Å²	67.8	40%	0.402	35%	0.347	S	S	.	.			trans	-101.8	68.9	-179.2	-72.3	178.8	-8.8	0	0	109.4	A606 T609 G620 P621	A606-Q611 WeakPolarHBondContact CB-O 3.34Å; A606-Q611 CarbonylContact O-C 3.53Å; A606-Q611 PolarHBondContact O-N 2.85Å; T609-Q611 WeakPolarHBondContact O-CG 3.4Å; T609-Q611 PolarHBondContact O-N 2.82Å; Q611-G620 CarbonylContact O-C 3.35Å; Q611-G620 WeakPolarHBondContact O-CA 3.49Å; Q611-P621 HydrophobicContact CB-CB 4.18Å; Q611-P621 WeakPolarHBondContact O-CD 3.47Å; Q611-P621 VanDerWaalsContact OE1-CA 3.24Å
612	Y	84.2	Confident	83.4	Confident	135 Å²	135	71.8 Å²	71.8	53%	0.529	37%	0.369	S	S	.	.			trans	-64.1	152.6	-177.1	-57.2	-80.9	0	0	0	113.4	I607 E610 G620	I607-Y612 HydrophobicContact CB-CE1 4.36Å; I607-Y612 HydrophobicContact CG1-CD1 4.46Å; I607-Y612 HydrophobicContact CG1-CE1 4.07Å; E610-Y612 HydrophobicContact CB-CE2 4.42Å; E610-Y612 WeakPolarHBondContact O-CD2 3.4Å; E610-Y612 PolarHBondContact O-N 2.66Å; Y612-G620 PolarHBondContact O-N 3.33Å; Y612-G620 VanDerWaalsContact O-N 3.14Å
613	Y	82.7	Confident	83.1	Confident	61 Å²	61	74.2 Å²	74.2	24%	0.239	38%	0.382	C	S	.	.			trans	-78.4	129.5	169.1	-71.3	-79	0	0	0	110.5	H592 L602 A606 K626	H592-Y613 AromaticContact CE1-CD1 3.65Å; H592-Y613 AromaticContact CE1-CD2 3.33Å; H592-Y613 WeakPolarHBondContact CE1-CD2 3.47Å; H592-Y613 AromaticContact CE1-CE1 3.86Å; H592-Y613 AromaticContact CE1-CE2 3.55Å; H592-Y613 AromaticContact CE1-CG 3.38Å; H592-Y613 AromaticContact CE1-CZ 3.82Å; H592-Y613 AromaticContact ND1-CD2 3.92Å; H592-Y613 AromaticContact ND1-CE2 3.79Å; H592-Y613 AromaticContact NE2-CD1 3.67Å; H592-Y613 AromaticContact NE2-CE1 3.8Å; H592-Y613 AromaticContact NE2-CG 3.87Å; L602-Y613 WeakPolarHBondContact CD1-OH 3.2Å; L602-Y613 HydrophobicContact CG-CE2 4.43Å; L602-Y613 VanDerWaalsContact CG-OH 3.31Å; L602-Y613 WeakPolarHBondContact CG-OH 3.27Å; A606-Y613 HydrophobicContact CB-CD2 3.79Å; A606-Y613 HydrophobicContact CB-CE2 3.75Å; Y613-K626 WeakPolarHBondContact OH-CE 3.13Å; Y613-K626 PolarHBondContact OH-NZ 3.32Å
614	T	77.6	Confident	83.1	Confident	82 Å²	82	80.4 Å²	80.4	50%	0.503	41%	0.408	S	S	.	.			trans	-127.7	171.2	174.6	66.5	0	0	0	0	109.1	Q616 S619	T614-Q616 PolarHBondContact O-N 3.37Å; T614-S619 VanDerWaalsContact N-CB 3.26Å; T614-S619 PolarHBondContact N-OG 2.86Å; T614-S619 WeakPolarHBondContact O-CB 3.46Å; T614-S619 PolarHBondContact O-OG 3.18Å; T614-S619 VanDerWaalsContact OG1-CB 3.28Å; T614-S619 WeakPolarHBondContact OG1-CB 3.42Å
615	D	71.5	Confident	83.2	Confident	175 Å²	175	80.8 Å²	80.8	94%	0.936	41%	0.41	S	S	*	.	S	Bend	trans	-64	-9.2	-177.7	-53.4	-60.8	0	0	0	114.5
616	Q	72.2	Confident	83.2	Confident	142 Å²	142	81.4 Å²	81.4	66%	0.664	41%	0.412	S	S	*	.	S	Bend	trans	-69.4	137.9	174.1	-66.1	-166.4	0.4	0	0	111.5	T614 N618 S619	T614-Q616 PolarHBondContact O-N 3.37Å; Q616-N618 PolarHBondContact O-N 2.8Å; Q616-S619 WeakPolarHBondContact O-CB 3.44Å; Q616-S619 PolarHBondContact O-N 2.79Å; Q616-S619 VanDerWaalsContact O-N 3.11Å; Q616-S619 PolarHBondContact O-OG 3.47Å; Q616-S619 VanDerWaalsContact O-OG 3.09Å
617	P	66.3	Low	83.3	Confident	76 Å²	76	83.8 Å²	83.8	49%	0.494	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14	-173.8	25.7	-35.2	0	0	0	114.9	K406	K406-P617 HydrophobicContact CD-CB 4.02Å; K406-P617 PolarHBondContact NZ-O 2.6Å
618	N	68.6	Low	83.6	Confident	119 Å²	119	83.3 Å²	83.3	64%	0.636	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	17.7	179.8	-67.6	0.9	0	0	0	112.9	Q616	Q616-N618 PolarHBondContact O-N 2.8Å
619	S	77	Confident	83.9	Confident	27 Å²	27	78.3 Å²	78.3	19%	0.189	40%	0.397	C	S	.	.			trans	-76.3	172	179.3	72.6	0	0	0	0	113.8	T614 Q616	T614-S619 VanDerWaalsContact N-CB 3.26Å; T614-S619 PolarHBondContact N-OG 2.86Å; T614-S619 WeakPolarHBondContact O-CB 3.46Å; T614-S619 PolarHBondContact O-OG 3.18Å; T614-S619 VanDerWaalsContact OG1-CB 3.28Å; T614-S619 WeakPolarHBondContact OG1-CB 3.42Å; Q616-S619 WeakPolarHBondContact O-CB 3.44Å; Q616-S619 PolarHBondContact O-N 2.79Å; Q616-S619 VanDerWaalsContact O-N 3.11Å; Q616-S619 PolarHBondContact O-OG 3.47Å; Q616-S619 VanDerWaalsContact O-OG 3.09Å
620	G	84.3	Confident	84.2	Confident	14 Å²	14	76 Å²	76	14%	0.144	38%	0.383	C	S	.	.	S	Bend	trans	82.2	-177.4	-173.2	0	0	0	0	0	113.7	Q611 Y612	Q611-G620 CarbonylContact O-C 3.35Å; Q611-G620 WeakPolarHBondContact O-CA 3.49Å; Y612-G620 PolarHBondContact O-N 3.33Å; Y612-G620 VanDerWaalsContact O-N 3.14Å
621	P	87.5	Confident	84.5	Confident	2 Å²	2	70 Å²	70	1%	0.013	36%	0.356	C	S	.	.	S	Bend	trans	-69.3	153.4	-174.5	19.6	-26.4	0	0	0	113.8	L605 A606 Q611 T625 K626	L605-P621 HydrophobicContact CD2-CB 4.39Å; L605-P621 HydrophobicContact CD2-CG 3.99Å; L605-P621 HydrophobicContact CG-CB 4.44Å; L605-P621 HydrophobicContact CG-CG 4.04Å; A606-P621 HydrophobicContact CB-CG 4.35Å; Q611-P621 HydrophobicContact CB-CB 4.18Å; Q611-P621 WeakPolarHBondContact O-CD 3.47Å; Q611-P621 VanDerWaalsContact OE1-CA 3.24Å; P621-T625 HydrophobicContact CB-CG2 4.43Å; P621-K626 HydrophobicContact CG-CG 4.24Å; P621-K626 VanDerWaalsContact O-CD 3.28Å; P621-K626 WeakPolarHBondContact O-CD 3.45Å; P621-K626 WeakPolarHBondContact O-CE 3.43Å; P621-K626 PolarHBondContact O-NZ 2.98Å
622	D	85.9	Confident	85	Confident	88 Å²	88	69.7 Å²	69.7	47%	0.471	35%	0.352	S	S	.	.			trans	-59.1	153.1	-179.8	177.5	48.4	0	0	0	113.3	K624 T625 K626	D622-K624 VanDerWaalsContact C-N 3.3Å; D622-K624 PolarHBondContact O-N 3.11Å; D622-K624 WeakPolarHBondContact OD2-CB 3.47Å; D622-K624 PolarHBondContact OD2-N 3.04Å; D622-T625 WeakPolarHBondContact O-CB 3.43Å; D622-T625 PolarHBondContact O-N 2.71Å; D622-T625 VanDerWaalsContact O-N 3.14Å; D622-K626 WeakPolarHBondContact O-CG 3.26Å; D622-K626 PolarHBondContact O-N 3.38Å
623	L	85.6	Confident	85.5	Confident	53 Å²	53	63.6 Å²	63.6	28%	0.277	33%	0.328	S	S	.	.	H	α-helix	trans	-56.4	-40.4	176.2	171.3	57.7	0	0	0	112.4	F399 T625 K626 Y627	F399-L623 HydrophobicContact CB-CD1 3.81Å; F399-L623 HydrophobicContact CD1-CD1 3.46Å; F399-L623 VanDerWaalsContact CD1-CD1 3.46Å; F399-L623 HydrophobicContact CE1-CD1 4.42Å; F399-L623 HydrophobicContact CG-CD1 4.02Å; L623-T625 VanDerWaalsContact C-N 3.34Å; L623-K626 PolarHBondContact O-N 3.27Å; L623-Y627 PolarHBondContact O-N 3.08Å
624	K	89.6	Confident	86	Confident	145 Å²	145	60.7 Å²	60.7	63%	0.63	32%	0.316	S	S	*	.	H	α-helix	trans	-62.5	-44.2	176.6	-172.7	-174.4	173.2	-173.3	0	110.7	D622 Y627 I628	D622-K624 VanDerWaalsContact C-N 3.3Å; D622-K624 PolarHBondContact O-N 3.11Å; D622-K624 WeakPolarHBondContact OD2-CB 3.47Å; D622-K624 PolarHBondContact OD2-N 3.04Å; K624-Y627 PolarHBondContact O-N 3.19Å; K624-I628 HydrophobicContact CD-CD1 4.5Å; K624-I628 HydrophobicContact CG-CD1 3.79Å; K624-I628 WeakPolarHBondContact O-CB 3.45Å; K624-I628 VanDerWaalsContact O-CG1 3.28Å; K624-I628 WeakPolarHBondContact O-CG1 3.36Å; K624-I628 PolarHBondContact O-N 2.79Å
625	T	92	Very high	86.8	Confident	42 Å²	42	60 Å²	60	26%	0.258	31%	0.306	S	S	.	.	H	α-helix	trans	-62.7	-50.1	176.8	-50.8	0	0	0	0	110.9	L605 T609 P621 D622 L623 Y627 I628 T629	L605-T625 HydrophobicContact CD1-CG2 4.36Å; L605-T625 HydrophobicContact CD2-CG2 4.38Å; T609-T625 HydrophobicContact CG2-CG2 4.15Å; P621-T625 HydrophobicContact CB-CG2 4.43Å; D622-T625 WeakPolarHBondContact O-CB 3.43Å; D622-T625 PolarHBondContact O-N 2.71Å; D622-T625 VanDerWaalsContact O-N 3.14Å; L623-T625 VanDerWaalsContact C-N 3.34Å; T625-Y627 VanDerWaalsContact C-N 3.32Å; T625-Y627 PolarHBondContact O-N 2.9Å; T625-I628 PolarHBondContact O-N 3.45Å; T625-T629 WeakPolarHBondContact O-CB 3.48Å; T625-T629 PolarHBondContact O-N 3.46Å; T625-T629 PolarHBondContact O-OG1 3.26Å; T625-T629 VanDerWaalsContact O-OG1 3.09Å
626	K	91.7	Very high	87.9	Confident	26 Å²	26	52 Å²	52	11%	0.113	26%	0.264	C	S	.	.	H	α-helix	trans	-53.5	-45.8	176.5	-75.5	165.6	167.5	147.9	0	112.2	Y585 L602 Y613 P621 D622 L623 A630	Y585-K626 HydrophobicContact CD2-CB 4.49Å; Y585-K626 HydrophobicContact CE2-CB 4.3Å; Y585-K626 HydrophobicContact CE2-CD 4.22Å; Y585-K626 HydrophobicContact CE2-CG 4.44Å; L602-K626 HydrophobicContact CD1-CD 4.37Å; L602-K626 HydrophobicContact CD1-CG 3.96Å; Y613-K626 WeakPolarHBondContact OH-CE 3.13Å; Y613-K626 PolarHBondContact OH-NZ 3.32Å; P621-K626 HydrophobicContact CG-CG 4.24Å; P621-K626 VanDerWaalsContact O-CD 3.28Å; P621-K626 WeakPolarHBondContact O-CD 3.45Å; P621-K626 WeakPolarHBondContact O-CE 3.43Å; P621-K626 PolarHBondContact O-NZ 2.98Å; D622-K626 WeakPolarHBondContact O-CG 3.26Å; D622-K626 PolarHBondContact O-N 3.38Å; L623-K626 PolarHBondContact O-N 3.27Å; K626-A630 WeakPolarHBondContact O-CB 3.42Å; K626-A630 PolarHBondContact O-N 3.07Å
627	Y	93.6	Very high	88.9	Confident	54 Å²	54	46 Å²	46	21%	0.212	24%	0.238	C	C	.	.	H	α-helix	trans	-68.4	-49	177.5	175.6	-107.7	0	0	0	113	Y395 F399 H578 L623 K624 T625 T629 A630 L631	Y395-Y627 AromaticContact CD2-CD2 3.97Å; Y395-Y627 HydrophobicContact CD2-CD2 3.97Å; Y395-Y627 HydrophobicContact CD2-CE2 4.06Å; Y395-Y627 AromaticContact CE2-CD2 3.91Å; Y395-Y627 HydrophobicContact CE2-CD2 3.91Å; Y395-Y627 HydrophobicContact CE2-CE2 4.35Å; Y395-Y627 HydrophobicContact CE2-CG 4.07Å; F399-Y627 HydrophobicContact CE1-CD2 4.31Å; F399-Y627 AromaticContact CE2-CD2 3.83Å; F399-Y627 HydrophobicContact CE2-CD2 3.83Å; F399-Y627 HydrophobicContact CE2-CE2 4.49Å; F399-Y627 AromaticContact CZ-CD2 3.68Å; F399-Y627 HydrophobicContact CZ-CD2 3.68Å; F399-Y627 HydrophobicContact CZ-CG 4.44Å; H578-Y627 AromaticContact CE1-CE2 3.78Å; H578-Y627 AromaticContact ND1-CE2 3.62Å; H578-Y627 AromaticContact ND1-CZ 3.71Å; H578-Y627 PolarHBondContact ND1-OH 3.39Å; L623-Y627 PolarHBondContact O-N 3.08Å; K624-Y627 PolarHBondContact O-N 3.19Å; T625-Y627 VanDerWaalsContact C-N 3.32Å; T625-Y627 PolarHBondContact O-N 2.9Å; Y627-T629 PolarHBondContact O-N 3.05Å; Y627-A630 PolarHBondContact O-N 2.88Å; Y627-L631 HydrophobicContact CE1-CD2 4.11Å; Y627-L631 WeakPolarHBondContact O-CB 3.02Å; Y627-L631 PolarHBondContact O-N 3.27Å
628	I	94.7	Very high	90.2	Very high	88 Å²	88	42.4 Å²	42.4	45%	0.451	21%	0.214	S	C	.	.	H	α-helix	trans	-63.1	-42.8	-178	-69.8	173.3	0	0	0	110.9	K624 T625 L631 Y632	K624-I628 HydrophobicContact CD-CD1 4.5Å; K624-I628 HydrophobicContact CG-CD1 3.79Å; K624-I628 WeakPolarHBondContact O-CB 3.45Å; K624-I628 VanDerWaalsContact O-CG1 3.28Å; K624-I628 WeakPolarHBondContact O-CG1 3.36Å; K624-I628 PolarHBondContact O-N 2.79Å; T625-I628 PolarHBondContact O-N 3.45Å; I628-L631 PolarHBondContact O-N 2.77Å; I628-Y632 VanDerWaalsContact O-CB 3.26Å; I628-Y632 WeakPolarHBondContact O-CB 3.47Å; I628-Y632 PolarHBondContact O-N 2.9Å
629	T	94.5	Very high	91.3	Very high	22 Å²	22	38.4 Å²	38.4	14%	0.135	19%	0.194	C	C	.	.	H	α-helix	trans	-65.1	-40.9	178	-61.2	0	0	0	0	112	W601 L605 T625 Y627 Y632 F633 V646	W601-T629 HydrophobicContact CE3-CG2 4.37Å; W601-T629 HydrophobicContact CZ3-CG2 3.77Å; L605-T629 HydrophobicContact CD1-CG2 3.98Å; L605-T629 HydrophobicContact CD2-CG2 4.1Å; T625-T629 WeakPolarHBondContact O-CB 3.48Å; T625-T629 PolarHBondContact O-N 3.46Å; T625-T629 PolarHBondContact O-OG1 3.26Å; T625-T629 VanDerWaalsContact O-OG1 3.09Å; Y627-T629 PolarHBondContact O-N 3.05Å; T629-Y632 PolarHBondContact O-N 2.83Å; T629-F633 PolarHBondContact O-N 2.85Å; T629-V646 HydrophobicContact CG2-CG2 3.46Å; T629-V646 VanDerWaalsContact CG2-CG2 3.46Å
630	A	94.7	Very high	92	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.6	-43.6	175.2	0	0	0	0	0	112.1	A581 W601 K626 Y627 F633 T634	A581-A630 HydrophobicContact CB-CB 4.26Å; W601-A630 HydrophobicContact CH2-CB 3.95Å; W601-A630 HydrophobicContact CZ2-CB 4.25Å; K626-A630 WeakPolarHBondContact O-CB 3.42Å; K626-A630 PolarHBondContact O-N 3.07Å; Y627-A630 PolarHBondContact O-N 2.88Å; A630-F633 PolarHBondContact O-N 3.19Å; A630-T634 PolarHBondContact O-N 3.2Å; A630-T634 VanDerWaalsContact O-N 3.14Å; A630-T634 PolarHBondContact O-OG1 2.95Å; A630-T634 VanDerWaalsContact O-OG1 3.12Å
631	L	94.8	Very high	92.4	Very high	34 Å²	34	45.9 Å²	45.9	18%	0.178	24%	0.236	C	C	.	.	H	α-helix	trans	-67.3	-40.2	178.5	-169.8	66.9	0	0	0	112.2	H578 A581 Y627 I628 T634 F635	H578-L631 HydrophobicContact CB-CD1 4.38Å; A581-L631 HydrophobicContact CB-CB 4.17Å; A581-L631 HydrophobicContact CB-CD1 3.91Å; Y627-L631 HydrophobicContact CE1-CD2 4.11Å; Y627-L631 WeakPolarHBondContact O-CB 3.02Å; Y627-L631 PolarHBondContact O-N 3.27Å; I628-L631 PolarHBondContact O-N 2.77Å; L631-T634 PolarHBondContact O-OG1 3.34Å; L631-F635 HydrophobicContact CD1-CD2 4.08Å; L631-F635 HydrophobicContact CD1-CE2 3.73Å; L631-F635 HydrophobicContact CD2-CE2 4.14Å; L631-F635 HydrophobicContact CG-CD2 3.81Å; L631-F635 HydrophobicContact CG-CE2 3.7Å; L631-F635 WeakPolarHBondContact O-CB 3.28Å; L631-F635 VanDerWaalsContact O-CD2 3.32Å; L631-F635 WeakPolarHBondContact O-CD2 3.44Å; L631-F635 PolarHBondContact O-N 3.46Å
632	Y	95.2	Very high	92.5	Very high	79 Å²	79	48.3 Å²	48.3	31%	0.31	26%	0.261	S	S	.	.	H	α-helix	trans	-60.7	-47.9	174.1	165.4	-102.5	0	0	0	112.1	I628 T629 F635 S636 F643 N645 V646	I628-Y632 VanDerWaalsContact O-CB 3.26Å; I628-Y632 WeakPolarHBondContact O-CB 3.47Å; I628-Y632 PolarHBondContact O-N 2.9Å; T629-Y632 PolarHBondContact O-N 2.83Å; Y632-F635 PolarHBondContact O-N 3.38Å; Y632-S636 WeakPolarHBondContact O-CB 3.08Å; Y632-S636 PolarHBondContact O-N 3.34Å; Y632-S636 PolarHBondContact O-OG 3.38Å; Y632-F643 AromaticContact CE2-CD2 3.68Å; Y632-F643 HydrophobicContact CE2-CD2 3.68Å; Y632-F643 AromaticContact CE2-CE2 3.9Å; Y632-F643 HydrophobicContact CE2-CE2 3.9Å; Y632-F643 AromaticContact CZ-CD2 3.66Å; Y632-F643 VanDerWaalsContact OH-CB 3.24Å; Y632-F643 WeakPolarHBondContact OH-CB 3.34Å; Y632-F643 VanDerWaalsContact OH-CD2 3.25Å; Y632-F643 WeakPolarHBondContact OH-CD2 3.46Å; Y632-F643 WeakPolarHBondContact OH-CG 3.26Å; Y632-N645 HydrophobicContact CE1-CB 4.25Å; Y632-N645 PolarHBondContact OH-ND2 2.98Å; Y632-V646 HydrophobicContact CD1-CG2 4.29Å; Y632-V646 HydrophobicContact CE1-CG2 4.37Å
633	F	94.8	Very high	92.8	Very high	6 Å²	6	49.6 Å²	49.6	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-55.2	-56.2	175.6	172.6	-107.7	0	0	0	110.4	W584 T629 A630 F635 S636 S637 V646	W584-F633 AromaticContact CD1-CD1 3.89Å; W584-F633 AromaticContact CD2-CD1 3.6Å; W584-F633 HydrophobicContact CD2-CD1 3.6Å; W584-F633 AromaticContact CD2-CE1 3.6Å; W584-F633 HydrophobicContact CD2-CE1 3.6Å; W584-F633 AromaticContact CE2-CD1 3.35Å; W584-F633 AromaticContact CE2-CE1 3.53Å; W584-F633 AromaticContact CE2-CG 3.97Å; W584-F633 HydrophobicContact CE3-CD1 4.21Å; W584-F633 AromaticContact CE3-CE1 3.71Å; W584-F633 HydrophobicContact CE3-CE1 3.71Å; W584-F633 AromaticContact CG-CD1 3.91Å; W584-F633 HydrophobicContact CG-CD1 3.91Å; W584-F633 HydrophobicContact CG-CE1 4.31Å; W584-F633 HydrophobicContact CH2-CD1 4.28Å; W584-F633 AromaticContact CH2-CE1 3.63Å; W584-F633 HydrophobicContact CH2-CE1 3.63Å; W584-F633 HydrophobicContact CH2-CE2 4.43Å; W584-F633 AromaticContact CH2-CZ 3.72Å; W584-F633 HydrophobicContact CH2-CZ 3.72Å; W584-F633 AromaticContact CZ2-CD1 3.73Å; W584-F633 HydrophobicContact CZ2-CD1 3.73Å; W584-F633 HydrophobicContact CZ2-CD2 4.39Å; W584-F633 AromaticContact CZ2-CE1 3.56Å; W584-F633 HydrophobicContact CZ2-CE1 3.56Å; W584-F633 HydrophobicContact CZ2-CE2 4.24Å; W584-F633 HydrophobicContact CZ2-CG 4.15Å; W584-F633 AromaticContact CZ2-CZ 3.84Å; W584-F633 HydrophobicContact CZ2-CZ 3.84Å; W584-F633 HydrophobicContact CZ3-CD1 4.49Å; W584-F633 AromaticContact CZ3-CE1 3.7Å; W584-F633 HydrophobicContact CZ3-CE1 3.7Å; W584-F633 HydrophobicContact CZ3-CZ 4.09Å; W584-F633 AromaticContact NE1-CD1 3.54Å; W584-F633 AromaticContact NE1-CG 3.93Å; T629-F633 PolarHBondContact O-N 2.85Å; A630-F633 PolarHBondContact O-N 3.19Å; F633-F635 PolarHBondContact O-N 3.42Å; F633-S636 PolarHBondContact O-N 3.42Å; F633-S636 VanDerWaalsContact O-N 3.07Å; F633-S636 PolarHBondContact O-OG 3.16Å; F633-S637 PolarHBondContact O-N 2.84Å; F633-S637 PolarHBondContact O-OG 2.92Å; F633-V646 HydrophobicContact CB-CB 4.21Å; F633-V646 HydrophobicContact CB-CG1 4.03Å; F633-V646 HydrophobicContact CD2-CB 4.03Å; F633-V646 HydrophobicContact CD2-CG1 3.93Å; F633-V646 WeakPolarHBondContact CD2-O 3.41Å; F633-V646 HydrophobicContact CG-CB 4.47Å; F633-V646 HydrophobicContact CG-CG1 4.1Å
634	T	94.9	Very high	92.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.3	-37	-175.9	51.9	0	0	0	0	113.6	A577 L580 A581 W584 A630 L631 S637 L638	A577-T634 PolarHBondContact O-OG1 3.11Å; L580-T634 HydrophobicContact CB-CG2 3.96Å; A581-T634 HydrophobicContact CB-CG2 4.47Å; W584-T634 HydrophobicContact CB-CG2 4.36Å; A630-T634 PolarHBondContact O-N 3.2Å; A630-T634 VanDerWaalsContact O-N 3.14Å; A630-T634 PolarHBondContact O-OG1 2.95Å; A630-T634 VanDerWaalsContact O-OG1 3.12Å; L631-T634 PolarHBondContact O-OG1 3.34Å; T634-S637 PolarHBondContact O-N 3.17Å; T634-L638 WeakPolarHBondContact O-CB 3.32Å; T634-L638 WeakPolarHBondContact O-CG 3.45Å; T634-L638 PolarHBondContact O-N 3Å
635	F	93.9	Very high	92.8	Very high	67 Å²	67	47.5 Å²	47.5	29%	0.294	27%	0.27	S	S	.	.	H	α-helix	trans	-61.6	-46.8	170.8	-88	-59	0	0	0	111.2	F573 A574 A577 L631 Y632 F633 S637 L638 T639	F573-F635 HydrophobicContact CD1-CE1 4.05Å; F573-F635 AromaticContact CE1-CD1 3.8Å; F573-F635 HydrophobicContact CE1-CD1 3.8Å; F573-F635 AromaticContact CE1-CE1 3.67Å; F573-F635 HydrophobicContact CE1-CE1 3.67Å; F573-F635 HydrophobicContact CZ-CD1 4.43Å; A574-F635 HydrophobicContact CB-CZ 4.48Å; A577-F635 HydrophobicContact CB-CD1 3.77Å; A577-F635 HydrophobicContact CB-CD2 4.4Å; A577-F635 HydrophobicContact CB-CE1 3.42Å; A577-F635 VanDerWaalsContact CB-CE1 3.42Å; A577-F635 HydrophobicContact CB-CE2 4.11Å; A577-F635 HydrophobicContact CB-CG 4.24Å; A577-F635 HydrophobicContact CB-CZ 3.61Å; L631-F635 HydrophobicContact CD1-CD2 4.08Å; L631-F635 HydrophobicContact CD1-CE2 3.73Å; L631-F635 HydrophobicContact CD2-CE2 4.14Å; L631-F635 HydrophobicContact CG-CD2 3.81Å; L631-F635 HydrophobicContact CG-CE2 3.7Å; L631-F635 WeakPolarHBondContact O-CB 3.28Å; L631-F635 VanDerWaalsContact O-CD2 3.32Å; L631-F635 WeakPolarHBondContact O-CD2 3.44Å; L631-F635 PolarHBondContact O-N 3.46Å; Y632-F635 PolarHBondContact O-N 3.38Å; F633-F635 PolarHBondContact O-N 3.42Å; F635-S637 VanDerWaalsContact C-N 3.26Å; F635-S637 PolarHBondContact O-N 3.08Å; F635-L638 PolarHBondContact O-N 2.91Å; F635-T639 PolarHBondContact O-N 3.33Å; F635-T639 PolarHBondContact O-OG1 2.95Å
636	S	94.2	Very high	92.8	Very high	8 Å²	8	46.6 Å²	46.6	6%	0.056	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-31.1	-178.7	78.9	0	0	0	0	113.5	Y632 F633 S640 I641 G642	Y632-S636 WeakPolarHBondContact O-CB 3.08Å; Y632-S636 PolarHBondContact O-N 3.34Å; Y632-S636 PolarHBondContact O-OG 3.38Å; F633-S636 PolarHBondContact O-N 3.42Å; F633-S636 VanDerWaalsContact O-N 3.07Å; F633-S636 PolarHBondContact O-OG 3.16Å; S636-S640 PolarHBondContact O-N 3.19Å; S636-I641 PolarHBondContact O-N 3.37Å; S636-G642 PolarHBondContact O-N 2.88Å
637	S	93.7	Very high	92.8	Very high	15 Å²	15	47.6 Å²	47.6	11%	0.105	28%	0.275	C	S	.	.	H	α-helix	trans	-76	-44.3	172.5	-53.3	0	0	0	0	112.3	F633 T634 F635 T639 S640	F633-S637 PolarHBondContact O-N 2.84Å; F633-S637 PolarHBondContact O-OG 2.92Å; T634-S637 PolarHBondContact O-N 3.17Å; F635-S637 VanDerWaalsContact C-N 3.26Å; F635-S637 PolarHBondContact O-N 3.08Å; S637-T639 VanDerWaalsContact C-N 3.34Å; S637-T639 PolarHBondContact O-N 2.89Å; S637-S640 PolarHBondContact O-N 3.18Å; S637-S640 VanDerWaalsContact O-N 3.1Å
638	L	92.5	Very high	92.8	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-66.7	-32.2	-180	-73.1	171.8	0	0	0	113.1	F573 A577 L580 T634 F635 S640 V660 V663 G664	F573-L638 HydrophobicContact CE2-CB 4.09Å; F573-L638 HydrophobicContact CZ-CB 3.96Å; A577-L638 HydrophobicContact CB-CD1 3.58Å; L580-L638 HydrophobicContact CD1-CD1 4.16Å; L580-L638 HydrophobicContact CD1-CD2 3.95Å; L580-L638 HydrophobicContact CD1-CG 4.4Å; T634-L638 WeakPolarHBondContact O-CB 3.32Å; T634-L638 WeakPolarHBondContact O-CG 3.45Å; T634-L638 PolarHBondContact O-N 3Å; F635-L638 PolarHBondContact O-N 2.91Å; L638-S640 VanDerWaalsContact C-N 3.31Å; L638-V660 HydrophobicContact CD2-CG1 4.12Å; L638-V660 HydrophobicContact CG-CG1 4.15Å; L638-V663 HydrophobicContact CD2-CG1 4.36Å; L638-G664 VanDerWaalsContact CD2-CA 3.49Å
639	T	92	Very high	92.7	Very high	35 Å²	35	45 Å²	45	22%	0.215	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	6.1	173.4	64	0	0	0	0	113.1	F573 F635 S637 I641	F573-T639 HydrophobicContact CE1-CG2 4.32Å; F573-T639 HydrophobicContact CZ-CG2 3.81Å; F635-T639 PolarHBondContact O-N 3.33Å; F635-T639 PolarHBondContact O-OG1 2.95Å; S637-T639 VanDerWaalsContact C-N 3.34Å; S637-T639 PolarHBondContact O-N 2.89Å; T639-I641 PolarHBondContact O-N 3.49Å; T639-I641 VanDerWaalsContact OG1-CD1 3.3Å; T639-I641 WeakPolarHBondContact OG1-CD1 3.49Å; T639-I641 WeakPolarHBondContact OG1-CG1 3.43Å
640	S	91.9	Very high	92.6	Very high	99 Å²	99	44 Å²	44	69%	0.692	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	24	-177.6	60.5	0	0	0	0	116.2	S636 S637 L638	S636-S640 PolarHBondContact O-N 3.19Å; S637-S640 PolarHBondContact O-N 3.18Å; S637-S640 VanDerWaalsContact O-N 3.1Å; L638-S640 VanDerWaalsContact C-N 3.31Å
641	I	93.4	Very high	92.6	Very high	100 Å²	100	49.8 Å²	49.8	51%	0.513	29%	0.292	S	S	.	.			trans	-83.2	-40.3	179.5	-62.1	171.9	0	0	0	111.4	S636 T639 F643	S636-I641 PolarHBondContact O-N 3.37Å; T639-I641 PolarHBondContact O-N 3.49Å; T639-I641 VanDerWaalsContact OG1-CD1 3.3Å; T639-I641 WeakPolarHBondContact OG1-CD1 3.49Å; T639-I641 WeakPolarHBondContact OG1-CG1 3.43Å; I641-F643 HydrophobicContact CB-CE2 4.46Å; I641-F643 HydrophobicContact CG2-CD1 3.94Å; I641-F643 HydrophobicContact CG2-CD2 4.03Å; I641-F643 HydrophobicContact CG2-CE1 3.64Å; I641-F643 HydrophobicContact CG2-CE2 3.74Å; I641-F643 HydrophobicContact CG2-CG 4.13Å; I641-F643 HydrophobicContact CG2-CZ 3.54Å; I641-F643 PolarHBondContact O-N 2.94Å
642	G	88.6	Confident	92.4	Very high	52 Å²	52	50.3 Å²	50.3	54%	0.536	30%	0.301	S	S	.	.			trans	57.2	48.3	168.4	0	0	0	0	0	116.4	S636 G644	S636-G642 PolarHBondContact O-N 2.88Å; G642-G644 PolarHBondContact O-N 2.99Å
643	F	92	Very high	92.4	Very high	116 Å²	116	46.6 Å²	46.6	51%	0.509	29%	0.287	S	S	.	.			trans	-53.3	-17.5	-173.6	-67.2	-71.6	0	0	0	117.4	Y632 I641 N645	Y632-F643 AromaticContact CE2-CD2 3.68Å; Y632-F643 HydrophobicContact CE2-CD2 3.68Å; Y632-F643 AromaticContact CE2-CE2 3.9Å; Y632-F643 HydrophobicContact CE2-CE2 3.9Å; Y632-F643 AromaticContact CZ-CD2 3.66Å; Y632-F643 VanDerWaalsContact OH-CB 3.24Å; Y632-F643 WeakPolarHBondContact OH-CB 3.34Å; Y632-F643 VanDerWaalsContact OH-CD2 3.25Å; Y632-F643 WeakPolarHBondContact OH-CD2 3.46Å; Y632-F643 WeakPolarHBondContact OH-CG 3.26Å; I641-F643 HydrophobicContact CB-CE2 4.46Å; I641-F643 HydrophobicContact CG2-CD1 3.94Å; I641-F643 HydrophobicContact CG2-CD2 4.03Å; I641-F643 HydrophobicContact CG2-CE1 3.64Å; I641-F643 HydrophobicContact CG2-CE2 3.74Å; I641-F643 HydrophobicContact CG2-CG 4.13Å; I641-F643 HydrophobicContact CG2-CZ 3.54Å; I641-F643 PolarHBondContact O-N 2.94Å; F643-N645 VanDerWaalsContact C-N 3.25Å; F643-N645 PolarHBondContact O-N 2.67Å; F643-N645 VanDerWaalsContact O-N 3.13Å
644	G	88.1	Confident	92.5	Very high	50 Å²	50	50.8 Å²	50.8	52%	0.515	31%	0.305	S	S	.	.	S	Bend	trans	80	-19.8	176.7	0	0	0	0	0	116.7	G642 V646	G642-G644 PolarHBondContact O-N 2.99Å; G644-V646 PolarHBondContact O-N 3.47Å
645	N	88.5	Confident	92.5	Very high	104 Å²	104	55 Å²	55	56%	0.556	33%	0.331	S	S	*	.	S	Bend	trans	-55.5	-25.1	177.8	-67	-25.6	0	0	0	114.6	Y632 F643	Y632-N645 HydrophobicContact CE1-CB 4.25Å; Y632-N645 PolarHBondContact OH-ND2 2.98Å; F643-N645 VanDerWaalsContact C-N 3.25Å; F643-N645 PolarHBondContact O-N 2.67Å; F643-N645 VanDerWaalsContact O-N 3.13Å
646	V	91.5	Very high	92.6	Very high	23 Å²	23	52.6 Å²	52.6	14%	0.139	32%	0.32	C	S	.	.	S	Bend	trans	-131	126.4	169.3	-175.7	0	0	0	0	105.9	W584 W601 T629 Y632 F633 G644	W584-V646 HydrophobicContact CZ2-CG1 4.25Å; W601-V646 HydrophobicContact CB-CG1 4.35Å; W601-V646 HydrophobicContact CE3-CG1 4.12Å; T629-V646 HydrophobicContact CG2-CG2 3.46Å; T629-V646 VanDerWaalsContact CG2-CG2 3.46Å; Y632-V646 HydrophobicContact CD1-CG2 4.29Å; Y632-V646 HydrophobicContact CE1-CG2 4.37Å; F633-V646 HydrophobicContact CB-CB 4.21Å; F633-V646 HydrophobicContact CB-CG1 4.03Å; F633-V646 HydrophobicContact CD2-CB 4.03Å; F633-V646 HydrophobicContact CD2-CG1 3.93Å; F633-V646 WeakPolarHBondContact CD2-O 3.41Å; F633-V646 HydrophobicContact CG-CB 4.47Å; F633-V646 HydrophobicContact CG-CG1 4.1Å; G644-V646 PolarHBondContact O-N 3.47Å
647	S	91.1	Very high	92.6	Very high	46 Å²	46	52.8 Å²	52.8	32%	0.322	32%	0.321	S	S	.	.			trans	-136.5	152.2	-173.1	53.1	0	0	0	0	111.1	N649	S647-N649 PolarHBondContact O-N 3.4Å
648	P	93.8	Very high	92.7	Very high	32 Å²	32	57 Å²	57	21%	0.208	34%	0.342	C	S	.	.			trans	-79.4	112	174	32.1	-34.4	0	0	0	110.6	W584 E653 K654	W584-P648 HydrophobicContact CH2-CB 4.05Å; P648-E653 VanDerWaalsContact CB-C 3.48Å; P648-E653 HydrophobicContact CB-CB 3.67Å; P648-E653 WeakPolarHBondContact CB-O 3.27Å; P648-K654 HydrophobicContact CB-CG 3.93Å; P648-K654 HydrophobicContact CG-CG 4.2Å; P648-K654 WeakPolarHBondContact O-CE 3.36Å
649	N	92.7	Very high	92.8	Very high	56 Å²	56	61.4 Å²	61.4	30%	0.299	36%	0.364	S	S	.	.			trans	-91.8	-44.3	179.4	-69	-26.1	0	0	0	111.4	I599 T604 S647 E653 K654	I599-N649 VanDerWaalsContact O-CB 3.31Å; I599-N649 WeakPolarHBondContact O-CB 3.46Å; I599-N649 PolarHBondContact O-ND2 2.95Å; I599-N649 VanDerWaalsContact O-ND2 3.1Å; T604-N649 PolarHBondContact OG1-ND2 3.31Å; S647-N649 PolarHBondContact O-N 3.4Å; N649-E653 WeakPolarHBondContact CA-OE2 3.41Å; N649-E653 PolarHBondContact N-OE2 3.47Å; N649-K654 WeakPolarHBondContact O-CE 3.48Å; N649-K654 PolarHBondContact O-NZ 3.42Å
650	T	93.3	Very high	92.9	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.006	35%	0.354	C	S	.	.	S	Bend	trans	-82.7	166.4	-176.2	81.6	0	0	0	0	112.6	E591 I599 A652 E653 K654	E591-T650 WeakPolarHBondContact OE1-CB 3.3Å; E591-T650 PolarHBondContact OE1-OG1 3.19Å; E591-T650 VanDerWaalsContact OE2-CB 3.3Å; E591-T650 WeakPolarHBondContact OE2-CB 3.3Å; E591-T650 WeakPolarHBondContact OE2-CG2 3.05Å; E591-T650 PolarHBondContact OE2-OG1 2.99Å; I599-T650 HydrophobicContact CG1-CG2 4.37Å; T650-A652 VanDerWaalsContact C-N 3.33Å; T650-A652 PolarHBondContact OG1-N 3.17Å; T650-E653 HydrophobicContact CG2-CG 4.43Å; T650-E653 PolarHBondContact N-OE2 3.25Å; T650-E653 WeakPolarHBondContact OG1-CB 3.49Å; T650-E653 VanDerWaalsContact OG1-CG 3.24Å; T650-E653 WeakPolarHBondContact OG1-CG 3.37Å; T650-E653 PolarHBondContact OG1-N 3.03Å; T650-K654 VanDerWaalsContact O-CB 3.31Å; T650-K654 WeakPolarHBondContact O-CB 3.49Å; T650-K654 WeakPolarHBondContact O-CD 3.38Å; T650-K654 WeakPolarHBondContact O-CG 3.48Å; T650-K654 PolarHBondContact O-N 2.97Å
651	N	93	Very high	93	Very high	122 Å²	122	59.8 Å²	59.8	65%	0.652	34%	0.344	S	S	*	.	H	α-helix	trans	-66.7	-34.8	175.5	-66.5	-1.9	0	0	0	112	V655	N651-V655 WeakPolarHBondContact O-CG2 3.45Å; N651-V655 PolarHBondContact O-N 3.31Å
652	A	92.2	Very high	93	Very high	45 Å²	45	60 Å²	60	37%	0.372	35%	0.346	S	S	.	.	H	α-helix	trans	-68.7	-46.2	177.1	0	0	0	0	0	111	I587 T650 K654 V655 F656	I587-A652 HydrophobicContact CG2-CB 4.26Å; T650-A652 VanDerWaalsContact C-N 3.33Å; T650-A652 PolarHBondContact OG1-N 3.17Å; A652-K654 VanDerWaalsContact C-N 3.33Å; A652-K654 PolarHBondContact O-N 3.33Å; A652-V655 PolarHBondContact O-N 3.32Å; A652-F656 WeakPolarHBondContact O-CB 3.34Å; A652-F656 PolarHBondContact O-N 3.26Å
653	E	95	Very high	93.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59	-42.5	173.8	-70.4	170	169.6	0	0	112	W584 I587 G600 W601 P648 N649 T650 F656 S657	W584-E653 HydrophobicContact CH2-CB 3.76Å; W584-E653 HydrophobicContact CH2-CG 3.82Å; W584-E653 HydrophobicContact CZ3-CB 3.68Å; W584-E653 HydrophobicContact CZ3-CG 3.8Å; I587-E653 HydrophobicContact CG2-CG 4.25Å; G600-E653 WeakPolarHBondContact CA-OE1 3.32Å; W601-E653 VanDerWaalsContact CD1-OE1 3.26Å; W601-E653 PolarHBondContact N-OE1 2.98Å; P648-E653 VanDerWaalsContact CB-C 3.48Å; P648-E653 HydrophobicContact CB-CB 3.67Å; P648-E653 WeakPolarHBondContact CB-O 3.27Å; N649-E653 WeakPolarHBondContact CA-OE2 3.41Å; N649-E653 PolarHBondContact N-OE2 3.47Å; T650-E653 HydrophobicContact CG2-CG 4.43Å; T650-E653 PolarHBondContact N-OE2 3.25Å; T650-E653 WeakPolarHBondContact OG1-CB 3.49Å; T650-E653 VanDerWaalsContact OG1-CG 3.24Å; T650-E653 WeakPolarHBondContact OG1-CG 3.37Å; T650-E653 PolarHBondContact OG1-N 3.03Å; E653-F656 PolarHBondContact O-N 3.01Å; E653-S657 WeakPolarHBondContact O-CB 3.43Å; E653-S657 PolarHBondContact O-N 3.11Å
654	K	95.3	Very high	93.2	Very high	95 Å²	95	54.2 Å²	54.2	41%	0.413	31%	0.31	S	S	.	.	H	α-helix	trans	-65.8	-45.9	178.7	-76.6	164.9	177.5	154.1	0	112.3	P648 N649 T650 A652 F656 S657 I658	P648-K654 HydrophobicContact CB-CG 3.93Å; P648-K654 HydrophobicContact CG-CG 4.2Å; P648-K654 WeakPolarHBondContact O-CE 3.36Å; N649-K654 WeakPolarHBondContact O-CE 3.48Å; N649-K654 PolarHBondContact O-NZ 3.42Å; T650-K654 VanDerWaalsContact O-CB 3.31Å; T650-K654 WeakPolarHBondContact O-CB 3.49Å; T650-K654 WeakPolarHBondContact O-CD 3.38Å; T650-K654 WeakPolarHBondContact O-CG 3.48Å; T650-K654 PolarHBondContact O-N 2.97Å; A652-K654 VanDerWaalsContact C-N 3.33Å; A652-K654 PolarHBondContact O-N 3.33Å; K654-F656 VanDerWaalsContact C-N 3.35Å; K654-F656 PolarHBondContact O-N 2.67Å; K654-S657 PolarHBondContact O-N 3.22Å; K654-I658 WeakPolarHBondContact O-CG1 3.36Å; K654-I658 PolarHBondContact O-N 3.25Å
655	V	96.2	Very high	93.4	Very high	88 Å²	88	55.3 Å²	55.3	53%	0.533	31%	0.31	S	S	.	.	H	α-helix	trans	-61.8	-43.6	175.6	169.3	0	0	0	0	110.8	N651 A652 S657 I658 I659	N651-V655 WeakPolarHBondContact O-CG2 3.45Å; N651-V655 PolarHBondContact O-N 3.31Å; A652-V655 PolarHBondContact O-N 3.32Å; V655-S657 PolarHBondContact O-N 3Å; V655-I658 PolarHBondContact O-N 3.26Å; V655-I659 HydrophobicContact CG1-CD1 4.23Å; V655-I659 WeakPolarHBondContact O-CG1 3.24Å; V655-I659 PolarHBondContact O-N 3.23Å
656	F	95.7	Very high	93.5	Very high	16 Å²	16	55.8 Å²	55.8	7%	0.07	31%	0.312	C	S	.	.	H	α-helix	trans	-60.5	-45.2	173.9	177.7	-96.8	0	0	0	111.9	L580 I583 W584 I587 A652 E653 K654 I658 I659 V660	L580-F656 HydrophobicContact CB-CZ 4.14Å; L580-F656 HydrophobicContact CD2-CE2 4.01Å; L580-F656 HydrophobicContact CD2-CZ 3.98Å; L580-F656 WeakPolarHBondContact O-CZ 3.29Å; I583-F656 HydrophobicContact CB-CE2 3.88Å; I583-F656 HydrophobicContact CB-CZ 4.23Å; I583-F656 HydrophobicContact CG2-CD2 3.93Å; I583-F656 HydrophobicContact CG2-CE2 3.43Å; I583-F656 VanDerWaalsContact CG2-CE2 3.43Å; I583-F656 HydrophobicContact CG2-CZ 4.2Å; W584-F656 HydrophobicContact CB-CE1 3.84Å; W584-F656 HydrophobicContact CB-CZ 4.2Å; W584-F656 HydrophobicContact CD2-CD1 4.36Å; W584-F656 HydrophobicContact CD2-CE1 4.23Å; W584-F656 AromaticContact CE3-CD1 3.35Å; W584-F656 HydrophobicContact CE3-CD1 3.35Å; W584-F656 AromaticContact CE3-CE1 3.64Å; W584-F656 HydrophobicContact CE3-CE1 3.64Å; W584-F656 HydrophobicContact CE3-CG 4.33Å; W584-F656 HydrophobicContact CG-CE1 4.36Å; W584-F656 AromaticContact CZ3-CD1 3.86Å; W584-F656 HydrophobicContact CZ3-CD1 3.86Å; W584-F656 HydrophobicContact CZ3-CE1 4.5Å; I587-F656 HydrophobicContact CD1-CB 3.77Å; I587-F656 HydrophobicContact CD1-CD1 4.42Å; I587-F656 HydrophobicContact CD1-CD2 3.72Å; I587-F656 HydrophobicContact CD1-CE2 4.44Å; I587-F656 HydrophobicContact CD1-CG 3.7Å; A652-F656 WeakPolarHBondContact O-CB 3.34Å; A652-F656 PolarHBondContact O-N 3.26Å; E653-F656 PolarHBondContact O-N 3.01Å; K654-F656 VanDerWaalsContact C-N 3.35Å; K654-F656 PolarHBondContact O-N 2.67Å; F656-I658 VanDerWaalsContact C-N 3.29Å; F656-I658 PolarHBondContact O-N 2.88Å; F656-I659 WeakPolarHBondContact O-CB 3.36Å; F656-I659 PolarHBondContact O-N 3.24Å; F656-I659 VanDerWaalsContact O-N 3.1Å; F656-V660 HydrophobicContact CD1-CG2 3.84Å; F656-V660 HydrophobicContact CE1-CG2 3.37Å; F656-V660 HydrophobicContact CE2-CG2 4.08Å; F656-V660 HydrophobicContact CG-CG2 4.4Å; F656-V660 HydrophobicContact CZ-CG2 3.51Å; F656-V660 WeakPolarHBondContact O-CG2 3.42Å; F656-V660 PolarHBondContact O-N 3.5Å
657	S	94.8	Very high	93.4	Very high	12 Å²	12	56.2 Å²	56.2	8%	0.084	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-35.9	177.9	-167.9	0	0	0	0	112.8	E653 K654 V655 V660 M661	E653-S657 WeakPolarHBondContact O-CB 3.43Å; E653-S657 PolarHBondContact O-N 3.11Å; K654-S657 PolarHBondContact O-N 3.22Å; V655-S657 PolarHBondContact O-N 3Å; S657-V660 PolarHBondContact O-N 2.78Å; S657-M661 VanDerWaalsContact O-CG 3.31Å; S657-M661 WeakPolarHBondContact O-CG 3.35Å; S657-M661 PolarHBondContact O-N 3.37Å
658	I	94.9	Very high	93.2	Very high	104 Å²	104	58.6 Å²	58.6	53%	0.533	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-43.9	174.1	-68.9	163.6	0	0	0	110.6	K654 V655 F656 M661 L662	K654-I658 WeakPolarHBondContact O-CG1 3.36Å; K654-I658 PolarHBondContact O-N 3.25Å; V655-I658 PolarHBondContact O-N 3.26Å; F656-I658 VanDerWaalsContact C-N 3.29Å; F656-I658 PolarHBondContact O-N 2.88Å; I658-M661 HydrophobicContact CG1-CE 4.18Å; I658-M661 PolarHBondContact O-N 2.74Å; I658-L662 PolarHBondContact O-N 3.36Å
659	I	95	Very high	93.1	Very high	93 Å²	93	60.1 Å²	60.1	48%	0.477	33%	0.331	S	S	.	.	H	α-helix	trans	-63	-44	176.2	-63.4	165.2	0	0	0	110.6	V655 F656 M661 L662 V663	V655-I659 HydrophobicContact CG1-CD1 4.23Å; V655-I659 WeakPolarHBondContact O-CG1 3.24Å; V655-I659 PolarHBondContact O-N 3.23Å; F656-I659 WeakPolarHBondContact O-CB 3.36Å; F656-I659 PolarHBondContact O-N 3.24Å; F656-I659 VanDerWaalsContact O-N 3.1Å; I659-M661 PolarHBondContact O-N 2.87Å; I659-L662 PolarHBondContact O-N 3.19Å; I659-V663 HydrophobicContact CG2-CG2 4.39Å; I659-V663 WeakPolarHBondContact O-CB 3.22Å; I659-V663 WeakPolarHBondContact O-CG2 3.49Å; I659-V663 PolarHBondContact O-N 2.87Å
660	V	94.8	Very high	92.7	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-61.9	-41.4	176.9	175.4	0	0	0	0	111.9	L580 L638 F656 S657 G664	L580-V660 HydrophobicContact CD1-CG1 4.41Å; L580-V660 HydrophobicContact CD1-CG2 4.24Å; L580-V660 HydrophobicContact CD2-CG2 4.16Å; L638-V660 HydrophobicContact CD2-CG1 4.12Å; L638-V660 HydrophobicContact CG-CG1 4.15Å; F656-V660 HydrophobicContact CD1-CG2 3.84Å; F656-V660 HydrophobicContact CE1-CG2 3.37Å; F656-V660 HydrophobicContact CE2-CG2 4.08Å; F656-V660 HydrophobicContact CG-CG2 4.4Å; F656-V660 HydrophobicContact CZ-CG2 3.51Å; F656-V660 WeakPolarHBondContact O-CG2 3.42Å; F656-V660 PolarHBondContact O-N 3.5Å; S657-V660 PolarHBondContact O-N 2.78Å; V660-G664 PolarHBondContact O-N 2.9Å
661	M	93.8	Very high	92.5	Very high	100 Å²	100	61.2 Å²	61.2	49%	0.493	34%	0.34	S	S	.	.	H	α-helix	trans	-66	-38.6	177.2	-72.1	-176.5	-62.4	0	0	112.4	S657 I658 I659 S665	S657-M661 VanDerWaalsContact O-CG 3.31Å; S657-M661 WeakPolarHBondContact O-CG 3.35Å; S657-M661 PolarHBondContact O-N 3.37Å; I658-M661 HydrophobicContact CG1-CE 4.18Å; I658-M661 PolarHBondContact O-N 2.74Å; I659-M661 PolarHBondContact O-N 2.87Å; M661-S665 PolarHBondContact O-N 3.07Å
662	L	93.7	Very high	92.2	Very high	106 Å²	106	61 Å²	61	56%	0.555	33%	0.334	S	S	*	.	H	α-helix	trans	-66.5	-47.3	175.8	-170.8	157	0	0	0	111.3	I658 I659 G664 S665 L666	I658-L662 PolarHBondContact O-N 3.36Å; I659-L662 PolarHBondContact O-N 3.19Å; L662-G664 VanDerWaalsContact C-N 3.32Å; L662-G664 PolarHBondContact O-N 3.43Å; L662-S665 PolarHBondContact O-N 3.23Å; L662-S665 PolarHBondContact O-OG 3.33Å; L662-L666 HydrophobicContact CD2-CD1 3.8Å; L662-L666 WeakPolarHBondContact O-CG 3.4Å; L662-L666 PolarHBondContact O-N 3.11Å
663	V	92	Very high	92.1	Very high	43 Å²	43	61.1 Å²	61.1	26%	0.261	34%	0.339	S	S	.	.	H	α-helix	trans	-61.7	-42.3	175.6	169.6	0	0	0	0	111	I576 L580 L638 I659 L666 M667	I576-V663 HydrophobicContact CG2-CG1 4.39Å; L580-V663 HydrophobicContact CD1-CG1 4.46Å; L638-V663 HydrophobicContact CD2-CG1 4.36Å; I659-V663 HydrophobicContact CG2-CG2 4.39Å; I659-V663 WeakPolarHBondContact O-CB 3.22Å; I659-V663 WeakPolarHBondContact O-CG2 3.49Å; I659-V663 PolarHBondContact O-N 2.87Å; V663-L666 PolarHBondContact O-N 3.02Å; V663-M667 HydrophobicContact CG1-CG 4.39Å; V663-M667 HydrophobicContact CG1-SD 3.48Å; V663-M667 WeakPolarHBondContact CG1-SD 3.48Å; V663-M667 WeakPolarHBondContact O-CB 3.41Å; V663-M667 WeakPolarHBondContact O-CG 3.15Å; V663-M667 PolarHBondContact O-N 2.9Å
664	G	92.2	Very high	91.7	Very high	2 Å²	2	64.4 Å²	64.4	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-58.9	-49.6	176.9	0	0	0	0	0	113	L638 V660 L662 L666 M667 Y668	L638-G664 VanDerWaalsContact CD2-CA 3.49Å; V660-G664 PolarHBondContact O-N 2.9Å; L662-G664 VanDerWaalsContact C-N 3.32Å; L662-G664 PolarHBondContact O-N 3.43Å; G664-L666 PolarHBondContact O-N 3.4Å; G664-M667 PolarHBondContact O-N 2.94Å; G664-Y668 WeakPolarHBondContact O-CB 3.46Å; G664-Y668 PolarHBondContact O-N 3.49Å
665	S	92.2	Very high	91.2	Very high	73 Å²	73	61.9 Å²	61.9	51%	0.51	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-42.7	-179.1	69.2	0	0	0	0	112.6	M661 L662 A669	M661-S665 PolarHBondContact O-N 3.07Å; L662-S665 PolarHBondContact O-N 3.23Å; L662-S665 PolarHBondContact O-OG 3.33Å; S665-A669 VanDerWaalsContact O-CB 3.32Å; S665-A669 WeakPolarHBondContact O-CB 3.46Å; S665-A669 PolarHBondContact O-N 3.4Å
666	L	90.8	Very high	90.8	Very high	114 Å²	114	59.1 Å²	59.1	60%	0.597	34%	0.339	S	S	*	.	H	α-helix	trans	-64.9	-43.4	176.1	-66.7	176.2	0	0	0	112.4	L662 V663 G664 S670	L662-L666 HydrophobicContact CD2-CD1 3.8Å; L662-L666 WeakPolarHBondContact O-CG 3.4Å; L662-L666 PolarHBondContact O-N 3.11Å; V663-L666 PolarHBondContact O-N 3.02Å; G664-L666 PolarHBondContact O-N 3.4Å; L666-S670 WeakPolarHBondContact O-CB 3.33Å; L666-S670 PolarHBondContact O-N 3.27Å
667	M	88.5	Confident	90.4	Very high	32 Å²	32	60.9 Å²	60.9	16%	0.158	36%	0.356	C	S	.	.	H	α-helix	trans	-68.4	-42	178.5	-75.3	173.6	48	0	0	112.3	F573 I576 V663 G664 S670 I671	F573-M667 HydrophobicContact CB-CE 4.31Å; F573-M667 HydrophobicContact CD2-CE 3.52Å; F573-M667 HydrophobicContact CE2-CE 4.21Å; F573-M667 HydrophobicContact CG-CE 4.24Å; I576-M667 HydrophobicContact CB-CE 3.88Å; I576-M667 HydrophobicContact CB-SD 4.25Å; I576-M667 HydrophobicContact CD1-CE 3.82Å; I576-M667 HydrophobicContact CD1-SD 3.71Å; I576-M667 HydrophobicContact CG1-CE 4.45Å; I576-M667 HydrophobicContact CG2-CE 3.9Å; I576-M667 HydrophobicContact CG2-SD 3.73Å; V663-M667 HydrophobicContact CG1-CG 4.39Å; V663-M667 HydrophobicContact CG1-SD 3.48Å; V663-M667 WeakPolarHBondContact CG1-SD 3.48Å; V663-M667 WeakPolarHBondContact O-CB 3.41Å; V663-M667 WeakPolarHBondContact O-CG 3.15Å; V663-M667 PolarHBondContact O-N 2.9Å; G664-M667 PolarHBondContact O-N 2.94Å; M667-S670 WeakPolarHBondContact O-CB 3.33Å; M667-S670 PolarHBondContact O-N 3.27Å; M667-I671 WeakPolarHBondContact O-CD1 3.36Å; M667-I671 VanDerWaalsContact O-CG1 3.31Å; M667-I671 WeakPolarHBondContact O-CG1 3.34Å; M667-I671 PolarHBondContact O-N 2.93Å
668	Y	87.3	Confident	89.9	Confident	97 Å²	97	61.5 Å²	61.5	38%	0.38	36%	0.359	S	S	.	.	H	α-helix	trans	-63	-46.2	177.4	-167.3	-92.8	0	0	0	110.9	G664 S670 I671 F672	G664-Y668 WeakPolarHBondContact O-CB 3.46Å; G664-Y668 PolarHBondContact O-N 3.49Å; Y668-S670 VanDerWaalsContact C-N 3.34Å; Y668-S670 PolarHBondContact O-N 3.28Å; Y668-I671 PolarHBondContact O-N 2.71Å; Y668-F672 AromaticContact CD1-CD2 3.95Å; Y668-F672 HydrophobicContact CD1-CD2 3.95Å; Y668-F672 HydrophobicContact CD1-CE2 4.2Å; Y668-F672 HydrophobicContact CD2-CD2 4.42Å; Y668-F672 HydrophobicContact CD2-CE2 4.13Å; Y668-F672 AromaticContact CE1-CD2 3.72Å; Y668-F672 HydrophobicContact CE1-CD2 3.72Å; Y668-F672 AromaticContact CE1-CE2 3.62Å; Y668-F672 HydrophobicContact CE1-CE2 3.62Å; Y668-F672 HydrophobicContact CE1-CG 4.47Å; Y668-F672 HydrophobicContact CE1-CZ 4.3Å; Y668-F672 HydrophobicContact CE2-CD2 4.22Å; Y668-F672 AromaticContact CE2-CE2 3.55Å; Y668-F672 HydrophobicContact CE2-CE2 3.55Å; Y668-F672 HydrophobicContact CE2-CZ 4.37Å; Y668-F672 HydrophobicContact CG-CD2 4.3Å; Y668-F672 HydrophobicContact CG-CE2 4.43Å; Y668-F672 AromaticContact CZ-CD2 3.86Å; Y668-F672 AromaticContact CZ-CE2 3.26Å; Y668-F672 AromaticContact CZ-CZ 3.83Å; Y668-F672 WeakPolarHBondContact O-CD2 3.24Å; Y668-F672 PolarHBondContact O-N 2.97Å; Y668-F672 WeakPolarHBondContact OH-CE2 3.28Å; Y668-F672 WeakPolarHBondContact OH-CZ 3.4Å
669	A	91	Very high	89.4	Confident	64 Å²	64	60.7 Å²	60.7	53%	0.529	35%	0.354	S	S	.	.	H	α-helix	trans	-59.1	-42.8	173.6	0	0	0	0	0	112.3	S665 F672 G673	S665-A669 VanDerWaalsContact O-CB 3.32Å; S665-A669 WeakPolarHBondContact O-CB 3.46Å; S665-A669 PolarHBondContact O-N 3.4Å; A669-F672 PolarHBondContact O-N 3.39Å; A669-G673 PolarHBondContact O-N 3.38Å
670	S	86.2	Confident	89	Confident	55 Å²	55	63.5 Å²	63.5	39%	0.385	37%	0.365	S	S	.	.	H	α-helix	trans	-62.1	-42.8	175.9	-177.4	0	0	0	0	112.6	L666 M667 Y668 N674	L666-S670 WeakPolarHBondContact O-CB 3.33Å; L666-S670 PolarHBondContact O-N 3.27Å; M667-S670 WeakPolarHBondContact O-CB 3.33Å; M667-S670 PolarHBondContact O-N 3.27Å; Y668-S670 VanDerWaalsContact C-N 3.34Å; Y668-S670 PolarHBondContact O-N 3.28Å; S670-N674 WeakPolarHBondContact O-CB 3.43Å; S670-N674 PolarHBondContact O-N 3.18Å; S670-N674 PolarHBondContact O-ND2 2.99Å
671	I	87.2	Confident	88.3	Confident	24 Å²	24	70.7 Å²	70.7	12%	0.123	39%	0.393	C	S	.	.	H	α-helix	trans	-62.8	-51.3	177.3	-69.9	160.1	0	0	0	110.7	L569 F573 M667 Y668 G673 N674 V675	L569-I671 HydrophobicContact CD2-CB 4.41Å; L569-I671 HydrophobicContact CD2-CG1 3.89Å; L569-I671 HydrophobicContact CG-CG1 3.89Å; F573-I671 HydrophobicContact CB-CD1 3.97Å; F573-I671 HydrophobicContact CD2-CD1 3.43Å; F573-I671 VanDerWaalsContact CD2-CD1 3.43Å; F573-I671 HydrophobicContact CE2-CD1 4.15Å; F573-I671 HydrophobicContact CG-CD1 3.85Å; M667-I671 WeakPolarHBondContact O-CD1 3.36Å; M667-I671 VanDerWaalsContact O-CG1 3.31Å; M667-I671 WeakPolarHBondContact O-CG1 3.34Å; M667-I671 PolarHBondContact O-N 2.93Å; Y668-I671 PolarHBondContact O-N 2.71Å; I671-G673 PolarHBondContact O-N 2.74Å; I671-N674 PolarHBondContact O-N 2.71Å; I671-V675 HydrophobicContact CG2-CG2 4.35Å; I671-V675 WeakPolarHBondContact O-CB 3.35Å; I671-V675 VanDerWaalsContact O-CG2 3.29Å; I671-V675 WeakPolarHBondContact O-CG2 3.48Å; I671-V675 PolarHBondContact O-N 3.23Å
672	F	88.2	Confident	87.7	Confident	118 Å²	118	71.3 Å²	71.3	52%	0.518	40%	0.397	S	S	.	.	H	α-helix	trans	-66.9	-35.1	-178.4	-84.9	-97.5	0	0	0	112.8	Y668 A669 G676	Y668-F672 AromaticContact CD1-CD2 3.95Å; Y668-F672 HydrophobicContact CD1-CD2 3.95Å; Y668-F672 HydrophobicContact CD1-CE2 4.2Å; Y668-F672 HydrophobicContact CD2-CD2 4.42Å; Y668-F672 HydrophobicContact CD2-CE2 4.13Å; Y668-F672 AromaticContact CE1-CD2 3.72Å; Y668-F672 HydrophobicContact CE1-CD2 3.72Å; Y668-F672 AromaticContact CE1-CE2 3.62Å; Y668-F672 HydrophobicContact CE1-CE2 3.62Å; Y668-F672 HydrophobicContact CE1-CG 4.47Å; Y668-F672 HydrophobicContact CE1-CZ 4.3Å; Y668-F672 HydrophobicContact CE2-CD2 4.22Å; Y668-F672 AromaticContact CE2-CE2 3.55Å; Y668-F672 HydrophobicContact CE2-CE2 3.55Å; Y668-F672 HydrophobicContact CE2-CZ 4.37Å; Y668-F672 HydrophobicContact CG-CD2 4.3Å; Y668-F672 HydrophobicContact CG-CE2 4.43Å; Y668-F672 AromaticContact CZ-CD2 3.86Å; Y668-F672 AromaticContact CZ-CE2 3.26Å; Y668-F672 AromaticContact CZ-CZ 3.83Å; Y668-F672 WeakPolarHBondContact O-CD2 3.24Å; Y668-F672 PolarHBondContact O-N 2.97Å; Y668-F672 WeakPolarHBondContact OH-CE2 3.28Å; Y668-F672 WeakPolarHBondContact OH-CZ 3.4Å; A669-F672 PolarHBondContact O-N 3.39Å; F672-G676 PolarHBondContact O-N 3.05Å
673	G	89.6	Confident	87.4	Confident	47 Å²	47	71.4 Å²	71.4	49%	0.485	39%	0.391	S	S	.	.	H	α-helix	trans	-61.8	-47.9	171.8	0	0	0	0	0	112.8	A669 I671 G676 A677	A669-G673 PolarHBondContact O-N 3.38Å; I671-G673 PolarHBondContact O-N 2.74Å; G673-G676 PolarHBondContact O-N 3.18Å; G673-A677 PolarHBondContact O-N 2.81Å
674	N	85.8	Confident	87.1	Confident	69 Å²	69	72.8 Å²	72.8	37%	0.369	40%	0.402	S	S	.	.	H	α-helix	trans	-66.7	-38.2	177.9	-79.1	-71.5	0	0	0	112.6	L569 S670 I671 L678	L569-N674 HydrophobicContact CD2-CB 3.86Å; S670-N674 WeakPolarHBondContact O-CB 3.43Å; S670-N674 PolarHBondContact O-N 3.18Å; S670-N674 PolarHBondContact O-ND2 2.99Å; I671-N674 PolarHBondContact O-N 2.71Å; N674-L678 WeakPolarHBondContact O-CB 3.34Å; N674-L678 PolarHBondContact O-N 2.66Å
675	V	86.1	Confident	86.6	Confident	43 Å²	43	74.3 Å²	74.3	26%	0.261	42%	0.418	S	S	.	.	H	α-helix	trans	-63.1	-45	173.4	168.7	0	0	0	0	110.9	L566 I671 L678 I679	L566-V675 HydrophobicContact CD1-CG2 3.54Å; L566-V675 HydrophobicContact CD2-CG2 4.42Å; I671-V675 HydrophobicContact CG2-CG2 4.35Å; I671-V675 WeakPolarHBondContact O-CB 3.35Å; I671-V675 VanDerWaalsContact O-CG2 3.29Å; I671-V675 WeakPolarHBondContact O-CG2 3.48Å; I671-V675 PolarHBondContact O-N 3.23Å; V675-L678 PolarHBondContact O-N 3.33Å; V675-I679 HydrophobicContact CG1-CD1 3.76Å; V675-I679 HydrophobicContact CG1-CG1 4.45Å; V675-I679 VanDerWaalsContact O-CG1 3.3Å; V675-I679 WeakPolarHBondContact O-CG1 3.2Å; V675-I679 PolarHBondContact O-N 3.25Å
676	G	88	Confident	86.4	Confident	30 Å²	30	74.1 Å²	74.1	31%	0.309	41%	0.414	S	S	.	.	H	α-helix	trans	-59.4	-47.5	176.5	0	0	0	0	0	112.7	F672 G673 L678 I679 Q680	F672-G676 PolarHBondContact O-N 3.05Å; G673-G676 PolarHBondContact O-N 3.18Å; G676-L678 PolarHBondContact O-N 3.1Å; G676-I679 PolarHBondContact O-N 2.95Å; G676-Q680 WeakPolarHBondContact O-CG 3.37Å; G676-Q680 PolarHBondContact O-N 3.35Å
677	A	86.1	Confident	86.3	Confident	53 Å²	53	71.4 Å²	71.4	44%	0.438	41%	0.408	S	S	.	.	H	α-helix	trans	-63.6	-37.9	176.1	0	0	0	0	0	112.7	G673 Q680 R681	G673-A677 PolarHBondContact O-N 2.81Å; A677-Q680 PolarHBondContact O-N 3Å; A677-R681 WeakPolarHBondContact O-CB 3.47Å; A677-R681 PolarHBondContact O-N 3.47Å
678	L	84	Confident	86.4	Confident	25 Å²	25	77 Å²	77	13%	0.131	43%	0.427	C	S	.	.	H	α-helix	trans	-65.6	-43.5	175.7	179.7	60.2	0	0	0	111.8	L566 N674 V675 G676 R681 L682	L566-L678 HydrophobicContact CB-CD2 4Å; L566-L678 HydrophobicContact CD2-CD2 3.89Å; N674-L678 WeakPolarHBondContact O-CB 3.34Å; N674-L678 PolarHBondContact O-N 2.66Å; V675-L678 PolarHBondContact O-N 3.33Å; G676-L678 PolarHBondContact O-N 3.1Å; L678-R681 PolarHBondContact O-N 2.99Å; L678-L682 HydrophobicContact CD1-CD1 4.13Å; L678-L682 HydrophobicContact CD1-CG 4.12Å; L678-L682 HydrophobicContact CG-CD1 3.95Å; L678-L682 HydrophobicContact CG-CG 4.39Å; L678-L682 WeakPolarHBondContact O-CB 3.38Å; L678-L682 VanDerWaalsContact O-CG 3.3Å; L678-L682 WeakPolarHBondContact O-CG 3.44Å; L678-L682 PolarHBondContact O-N 2.9Å
679	I	84.7	Confident	86.5	Confident	87 Å²	87	74.5 Å²	74.5	45%	0.446	42%	0.417	S	S	.	.	H	α-helix	trans	-59.9	-47.1	175.7	-70.5	167.3	0	0	0	110.2	V675 G676 R681 L682 Y683	V675-I679 HydrophobicContact CG1-CD1 3.76Å; V675-I679 HydrophobicContact CG1-CG1 4.45Å; V675-I679 VanDerWaalsContact O-CG1 3.3Å; V675-I679 WeakPolarHBondContact O-CG1 3.2Å; V675-I679 PolarHBondContact O-N 3.25Å; G676-I679 PolarHBondContact O-N 2.95Å; I679-R681 VanDerWaalsContact C-N 3.34Å; I679-R681 PolarHBondContact O-N 3.41Å; I679-L682 PolarHBondContact O-N 2.92Å; I679-Y683 HydrophobicContact CG2-CD2 3.91Å; I679-Y683 HydrophobicContact CG2-CE2 4.24Å; I679-Y683 WeakPolarHBondContact O-CD2 3.48Å; I679-Y683 PolarHBondContact O-N 3.37Å
680	Q	86.1	Confident	86.6	Confident	151 Å²	151	76.3 Å²	76.3	71%	0.706	42%	0.415	S	S	*	.	H	α-helix	trans	-59.5	-41.6	175.7	-71.5	175.2	-6.7	0	0	112.4	G676 A677 S684	G676-Q680 WeakPolarHBondContact O-CG 3.37Å; G676-Q680 PolarHBondContact O-N 3.35Å; A677-Q680 PolarHBondContact O-N 3Å; Q680-S684 PolarHBondContact O-N 3.14Å
681	R	82.1	Confident	86.9	Confident	152 Å²	152	75.9 Å²	75.9	57%	0.574	42%	0.415	S	S	*	.	H	α-helix	trans	-65.6	-43.3	176.7	-174.8	173.8	175.3	-173.6	-4.5	112.1	A677 L678 I679 S684	A677-R681 WeakPolarHBondContact O-CB 3.47Å; A677-R681 PolarHBondContact O-N 3.47Å; L678-R681 PolarHBondContact O-N 2.99Å; I679-R681 VanDerWaalsContact C-N 3.34Å; I679-R681 PolarHBondContact O-N 3.41Å; R681-S684 WeakPolarHBondContact O-CB 3.33Å; R681-S684 PolarHBondContact O-N 3.22Å; R681-S684 PolarHBondContact O-OG 3.05Å
682	L	80.5	Confident	87	Confident	112 Å²	112	78.9 Å²	78.9	59%	0.586	43%	0.428	S	S	*	.	H	α-helix	trans	-66.1	-42.3	-179.6	-73.1	170.4	0	0	0	112.7	L678 I679 S684	L678-L682 HydrophobicContact CD1-CD1 4.13Å; L678-L682 HydrophobicContact CD1-CG 4.12Å; L678-L682 HydrophobicContact CG-CD1 3.95Å; L678-L682 HydrophobicContact CG-CG 4.39Å; L678-L682 WeakPolarHBondContact O-CB 3.38Å; L678-L682 VanDerWaalsContact O-CG 3.3Å; L678-L682 WeakPolarHBondContact O-CG 3.44Å; L678-L682 PolarHBondContact O-N 2.9Å; I679-L682 PolarHBondContact O-N 2.92Å; L682-S684 VanDerWaalsContact C-N 3.34Å
683	Y	86.5	Confident	87.3	Confident	109 Å²	109	74 Å²	74	43%	0.427	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	6.4	179.9	-69.6	-71.9	0	0	0	114.3	I679 G685 T686 A687	I679-Y683 HydrophobicContact CG2-CD2 3.91Å; I679-Y683 HydrophobicContact CG2-CE2 4.24Å; I679-Y683 WeakPolarHBondContact O-CD2 3.48Å; I679-Y683 PolarHBondContact O-N 3.37Å; Y683-G685 VanDerWaalsContact C-N 3.33Å; Y683-G685 PolarHBondContact O-N 3.47Å; Y683-T686 PolarHBondContact O-N 2.85Å; Y683-A687 WeakPolarHBondContact O-CB 3.2Å; Y683-A687 PolarHBondContact O-N 3.26Å
684	S	86.1	Confident	87.5	Confident	71 Å²	71	77.4 Å²	77.4	50%	0.497	41%	0.414	S	S	.	.	H	α-helix	trans	-55.8	-40.6	-175.6	57.2	0	0	0	0	114.3	Q680 R681 L682 R688	Q680-S684 PolarHBondContact O-N 3.14Å; R681-S684 WeakPolarHBondContact O-CB 3.33Å; R681-S684 PolarHBondContact O-N 3.22Å; R681-S684 PolarHBondContact O-OG 3.05Å; L682-S684 VanDerWaalsContact C-N 3.34Å; S684-R688 PolarHBondContact O-N 2.68Å
685	G	82.8	Confident	88	Confident	34 Å²	34	83.1 Å²	83.1	35%	0.351	43%	0.43	S	S	.	.	H	α-helix	trans	-64.7	-50	175.2	0	0	0	0	0	112.5	Y683 A687 R688 Y689 W721	Y683-G685 VanDerWaalsContact C-N 3.33Å; Y683-G685 PolarHBondContact O-N 3.47Å; G685-A687 VanDerWaalsContact C-N 3.31Å; G685-A687 PolarHBondContact O-N 2.95Å; G685-R688 WeakPolarHBondContact O-CB 3.46Å; G685-R688 PolarHBondContact O-N 2.82Å; G685-R688 VanDerWaalsContact O-N 3.17Å; G685-Y689 PolarHBondContact O-N 2.99Å; G685-W721 WeakPolarHBondContact O-CH2 3.41Å; G685-W721 VanDerWaalsContact O-CZ2 3.29Å; G685-W721 WeakPolarHBondContact O-CZ2 3.4Å
686	T	87.5	Confident	88.3	Confident	69 Å²	69	82.5 Å²	82.5	42%	0.423	43%	0.425	S	S	.	.	H	α-helix	trans	-63.4	-36.5	178.2	-42.5	0	0	0	0	112	Y683 Y689 H690	Y683-T686 PolarHBondContact O-N 2.85Å; T686-Y689 WeakPolarHBondContact O-CB 3.17Å; T686-Y689 PolarHBondContact O-N 2.78Å; T686-H690 PolarHBondContact O-CD2 2.98Å; T686-H690 PolarHBondContact O-N 3.48Å
687	A	89	Confident	88.6	Confident	57 Å²	57	85 Å²	85	47%	0.471	43%	0.427	S	S	.	.	H	α-helix	trans	-65.1	-41.5	173.5	0	0	0	0	0	111.9	Y683 G685 H690 A691	Y683-A687 WeakPolarHBondContact O-CB 3.2Å; Y683-A687 PolarHBondContact O-N 3.26Å; G685-A687 VanDerWaalsContact C-N 3.31Å; G685-A687 PolarHBondContact O-N 2.95Å; A687-H690 PolarHBondContact O-N 3.4Å; A687-A691 WeakPolarHBondContact O-CB 3.45Å; A687-A691 PolarHBondContact O-N 3.08Å
688	R	88.9	Confident	89.1	Confident	150 Å²	150	89 Å²	89	57%	0.566	44%	0.437	S	S	*	.	H	α-helix	trans	-62.4	-43.6	173.4	-179.8	174.9	175.8	153.6	-2.5	111.7	S684 G685 A691 Q692 W721	S684-R688 PolarHBondContact O-N 2.68Å; G685-R688 WeakPolarHBondContact O-CB 3.46Å; G685-R688 PolarHBondContact O-N 2.82Å; G685-R688 VanDerWaalsContact O-N 3.17Å; R688-A691 PolarHBondContact O-N 2.71Å; R688-Q692 WeakPolarHBondContact O-CB 3.47Å; R688-Q692 PolarHBondContact O-N 2.81Å; R688-W721 HydrophobicContact CB-CH2 4.15Å; R688-W721 HydrophobicContact CG-CH2 4.1Å; R688-W721 HydrophobicContact CG-CZ3 4.2Å
689	Y	90.3	Very high	89.6	Confident	44 Å²	44	93 Å²	93	17%	0.173	45%	0.453	C	S	.	.	H	α-helix	trans	-57.6	-52.6	174.4	175.8	-119.7	0	0	0	111.9	G685 T686 A691 Q692 M693 T718 W721	G685-Y689 PolarHBondContact O-N 2.99Å; T686-Y689 WeakPolarHBondContact O-CB 3.17Å; T686-Y689 PolarHBondContact O-N 2.78Å; Y689-A691 PolarHBondContact O-N 3.47Å; Y689-Q692 PolarHBondContact O-N 3.33Å; Y689-M693 HydrophobicContact CE2-CE 4.16Å; Y689-M693 WeakPolarHBondContact O-CB 3.32Å; Y689-M693 PolarHBondContact O-N 2.85Å; Y689-T718 PolarHBondContact OH-OG1 3.45Å; Y689-W721 HydrophobicContact CD2-CB 3.91Å; Y689-W721 AromaticContact CD2-CD1 3.84Å; Y689-W721 AromaticContact CD2-CD2 3.52Å; Y689-W721 HydrophobicContact CD2-CD2 3.52Å; Y689-W721 AromaticContact CD2-CE3 3.92Å; Y689-W721 HydrophobicContact CD2-CE3 3.92Å; Y689-W721 AromaticContact CD2-CG 3.45Å; Y689-W721 HydrophobicContact CD2-CG 3.45Å; Y689-W721 VanDerWaalsContact CD2-CG 3.45Å; Y689-W721 HydrophobicContact CE2-CB 3.92Å; Y689-W721 HydrophobicContact CE2-CD2 4.41Å; Y689-W721 AromaticContact CE2-CG 3.89Å; Y689-W721 HydrophobicContact CE2-CG 3.89Å; Y689-W721 HydrophobicContact CG-CD2 4.03Å; Y689-W721 HydrophobicContact CG-CG 4.17Å
690	H	92	Very high	90.1	Very high	103 Å²	103	89.4 Å²	89.4	48%	0.477	44%	0.435	S	S	.	.	H	α-helix	trans	-63.7	-38.5	179.6	-70.7	-48.2	0	0	0	112.6	T686 A687 Q692 M693 L694	T686-H690 PolarHBondContact O-CD2 2.98Å; T686-H690 PolarHBondContact O-N 3.48Å; A687-H690 PolarHBondContact O-N 3.4Å; H690-Q692 PolarHBondContact O-N 3.21Å; H690-M693 PolarHBondContact O-N 3.26Å; H690-L694 VanDerWaalsContact O-CB 3.31Å; H690-L694 WeakPolarHBondContact O-CB 3.48Å; H690-L694 WeakPolarHBondContact O-CG 3.47Å; H690-L694 PolarHBondContact O-N 3.03Å
691	A	92.8	Very high	90.5	Very high	46 Å²	46	92.5 Å²	92.5	38%	0.38	44%	0.44	S	S	.	.	H	α-helix	trans	-63.2	-39.7	174.6	0	0	0	0	0	112.6	A687 R688 Y689 R695	A687-A691 WeakPolarHBondContact O-CB 3.45Å; A687-A691 PolarHBondContact O-N 3.08Å; R688-A691 PolarHBondContact O-N 2.71Å; Y689-A691 PolarHBondContact O-N 3.47Å; A691-R695 WeakPolarHBondContact O-CG 3.36Å; A691-R695 PolarHBondContact O-N 3.17Å
692	Q	91	Very high	91.1	Very high	87 Å²	87	92.7 Å²	92.7	41%	0.407	45%	0.446	S	S	.	.	H	α-helix	trans	-68.1	-46.4	175.2	-178.7	170.7	-14.5	0	0	111.8	R688 Y689 H690 L694 R695 I696	R688-Q692 WeakPolarHBondContact O-CB 3.47Å; R688-Q692 PolarHBondContact O-N 2.81Å; Y689-Q692 PolarHBondContact O-N 3.33Å; H690-Q692 PolarHBondContact O-N 3.21Å; Q692-L694 VanDerWaalsContact C-N 3.31Å; Q692-L694 PolarHBondContact O-N 3.17Å; Q692-R695 PolarHBondContact O-N 3.07Å; Q692-I696 HydrophobicContact CG-CD1 4.16Å; Q692-I696 WeakPolarHBondContact O-CG1 3.22Å; Q692-I696 PolarHBondContact O-N 3.48Å
693	M	92.6	Very high	91.9	Very high	15 Å²	15	92.4 Å²	92.4	7%	0.074	44%	0.441	C	S	.	.	H	α-helix	trans	-63.8	-33.2	177.2	-178.5	57.1	68.1	0	0	112.5	Y689 H690 I696 K697	Y689-M693 HydrophobicContact CE2-CE 4.16Å; Y689-M693 WeakPolarHBondContact O-CB 3.32Å; Y689-M693 PolarHBondContact O-N 2.85Å; H690-M693 PolarHBondContact O-N 3.26Å; M693-I696 PolarHBondContact O-N 2.99Å; M693-K697 HydrophobicContact CG-CD 4.19Å; M693-K697 WeakPolarHBondContact O-CB 3.37Å; M693-K697 WeakPolarHBondContact O-CG 3.23Å; M693-K697 PolarHBondContact O-N 2.79Å; M693-K697 HydrophobicContact SD-CD 4.16Å; M693-K697 VanDerWaalsContact SD-CE 3.53Å; M693-K697 HydrophobicContact SD-CG 4.42Å
694	L	95.3	Very high	92.2	Very high	119 Å²	119	95.4 Å²	95.4	62%	0.623	46%	0.459	S	S	*	.	H	α-helix	trans	-65.3	-46.4	172.6	-78.6	168	0	0	0	111.8	H690 Q692 I696 K697 E698	H690-L694 VanDerWaalsContact O-CB 3.31Å; H690-L694 WeakPolarHBondContact O-CB 3.48Å; H690-L694 WeakPolarHBondContact O-CG 3.47Å; H690-L694 PolarHBondContact O-N 3.03Å; Q692-L694 VanDerWaalsContact C-N 3.31Å; Q692-L694 PolarHBondContact O-N 3.17Å; L694-I696 VanDerWaalsContact C-N 3.3Å; L694-I696 PolarHBondContact O-N 3.09Å; L694-K697 PolarHBondContact O-N 3.15Å; L694-K697 VanDerWaalsContact O-N 3.12Å; L694-E698 WeakPolarHBondContact O-CB 3.37Å; L694-E698 PolarHBondContact O-N 3.03Å
695	R	95.1	Very high	92.6	Very high	188 Å²	188	93.4 Å²	93.4	71%	0.709	44%	0.442	S	S	*	.	H	α-helix	trans	-59.2	-40.9	174.7	-69.3	173.1	-176.2	-174	0.2	112.1	A691 Q692 K697 E698 F699	A691-R695 WeakPolarHBondContact O-CG 3.36Å; A691-R695 PolarHBondContact O-N 3.17Å; Q692-R695 PolarHBondContact O-N 3.07Å; R695-K697 VanDerWaalsContact C-N 3.34Å; R695-E698 PolarHBondContact O-N 3.2Å; R695-F699 WeakPolarHBondContact O-CB 3.46Å; R695-F699 PolarHBondContact O-N 2.94Å
696	I	93.8	Very high	93.2	Very high	31 Å²	31	95.7 Å²	95.7	16%	0.159	45%	0.451	C	S	.	.	H	α-helix	trans	-62.8	-42.4	175.8	-70.4	167.1	0	0	0	110.5	Q692 M693 L694 F699 I700 L713 S717	Q692-I696 HydrophobicContact CG-CD1 4.16Å; Q692-I696 WeakPolarHBondContact O-CG1 3.22Å; Q692-I696 PolarHBondContact O-N 3.48Å; M693-I696 PolarHBondContact O-N 2.99Å; L694-I696 VanDerWaalsContact C-N 3.3Å; L694-I696 PolarHBondContact O-N 3.09Å; I696-F699 PolarHBondContact O-N 3.29Å; I696-I700 HydrophobicContact CG2-CD1 3.71Å; I696-I700 WeakPolarHBondContact O-CB 3.49Å; I696-I700 WeakPolarHBondContact O-CD1 3.38Å; I696-I700 WeakPolarHBondContact O-CG1 3.35Å; I696-I700 PolarHBondContact O-N 3.01Å; I696-L713 HydrophobicContact CG2-CD2 4.08Å; I696-L713 HydrophobicContact CG2-CG 3.98Å; I696-S717 WeakPolarHBondContact CD1-OG 3.41Å
697	K	94.2	Very high	93.4	Very high	81 Å²	81	97 Å²	97	35%	0.352	46%	0.463	S	S	.	.	H	α-helix	trans	-70.4	-32.1	177.8	-75.7	174.2	175.2	-178.9	0	113.6	M693 L694 R695 R701 E714	M693-K697 HydrophobicContact CG-CD 4.19Å; M693-K697 WeakPolarHBondContact O-CB 3.37Å; M693-K697 WeakPolarHBondContact O-CG 3.23Å; M693-K697 PolarHBondContact O-N 2.79Å; M693-K697 HydrophobicContact SD-CD 4.16Å; M693-K697 VanDerWaalsContact SD-CE 3.53Å; M693-K697 HydrophobicContact SD-CG 4.42Å; L694-K697 PolarHBondContact O-N 3.15Å; L694-K697 VanDerWaalsContact O-N 3.12Å; R695-K697 VanDerWaalsContact C-N 3.34Å; K697-R701 WeakPolarHBondContact O-CB 3.32Å; K697-R701 PolarHBondContact O-N 3.27Å; K697-E714 WeakPolarHBondContact CE-OE1 3.48Å; K697-E714 WeakPolarHBondContact CE-OE2 3.37Å; K697-E714 IonicContact NZ-OE1 3.92Å; K697-E714 IonicContact NZ-OE2 2.77Å; K697-E714 PolarHBondContact NZ-OE2 3.1Å
698	E	95.1	Very high	93.5	Very high	139 Å²	139	98.9 Å²	98.9	65%	0.65	47%	0.47	S	S	*	.	H	α-helix	trans	-67.4	-46.5	171.4	-173.9	162.4	-138	0	0	111.3	L694 R695 R701 F702	L694-E698 WeakPolarHBondContact O-CB 3.37Å; L694-E698 PolarHBondContact O-N 3.03Å; R695-E698 PolarHBondContact O-N 3.2Å; E698-R701 PolarHBondContact O-N 3.45Å; E698-R701 VanDerWaalsContact O-N 3.16Å; E698-F702 WeakPolarHBondContact O-CB 3.31Å; E698-F702 PolarHBondContact O-N 3.48Å
699	F	95.7	Very high	93.5	Very high	108 Å²	108	96 Å²	96	47%	0.474	47%	0.466	S	S	.	.	H	α-helix	trans	-58.9	-46.5	173.5	179.1	-95.8	0	0	0	112.6	R695 I696 R701 F702 H703 I705	R695-F699 WeakPolarHBondContact O-CB 3.46Å; R695-F699 PolarHBondContact O-N 2.94Å; I696-F699 PolarHBondContact O-N 3.29Å; F699-R701 VanDerWaalsContact C-N 3.3Å; F699-R701 PolarHBondContact O-N 3.04Å; F699-F702 PolarHBondContact O-N 3.36Å; F699-H703 AromaticContact CD2-CD2 3.48Å; F699-H703 VanDerWaalsContact CD2-CD2 3.48Å; F699-H703 WeakPolarHBondContact CD2-CD2 3.48Å; F699-H703 AromaticContact CD2-NE2 3.72Å; F699-H703 AromaticContact CE2-CD2 3.26Å; F699-H703 WeakPolarHBondContact CE2-CD2 3.48Å; F699-H703 AromaticContact CE2-NE2 3.3Å; F699-H703 VanDerWaalsContact CE2-NE2 3.3Å; F699-H703 WeakPolarHBondContact CE2-NE2 3.29Å; F699-H703 AromaticContact CZ-CD2 3.63Å; F699-H703 AromaticContact CZ-NE2 3.97Å; F699-H703 PolarHBondContact O-N 2.78Å; F699-I705 HydrophobicContact CD1-CD1 3.86Å; F699-I705 HydrophobicContact CE1-CD1 3.68Å
700	I	95.1	Very high	93.6	Very high	11 Å²	11	99.2 Å²	99.2	6%	0.056	48%	0.478	C	S	.	.	H	α-helix	trans	-55.7	-43.8	173.3	-75.6	159.9	0	0	0	111.4	I696 Q704 I705 R710 L713 E714	I696-I700 HydrophobicContact CG2-CD1 3.71Å; I696-I700 WeakPolarHBondContact O-CB 3.49Å; I696-I700 WeakPolarHBondContact O-CD1 3.38Å; I696-I700 WeakPolarHBondContact O-CG1 3.35Å; I696-I700 PolarHBondContact O-N 3.01Å; I700-Q704 PolarHBondContact O-N 2.84Å; I700-I705 HydrophobicContact CG1-CD1 4.17Å; I700-I705 HydrophobicContact CG2-CB 4.35Å; I700-I705 PolarHBondContact O-N 3.03Å; I700-R710 HydrophobicContact CD1-CG 4.19Å; I700-R710 HydrophobicContact CG2-CB 4.25Å; I700-R710 HydrophobicContact CG2-CG 3.84Å; I700-L713 HydrophobicContact CD1-CD2 4.06Å; I700-L713 HydrophobicContact CG1-CD2 3.94Å; I700-E714 HydrophobicContact CD1-CG 4.14Å
701	R	94.3	Very high	93.5	Very high	217 Å²	217	99.7 Å²	99.7	82%	0.819	48%	0.48	S	S	*	.	H	α-helix	trans	-70.9	-41.1	-180	-176.4	-179.1	-179.4	-174.4	-0.1	112.2	K697 E698 F699 Q704	K697-R701 WeakPolarHBondContact O-CB 3.32Å; K697-R701 PolarHBondContact O-N 3.27Å; E698-R701 PolarHBondContact O-N 3.45Å; E698-R701 VanDerWaalsContact O-N 3.16Å; F699-R701 VanDerWaalsContact C-N 3.3Å; F699-R701 PolarHBondContact O-N 3.04Å; R701-Q704 PolarHBondContact O-N 3.17Å
702	F	95.5	Very high	93.3	Very high	156 Å²	156	102.7 Å²	102.7	68%	0.684	48%	0.481	S	S	*	.	H	α-helix	trans	-65.9	-48.8	-178.5	-177.8	-99.8	0	0	0	111.6	E698 F699 Q704	E698-F702 WeakPolarHBondContact O-CB 3.31Å; E698-F702 PolarHBondContact O-N 3.48Å; F699-F702 PolarHBondContact O-N 3.36Å; F702-Q704 VanDerWaalsContact C-N 3.28Å; F702-Q704 PolarHBondContact O-N 3.06Å
703	H	95.7	Very high	93.3	Very high	105 Å²	105	101 Å²	101	49%	0.486	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	6.4	177.7	-66.5	-69.9	0	0	0	114.5	F699 I705	F699-H703 AromaticContact CD2-CD2 3.48Å; F699-H703 VanDerWaalsContact CD2-CD2 3.48Å; F699-H703 WeakPolarHBondContact CD2-CD2 3.48Å; F699-H703 AromaticContact CD2-NE2 3.72Å; F699-H703 AromaticContact CE2-CD2 3.26Å; F699-H703 WeakPolarHBondContact CE2-CD2 3.48Å; F699-H703 AromaticContact CE2-NE2 3.3Å; F699-H703 VanDerWaalsContact CE2-NE2 3.3Å; F699-H703 WeakPolarHBondContact CE2-NE2 3.29Å; F699-H703 AromaticContact CZ-CD2 3.63Å; F699-H703 AromaticContact CZ-NE2 3.97Å; F699-H703 PolarHBondContact O-N 2.78Å; H703-I705 VanDerWaalsContact C-N 3.26Å; H703-I705 HydrophobicContact CB-CD1 4.42Å; H703-I705 HydrophobicContact CB-CG1 3.93Å; H703-I705 PolarHBondContact O-N 2.9Å
704	Q	94.3	Very high	93.2	Very high	172 Å²	172	102.1 Å²	102.1	80%	0.804	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	42	-179.7	-55	-174	5.8	0	0	113.5	I700 R701 F702	I700-Q704 PolarHBondContact O-N 2.84Å; R701-Q704 PolarHBondContact O-N 3.17Å; F702-Q704 VanDerWaalsContact C-N 3.28Å; F702-Q704 PolarHBondContact O-N 3.06Å
705	I	94.3	Very high	92.8	Very high	29 Å²	29	100.6 Å²	100.6	15%	0.149	47%	0.47	C	S	.	.			trans	-61.4	127.4	-170.8	-61.8	-173.7	0	0	0	110.7	F699 I700 H703 L709 R710	F699-I705 HydrophobicContact CD1-CD1 3.86Å; F699-I705 HydrophobicContact CE1-CD1 3.68Å; I700-I705 HydrophobicContact CG1-CD1 4.17Å; I700-I705 HydrophobicContact CG2-CB 4.35Å; I700-I705 PolarHBondContact O-N 3.03Å; H703-I705 VanDerWaalsContact C-N 3.26Å; H703-I705 HydrophobicContact CB-CD1 4.42Å; H703-I705 HydrophobicContact CB-CG1 3.93Å; H703-I705 PolarHBondContact O-N 2.9Å; I705-L709 HydrophobicContact CG2-CB 3.92Å; I705-L709 HydrophobicContact CG2-CD2 4Å; I705-L709 HydrophobicContact CG2-CG 3.82Å; I705-R710 HydrophobicContact CG2-CB 4.27Å
706	P	94.9	Very high	92.4	Very high	82 Å²	82	96.3 Å²	96.3	53%	0.532	45%	0.454	S	S	.	.			trans	-66.4	146.2	-175.1	27.1	-35.8	0	0	0	112.3	P708 L709 R710	P706-P708 VanDerWaalsContact C-CD 3.47Å; P706-P708 VanDerWaalsContact O-N 3.12Å; P706-L709 HydrophobicContact CG-CB 4.46Å; P706-L709 PolarHBondContact O-N 2.91Å; P706-R710 PolarHBondContact O-N 2.74Å
707	S	91.5	Very high	92.1	Very high	96 Å²	96	95.2 Å²	95.2	67%	0.671	45%	0.45	S	S	*	.	H	α-helix	trans	-39.6	-48.9	-174.5	-52.8	0	0	0	0	116.7	R710 Q711	S707-R710 WeakPolarHBondContact O-CB 3.11Å; S707-R710 PolarHBondContact O-N 3.28Å; S707-Q711 WeakPolarHBondContact O-CB 3.4Å; S707-Q711 PolarHBondContact O-N 3.14Å
708	P	90.6	Very high	91.9	Very high	97 Å²	97	93.4 Å²	93.4	63%	0.63	45%	0.445	S	S	*	.	H	α-helix	trans	-64.8	-42.9	179.8	23.9	-34.5	0	0	0	113.4	P706 Q711 R712	P706-P708 VanDerWaalsContact C-CD 3.47Å; P706-P708 VanDerWaalsContact O-N 3.12Å; P708-Q711 PolarHBondContact O-N 2.95Å; P708-R712 PolarHBondContact O-N 3.19Å; P708-R712 VanDerWaalsContact O-N 3.16Å
709	L	90.4	Very high	91.3	Very high	91 Å²	91	88.2 Å²	88.2	48%	0.476	42%	0.421	S	S	.	.	H	α-helix	trans	-71.7	-35.6	177.3	-179.2	56.8	0	0	0	111.2	I705 P706 L713	I705-L709 HydrophobicContact CG2-CB 3.92Å; I705-L709 HydrophobicContact CG2-CD2 4Å; I705-L709 HydrophobicContact CG2-CG 3.82Å; P706-L709 HydrophobicContact CG-CB 4.46Å; P706-L709 PolarHBondContact O-N 2.91Å; L709-L713 WeakPolarHBondContact O-CB 3.26Å; L709-L713 PolarHBondContact O-N 3.32Å
710	R	91.5	Very high	90.7	Very high	111 Å²	111	84.9 Å²	84.9	42%	0.419	41%	0.41	S	S	.	.	H	α-helix	trans	-58.2	-48.5	171.4	166.5	176	-178.2	-158.2	-11.9	111.8	I700 I705 P706 S707 L713 E714	I700-R710 HydrophobicContact CD1-CG 4.19Å; I700-R710 HydrophobicContact CG2-CB 4.25Å; I700-R710 HydrophobicContact CG2-CG 3.84Å; I705-R710 HydrophobicContact CG2-CB 4.27Å; P706-R710 PolarHBondContact O-N 2.74Å; S707-R710 WeakPolarHBondContact O-CB 3.11Å; S707-R710 PolarHBondContact O-N 3.28Å; R710-L713 PolarHBondContact O-N 2.95Å; R710-E714 IonicContact CZ-OE1 2.77Å; R710-E714 IonicContact NE-OE1 2.72Å; R710-E714 PolarHBondContact NE-OE1 3.24Å; R710-E714 IonicContact NH2-OE1 3.51Å; R710-E714 PolarHBondContact NH2-OE1 2.85Å; R710-E714 PolarHBondContact O-N 3.29Å
711	Q	90.3	Very high	90.2	Very high	113 Å²	113	86.6 Å²	86.6	53%	0.528	42%	0.415	S	S	.	.	H	α-helix	trans	-61.1	-49.9	-179.7	178.3	174	-10.5	0	0	110.5	S707 P708 L713 E714 E715	S707-Q711 WeakPolarHBondContact O-CB 3.4Å; S707-Q711 PolarHBondContact O-N 3.14Å; P708-Q711 PolarHBondContact O-N 2.95Å; Q711-L713 VanDerWaalsContact C-N 3.25Å; Q711-L713 PolarHBondContact O-N 2.88Å; Q711-E714 PolarHBondContact O-N 3.03Å; Q711-E714 VanDerWaalsContact O-N 3.16Å; Q711-E715 HydrophobicContact CG-CG 4.3Å; Q711-E715 VanDerWaalsContact CG-OE1 3.23Å; Q711-E715 WeakPolarHBondContact CG-OE1 3.28Å; Q711-E715 PolarHBondContact NE2-OE1 3.11Å; Q711-E715 WeakPolarHBondContact O-CB 3.36Å; Q711-E715 WeakPolarHBondContact O-CG 3.47Å; Q711-E715 PolarHBondContact O-N 3.4Å
712	R	88.1	Confident	89.8	Confident	108 Å²	108	82.7 Å²	82.7	41%	0.408	41%	0.406	S	S	.	.	H	α-helix	trans	-53.7	-40.3	175.9	-170.2	176.1	179.5	-163.6	-5.5	112.4	P708 Y716 D783	P708-R712 PolarHBondContact O-N 3.19Å; P708-R712 VanDerWaalsContact O-N 3.16Å; R712-Y716 WeakPolarHBondContact O-CB 3.48Å; R712-Y716 PolarHBondContact O-N 2.76Å; R712-D783 IonicContact CZ-OD1 2.68Å; R712-D783 IonicContact NE-OD1 3.15Å; R712-D783 PolarHBondContact NE-OD1 3.46Å; R712-D783 IonicContact NH2-OD1 2.71Å; R712-D783 PolarHBondContact NH2-OD1 3.04Å; R712-D783 IonicContact NH2-OD2 3.48Å
713	L	90.3	Very high	88.9	Confident	52 Å²	52	79.7 Å²	79.7	27%	0.272	39%	0.394	S	S	.	.	H	α-helix	trans	-72.9	-39.3	178.4	-174.6	60	0	0	0	113.5	I696 I700 L709 R710 Q711 S717	I696-L713 HydrophobicContact CG2-CD2 4.08Å; I696-L713 HydrophobicContact CG2-CG 3.98Å; I700-L713 HydrophobicContact CD1-CD2 4.06Å; I700-L713 HydrophobicContact CG1-CD2 3.94Å; L709-L713 WeakPolarHBondContact O-CB 3.26Å; L709-L713 PolarHBondContact O-N 3.32Å; R710-L713 PolarHBondContact O-N 2.95Å; Q711-L713 VanDerWaalsContact C-N 3.25Å; Q711-L713 PolarHBondContact O-N 2.88Å; L713-S717 VanDerWaalsContact O-CB 3.31Å; L713-S717 WeakPolarHBondContact O-CB 3.43Å; L713-S717 PolarHBondContact O-N 3.15Å; L713-S717 VanDerWaalsContact O-N 3.11Å
714	E	91	Very high	88.2	Confident	38 Å²	38	77.2 Å²	77.2	18%	0.178	39%	0.386	C	S	.	.	H	α-helix	trans	-67.4	-39.1	174	-71.4	-168.5	-144.2	0	0	111.8	K697 I700 R710 Q711 T718	K697-E714 WeakPolarHBondContact CE-OE1 3.48Å; K697-E714 WeakPolarHBondContact CE-OE2 3.37Å; K697-E714 IonicContact NZ-OE1 3.92Å; K697-E714 IonicContact NZ-OE2 2.77Å; K697-E714 PolarHBondContact NZ-OE2 3.1Å; I700-E714 HydrophobicContact CD1-CG 4.14Å; R710-E714 IonicContact CZ-OE1 2.77Å; R710-E714 IonicContact NE-OE1 2.72Å; R710-E714 PolarHBondContact NE-OE1 3.24Å; R710-E714 IonicContact NH2-OE1 3.51Å; R710-E714 PolarHBondContact NH2-OE1 2.85Å; R710-E714 PolarHBondContact O-N 3.29Å; Q711-E714 PolarHBondContact O-N 3.03Å; Q711-E714 VanDerWaalsContact O-N 3.16Å; E714-T718 PolarHBondContact O-N 2.85Å; E714-T718 PolarHBondContact O-OG1 3.19Å
715	E	88	Confident	87.5	Confident	88 Å²	88	73.9 Å²	73.9	41%	0.411	37%	0.374	S	S	.	.	H	α-helix	trans	-67.6	-53	177.1	-73.6	174.2	-179	0	0	111.7	Q711 S717 T718 Q719	Q711-E715 HydrophobicContact CG-CG 4.3Å; Q711-E715 VanDerWaalsContact CG-OE1 3.23Å; Q711-E715 WeakPolarHBondContact CG-OE1 3.28Å; Q711-E715 PolarHBondContact NE2-OE1 3.11Å; Q711-E715 WeakPolarHBondContact O-CB 3.36Å; Q711-E715 WeakPolarHBondContact O-CG 3.47Å; Q711-E715 PolarHBondContact O-N 3.4Å; E715-S717 VanDerWaalsContact C-N 3.31Å; E715-S717 PolarHBondContact O-N 3.49Å; E715-T718 WeakPolarHBondContact O-CA 3.34Å; E715-T718 WeakPolarHBondContact O-CB 3.3Å; E715-T718 PolarHBondContact O-N 3.2Å; E715-Q719 WeakPolarHBondContact O-CG 3.49Å; E715-Q719 PolarHBondContact O-N 3.29Å; E715-Q719 PolarHBondContact O-OE1 3.36Å
716	Y	85.8	Confident	86.5	Confident	97 Å²	97	73.4 Å²	73.4	38%	0.38	38%	0.376	S	S	.	.	H	α-helix	trans	-54.4	-46.1	176	174.1	-97.4	0	0	0	111.9	R712 T718 Q719 V720	R712-Y716 WeakPolarHBondContact O-CB 3.48Å; R712-Y716 PolarHBondContact O-N 2.76Å; Y716-T718 PolarHBondContact O-N 3.16Å; Y716-Q719 PolarHBondContact O-N 3.48Å; Y716-V720 HydrophobicContact CD1-CG2 4.34Å; Y716-V720 HydrophobicContact CD2-CG2 3.98Å; Y716-V720 HydrophobicContact CE1-CG2 4.02Å; Y716-V720 HydrophobicContact CE2-CG2 3.62Å; Y716-V720 HydrophobicContact CG-CG2 4.32Å; Y716-V720 WeakPolarHBondContact O-CB 3.26Å; Y716-V720 WeakPolarHBondContact O-CG2 3.49Å; Y716-V720 PolarHBondContact O-N 3.43Å
717	S	87.3	Confident	85.9	Confident	9 Å²	9	74.6 Å²	74.6	6%	0.063	38%	0.377	C	S	.	.	H	α-helix	trans	-65.6	-24.1	177.8	-176.6	0	0	0	0	113.7	I696 L713 E715 W721	I696-S717 WeakPolarHBondContact CD1-OG 3.41Å; L713-S717 VanDerWaalsContact O-CB 3.31Å; L713-S717 WeakPolarHBondContact O-CB 3.43Å; L713-S717 PolarHBondContact O-N 3.15Å; L713-S717 VanDerWaalsContact O-N 3.11Å; E715-S717 VanDerWaalsContact C-N 3.31Å; E715-S717 PolarHBondContact O-N 3.49Å; S717-W721 WeakPolarHBondContact O-CB 3.44Å
718	T	89.3	Confident	85.1	Confident	42 Å²	42	73.4 Å²	73.4	26%	0.258	36%	0.363	S	S	.	.	H	α-helix	trans	-79.9	-49.6	175.7	-55.5	0	0	0	0	109.9	Y689 E714 E715 Y716 V720 W721 E722	Y689-T718 PolarHBondContact OH-OG1 3.45Å; E714-T718 PolarHBondContact O-N 2.85Å; E714-T718 PolarHBondContact O-OG1 3.19Å; E715-T718 WeakPolarHBondContact O-CA 3.34Å; E715-T718 WeakPolarHBondContact O-CB 3.3Å; E715-T718 PolarHBondContact O-N 3.2Å; Y716-T718 PolarHBondContact O-N 3.16Å; T718-V720 PolarHBondContact O-N 3.15Å; T718-W721 WeakPolarHBondContact O-CB 3.38Å; T718-W721 PolarHBondContact O-N 3.3Å; T718-W721 VanDerWaalsContact O-N 3.14Å; T718-E722 WeakPolarHBondContact O-CG 3.47Å; T718-E722 PolarHBondContact O-N 3.19Å
719	Q	83	Confident	84.3	Confident	30 Å²	30	72 Å²	72	14%	0.14	35%	0.349	C	S	.	.	H	α-helix	trans	-62.7	-44.3	-178.7	-66.5	151.6	-14.3	0	0	112.3	E715 Y716 W721 E722 H723 Y912	E715-Q719 WeakPolarHBondContact O-CG 3.49Å; E715-Q719 PolarHBondContact O-N 3.29Å; E715-Q719 PolarHBondContact O-OE1 3.36Å; Y716-Q719 PolarHBondContact O-N 3.48Å; Q719-W721 VanDerWaalsContact C-N 3.28Å; Q719-W721 PolarHBondContact O-N 2.92Å; Q719-E722 PolarHBondContact O-N 3.46Å; Q719-H723 WeakPolarHBondContact O-CB 3.44Å; Q719-H723 PolarHBondContact O-N 3.48Å; Q719-Y912 HydrophobicContact CG-CE1 4.03Å; Q719-Y912 PolarHBondContact NE2-OH 2.98Å; Q719-Y912 VanDerWaalsContact NE2-OH 3.07Å
720	V	82.8	Confident	83.6	Confident	39 Å²	39	70.6 Å²	70.6	24%	0.236	34%	0.344	C	S	.	.	H	α-helix	trans	-63.3	-36.1	175.5	171.4	0	0	0	0	111.2	Y716 T718 T724	Y716-V720 HydrophobicContact CD1-CG2 4.34Å; Y716-V720 HydrophobicContact CD2-CG2 3.98Å; Y716-V720 HydrophobicContact CE1-CG2 4.02Å; Y716-V720 HydrophobicContact CE2-CG2 3.62Å; Y716-V720 HydrophobicContact CG-CG2 4.32Å; Y716-V720 WeakPolarHBondContact O-CB 3.26Å; Y716-V720 WeakPolarHBondContact O-CG2 3.49Å; Y716-V720 PolarHBondContact O-N 3.43Å; T718-V720 PolarHBondContact O-N 3.15Å; V720-T724 HydrophobicContact CG1-CG2 4.28Å; V720-T724 WeakPolarHBondContact O-CB 3.29Å; V720-T724 WeakPolarHBondContact O-CG2 3.17Å; V720-T724 PolarHBondContact O-N 3.46Å; V720-T724 PolarHBondContact O-OG1 2.73Å
721	W	86.4	Confident	82.9	Confident	47 Å²	47	71.2 Å²	71.2	18%	0.178	35%	0.353	C	S	.	.	H	α-helix	trans	-67.2	-44.5	174.8	-178.3	-86.3	0	0	0	111.9	G685 R688 Y689 S717 T718 Q719 N725	G685-W721 WeakPolarHBondContact O-CH2 3.41Å; G685-W721 VanDerWaalsContact O-CZ2 3.29Å; G685-W721 WeakPolarHBondContact O-CZ2 3.4Å; R688-W721 HydrophobicContact CB-CH2 4.15Å; R688-W721 HydrophobicContact CG-CH2 4.1Å; R688-W721 HydrophobicContact CG-CZ3 4.2Å; Y689-W721 HydrophobicContact CD2-CB 3.91Å; Y689-W721 AromaticContact CD2-CD1 3.84Å; Y689-W721 AromaticContact CD2-CD2 3.52Å; Y689-W721 HydrophobicContact CD2-CD2 3.52Å; Y689-W721 AromaticContact CD2-CE3 3.92Å; Y689-W721 HydrophobicContact CD2-CE3 3.92Å; Y689-W721 AromaticContact CD2-CG 3.45Å; Y689-W721 HydrophobicContact CD2-CG 3.45Å; Y689-W721 VanDerWaalsContact CD2-CG 3.45Å; Y689-W721 HydrophobicContact CE2-CB 3.92Å; Y689-W721 HydrophobicContact CE2-CD2 4.41Å; Y689-W721 AromaticContact CE2-CG 3.89Å; Y689-W721 HydrophobicContact CE2-CG 3.89Å; Y689-W721 HydrophobicContact CG-CD2 4.03Å; Y689-W721 HydrophobicContact CG-CG 4.17Å; S717-W721 WeakPolarHBondContact O-CB 3.44Å; T718-W721 WeakPolarHBondContact O-CB 3.38Å; T718-W721 PolarHBondContact O-N 3.3Å; T718-W721 VanDerWaalsContact O-N 3.14Å; Q719-W721 VanDerWaalsContact C-N 3.28Å; Q719-W721 PolarHBondContact O-N 2.92Å; W721-N725 WeakPolarHBondContact O-CA 3.31Å; W721-N725 PolarHBondContact O-N 3.47Å
722	E	84.7	Confident	82.1	Confident	135 Å²	135	68.4 Å²	68.4	63%	0.631	34%	0.344	S	S	*	.	H	α-helix	trans	-63.8	-41.3	177.7	-71.3	178.5	171.2	0	0	112.3	T718 Q719 N725	T718-E722 WeakPolarHBondContact O-CG 3.47Å; T718-E722 PolarHBondContact O-N 3.19Å; Q719-E722 PolarHBondContact O-N 3.46Å; E722-N725 PolarHBondContact O-ND2 3.17Å
723	H	76.5	Confident	81.4	Confident	93 Å²	93	64.1 Å²	64.1	43%	0.431	33%	0.328	S	S	.	.	H	α-helix	trans	-67.1	-51	177	-168.5	122.6	0	0	0	111.8	Q719 H778 D914	Q719-H723 WeakPolarHBondContact O-CB 3.44Å; Q719-H723 PolarHBondContact O-N 3.48Å; H723-H778 AromaticContact CE1-CE1 3.99Å; H723-H778 AromaticContact CE1-ND1 3.63Å; H723-H778 AromaticContact ND1-CE1 3.45Å; H723-H778 PolarHBondContact ND1-CE1 3.49Å; H723-H778 AromaticContact ND1-CG 3.89Å; H723-H778 AromaticContact ND1-ND1 3.42Å; H723-H778 PolarHBondContact ND1-ND1 3.48Å; H723-H778 AromaticContact ND1-NE2 3.89Å; H723-D914 IonicContact CE1-OD1 3.67Å; H723-D914 PolarHBondContact CE1-OD1 3.44Å; H723-D914 VanDerWaalsContact CE1-OD1 3.24Å; H723-D914 IonicContact CE1-OD2 3.52Å; H723-D914 IonicContact ND1-OD1 2.71Å
724	T	81	Confident	80.9	Confident	52 Å²	52	70.2 Å²	70.2	32%	0.319	35%	0.349	S	S	.	.	H	α-helix	trans	-83	-14	-175.1	62.2	0	0	0	0	114.1	V720 G726 I727	V720-T724 HydrophobicContact CG1-CG2 4.28Å; V720-T724 WeakPolarHBondContact O-CB 3.29Å; V720-T724 WeakPolarHBondContact O-CG2 3.17Å; V720-T724 PolarHBondContact O-N 3.46Å; V720-T724 PolarHBondContact O-OG1 2.73Å; T724-G726 PolarHBondContact O-N 3.3Å; T724-G726 VanDerWaalsContact O-N 3.17Å; T724-G726 PolarHBondContact OG1-N 3.17Å; T724-I727 WeakPolarHBondContact O-CB 3.48Å; T724-I727 WeakPolarHBondContact O-CG1 3.5Å; T724-I727 PolarHBondContact O-N 2.89Å
725	N	79.4	Confident	80.3	Confident	103 Å²	103	72.9 Å²	72.9	55%	0.551	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	25.5	-165.9	-66.2	-106.9	0	0	0	112.9	W721 E722 I727	W721-N725 WeakPolarHBondContact O-CA 3.31Å; W721-N725 PolarHBondContact O-N 3.47Å; E722-N725 PolarHBondContact O-ND2 3.17Å; N725-I727 VanDerWaalsContact C-N 3.31Å
726	G	75	Confident	80.1	Confident	18 Å²	18	72.8 Å²	72.8	19%	0.186	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	12	-175	0	0	0	0	0	115.2	T724	T724-G726 PolarHBondContact O-N 3.3Å; T724-G726 VanDerWaalsContact O-N 3.17Å; T724-G726 PolarHBondContact OG1-N 3.17Å
727	I	80.6	Confident	80.2	Confident	108 Å²	108	71.1 Å²	71.1	55%	0.554	37%	0.372	S	S	*	.			trans	-87.7	120.5	178.9	-55.2	175	0	0	0	110	T724 N725 V732	T724-I727 WeakPolarHBondContact O-CB 3.48Å; T724-I727 WeakPolarHBondContact O-CG1 3.5Å; T724-I727 PolarHBondContact O-N 2.89Å; N725-I727 VanDerWaalsContact C-N 3.31Å; I727-V732 HydrophobicContact CG2-CG2 3.76Å
728	D	75.3	Confident	80	Confident	71 Å²	71	75.9 Å²	75.9	38%	0.38	39%	0.393	S	S	.	.			trans	-85.7	113.1	171.7	-177.5	-19.3	0	0	0	110.2	T730 M731 V732	D728-T730 PolarHBondContact O-N 3.4Å; D728-T730 WeakPolarHBondContact OD1-CB 3.44Å; D728-T730 PolarHBondContact OD1-N 2.97Å; D728-T730 PolarHBondContact OD1-OG1 3.41Å; D728-T730 PolarHBondContact OD2-OG1 2.68Å; D728-M731 HydrophobicContact CB-CB 4.12Å; D728-M731 HydrophobicContact CB-CG 3.99Å; D728-M731 PolarHBondContact O-N 3.03Å; D728-M731 PolarHBondContact OD1-N 2.96Å; D728-M731 WeakPolarHBondContact OD2-CG 3.3Å; D728-V732 WeakPolarHBondContact O-CG2 3.38Å; D728-V732 PolarHBondContact O-N 3.17Å; D728-V732 VanDerWaalsContact O-N 3.16Å
729	M	74.2	Confident	79.6	Confident	68 Å²	68	77.3 Å²	77.3	34%	0.335	41%	0.405	S	S	.	.	H	α-helix	trans	-60.5	-31.9	-179.9	-173.9	63.6	-177.2	0	0	112.8	V732 Q733 I744 V748	M729-V732 PolarHBondContact O-N 3.27Å; M729-Q733 HydrophobicContact CE-CG 4.25Å; M729-Q733 VanDerWaalsContact O-CG 3.31Å; M729-Q733 WeakPolarHBondContact O-CG 3.4Å; M729-Q733 PolarHBondContact O-N 3.39Å; M729-I744 HydrophobicContact CE-CG2 3.91Å; M729-V748 HydrophobicContact CE-CG2 4.14Å
730	T	76	Confident	79.8	Confident	61 Å²	61	80 Å²	80	37%	0.374	42%	0.42	S	S	.	.	H	α-helix	trans	-71	-43.5	-178.9	70.4	0	0	0	0	111	D728 V732 Q733 Y734	D728-T730 PolarHBondContact O-N 3.4Å; D728-T730 WeakPolarHBondContact OD1-CB 3.44Å; D728-T730 PolarHBondContact OD1-N 2.97Å; D728-T730 PolarHBondContact OD1-OG1 3.41Å; D728-T730 PolarHBondContact OD2-OG1 2.68Å; T730-V732 VanDerWaalsContact C-N 3.27Å; T730-V732 PolarHBondContact O-N 3.05Å; T730-Q733 WeakPolarHBondContact O-CB 3.48Å; T730-Q733 PolarHBondContact O-N 2.93Å; T730-Q733 VanDerWaalsContact O-N 3.16Å; T730-Y734 WeakPolarHBondContact O-CD2 3.33Å; T730-Y734 PolarHBondContact O-N 3.48Å
731	M	75.4	Confident	80.1	Confident	124 Å²	124	80 Å²	80	61%	0.611	42%	0.417	S	S	*	.	H	α-helix	trans	-61.9	-35.3	174	-67.7	-66.2	-65.3	0	0	112	D728 S735	D728-M731 HydrophobicContact CB-CB 4.12Å; D728-M731 HydrophobicContact CB-CG 3.99Å; D728-M731 PolarHBondContact O-N 3.03Å; D728-M731 PolarHBondContact OD1-N 2.96Å; D728-M731 WeakPolarHBondContact OD2-CG 3.3Å; M731-S735 PolarHBondContact O-N 2.88Å; M731-S735 PolarHBondContact O-OG 3.07Å
732	V	74.2	Confident	80	Confident	53 Å²	53	78.1 Å²	78.1	32%	0.321	41%	0.411	S	S	.	.	H	α-helix	trans	-67.7	-44.7	173.1	174.2	0	0	0	0	111.2	I727 D728 M729 T730 S735 F736	I727-V732 HydrophobicContact CG2-CG2 3.76Å; D728-V732 WeakPolarHBondContact O-CG2 3.38Å; D728-V732 PolarHBondContact O-N 3.17Å; D728-V732 VanDerWaalsContact O-N 3.16Å; M729-V732 PolarHBondContact O-N 3.27Å; T730-V732 VanDerWaalsContact C-N 3.27Å; T730-V732 PolarHBondContact O-N 3.05Å; V732-S735 WeakPolarHBondContact O-CB 3.46Å; V732-S735 PolarHBondContact O-N 2.89Å; V732-F736 HydrophobicContact CG1-CE2 3.93Å; V732-F736 WeakPolarHBondContact O-CD2 3.43Å; V732-F736 WeakPolarHBondContact O-CE2 3.41Å
733	Q	74.4	Confident	80.1	Confident	19 Å²	19	74.8 Å²	74.8	9%	0.089	40%	0.397	C	S	.	.	H	α-helix	trans	-58.5	-51.9	176.4	-74.4	163.4	-14.5	0	0	111.6	M729 T730 S735 F736 Q741 C745	M729-Q733 HydrophobicContact CE-CG 4.25Å; M729-Q733 VanDerWaalsContact O-CG 3.31Å; M729-Q733 WeakPolarHBondContact O-CG 3.4Å; M729-Q733 PolarHBondContact O-N 3.39Å; T730-Q733 WeakPolarHBondContact O-CB 3.48Å; T730-Q733 PolarHBondContact O-N 2.93Å; T730-Q733 VanDerWaalsContact O-N 3.16Å; Q733-S735 PolarHBondContact O-N 3.46Å; Q733-F736 PolarHBondContact O-N 3.31Å; Q733-Q741 VanDerWaalsContact O-CG 3.22Å; Q733-Q741 WeakPolarHBondContact O-CG 3.31Å; Q733-Q741 PolarHBondContact O-NE2 3.27Å; Q733-Q741 VanDerWaalsContact O-NE2 3.12Å; Q733-C745 PolarHBondContact NE2-SG 2.71Å
734	Y	78.5	Confident	80.7	Confident	179 Å²	179	72.8 Å²	72.8	70%	0.702	39%	0.389	S	S	*	.	H	α-helix	trans	-63.8	-11.6	-180	-68.4	-59.8	0	0	0	114.6	T730 F736	T730-Y734 WeakPolarHBondContact O-CD2 3.33Å; T730-Y734 PolarHBondContact O-N 3.48Å; Y734-F736 VanDerWaalsContact C-N 3.3Å
735	S	78.4	Confident	81.1	Confident	95 Å²	95	70.4 Å²	70.4	66%	0.664	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-8.7	173.8	-59	0	0	0	0	113.8	M731 V732 Q733	M731-S735 PolarHBondContact O-N 2.88Å; M731-S735 PolarHBondContact O-OG 3.07Å; V732-S735 WeakPolarHBondContact O-CB 3.46Å; V732-S735 PolarHBondContact O-N 2.89Å; Q733-S735 PolarHBondContact O-N 3.46Å
736	F	84.9	Confident	81.5	Confident	85 Å²	85	68 Å²	68	37%	0.373	36%	0.361	S	S	.	.	S	Bend	trans	-117.6	155.9	-178.9	-63	-67.6	0	0	0	112.2	V732 Q733 Y734 L740 Q741 I744	V732-F736 HydrophobicContact CG1-CE2 3.93Å; V732-F736 WeakPolarHBondContact O-CD2 3.43Å; V732-F736 WeakPolarHBondContact O-CE2 3.41Å; Q733-F736 PolarHBondContact O-N 3.31Å; Y734-F736 VanDerWaalsContact C-N 3.3Å; F736-L740 HydrophobicContact CB-CB 4.19Å; F736-Q741 HydrophobicContact CB-CG 4.22Å; F736-Q741 PolarHBondContact O-NE2 2.95Å; F736-I744 HydrophobicContact CD2-CD1 3.63Å; F736-I744 HydrophobicContact CE2-CD1 3.85Å; F736-I744 HydrophobicContact CG-CD1 4.16Å
737	P	88	Confident	82.2	Confident	63 Å²	63	74.6 Å²	74.6	41%	0.409	38%	0.382	S	S	.	.			trans	-65.8	150.5	169.4	28.9	-35.7	0	0	0	111.6	S739 L740 Q741	P737-S739 PolarHBondContact O-N 3.36Å; P737-L740 HydrophobicContact CG-CB 4.23Å; P737-L740 HydrophobicContact CG-CD1 3.96Å; P737-L740 HydrophobicContact CG-CG 4.14Å; P737-L740 PolarHBondContact O-N 3.15Å; P737-Q741 PolarHBondContact O-N 3.15Å
738	E	83.2	Confident	82.6	Confident	109 Å²	109	72.3 Å²	72.3	51%	0.509	37%	0.373	S	S	.	.	H	α-helix	trans	-48.9	-36.5	-175.8	-175.2	176.5	-152.3	0	0	114.5	Q741 S742 L772	E738-Q741 PolarHBondContact O-N 3.06Å; E738-S742 PolarHBondContact O-N 2.6Å; E738-L772 HydrophobicContact CG-CD1 4.47Å
739	S	81	Confident	83.3	Confident	72 Å²	72	69.4 Å²	69.4	50%	0.503	36%	0.356	S	S	.	.	H	α-helix	trans	-58.5	-55.2	173.5	49.1	0	0	0	0	111.8	P737 Q741 S742 D743	P737-S739 PolarHBondContact O-N 3.36Å; S739-Q741 VanDerWaalsContact C-N 3.35Å; S739-Q741 PolarHBondContact O-N 3.46Å; S739-S742 PolarHBondContact O-N 3.44Å; S739-S742 VanDerWaalsContact O-N 3.15Å; S739-S742 PolarHBondContact O-OG 2.82Å; S739-D743 PolarHBondContact O-N 3.18Å; S739-D743 VanDerWaalsContact O-N 3.1Å; S739-D743 VanDerWaalsContact O-OD2 3.12Å
740	L	86.1	Confident	84	Confident	87 Å²	87	70.8 Å²	70.8	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-67.2	-33	177.2	-69	179.8	0	0	0	112.6	F736 P737 S742 D743 I744	F736-L740 HydrophobicContact CB-CB 4.19Å; P737-L740 HydrophobicContact CG-CB 4.23Å; P737-L740 HydrophobicContact CG-CD1 3.96Å; P737-L740 HydrophobicContact CG-CG 4.14Å; P737-L740 PolarHBondContact O-N 3.15Å; L740-S742 VanDerWaalsContact C-N 3.3Å; L740-S742 PolarHBondContact O-N 2.92Å; L740-D743 PolarHBondContact O-N 3.34Å; L740-I744 WeakPolarHBondContact O-CB 3.16Å; L740-I744 WeakPolarHBondContact O-CD1 2.75Å; L740-I744 WeakPolarHBondContact O-CG1 3.29Å; L740-I744 PolarHBondContact O-N 3.49Å
741	Q	88.2	Confident	84.6	Confident	37 Å²	37	73.1 Å²	73.1	17%	0.173	36%	0.364	C	S	.	.	H	α-helix	trans	-57	-46.7	170.2	-65.8	-179.1	18.9	0	0	110.6	Q733 F736 P737 E738 S739 D743 I744 C745 L772	Q733-Q741 VanDerWaalsContact O-CG 3.22Å; Q733-Q741 WeakPolarHBondContact O-CG 3.31Å; Q733-Q741 PolarHBondContact O-NE2 3.27Å; Q733-Q741 VanDerWaalsContact O-NE2 3.12Å; F736-Q741 HydrophobicContact CB-CG 4.22Å; F736-Q741 PolarHBondContact O-NE2 2.95Å; P737-Q741 PolarHBondContact O-N 3.15Å; E738-Q741 PolarHBondContact O-N 3.06Å; S739-Q741 VanDerWaalsContact C-N 3.35Å; S739-Q741 PolarHBondContact O-N 3.46Å; Q741-D743 PolarHBondContact O-N 2.69Å; Q741-I744 PolarHBondContact O-N 2.76Å; Q741-C745 WeakPolarHBondContact O-CB 3.45Å; Q741-C745 PolarHBondContact O-N 3.09Å; Q741-C745 PolarHBondContact O-SG 2.98Å; Q741-L772 HydrophobicContact CB-CD2 3.78Å
742	S	85.7	Confident	85.3	Confident	8 Å²	8	67.2 Å²	67.2	6%	0.056	34%	0.335	C	S	.	.	H	α-helix	trans	-65.9	-37.7	-179.9	76.4	0	0	0	0	112.8	E738 S739 L740 L746 R768 S771	E738-S742 PolarHBondContact O-N 2.6Å; S739-S742 PolarHBondContact O-N 3.44Å; S739-S742 VanDerWaalsContact O-N 3.15Å; S739-S742 PolarHBondContact O-OG 2.82Å; L740-S742 VanDerWaalsContact C-N 3.3Å; L740-S742 PolarHBondContact O-N 2.92Å; S742-L746 WeakPolarHBondContact O-CB 3.46Å; S742-L746 PolarHBondContact O-N 3.17Å; S742-R768 PolarHBondContact OG-NH1 3.22Å; S742-S771 PolarHBondContact O-OG 3.46Å
743	D	87.2	Confident	86	Confident	65 Å²	65	65.4 Å²	65.4	35%	0.348	32%	0.324	S	S	.	.	H	α-helix	trans	-67.3	-40.6	174.4	-75.8	-67.7	0	0	0	112.4	S739 L740 Q741 Y747 R768	S739-D743 PolarHBondContact O-N 3.18Å; S739-D743 VanDerWaalsContact O-N 3.1Å; S739-D743 VanDerWaalsContact O-OD2 3.12Å; L740-D743 PolarHBondContact O-N 3.34Å; Q741-D743 PolarHBondContact O-N 2.69Å; D743-Y747 WeakPolarHBondContact O-CB 3.27Å; D743-Y747 PolarHBondContact O-N 2.87Å; D743-R768 IonicContact OD1-CZ 3.71Å; D743-R768 VanDerWaalsContact OD1-CZ 3.31Å; D743-R768 IonicContact OD1-NH1 3.99Å; D743-R768 PolarHBondContact OD1-NH1 3.4Å; D743-R768 IonicContact OD1-NH2 2.68Å; D743-R768 PolarHBondContact OD1-NH2 3.49Å; D743-R768 IonicContact OD2-CZ 3.56Å; D743-R768 IonicContact OD2-NH1 3.59Å; D743-R768 PolarHBondContact OD2-NH1 2.99Å; D743-R768 IonicContact OD2-NH2 3.53Å
744	I	87.7	Confident	86.4	Confident	52 Å²	52	67.1 Å²	67.1	27%	0.267	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-48.2	175.8	-69.3	164.3	0	0	0	110.3	M729 F736 L740 Q741 Y747 V748	M729-I744 HydrophobicContact CE-CG2 3.91Å; F736-I744 HydrophobicContact CD2-CD1 3.63Å; F736-I744 HydrophobicContact CE2-CD1 3.85Å; F736-I744 HydrophobicContact CG-CD1 4.16Å; L740-I744 WeakPolarHBondContact O-CB 3.16Å; L740-I744 WeakPolarHBondContact O-CD1 2.75Å; L740-I744 WeakPolarHBondContact O-CG1 3.29Å; L740-I744 PolarHBondContact O-N 3.49Å; Q741-I744 PolarHBondContact O-N 2.76Å; I744-Y747 PolarHBondContact O-N 3.16Å; I744-V748 HydrophobicContact CG2-CG2 4.41Å; I744-V748 WeakPolarHBondContact O-CG2 3.45Å; I744-V748 PolarHBondContact O-N 3.16Å
745	C	89.1	Confident	86.5	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.007	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-40.7	178.6	-70	0	0	0	0	112	Q733 Q741 Y747 V748 Y749 S771	Q733-C745 PolarHBondContact NE2-SG 2.71Å; Q741-C745 WeakPolarHBondContact O-CB 3.45Å; Q741-C745 PolarHBondContact O-N 3.09Å; Q741-C745 PolarHBondContact O-SG 2.98Å; C745-Y747 VanDerWaalsContact C-N 3.31Å; C745-Y747 PolarHBondContact O-N 2.98Å; C745-V748 PolarHBondContact O-N 3.44Å; C745-Y749 HydrophobicContact CB-CD2 3.95Å; C745-Y749 HydrophobicContact CB-CE2 4.04Å; C745-Y749 WeakPolarHBondContact O-CB 3.26Å; C745-Y749 WeakPolarHBondContact O-CD2 3.46Å; C745-Y749 PolarHBondContact O-N 2.88Å; C745-S771 WeakPolarHBondContact CB-O 3.3Å; C745-S771 WeakPolarHBondContact CB-OG 3.24Å
746	L	89.5	Confident	86.6	Confident	52 Å²	52	56.1 Å²	56.1	27%	0.272	29%	0.292	S	S	.	.	H	α-helix	trans	-58.9	-41.6	173.9	-170.8	76.5	0	0	0	111.6	S742 R750 L753 L767	S742-L746 WeakPolarHBondContact O-CB 3.46Å; S742-L746 PolarHBondContact O-N 3.17Å; L746-R750 WeakPolarHBondContact O-CA 3.36Å; L746-R750 WeakPolarHBondContact O-CB 3.4Å; L746-R750 PolarHBondContact O-N 2.94Å; L746-R750 VanDerWaalsContact O-N 3.07Å; L746-L753 HydrophobicContact CD1-CD1 3.68Å; L746-L767 HydrophobicContact CD1-CB 3.92Å
747	Y	89.5	Confident	86.3	Confident	158 Å²	158	54.5 Å²	54.5	62%	0.62	29%	0.294	S	S	*	.	H	α-helix	trans	-70.8	-39.2	177.9	178.3	-97.7	0	0	0	113.6	D743 I744 C745 R750	D743-Y747 WeakPolarHBondContact O-CB 3.27Å; D743-Y747 PolarHBondContact O-N 2.87Å; I744-Y747 PolarHBondContact O-N 3.16Å; C745-Y747 VanDerWaalsContact C-N 3.31Å; C745-Y747 PolarHBondContact O-N 2.98Å; Y747-R750 WeakPolarHBondContact O-CD 3.3Å; Y747-R750 WeakPolarHBondContact O-CG 3.27Å; Y747-R750 PolarHBondContact OH-NH1 3.03Å
748	V	88	Confident	85.9	Confident	59 Å²	59	51.5 Å²	51.5	36%	0.358	28%	0.275	S	S	.	.	H	α-helix	trans	-72.9	-43.3	179.4	171.2	0	0	0	0	111.5	M729 I744 C745 R750	M729-V748 HydrophobicContact CE-CG2 4.14Å; I744-V748 HydrophobicContact CG2-CG2 4.41Å; I744-V748 WeakPolarHBondContact O-CG2 3.45Å; I744-V748 PolarHBondContact O-N 3.16Å; C745-V748 PolarHBondContact O-N 3.44Å; V748-R750 VanDerWaalsContact C-N 3.34Å
749	Y	90.7	Very high	86	Confident	10 Å²	10	46.4 Å²	46.4	4%	0.039	25%	0.251	C	S	.	.	S	Bend	trans	-93.6	12.7	-178.2	-53.2	-51.5	0	0	0	113.5	C745 H751 F752 L753 S771 I774 Q916	C745-Y749 HydrophobicContact CB-CD2 3.95Å; C745-Y749 HydrophobicContact CB-CE2 4.04Å; C745-Y749 WeakPolarHBondContact O-CB 3.26Å; C745-Y749 WeakPolarHBondContact O-CD2 3.46Å; C745-Y749 PolarHBondContact O-N 2.88Å; Y749-H751 PolarHBondContact O-N 2.81Å; Y749-F752 WeakPolarHBondContact O-CB 3.43Å; Y749-F752 PolarHBondContact O-N 2.9Å; Y749-L753 PolarHBondContact O-N 3.28Å; Y749-L753 VanDerWaalsContact O-N 3.1Å; Y749-S771 WeakPolarHBondContact CD2-O 3.4Å; Y749-S771 WeakPolarHBondContact CE2-O 3.27Å; Y749-I774 HydrophobicContact CD1-CB 4.29Å; Y749-I774 HydrophobicContact CD1-CG2 3.5Å; Y749-I774 VanDerWaalsContact CD1-CG2 3.5Å; Y749-I774 HydrophobicContact CD2-CB 3.7Å; Y749-I774 HydrophobicContact CD2-CD1 4.35Å; Y749-I774 HydrophobicContact CD2-CG2 3.85Å; Y749-I774 HydrophobicContact CE1-CB 4.48Å; Y749-I774 HydrophobicContact CE1-CG2 3.71Å; Y749-I774 HydrophobicContact CE2-CB 3.9Å; Y749-I774 HydrophobicContact CE2-CG2 4.03Å; Y749-I774 HydrophobicContact CG-CB 3.91Å; Y749-I774 HydrophobicContact CG-CD1 4.14Å; Y749-I774 HydrophobicContact CG-CG2 3.59Å; Y749-I774 PolarHBondContact OH-O 3.41Å; Y749-Q916 HydrophobicContact CD1-CG 4.11Å; Y749-Q916 HydrophobicContact CE1-CG 4.27Å
750	R	89.3	Confident	86	Confident	97 Å²	97	49.7 Å²	49.7	37%	0.366	26%	0.256	S	S	.	.	H	α-helix	trans	-51	-34.1	177.8	71.7	-176.6	-175.6	-130.6	8.8	113.5	L746 Y747 V748 L753 S754	L746-R750 WeakPolarHBondContact O-CA 3.36Å; L746-R750 WeakPolarHBondContact O-CB 3.4Å; L746-R750 PolarHBondContact O-N 2.94Å; L746-R750 VanDerWaalsContact O-N 3.07Å; Y747-R750 WeakPolarHBondContact O-CD 3.3Å; Y747-R750 WeakPolarHBondContact O-CG 3.27Å; Y747-R750 PolarHBondContact OH-NH1 3.03Å; V748-R750 VanDerWaalsContact C-N 3.34Å; R750-L753 PolarHBondContact O-N 3.05Å; R750-S754 WeakPolarHBondContact O-CB 3.29Å; R750-S754 PolarHBondContact O-N 3.46Å; R750-S754 PolarHBondContact O-OG 3.06Å
751	H	87	Confident	85.5	Confident	110 Å²	110	48.1 Å²	48.1	51%	0.509	25%	0.253	S	S	.	.	H	α-helix	trans	-69.9	-49.9	-177.3	-70.8	-67.4	0	0	0	111.2	Y749 L753 S754 G755 Y797	Y749-H751 PolarHBondContact O-N 2.81Å; H751-L753 VanDerWaalsContact C-N 3.33Å; H751-L753 PolarHBondContact O-N 3.18Å; H751-S754 WeakPolarHBondContact CA-OG 3.23Å; H751-S754 CarbonylContact O-C 3.43Å; H751-S754 PolarHBondContact O-N 3.42Å; H751-S754 VanDerWaalsContact O-N 3.07Å; H751-S754 PolarHBondContact O-OG 3.37Å; H751-G755 PolarHBondContact O-N 3.17Å; H751-Y797 HydrophobicContact CB-CE1 4.37Å; H751-Y797 PolarHBondContact O-OH 2.87Å
752	F	90	Very high	85.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-51.4	-50.2	169.5	180	-72	0	0	0	111.5	Y749 S754 G755 F759 I774 M795 Y797 F821 Q916 I918	Y749-F752 WeakPolarHBondContact O-CB 3.43Å; Y749-F752 PolarHBondContact O-N 2.9Å; F752-S754 VanDerWaalsContact C-N 3.25Å; F752-S754 PolarHBondContact O-N 2.99Å; F752-G755 PolarHBondContact O-N 3.02Å; F752-F759 HydrophobicContact CD1-CE2 4.21Å; F752-F759 AromaticContact CE1-CE2 3.88Å; F752-F759 HydrophobicContact CE1-CE2 3.88Å; F752-F759 AromaticContact CE1-CZ 3.94Å; F752-F759 HydrophobicContact CE1-CZ 3.94Å; F752-I774 HydrophobicContact CD1-CD1 3.52Å; F752-I774 HydrophobicContact CD1-CG1 4.49Å; F752-I774 HydrophobicContact CD2-CD1 4.43Å; F752-I774 HydrophobicContact CE1-CD1 3.68Å; F752-I774 HydrophobicContact CE1-CG1 4.24Å; F752-I774 HydrophobicContact CG-CD1 3.95Å; F752-I774 HydrophobicContact CZ-CD1 4.2Å; F752-I774 HydrophobicContact CZ-CG1 4.33Å; F752-M795 HydrophobicContact CE1-CE 4.3Å; F752-M795 HydrophobicContact CE2-CE 4.29Å; F752-M795 HydrophobicContact CZ-CE 3.57Å; F752-Y797 HydrophobicContact CB-CD1 3.94Å; F752-Y797 HydrophobicContact CB-CE1 4.3Å; F752-Y797 HydrophobicContact CB-CG 4.35Å; F752-Y797 VanDerWaalsContact CD2-CB 3.48Å; F752-Y797 HydrophobicContact CD2-CD1 4.13Å; F752-Y797 AromaticContact CD2-CG 3.93Å; F752-Y797 HydrophobicContact CD2-CG 3.93Å; F752-Y797 HydrophobicContact CG-CD1 4.44Å; F752-Y797 HydrophobicContact CG-CG 4.41Å; F752-F821 HydrophobicContact CD2-CE1 4.26Å; F752-F821 HydrophobicContact CE2-CE1 4.17Å; F752-F821 HydrophobicContact CG-CE1 4.47Å; F752-F821 HydrophobicContact CZ-CE1 4.32Å; F752-Q916 HydrophobicContact CD2-CB 3.95Å; F752-I918 HydrophobicContact CZ-CG2 4.06Å
753	L	88.7	Confident	85.3	Confident	15 Å²	15	52.1 Å²	52.1	8%	0.079	28%	0.275	C	S	.	.	H	α-helix	trans	-69	-21.9	-179.3	-62.5	172.8	0	0	0	113.2	L746 Y749 R750 H751 F759 L767 I770 I774	L746-L753 HydrophobicContact CD1-CD1 3.68Å; Y749-L753 PolarHBondContact O-N 3.28Å; Y749-L753 VanDerWaalsContact O-N 3.1Å; R750-L753 PolarHBondContact O-N 3.05Å; H751-L753 VanDerWaalsContact C-N 3.33Å; H751-L753 PolarHBondContact O-N 3.18Å; L753-F759 HydrophobicContact CD2-CG 4.4Å; L753-F759 WeakPolarHBondContact O-CB 3.3Å; L753-L767 HydrophobicContact CD2-CD2 4.09Å; L753-I770 HydrophobicContact CD2-CG2 3.88Å; L753-I774 HydrophobicContact CD2-CD1 4.31Å; L753-I774 HydrophobicContact CG-CD1 4.49Å
754	S	84.8	Confident	85.2	Confident	56 Å²	56	53 Å²	53	39%	0.392	28%	0.279	S	S	.	.	H	α-helix	trans	-91.1	-14.5	174.2	75.1	0	0	0	0	114.3	R750 H751 F752 K760	R750-S754 WeakPolarHBondContact O-CB 3.29Å; R750-S754 PolarHBondContact O-N 3.46Å; R750-S754 PolarHBondContact O-OG 3.06Å; H751-S754 WeakPolarHBondContact CA-OG 3.23Å; H751-S754 CarbonylContact O-C 3.43Å; H751-S754 PolarHBondContact O-N 3.42Å; H751-S754 VanDerWaalsContact O-N 3.07Å; H751-S754 PolarHBondContact O-OG 3.37Å; F752-S754 VanDerWaalsContact C-N 3.25Å; F752-S754 PolarHBondContact O-N 2.99Å; S754-K760 WeakPolarHBondContact O-CE 3.45Å; S754-K760 PolarHBondContact O-NZ 3.35Å
755	G	80	Confident	85.2	Confident	32 Å²	32	51.9 Å²	51.9	33%	0.33	28%	0.28	S	S	.	.	H	α-helix	trans	-66.7	-58.7	-176.5	0	0	0	0	0	111.6	H751 F752	H751-G755 PolarHBondContact O-N 3.17Å; F752-G755 PolarHBondContact O-N 3.02Å
756	S	80.2	Confident	85.2	Confident	11 Å²	11	52 Å²	52	8%	0.077	28%	0.281	C	S	.	.	S	Bend	trans	-85.7	145.1	-178.1	-179.1	0	0	0	0	113.6	A758 R940 F941	S756-A758 PolarHBondContact O-N 2.96Å; S756-A758 WeakPolarHBondContact OG-CB 3.48Å; S756-A758 PolarHBondContact OG-N 3.33Å; S756-A758 VanDerWaalsContact OG-N 3.12Å; S756-R940 PolarHBondContact OG-O 3.41Å; S756-F941 VanDerWaalsContact OG-CD2 3.29Å; S756-F941 WeakPolarHBondContact OG-CD2 3.48Å
757	A	77.8	Confident	85.3	Confident	50 Å²	50	50.8 Å²	50.8	41%	0.413	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-17	170	0	0	0	0	0	113.5	R940	A757-R940 HydrophobicContact CB-CB 4.44Å
758	A	80.1	Confident	85.3	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-34.7	176.9	0	0	0	0	0	113.1	S756 R936 L937 R940 F941	S756-A758 PolarHBondContact O-N 2.96Å; S756-A758 WeakPolarHBondContact OG-CB 3.48Å; S756-A758 PolarHBondContact OG-N 3.33Å; S756-A758 VanDerWaalsContact OG-N 3.12Å; A758-R936 HydrophobicContact CB-CB 4.35Å; A758-R936 WeakPolarHBondContact CB-O 3.4Å; A758-L937 HydrophobicContact CB-CD2 4.16Å; A758-R940 HydrophobicContact CB-CB 4.2Å; A758-F941 HydrophobicContact CB-CB 4.14Å; A758-F941 HydrophobicContact CB-CD2 4.29Å
759	F	85.3	Confident	85.4	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.009	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-29.2	-176.3	-56.9	-54.7	0	0	0	113.7	F752 L753 S761 L762 L767 I770 M795 F821 L933 L937 F941	F752-F759 HydrophobicContact CD1-CE2 4.21Å; F752-F759 AromaticContact CE1-CE2 3.88Å; F752-F759 HydrophobicContact CE1-CE2 3.88Å; F752-F759 AromaticContact CE1-CZ 3.94Å; F752-F759 HydrophobicContact CE1-CZ 3.94Å; L753-F759 HydrophobicContact CD2-CG 4.4Å; L753-F759 WeakPolarHBondContact O-CB 3.3Å; F759-S761 PolarHBondContact O-N 2.93Å; F759-L762 HydrophobicContact CB-CD1 4.4Å; F759-L762 HydrophobicContact CD1-CD1 3.87Å; F759-L762 PolarHBondContact O-N 3.02Å; F759-L762 VanDerWaalsContact O-N 3.15Å; F759-L767 HydrophobicContact CB-CD2 4.33Å; F759-I770 HydrophobicContact CD1-CD1 4.35Å; F759-M795 HydrophobicContact CZ-CE 4.24Å; F759-F821 HydrophobicContact CE2-CE1 4.39Å; F759-F821 HydrophobicContact CE2-CZ 4.2Å; F759-L933 HydrophobicContact CD1-CD1 4.43Å; F759-L933 HydrophobicContact CE1-CD1 4.24Å; F759-L937 HydrophobicContact CE1-CD2 4.25Å; F759-L937 HydrophobicContact CZ-CD2 4.33Å; F759-F941 HydrophobicContact CE2-CD2 4.42Å; F759-F941 HydrophobicContact CE2-CE2 4.03Å; F759-F941 HydrophobicContact CZ-CD2 4.41Å; F759-F941 HydrophobicContact CZ-CE2 4.14Å
760	K	80.4	Confident	85.4	Confident	142 Å²	142	45.7 Å²	45.7	62%	0.617	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.1	-172.2	-72	174.6	-178.2	159.9	0	115.6	S754	S754-K760 WeakPolarHBondContact O-CE 3.45Å; S754-K760 PolarHBondContact O-NZ 3.35Å
761	S	75.7	Confident	85.5	Confident	54 Å²	54	41 Å²	41	38%	0.378	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.1	22.6	-179.7	67.8	0	0	0	0	113.4	F759 R936	F759-S761 PolarHBondContact O-N 2.93Å; S761-R936 PolarHBondContact OG-NE 2.92Å
762	L	83.3	Confident	85.6	Confident	17 Å²	17	37.5 Å²	37.5	9%	0.089	22%	0.22	C	C	.	.	S	Bend	trans	-91.2	153.4	176.1	-62.1	176	0	0	0	111.3	F759 C766 L767 I770 L933 R936	F759-L762 HydrophobicContact CB-CD1 4.4Å; F759-L762 HydrophobicContact CD1-CD1 3.87Å; F759-L762 PolarHBondContact O-N 3.02Å; F759-L762 VanDerWaalsContact O-N 3.15Å; L762-C766 HydrophobicContact CB-CB 4.46Å; L762-L767 HydrophobicContact CB-CD2 4.12Å; L762-L767 HydrophobicContact CB-CG 4.07Å; L762-L767 HydrophobicContact CD1-CD2 4.22Å; L762-I770 HydrophobicContact CD1-CD1 3.77Å; L762-L933 HydrophobicContact CD1-CD1 3.7Å; L762-L933 HydrophobicContact CD2-CD1 4.44Å; L762-R936 HydrophobicContact CD2-CG 4.27Å
763	N	86.2	Confident	85.6	Confident	112 Å²	112	39.7 Å²	39.7	60%	0.599	23%	0.228	S	C	*	.			trans	-61.8	138.4	171.8	-179.5	-19.8	0	0	0	111.2	G765 C766 L767	N763-G765 PolarHBondContact O-N 2.91Å; N763-G765 PolarHBondContact OD1-N 3.24Å; N763-C766 WeakPolarHBondContact O-CA 3.36Å; N763-C766 WeakPolarHBondContact O-CB 3.32Å; N763-C766 PolarHBondContact O-N 3.44Å; N763-L767 PolarHBondContact O-N 3.22Å
764	D	86.6	Confident	85.7	Confident	82 Å²	82	39 Å²	39	44%	0.439	23%	0.225	S	C	.	.	H	α-helix	trans	-41.4	-42.1	172.1	-80.1	12.1	0	0	0	113.1	C766 L767 R768 R1033	D764-C766 PolarHBondContact O-N 2.83Å; D764-L767 PolarHBondContact O-N 2.97Å; D764-R768 WeakPolarHBondContact O-CB 3.42Å; D764-R768 VanDerWaalsContact O-CG 3.26Å; D764-R768 WeakPolarHBondContact O-CG 3.5Å; D764-R768 PolarHBondContact O-N 3.42Å; D764-R1033 IonicContact OD2-NH1 3.58Å
765	G	86.2	Confident	85.9	Confident	29 Å²	29	40.5 Å²	40.5	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-65.5	-35.1	178.9	0	0	0	0	0	113.7	N763 N769	N763-G765 PolarHBondContact O-N 2.91Å; N763-G765 PolarHBondContact OD1-N 3.24Å; G765-N769 PolarHBondContact O-N 2.85Å
766	C	89.9	Confident	86.3	Confident	4 Å²	4	42.2 Å²	42.2	3%	0.027	23%	0.229	C	C	.	.	H	α-helix	trans	-71.7	-45.6	173.7	-172.3	0	0	0	0	110.5	L762 N763 D764 R768 N769 I770 Y930	L762-C766 HydrophobicContact CB-CB 4.46Å; N763-C766 WeakPolarHBondContact O-CA 3.36Å; N763-C766 WeakPolarHBondContact O-CB 3.32Å; N763-C766 PolarHBondContact O-N 3.44Å; D764-C766 PolarHBondContact O-N 2.83Å; C766-R768 VanDerWaalsContact C-N 3.32Å; C766-R768 PolarHBondContact O-N 3.49Å; C766-N769 PolarHBondContact O-N 3.44Å; C766-I770 VanDerWaalsContact O-CG1 3.3Å; C766-I770 WeakPolarHBondContact O-CG1 3.2Å; C766-I770 PolarHBondContact O-N 2.86Å; C766-Y930 HydrophobicContact CB-CD1 4.08Å; C766-Y930 HydrophobicContact CB-CD2 4.26Å; C766-Y930 HydrophobicContact CB-CE1 4.1Å; C766-Y930 HydrophobicContact CB-CE2 4.26Å; C766-Y930 HydrophobicContact CB-CG 4.17Å; C766-Y930 VanDerWaalsContact SG-CD2 3.54Å; C766-Y930 VanDerWaalsContact SG-CG 3.57Å
767	L	91.4	Very high	86.6	Confident	27 Å²	27	43.6 Å²	43.6	14%	0.141	24%	0.238	C	C	.	.	H	α-helix	trans	-59	-41	177	-68.6	172.2	0	0	0	112.5	L746 L753 F759 L762 N763 D764 I770 S771	L746-L767 HydrophobicContact CD1-CB 3.92Å; L753-L767 HydrophobicContact CD2-CD2 4.09Å; F759-L767 HydrophobicContact CB-CD2 4.33Å; L762-L767 HydrophobicContact CB-CD2 4.12Å; L762-L767 HydrophobicContact CB-CG 4.07Å; L762-L767 HydrophobicContact CD1-CD2 4.22Å; N763-L767 PolarHBondContact O-N 3.22Å; D764-L767 PolarHBondContact O-N 2.97Å; L767-I770 PolarHBondContact O-N 3.04Å; L767-S771 WeakPolarHBondContact O-CB 3.33Å; L767-S771 PolarHBondContact O-N 2.91Å
768	R	89.8	Confident	87	Confident	57 Å²	57	42.8 Å²	42.8	22%	0.215	23%	0.226	C	C	.	.	H	α-helix	trans	-58.7	-51.5	172.7	-77.6	170.9	-175	-88.1	-8.4	111.7	S742 D743 D764 C766 I770 S771 L772	S742-R768 PolarHBondContact OG-NH1 3.22Å; D743-R768 IonicContact OD1-CZ 3.71Å; D743-R768 VanDerWaalsContact OD1-CZ 3.31Å; D743-R768 IonicContact OD1-NH1 3.99Å; D743-R768 PolarHBondContact OD1-NH1 3.4Å; D743-R768 IonicContact OD1-NH2 2.68Å; D743-R768 PolarHBondContact OD1-NH2 3.49Å; D743-R768 IonicContact OD2-CZ 3.56Å; D743-R768 IonicContact OD2-NH1 3.59Å; D743-R768 PolarHBondContact OD2-NH1 2.99Å; D743-R768 IonicContact OD2-NH2 3.53Å; D764-R768 WeakPolarHBondContact O-CB 3.42Å; D764-R768 VanDerWaalsContact O-CG 3.26Å; D764-R768 WeakPolarHBondContact O-CG 3.5Å; D764-R768 PolarHBondContact O-N 3.42Å; C766-R768 VanDerWaalsContact C-N 3.32Å; C766-R768 PolarHBondContact O-N 3.49Å; R768-I770 PolarHBondContact O-N 3.41Å; R768-S771 PolarHBondContact O-N 3.12Å; R768-S771 VanDerWaalsContact O-N 3.13Å; R768-S771 PolarHBondContact O-OG 3.39Å; R768-L772 PolarHBondContact O-N 3.24Å; R768-L772 VanDerWaalsContact O-N 3.15Å
769	N	89.6	Confident	87.3	Confident	61 Å²	61	43 Å²	43	33%	0.326	23%	0.227	S	C	.	.	H	α-helix	trans	-66.4	-32.7	180	-83.5	-26.1	0	0	0	113.7	G765 C766 L926 Y930	G765-N769 PolarHBondContact O-N 2.85Å; C766-N769 PolarHBondContact O-N 3.44Å; N769-L926 HydrophobicContact CB-CD2 3.97Å; N769-Y930 HydrophobicContact CB-CE2 4.21Å; N769-Y930 PolarHBondContact ND2-OH 3.15Å
770	I	91.8	Very high	87.3	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-63.2	-50.3	168.4	-66.2	160.8	0	0	0	109.7	L753 F759 L762 C766 L767 R768 L772 R773 I774 I918 L926 L933	L753-I770 HydrophobicContact CD2-CG2 3.88Å; F759-I770 HydrophobicContact CD1-CD1 4.35Å; L762-I770 HydrophobicContact CD1-CD1 3.77Å; C766-I770 VanDerWaalsContact O-CG1 3.3Å; C766-I770 WeakPolarHBondContact O-CG1 3.2Å; C766-I770 PolarHBondContact O-N 2.86Å; L767-I770 PolarHBondContact O-N 3.04Å; R768-I770 PolarHBondContact O-N 3.41Å; I770-L772 VanDerWaalsContact C-N 3.29Å; I770-L772 PolarHBondContact O-N 3.38Å; I770-R773 PolarHBondContact O-N 3.02Å; I770-I774 HydrophobicContact CG2-CD1 4.11Å; I770-I774 HydrophobicContact CG2-CG1 4.36Å; I770-I774 PolarHBondContact O-N 3.28Å; I770-I918 HydrophobicContact CG2-CD1 4.37Å; I770-L926 HydrophobicContact CB-CD1 4.44Å; I770-L926 HydrophobicContact CG1-CD1 3.95Å; I770-L933 HydrophobicContact CD1-CD1 4.18Å; I770-L933 HydrophobicContact CD1-CD2 4.25Å; I770-L933 HydrophobicContact CG1-CD2 4.47Å
771	S	90.7	Very high	87.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-32.9	-174.2	78.4	0	0	0	0	114.1	S742 C745 Y749 L767 R768 R773 I774	S742-S771 PolarHBondContact O-OG 3.46Å; C745-S771 WeakPolarHBondContact CB-O 3.3Å; C745-S771 WeakPolarHBondContact CB-OG 3.24Å; Y749-S771 WeakPolarHBondContact CD2-O 3.4Å; Y749-S771 WeakPolarHBondContact CE2-O 3.27Å; L767-S771 WeakPolarHBondContact O-CB 3.33Å; L767-S771 PolarHBondContact O-N 2.91Å; R768-S771 PolarHBondContact O-N 3.12Å; R768-S771 VanDerWaalsContact O-N 3.13Å; R768-S771 PolarHBondContact O-OG 3.39Å; S771-R773 PolarHBondContact O-N 3.48Å; S771-I774 PolarHBondContact O-N 2.9Å
772	L	88.6	Confident	88.1	Confident	35 Å²	35	40.8 Å²	40.8	18%	0.183	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-21.1	176.5	-70.1	172.6	0	0	0	113.3	E738 Q741 R768 I770 R775	E738-L772 HydrophobicContact CG-CD1 4.47Å; Q741-L772 HydrophobicContact CB-CD2 3.78Å; R768-L772 PolarHBondContact O-N 3.24Å; R768-L772 VanDerWaalsContact O-N 3.15Å; I770-L772 VanDerWaalsContact C-N 3.29Å; I770-L772 PolarHBondContact O-N 3.38Å; L772-R775 PolarHBondContact O-NH1 3.31Å; L772-R775 PolarHBondContact O-NH2 3.38Å
773	R	90	Very high	88.3	Confident	47 Å²	47	41.2 Å²	41.2	18%	0.177	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-16.7	-179.7	-58.8	-169.5	-171.3	-146	-2.7	113.7	I770 S771 I918 D922 E925	I770-R773 PolarHBondContact O-N 3.02Å; S771-R773 PolarHBondContact O-N 3.48Å; R773-I918 HydrophobicContact CB-CD1 4.01Å; R773-I918 HydrophobicContact CB-CG1 4.23Å; R773-D922 HydrophobicContact CB-CB 4.29Å; R773-D922 WeakPolarHBondContact CD-OD2 3.45Å; R773-D922 PolarHBondContact NH1-O 3.42Å; R773-E925 IonicContact CZ-OE1 3.47Å; R773-E925 IonicContact CZ-OE2 3.41Å; R773-E925 IonicContact NH1-OE1 3.31Å; R773-E925 IonicContact NH1-OE2 2.92Å; R773-E925 PolarHBondContact NH1-OE2 3.47Å; R773-E925 IonicContact NH2-OE1 2.72Å; R773-E925 PolarHBondContact NH2-OE1 3.4Å; R773-E925 IonicContact NH2-OE2 3.61Å; R773-E925 PolarHBondContact NH2-OE2 3.02Å
774	I	91	Very high	88.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.212	C	C	.	.			trans	-63.9	140.8	173.8	-63.1	171.6	0	0	0	110.3	Y749 F752 L753 I770 S771 Q916 F917	Y749-I774 HydrophobicContact CD1-CB 4.29Å; Y749-I774 HydrophobicContact CD1-CG2 3.5Å; Y749-I774 VanDerWaalsContact CD1-CG2 3.5Å; Y749-I774 HydrophobicContact CD2-CB 3.7Å; Y749-I774 HydrophobicContact CD2-CD1 4.35Å; Y749-I774 HydrophobicContact CD2-CG2 3.85Å; Y749-I774 HydrophobicContact CE1-CB 4.48Å; Y749-I774 HydrophobicContact CE1-CG2 3.71Å; Y749-I774 HydrophobicContact CE2-CB 3.9Å; Y749-I774 HydrophobicContact CE2-CG2 4.03Å; Y749-I774 HydrophobicContact CG-CB 3.91Å; Y749-I774 HydrophobicContact CG-CD1 4.14Å; Y749-I774 HydrophobicContact CG-CG2 3.59Å; Y749-I774 PolarHBondContact OH-O 3.41Å; F752-I774 HydrophobicContact CD1-CD1 3.52Å; F752-I774 HydrophobicContact CD1-CG1 4.49Å; F752-I774 HydrophobicContact CD2-CD1 4.43Å; F752-I774 HydrophobicContact CE1-CD1 3.68Å; F752-I774 HydrophobicContact CE1-CG1 4.24Å; F752-I774 HydrophobicContact CG-CD1 3.95Å; F752-I774 HydrophobicContact CZ-CD1 4.2Å; F752-I774 HydrophobicContact CZ-CG1 4.33Å; L753-I774 HydrophobicContact CD2-CD1 4.31Å; L753-I774 HydrophobicContact CG-CD1 4.49Å; I770-I774 HydrophobicContact CG2-CD1 4.11Å; I770-I774 HydrophobicContact CG2-CG1 4.36Å; I770-I774 PolarHBondContact O-N 3.28Å; S771-I774 PolarHBondContact O-N 2.9Å; I774-Q916 HydrophobicContact CG2-CB 4.24Å; I774-F917 CarbonylContact C-O 3.57Å; I774-F917 WeakPolarHBondContact CA-O 3.26Å
775	R	89.3	Confident	88.7	Confident	88 Å²	88	35.5 Å²	35.5	33%	0.332	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	168.3	173.9	-57.6	-62.7	169.5	-109.4	-0.2	109.6	L772 Q916 F917	L772-R775 PolarHBondContact O-NH1 3.31Å; L772-R775 PolarHBondContact O-NH2 3.38Å; R775-Q916 CarbonylContact O-C 3.57Å; R775-Q916 WeakPolarHBondContact O-CA 3.45Å; R775-F917 HydrophobicContact CB-CD1 4.02Å; R775-F917 HydrophobicContact CB-CD2 4.24Å; R775-F917 HydrophobicContact CB-CE1 3.57Å; R775-F917 HydrophobicContact CB-CE2 3.81Å; R775-F917 HydrophobicContact CB-CG 4.34Å; R775-F917 HydrophobicContact CB-CZ 3.46Å; R775-F917 VanDerWaalsContact CB-CZ 3.46Å; R775-F917 HydrophobicContact CG-CE2 4.2Å; R775-F917 HydrophobicContact CG-CZ 4.15Å; R775-F917 PolarHBondContact N-O 3.28Å; R775-F917 PolarHBondContact O-N 3.28Å
776	S	88.2	Confident	88.9	Confident	68 Å²	68	34.4 Å²	34.4	48%	0.476	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	138.8	177.2	-152.8	0	0	0	0	109.8	V915	S776-V915 CarbonylContact C-O 3.57Å; S776-V915 WeakPolarHBondContact CA-O 3.47Å
777	S	86.4	Confident	89	Confident	39 Å²	39	38.3 Å²	38.3	27%	0.273	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	151.5	169.3	-169.2	0	0	0	0	109.2	V915	S777-V915 PolarHBondContact N-O 2.91Å; S777-V915 PolarHBondContact O-N 3.35Å
778	H	86.4	Confident	88.9	Confident	33 Å²	33	39.9 Å²	39.9	15%	0.153	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	128.1	172.8	-177.7	71.5	0	0	0	108.5	H723 Y912 D914	H723-H778 AromaticContact CE1-CE1 3.99Å; H723-H778 AromaticContact CE1-ND1 3.63Å; H723-H778 AromaticContact ND1-CE1 3.45Å; H723-H778 PolarHBondContact ND1-CE1 3.49Å; H723-H778 AromaticContact ND1-CG 3.89Å; H723-H778 AromaticContact ND1-ND1 3.42Å; H723-H778 PolarHBondContact ND1-ND1 3.48Å; H723-H778 AromaticContact ND1-NE2 3.89Å; H778-Y912 AromaticContact NE2-CD1 3.82Å; H778-D914 IonicContact CE1-OD1 2.67Å; H778-D914 PolarHBondContact CE1-OD1 2.92Å; H778-D914 IonicContact CG-OD1 2.74Å; H778-D914 IonicContact ND1-OD1 3.17Å; H778-D914 PolarHBondContact ND1-OD1 3.3Å
779	M	87.1	Confident	88.8	Confident	6 Å²	6	38.8 Å²	38.8	3%	0.03	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.1	-176.1	-62.6	-179	70.3	0	0	110.7	D783 L785 L803 A909 Y912 A913 V915	M779-D783 HydrophobicContact CE-CB 4.06Å; M779-D783 WeakPolarHBondContact CE-O 3.37Å; M779-L785 HydrophobicContact CE-CB 3.6Å; M779-L785 HydrophobicContact SD-CB 3.75Å; M779-L785 HydrophobicContact SD-CD1 4.08Å; M779-L785 HydrophobicContact SD-CD2 4.02Å; M779-L785 HydrophobicContact SD-CG 4.17Å; M779-L803 HydrophobicContact SD-CD2 3.94Å; M779-A909 HydrophobicContact CB-CB 3.93Å; M779-A909 HydrophobicContact CE-CB 3.82Å; M779-A909 HydrophobicContact SD-CB 4.35Å; M779-Y912 CarbonylContact O-C 3.59Å; M779-Y912 VanDerWaalsContact O-CA 3.3Å; M779-Y912 WeakPolarHBondContact O-CA 3.47Å; M779-A913 HydrophobicContact CB-CB 4.39Å; M779-A913 PolarHBondContact N-O 3Å; M779-A913 PolarHBondContact O-N 3.45Å; M779-V915 HydrophobicContact SD-CG2 4.16Å
780	P	85.3	Confident	88.7	Confident	10 Å²	10	38.9 Å²	38.9	7%	0.065	22%	0.224	C	C	.	.			trans	-76	165.4	164.7	33.3	-34.4	0	0	0	111.5	D783 A909 Y912	P780-D783 WeakPolarHBondContact CD-OD2 3.49Å; P780-D783 HydrophobicContact CG-CB 4.05Å; P780-D783 WeakPolarHBondContact O-CB 3.45Å; P780-D783 PolarHBondContact O-N 2.91Å; P780-A909 WeakPolarHBondContact O-CB 3.42Å; P780-Y912 HydrophobicContact CB-CD1 4.32Å; P780-Y912 HydrophobicContact CB-CE1 3.99Å
781	P	86.7	Confident	88.6	Confident	51 Å²	51	43.2 Å²	43.2	33%	0.331	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	146.3	171.3	-23.6	32.7	0	0	0	112.6	D783 Y912	P781-D783 PolarHBondContact O-N 3.46Å; P781-Y912 HydrophobicContact CG-CD2 4.19Å; P781-Y912 HydrophobicContact CG-CE2 4.08Å
782	S	84.8	Confident	88.5	Confident	90 Å²	90	43.4 Å²	43.4	63%	0.629	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	-2.7	-176.9	-53.5	0	0	0	0	116.7	R908 A909	S782-R908 WeakPolarHBondContact O-CG 3.38Å; S782-A909 PolarHBondContact N-O 2.99Å
783	D	87.7	Confident	88.5	Confident	25 Å²	25	45.2 Å²	45.2	13%	0.134	26%	0.261	C	S	.	.			trans	-72.5	139.5	174.2	-98.8	19.6	0	0	0	112.2	R712 M779 P780 P781 R908 A909	R712-D783 IonicContact CZ-OD1 2.68Å; R712-D783 IonicContact NE-OD1 3.15Å; R712-D783 PolarHBondContact NE-OD1 3.46Å; R712-D783 IonicContact NH2-OD1 2.71Å; R712-D783 PolarHBondContact NH2-OD1 3.04Å; R712-D783 IonicContact NH2-OD2 3.48Å; M779-D783 HydrophobicContact CE-CB 4.06Å; M779-D783 WeakPolarHBondContact CE-O 3.37Å; P780-D783 WeakPolarHBondContact CD-OD2 3.49Å; P780-D783 HydrophobicContact CG-CB 4.05Å; P780-D783 WeakPolarHBondContact O-CB 3.45Å; P780-D783 PolarHBondContact O-N 2.91Å; P781-D783 PolarHBondContact O-N 3.46Å; D783-R908 CarbonylContact O-C 3.58Å; D783-R908 VanDerWaalsContact O-CA 3.27Å; D783-R908 WeakPolarHBondContact O-CA 3.37Å; D783-R908 WeakPolarHBondContact O-CG 3.21Å; D783-A909 PolarHBondContact O-N 3.26Å
784	T	90.2	Very high	88.5	Confident	37 Å²	37	43 Å²	43	23%	0.227	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.1	175	42	0	0	0	0	111.3	H787 V907 R908	T784-H787 WeakPolarHBondContact CB-NE2 3.31Å; T784-H787 PolarHBondContact OG1-NE2 2.93Å; T784-V907 CarbonylContact C-O 3.51Å; T784-V907 WeakPolarHBondContact CA-O 3.43Å; T784-R908 HydrophobicContact CG2-CB 4.1Å; T784-R908 HydrophobicContact CG2-CG 3.96Å
785	L	91.6	Very high	88.5	Confident	37 Å²	37	43.1 Å²	43.1	19%	0.194	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-37.7	177.2	-172.6	59.9	0	0	0	112.5	M779 Y796 F822 V907 V915	M779-L785 HydrophobicContact CE-CB 3.6Å; M779-L785 HydrophobicContact SD-CB 3.75Å; M779-L785 HydrophobicContact SD-CD1 4.08Å; M779-L785 HydrophobicContact SD-CD2 4.02Å; M779-L785 HydrophobicContact SD-CG 4.17Å; L785-Y796 HydrophobicContact CD1-CE1 4.21Å; L785-Y796 HydrophobicContact CD2-CD1 3.79Å; L785-Y796 HydrophobicContact CD2-CE1 3.88Å; L785-Y796 HydrophobicContact CD2-CG 4.29Å; L785-Y796 HydrophobicContact CG-CE1 4.16Å; L785-F822 HydrophobicContact CD2-CE2 3.91Å; L785-F822 HydrophobicContact CD2-CZ 3.69Å; L785-V907 PolarHBondContact N-O 3.24Å; L785-V915 HydrophobicContact CD2-CG1 4.15Å
786	V	91.5	Very high	88.7	Confident	7 Å²	7	40.2 Å²	40.2	4%	0.042	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	135.8	-178.1	-176.9	0	0	0	0	106.7	D790 L792 Y796 A906 V907	V786-D790 HydrophobicContact CG1-CB 4.09Å; V786-L792 HydrophobicContact CG1-CD2 4.11Å; V786-Y796 HydrophobicContact CG2-CE2 4.35Å; V786-A906 CarbonylContact O-C 3.46Å; V786-A906 WeakPolarHBondContact O-CA 3.3Å; V786-V907 HydrophobicContact CB-CB 4.35Å; V786-V907 HydrophobicContact CB-CG2 4.25Å; V786-V907 PolarHBondContact O-N 3.2Å
787	H	91.4	Very high	88.9	Confident	86 Å²	86	37.8 Å²	37.8	40%	0.398	22%	0.223	S	C	.	.			trans	-104.9	160	176.1	-49.8	81.5	0	0	0	111	T784 G789 D790	T784-H787 WeakPolarHBondContact CB-NE2 3.31Å; T784-H787 PolarHBondContact OG1-NE2 2.93Å; H787-G789 PolarHBondContact O-N 3.48Å; H787-G789 VanDerWaalsContact O-N 3.14Å; H787-D790 WeakPolarHBondContact CB-OD2 3.33Å; H787-D790 IonicContact CG-OD2 2.59Å; H787-D790 PolarHBondContact N-OD2 2.87Å; H787-D790 IonicContact ND1-OD2 3.58Å; H787-D790 PolarHBondContact ND1-OD2 2.92Å; H787-D790 WeakPolarHBondContact O-CB 3.44Å; H787-D790 PolarHBondContact O-N 3.32Å; H787-D790 VanDerWaalsContact O-N 3.1Å
788	T	89.7	Confident	89.2	Confident	59 Å²	59	36 Å²	36	36%	0.362	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	115.5	171.9	51.1	0	0	0	0	110.3	T808 A906	T788-T808 HydrophobicContact CG2-CG2 3.71Å; T788-A906 HydrophobicContact CG2-CB 4.28Å
789	G	86.1	Confident	89.4	Confident	35 Å²	35	35.8 Å²	35.8	36%	0.361	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	101.4	-10.6	-177.7	0	0	0	0	0	115.8	H787 K902 S903	H787-G789 PolarHBondContact O-N 3.48Å; H787-G789 VanDerWaalsContact O-N 3.14Å; G789-K902 WeakPolarHBondContact O-CD 3.2Å; G789-K902 WeakPolarHBondContact O-CG 3.35Å; G789-S903 WeakPolarHBondContact CA-O 3.5Å; G789-S903 PolarHBondContact N-O 3.45Å
790	D	89.1	Confident	89.6	Confident	63 Å²	63	41.2 Å²	41.2	34%	0.337	23%	0.234	S	C	.	.			trans	-63.7	147.4	177.4	-76.1	-10.1	0	0	0	111.4	V786 H787 K902 S903	V786-D790 HydrophobicContact CG1-CB 4.09Å; H787-D790 WeakPolarHBondContact CB-OD2 3.33Å; H787-D790 IonicContact CG-OD2 2.59Å; H787-D790 PolarHBondContact N-OD2 2.87Å; H787-D790 IonicContact ND1-OD2 3.58Å; H787-D790 PolarHBondContact ND1-OD2 2.92Å; H787-D790 WeakPolarHBondContact O-CB 3.44Å; H787-D790 PolarHBondContact O-N 3.32Å; H787-D790 VanDerWaalsContact O-N 3.1Å; D790-K902 CarbonylContact O-C 3.48Å; D790-K902 VanDerWaalsContact O-CA 3.3Å; D790-K902 WeakPolarHBondContact O-CA 3.35Å; D790-S903 PolarHBondContact O-N 3.29Å
791	L	88.8	Confident	89.9	Confident	91 Å²	91	41.7 Å²	41.7	48%	0.476	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-74.1	129.6	174.8	-63.7	174	0	0	0	109.9	T793 P900 K902	L791-T793 VanDerWaalsContact C-N 3.29Å; L791-T793 HydrophobicContact CB-CG2 4.18Å; L791-T793 PolarHBondContact O-N 2.94Å; L791-P900 HydrophobicContact CB-CB 4.38Å; L791-P900 HydrophobicContact CB-CG 4.03Å; L791-P900 HydrophobicContact CD1-CG 4.27Å; L791-P900 HydrophobicContact CD2-CG 4.27Å; L791-P900 WeakPolarHBondContact CD2-O 3.39Å; L791-P900 HydrophobicContact CG-CG 4.42Å; L791-K902 HydrophobicContact CD2-CG 3.82Å
792	L	87.9	Confident	90.2	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.021	23%	0.233	C	C	.	.			trans	-77.8	81.7	177.9	-62.3	177.5	0	0	0	110.5	V786 P901 L947 T948	V786-L792 HydrophobicContact CG1-CD2 4.11Å; L792-P901 HydrophobicContact CD1-CG 4.41Å; L792-P901 PolarHBondContact N-O 2.95Å; L792-L947 HydrophobicContact CD1-CB 3.76Å; L792-L947 HydrophobicContact CD2-CB 4.25Å; L792-L947 HydrophobicContact CD2-CD1 3.75Å; L792-T948 HydrophobicContact CD1-CG2 3.47Å; L792-T948 VanDerWaalsContact CD1-CG2 3.47Å
793	T	88.6	Confident	90.7	Very high	74 Å²	74	36 Å²	36	45%	0.454	20%	0.203	S	C	.	.			trans	-84	-14.9	-176	50.1	0	0	0	0	114.4	L791 R920	L791-T793 VanDerWaalsContact C-N 3.29Å; L791-T793 HydrophobicContact CB-CG2 4.18Å; L791-T793 PolarHBondContact O-N 2.94Å; T793-R920 WeakPolarHBondContact O-CB 3.29Å; T793-R920 PolarHBondContact O-N 3.01Å
794	A	91.2	Very high	90.9	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.008	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	161.7	-176.1	0	0	0	0	0	112.8	Y796 G824 F917 I918	A794-Y796 HydrophobicContact CB-CE1 4.45Å; A794-Y796 HydrophobicContact CB-CE2 3.92Å; A794-G824 PolarHBondContact O-N 3.22Å; A794-F917 HydrophobicContact CB-CD2 4.13Å; A794-I918 WeakPolarHBondContact CA-O 3.49Å; A794-I918 WeakPolarHBondContact CB-O 3.31Å
795	M	90.6	Very high	91.1	Very high	1 Å²	1	34 Å²	34	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.8	169.7	-174.1	-170.4	83.5	0	0	108.6	F752 F759 F821 L825 F917 I918 L923 F941	F752-M795 HydrophobicContact CE1-CE 4.3Å; F752-M795 HydrophobicContact CE2-CE 4.29Å; F752-M795 HydrophobicContact CZ-CE 3.57Å; F759-M795 HydrophobicContact CZ-CE 4.24Å; M795-F821 HydrophobicContact CE-CD1 4.22Å; M795-F821 HydrophobicContact CE-CE1 4.21Å; M795-L825 HydrophobicContact SD-CD2 3.63Å; M795-F917 CarbonylContact O-C 3.57Å; M795-F917 WeakPolarHBondContact O-CA 3.4Å; M795-F917 WeakPolarHBondContact O-CB 3.36Å; M795-I918 HydrophobicContact CB-CG2 4.26Å; M795-I918 HydrophobicContact CE-CG2 3.97Å; M795-I918 PolarHBondContact N-O 3.26Å; M795-I918 PolarHBondContact O-N 3Å; M795-L923 HydrophobicContact SD-CD2 4.1Å; M795-F941 HydrophobicContact CE-CE2 4.03Å; M795-F941 HydrophobicContact CE-CZ 3.82Å; M795-F941 HydrophobicContact CG-CZ 4.23Å; M795-F941 HydrophobicContact SD-CE1 3.69Å; M795-F941 HydrophobicContact SD-CE2 3.94Å; M795-F941 HydrophobicContact SD-CZ 3.29Å; M795-F941 WeakPolarHBondContact SD-CZ 3.42Å
796	Y	92.5	Very high	91	Very high	28 Å²	28	32.3 Å²	32.3	11%	0.11	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	154.6	-172.4	-60.9	-89.3	0	0	0	111.6	L785 V786 A794 F821 F822 V915 Q916 F917	L785-Y796 HydrophobicContact CD1-CE1 4.21Å; L785-Y796 HydrophobicContact CD2-CD1 3.79Å; L785-Y796 HydrophobicContact CD2-CE1 3.88Å; L785-Y796 HydrophobicContact CD2-CG 4.29Å; L785-Y796 HydrophobicContact CG-CE1 4.16Å; V786-Y796 HydrophobicContact CG2-CE2 4.35Å; A794-Y796 HydrophobicContact CB-CE1 4.45Å; A794-Y796 HydrophobicContact CB-CE2 3.92Å; Y796-F821 VanDerWaalsContact O-CA 3.32Å; Y796-F821 WeakPolarHBondContact O-CA 3.27Å; Y796-F822 VanDerWaalsContact CB-CE1 3.43Å; Y796-F822 HydrophobicContact CD1-CZ 4.47Å; Y796-F822 HydrophobicContact CD2-CD2 4.2Å; Y796-F822 AromaticContact CD2-CE2 3.9Å; Y796-F822 HydrophobicContact CD2-CE2 3.9Å; Y796-F822 HydrophobicContact CD2-CZ 4.39Å; Y796-F822 HydrophobicContact CG-CD2 4.4Å; Y796-F822 HydrophobicContact CG-CE1 4.42Å; Y796-F822 AromaticContact CG-CE2 3.85Å; Y796-F822 HydrophobicContact CG-CE2 3.85Å; Y796-F822 AromaticContact CG-CZ 3.86Å; Y796-F822 HydrophobicContact CG-CZ 3.86Å; Y796-F822 PolarHBondContact N-O 3.46Å; Y796-F822 PolarHBondContact O-N 2.77Å; Y796-V915 HydrophobicContact CD1-CG1 3.83Å; Y796-V915 HydrophobicContact CG-CG1 4.35Å; Y796-Q916 CarbonylContact C-O 3.52Å; Y796-Q916 WeakPolarHBondContact CA-O 3.43Å; Y796-F917 HydrophobicContact CD1-CB 3.48Å; Y796-F917 VanDerWaalsContact CD1-CB 3.48Å; Y796-F917 HydrophobicContact CD1-CG 4.2Å; Y796-F917 HydrophobicContact CE1-CB 3.8Å; Y796-F917 HydrophobicContact CE1-CD1 4.4Å; Y796-F917 HydrophobicContact CE1-CG 4.05Å; Y796-F917 HydrophobicContact CG-CB 4.19Å
797	Y	92.9	Very high	90.9	Very high	17 Å²	17	33.3 Å²	33.3	7%	0.067	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	127.4	178.8	173.9	-103.1	0	0	0	110.1	H751 F752 V799 G819 D820 F821 V915 Q916	H751-Y797 HydrophobicContact CB-CE1 4.37Å; H751-Y797 PolarHBondContact O-OH 2.87Å; F752-Y797 HydrophobicContact CB-CD1 3.94Å; F752-Y797 HydrophobicContact CB-CE1 4.3Å; F752-Y797 HydrophobicContact CB-CG 4.35Å; F752-Y797 VanDerWaalsContact CD2-CB 3.48Å; F752-Y797 HydrophobicContact CD2-CD1 4.13Å; F752-Y797 AromaticContact CD2-CG 3.93Å; F752-Y797 HydrophobicContact CD2-CG 3.93Å; F752-Y797 HydrophobicContact CG-CD1 4.44Å; F752-Y797 HydrophobicContact CG-CG 4.41Å; Y797-V799 HydrophobicContact CD1-CG2 3.79Å; Y797-V799 HydrophobicContact CE1-CB 4.44Å; Y797-V799 HydrophobicContact CE1-CG2 3.96Å; Y797-V799 PolarHBondContact O-N 3.37Å; Y797-G819 WeakPolarHBondContact CE2-O 3.23Å; Y797-D820 WeakPolarHBondContact CA-O 3.35Å; Y797-F821 AromaticContact CD2-CD1 3.8Å; Y797-F821 HydrophobicContact CD2-CD1 3.8Å; Y797-F821 AromaticContact CD2-CD2 3.86Å; Y797-F821 HydrophobicContact CD2-CD2 3.86Å; Y797-F821 AromaticContact CD2-CE1 3.47Å; Y797-F821 HydrophobicContact CD2-CE1 3.47Å; Y797-F821 VanDerWaalsContact CD2-CE1 3.47Å; Y797-F821 AromaticContact CD2-CE2 3.51Å; Y797-F821 HydrophobicContact CD2-CE2 3.51Å; Y797-F821 HydrophobicContact CD2-CG 4.01Å; Y797-F821 AromaticContact CD2-CZ 3.31Å; Y797-F821 HydrophobicContact CD2-CZ 3.31Å; Y797-F821 HydrophobicContact CE2-CD2 4.33Å; Y797-F821 HydrophobicContact CE2-CE1 4.39Å; Y797-F821 AromaticContact CE2-CE2 3.75Å; Y797-F821 HydrophobicContact CE2-CE2 3.75Å; Y797-F821 AromaticContact CE2-CZ 3.8Å; Y797-F821 HydrophobicContact CE2-CZ 3.8Å; Y797-F821 HydrophobicContact CG-CD1 4.28Å; Y797-F821 AromaticContact CG-CE1 3.89Å; Y797-F821 HydrophobicContact CG-CE1 3.89Å; Y797-F821 HydrophobicContact CG-CZ 4.09Å; Y797-V915 WeakPolarHBondContact O-CA 3.39Å; Y797-Q916 HydrophobicContact CD1-CB 4.46Å; Y797-Q916 PolarHBondContact N-O 2.92Å; Y797-Q916 PolarHBondContact O-N 3.03Å
798	V	93	Very high	90.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	114.7	177.6	-173.2	0	0	0	0	109.7	L803 L816 N817 P818 G819 D820 F822	V798-L803 HydrophobicContact CG2-CD1 3.89Å; V798-L803 HydrophobicContact CG2-CG 4.41Å; V798-L816 HydrophobicContact CG2-CB 4.09Å; V798-N817 WeakPolarHBondContact CB-O 3.43Å; V798-P818 WeakPolarHBondContact O-CA 3.17Å; V798-G819 PolarHBondContact O-N 3.39Å; V798-D820 PolarHBondContact N-O 2.84Å; V798-F822 HydrophobicContact CG2-CD1 4.26Å; V798-F822 HydrophobicContact CG2-CE1 3.76Å
799	V	91.2	Very high	90.3	Very high	30 Å²	30	36.4 Å²	36.4	18%	0.182	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-40.2	177.8	-168.4	0	0	0	0	111.3	Y797 D914 Q916	Y797-V799 HydrophobicContact CD1-CG2 3.79Å; Y797-V799 HydrophobicContact CE1-CB 4.44Å; Y797-V799 HydrophobicContact CE1-CG2 3.96Å; Y797-V799 PolarHBondContact O-N 3.37Å; V799-D914 WeakPolarHBondContact CA-O 3.39Å; V799-D914 HydrophobicContact CB-CB 4.04Å; V799-D914 VanDerWaalsContact CB-O 3.32Å; V799-D914 WeakPolarHBondContact CB-O 3.38Å; V799-D914 PolarHBondContact N-O 3.27Å; V799-Q916 HydrophobicContact CG2-CB 3.97Å; V799-Q916 HydrophobicContact CG2-CG 3.56Å
800	K	90.7	Very high	90.1	Very high	119 Å²	119	39.7 Å²	39.7	52%	0.517	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	161	177.2	-56.3	-164.2	-155.8	106.1	0	110.6	A913 D914	K800-A913 VanDerWaalsContact O-CA 3.27Å; K800-A913 WeakPolarHBondContact O-CA 3.49Å; K800-D914 HydrophobicContact CB-CB 4.1Å; K800-D914 WeakPolarHBondContact CD-OD2 3.48Å; K800-D914 HydrophobicContact CG-CB 4.37Å; K800-D914 PolarHBondContact N-O 2.93Å; K800-D914 IonicContact NZ-OD2 2.7Å; K800-D914 PolarHBondContact NZ-OD2 3.47Å; K800-D914 PolarHBondContact O-N 3.49Å
801	G	91.1	Very high	90.1	Very high	21 Å²	21	41.4 Å²	41.4	22%	0.216	23%	0.226	C	C	.	.	S	Bend	trans	77.2	-174.6	-179.3	0	0	0	0	0	112.5	P818 T911 Y912	G801-P818 VanDerWaalsContact O-CD 3.31Å; G801-P818 WeakPolarHBondContact O-CD 3.47Å; G801-P818 WeakPolarHBondContact O-CG 3.44Å; G801-T911 WeakPolarHBondContact CA-OG1 3.48Å; G801-Y912 WeakPolarHBondContact CA-O 3.29Å
802	S	93.7	Very high	90.1	Very high	22 Å²	22	41.8 Å²	41.8	15%	0.154	23%	0.227	C	C	.	.			trans	-129.2	147	174.9	53.1	0	0	0	0	112	L816 L910 T911	S802-L816 VanDerWaalsContact CA-O 3.31Å; S802-L816 WeakPolarHBondContact CA-O 3.48Å; S802-L910 PolarHBondContact O-N 2.96Å; S802-T911 PolarHBondContact N-OG1 2.88Å; S802-T911 VanDerWaalsContact N-OG1 3.08Å
803	L	94.6	Very high	90	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	138.1	175.7	-48.2	172.4	0	0	0	108.8	M779 V798 V815 L816 F822 V907 R908 A909 A913 V915	M779-L803 HydrophobicContact SD-CD2 3.94Å; V798-L803 HydrophobicContact CG2-CD1 3.89Å; V798-L803 HydrophobicContact CG2-CG 4.41Å; L803-V815 CarbonylContact O-C 3.57Å; L803-V815 VanDerWaalsContact O-CA 3.31Å; L803-V815 WeakPolarHBondContact O-CA 3.42Å; L803-L816 HydrophobicContact CB-CB 4.25Å; L803-L816 HydrophobicContact CB-CD1 4.38Å; L803-L816 HydrophobicContact CD1-CD1 4.35Å; L803-L816 PolarHBondContact N-O 2.87Å; L803-L816 PolarHBondContact O-N 3.35Å; L803-F822 HydrophobicContact CD1-CE1 3.71Å; L803-F822 HydrophobicContact CD1-CE2 4.4Å; L803-F822 HydrophobicContact CD1-CZ 3.48Å; L803-F822 VanDerWaalsContact CD1-CZ 3.48Å; L803-V907 HydrophobicContact CB-CG1 3.92Å; L803-V907 HydrophobicContact CD1-CG1 3.9Å; L803-V907 HydrophobicContact CG-CG1 4.47Å; L803-R908 CarbonylContact C-O 3.56Å; L803-R908 VanDerWaalsContact CA-O 3.24Å; L803-R908 WeakPolarHBondContact CA-O 3.35Å; L803-A909 HydrophobicContact CD2-CB 3.75Å; L803-A913 HydrophobicContact CD2-CB 3.67Å; L803-V915 HydrophobicContact CD1-CG2 4.17Å
804	E	93.5	Very high	89.9	Confident	18 Å²	18	43.2 Å²	43.2	8%	0.084	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	143.7	166.8	54.9	174.9	-163.9	0	0	110.7	V806 I812 V907 R908 L910	E804-V806 HydrophobicContact CB-CG2 4.04Å; E804-V806 HydrophobicContact CG-CG2 3.64Å; E804-I812 HydrophobicContact CB-CG2 4.31Å; E804-I812 WeakPolarHBondContact OE2-CD1 3.32Å; E804-V907 WeakPolarHBondContact O-CA 3.44Å; E804-R908 HydrophobicContact CG-CB 3.85Å; E804-R908 WeakPolarHBondContact CG-O 3.35Å; E804-R908 PolarHBondContact N-O 3.46Å; E804-R908 PolarHBondContact O-N 3.03Å; E804-R908 VanDerWaalsContact OE1-CD 3.28Å; E804-R908 WeakPolarHBondContact OE1-CD 3.33Å; E804-R908 IonicContact OE1-CZ 3.61Å; E804-R908 IonicContact OE1-NE 2.71Å; E804-R908 IonicContact OE1-NH1 2.74Å; E804-R908 PolarHBondContact OE1-NH1 2.92Å; E804-L910 HydrophobicContact CB-CD1 4.15Å; E804-L910 HydrophobicContact CB-CD2 4.14Å; E804-L910 HydrophobicContact CB-CG 4.02Å; E804-L910 HydrophobicContact CG-CD2 3.92Å; E804-L910 HydrophobicContact CG-CG 4.03Å; E804-L910 WeakPolarHBondContact OE2-CD2 3.34Å
805	V	92.6	Very high	89.9	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	125.3	169.2	-176.1	0	0	0	0	108.2	L813 G814 L816 F905 A906 V907 L945 L947	V805-L813 PolarHBondContact O-N 3.07Å; V805-G814 PolarHBondContact N-O 2.88Å; V805-L816 HydrophobicContact CG2-CD1 3.79Å; V805-L816 HydrophobicContact CG2-CG 3.96Å; V805-F905 HydrophobicContact CG1-CB 3.69Å; V805-F905 HydrophobicContact CG1-CD2 4.29Å; V805-F905 HydrophobicContact CG1-CG 4.21Å; V805-A906 WeakPolarHBondContact CA-O 3.39Å; V805-V907 HydrophobicContact CG2-CG2 4.35Å; V805-L945 HydrophobicContact CB-CD1 4.17Å; V805-L945 HydrophobicContact CG1-CD1 4.33Å; V805-L945 HydrophobicContact CG1-CD2 3.99Å; V805-L945 HydrophobicContact CG2-CD1 4.08Å; V805-L947 HydrophobicContact CG1-CD2 3.93Å
806	V	91.3	Very high	90	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	138.9	-162.7	-168.3	0	0	0	0	110.9	E804 D810 I812 F905 A906	E804-V806 HydrophobicContact CB-CG2 4.04Å; E804-V806 HydrophobicContact CG-CG2 3.64Å; V806-D810 HydrophobicContact CG1-CB 4.47Å; V806-I812 HydrophobicContact CG2-CG1 4.46Å; V806-F905 CarbonylContact O-C 3.36Å; V806-F905 WeakPolarHBondContact O-CA 3.37Å; V806-F905 WeakPolarHBondContact O-CB 3.31Å; V806-A906 PolarHBondContact N-O 3.02Å; V806-A906 PolarHBondContact O-N 3.41Å
807	T	88.4	Confident	90	Very high	29 Å²	29	48.9 Å²	48.9	18%	0.178	27%	0.272	C	S	.	.			trans	-75.7	169.1	177.4	-49.2	0	0	0	0	110.9	D809 D810 I811 L813	T807-D809 PolarHBondContact O-N 3.18Å; T807-D809 VanDerWaalsContact O-N 3.07Å; T807-D810 PolarHBondContact O-N 3.33Å; T807-I811 WeakPolarHBondContact CB-O 3.43Å; T807-I811 PolarHBondContact N-O 2.81Å; T807-I811 PolarHBondContact OG1-O 3.03Å; T807-L813 WeakPolarHBondContact OG1-CG 3.4Å
808	T	84.7	Confident	89.9	Confident	93 Å²	93	51.9 Å²	51.9	57%	0.571	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-25	169.1	45.2	0	0	0	0	113.7	T788 D810	T788-T808 HydrophobicContact CG2-CG2 3.71Å; T808-D810 VanDerWaalsContact C-N 3.35Å
809	D	84.4	Confident	89.7	Confident	117 Å²	117	53.4 Å²	53.4	63%	0.626	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	22.4	-170.4	-46.8	-12.2	0	0	0	111	T807 I811	T807-D809 PolarHBondContact O-N 3.18Å; T807-D809 VanDerWaalsContact O-N 3.07Å; D809-I811 HydrophobicContact CB-CD1 4.32Å; D809-I811 HydrophobicContact CB-CG1 4.29Å; D809-I811 PolarHBondContact O-N 3.45Å
810	D	82.5	Confident	89.7	Confident	103 Å²	103	53.6 Å²	53.6	55%	0.551	31%	0.308	S	S	*	.	S	Bend	trans	54.9	12.7	-172.2	-88.7	-57.6	0	0	0	116	V806 T807 T808 I812 R908	V806-D810 HydrophobicContact CG1-CB 4.47Å; T807-D810 PolarHBondContact O-N 3.33Å; T808-D810 VanDerWaalsContact C-N 3.35Å; D810-I812 PolarHBondContact O-N 3.08Å; D810-R908 IonicContact OD1-CZ 3.46Å; D810-R908 IonicContact OD1-NH1 3.32Å; D810-R908 PolarHBondContact OD1-NH1 3.04Å; D810-R908 IonicContact OD1-NH2 2.67Å; D810-R908 PolarHBondContact OD1-NH2 3.36Å
811	I	87.9	Confident	89.7	Confident	99 Å²	99	48.4 Å²	48.4	51%	0.508	29%	0.286	S	S	.	.			trans	-72.2	115.6	174.3	-56.3	174.4	0	0	0	110.2	T807 D809 L813	T807-I811 WeakPolarHBondContact CB-O 3.43Å; T807-I811 PolarHBondContact N-O 2.81Å; T807-I811 PolarHBondContact OG1-O 3.03Å; D809-I811 HydrophobicContact CB-CD1 4.32Å; D809-I811 HydrophobicContact CB-CG1 4.29Å; D809-I811 PolarHBondContact O-N 3.45Å; I811-L813 PolarHBondContact O-N 2.95Å
812	I	88.3	Confident	89.7	Confident	99 Å²	99	47.4 Å²	47.4	51%	0.508	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	124.9	173	-56.2	170.2	0	0	0	109.6	E804 V806 D810	E804-I812 HydrophobicContact CB-CG2 4.31Å; E804-I812 WeakPolarHBondContact OE2-CD1 3.32Å; V806-I812 HydrophobicContact CG2-CG1 4.46Å; D810-I812 PolarHBondContact O-N 3.08Å
813	L	86	Confident	89.3	Confident	86 Å²	86	46.6 Å²	46.6	45%	0.45	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-23.1	179.1	-63.3	173.4	0	0	0	113	V805 T807 I811 F905	V805-L813 PolarHBondContact O-N 3.07Å; T807-L813 WeakPolarHBondContact OG1-CG 3.4Å; I811-L813 PolarHBondContact O-N 2.95Å; L813-F905 HydrophobicContact CD1-CD1 3.32Å; L813-F905 HydrophobicContact CD1-CD2 4.08Å; L813-F905 HydrophobicContact CD1-CE1 3.35Å; L813-F905 HydrophobicContact CD1-CE2 4.11Å; L813-F905 HydrophobicContact CD1-CG 3.7Å; L813-F905 HydrophobicContact CD1-CZ 3.76Å
814	G	87.3	Confident	88.6	Confident	23 Å²	23	46.8 Å²	46.8	24%	0.237	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.8	171.5	-178.5	0	0	0	0	0	112.5	V805	V805-G814 PolarHBondContact N-O 2.88Å
815	V	91.6	Very high	88	Confident	66 Å²	66	47.7 Å²	47.7	40%	0.4	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.1	178.6	178.5	0	0	0	0	109.3	L803 N817 L910	L803-V815 CarbonylContact O-C 3.57Å; L803-V815 VanDerWaalsContact O-CA 3.31Å; L803-V815 WeakPolarHBondContact O-CA 3.42Å; V815-N817 PolarHBondContact O-ND2 2.81Å; V815-N817 VanDerWaalsContact O-ND2 3.11Å; V815-L910 HydrophobicContact CG1-CD1 3.95Å; V815-L910 HydrophobicContact CG2-CD1 4.04Å
816	L	92.2	Very high	87.1	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.016	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	131.3	172.6	-56.2	166.9	0	0	0	109	V798 S802 L803 V805 D820 F822 V907 T944 L945	V798-L816 HydrophobicContact CG2-CB 4.09Å; S802-L816 VanDerWaalsContact CA-O 3.31Å; S802-L816 WeakPolarHBondContact CA-O 3.48Å; L803-L816 HydrophobicContact CB-CB 4.25Å; L803-L816 HydrophobicContact CB-CD1 4.38Å; L803-L816 HydrophobicContact CD1-CD1 4.35Å; L803-L816 PolarHBondContact N-O 2.87Å; L803-L816 PolarHBondContact O-N 3.35Å; V805-L816 HydrophobicContact CG2-CD1 3.79Å; V805-L816 HydrophobicContact CG2-CG 3.96Å; L816-D820 HydrophobicContact CB-CB 4.3Å; L816-D820 HydrophobicContact CD2-CB 4.21Å; L816-F822 HydrophobicContact CD1-CB 4.05Å; L816-F822 HydrophobicContact CD1-CD1 3.67Å; L816-F822 HydrophobicContact CD1-CD2 4.09Å; L816-F822 HydrophobicContact CD1-CE1 4.08Å; L816-F822 HydrophobicContact CD1-CE2 4.46Å; L816-F822 HydrophobicContact CD1-CG 3.67Å; L816-F822 HydrophobicContact CD1-CZ 4.44Å; L816-V907 HydrophobicContact CD1-CG1 4.27Å; L816-T944 HydrophobicContact CD2-CG2 4.26Å; L816-L945 HydrophobicContact CD2-CB 4.21Å
817	N	92.1	Very high	86	Confident	80 Å²	80	50.5 Å²	50.5	43%	0.428	30%	0.296	S	S	.	.			trans	-116.7	167.4	-173.7	-67.2	-80.4	0	0	0	111	V798 V815 G819 D820	V798-N817 WeakPolarHBondContact CB-O 3.43Å; V815-N817 PolarHBondContact O-ND2 2.81Å; V815-N817 VanDerWaalsContact O-ND2 3.11Å; N817-G819 PolarHBondContact O-N 2.93Å; N817-G819 VanDerWaalsContact O-N 3.14Å; N817-D820 PolarHBondContact N-OD2 2.69Å; N817-D820 WeakPolarHBondContact O-CB 3.39Å; N817-D820 PolarHBondContact O-N 3.42Å
818	P	91.2	Very high	85	Confident	80 Å²	80	50.2 Å²	50.2	52%	0.519	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	119.6	178.7	-25.6	36.7	0	0	0	112.2	V798 G801	V798-P818 WeakPolarHBondContact O-CA 3.17Å; G801-P818 VanDerWaalsContact O-CD 3.31Å; G801-P818 WeakPolarHBondContact O-CD 3.47Å; G801-P818 WeakPolarHBondContact O-CG 3.44Å
819	G	88.4	Confident	83.4	Confident	31 Å²	31	49.2 Å²	49.2	32%	0.32	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	115.4	-19.4	-171.8	0	0	0	0	0	114.5	Y797 V798 N817	Y797-G819 WeakPolarHBondContact CE2-O 3.23Å; V798-G819 PolarHBondContact O-N 3.39Å; N817-G819 PolarHBondContact O-N 2.93Å; N817-G819 VanDerWaalsContact O-N 3.14Å
820	D	90.8	Very high	81.7	Confident	34 Å²	34	46.1 Å²	46.1	18%	0.182	28%	0.282	C	S	.	.			trans	-78.1	144	-174.8	-75.4	-40.4	0	0	0	114.1	Y797 V798 L816 N817 T944	Y797-D820 WeakPolarHBondContact CA-O 3.35Å; V798-D820 PolarHBondContact N-O 2.84Å; L816-D820 HydrophobicContact CB-CB 4.3Å; L816-D820 HydrophobicContact CD2-CB 4.21Å; N817-D820 PolarHBondContact N-OD2 2.69Å; N817-D820 WeakPolarHBondContact O-CB 3.39Å; N817-D820 PolarHBondContact O-N 3.42Å; D820-T944 HydrophobicContact CB-CG2 4.21Å; D820-T944 WeakPolarHBondContact CB-OG1 3.32Å; D820-T944 WeakPolarHBondContact OD1-CB 3.28Å; D820-T944 WeakPolarHBondContact OD1-CG2 3.41Å; D820-T944 PolarHBondContact OD1-OG1 2.93Å
821	F	90.7	Very high	79.9	Confident	10 Å²	10	44.8 Å²	44.8	4%	0.044	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	135.9	174.5	-73.1	-86.8	0	0	0	111.5	F752 F759 M795 Y796 Y797 F941 L943 T944	F752-F821 HydrophobicContact CD2-CE1 4.26Å; F752-F821 HydrophobicContact CE2-CE1 4.17Å; F752-F821 HydrophobicContact CG-CE1 4.47Å; F752-F821 HydrophobicContact CZ-CE1 4.32Å; F759-F821 HydrophobicContact CE2-CE1 4.39Å; F759-F821 HydrophobicContact CE2-CZ 4.2Å; M795-F821 HydrophobicContact CE-CD1 4.22Å; M795-F821 HydrophobicContact CE-CE1 4.21Å; Y796-F821 VanDerWaalsContact O-CA 3.32Å; Y796-F821 WeakPolarHBondContact O-CA 3.27Å; Y797-F821 AromaticContact CD2-CD1 3.8Å; Y797-F821 HydrophobicContact CD2-CD1 3.8Å; Y797-F821 AromaticContact CD2-CD2 3.86Å; Y797-F821 HydrophobicContact CD2-CD2 3.86Å; Y797-F821 AromaticContact CD2-CE1 3.47Å; Y797-F821 HydrophobicContact CD2-CE1 3.47Å; Y797-F821 VanDerWaalsContact CD2-CE1 3.47Å; Y797-F821 AromaticContact CD2-CE2 3.51Å; Y797-F821 HydrophobicContact CD2-CE2 3.51Å; Y797-F821 HydrophobicContact CD2-CG 4.01Å; Y797-F821 AromaticContact CD2-CZ 3.31Å; Y797-F821 HydrophobicContact CD2-CZ 3.31Å; Y797-F821 HydrophobicContact CE2-CD2 4.33Å; Y797-F821 HydrophobicContact CE2-CE1 4.39Å; Y797-F821 AromaticContact CE2-CE2 3.75Å; Y797-F821 HydrophobicContact CE2-CE2 3.75Å; Y797-F821 AromaticContact CE2-CZ 3.8Å; Y797-F821 HydrophobicContact CE2-CZ 3.8Å; Y797-F821 HydrophobicContact CG-CD1 4.28Å; Y797-F821 AromaticContact CG-CE1 3.89Å; Y797-F821 HydrophobicContact CG-CE1 3.89Å; Y797-F821 HydrophobicContact CG-CZ 4.09Å; F821-F941 HydrophobicContact CB-CE1 4.2Å; F821-F941 HydrophobicContact CB-CZ 3.71Å; F821-F941 AromaticContact CD1-CE2 3.89Å; F821-F941 HydrophobicContact CD1-CE2 3.89Å; F821-F941 AromaticContact CD1-CZ 3.49Å; F821-F941 HydrophobicContact CD1-CZ 3.49Å; F821-F941 VanDerWaalsContact CD1-CZ 3.49Å; F821-F941 HydrophobicContact CD2-CE2 4.26Å; F821-F941 HydrophobicContact CD2-CZ 4.16Å; F821-F941 AromaticContact CE1-CE2 3.97Å; F821-F941 HydrophobicContact CE1-CE2 3.97Å; F821-F941 HydrophobicContact CE1-CZ 4.05Å; F821-F941 HydrophobicContact CE2-CE2 4.36Å; F821-F941 HydrophobicContact CG-CE1 4.46Å; F821-F941 HydrophobicContact CG-CE2 4.02Å; F821-F941 AromaticContact CG-CZ 3.53Å; F821-F941 HydrophobicContact CG-CZ 3.53Å; F821-F941 HydrophobicContact CZ-CE2 4.21Å; F821-L943 HydrophobicContact CB-CD2 4.37Å; F821-T944 PolarHBondContact N-OG1 3.13Å; F821-T944 PolarHBondContact O-N 2.77Å
822	F	90.5	Very high	77.6	Confident	1 Å²	1	46.1 Å²	46.1	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	174.9	-179.1	67.9	-79.5	0	0	0	111.7	L785 Y796 V798 L803 L816 V907 V915 L947	L785-F822 HydrophobicContact CD2-CE2 3.91Å; L785-F822 HydrophobicContact CD2-CZ 3.69Å; Y796-F822 VanDerWaalsContact CB-CE1 3.43Å; Y796-F822 HydrophobicContact CD1-CZ 4.47Å; Y796-F822 HydrophobicContact CD2-CD2 4.2Å; Y796-F822 AromaticContact CD2-CE2 3.9Å; Y796-F822 HydrophobicContact CD2-CE2 3.9Å; Y796-F822 HydrophobicContact CD2-CZ 4.39Å; Y796-F822 HydrophobicContact CG-CD2 4.4Å; Y796-F822 HydrophobicContact CG-CE1 4.42Å; Y796-F822 AromaticContact CG-CE2 3.85Å; Y796-F822 HydrophobicContact CG-CE2 3.85Å; Y796-F822 AromaticContact CG-CZ 3.86Å; Y796-F822 HydrophobicContact CG-CZ 3.86Å; Y796-F822 PolarHBondContact N-O 3.46Å; Y796-F822 PolarHBondContact O-N 2.77Å; V798-F822 HydrophobicContact CG2-CD1 4.26Å; V798-F822 HydrophobicContact CG2-CE1 3.76Å; L803-F822 HydrophobicContact CD1-CE1 3.71Å; L803-F822 HydrophobicContact CD1-CE2 4.4Å; L803-F822 HydrophobicContact CD1-CZ 3.48Å; L803-F822 VanDerWaalsContact CD1-CZ 3.48Å; L816-F822 HydrophobicContact CD1-CB 4.05Å; L816-F822 HydrophobicContact CD1-CD1 3.67Å; L816-F822 HydrophobicContact CD1-CD2 4.09Å; L816-F822 HydrophobicContact CD1-CE1 4.08Å; L816-F822 HydrophobicContact CD1-CE2 4.46Å; L816-F822 HydrophobicContact CD1-CG 3.67Å; L816-F822 HydrophobicContact CD1-CZ 4.44Å; F822-V907 HydrophobicContact CD2-CG2 4.4Å; F822-V907 HydrophobicContact CE2-CG1 4Å; F822-V907 HydrophobicContact CE2-CG2 4.35Å; F822-V907 HydrophobicContact CZ-CG1 4.39Å; F822-V915 HydrophobicContact CE1-CG1 4.29Å; F822-V915 HydrophobicContact CZ-CG1 4.14Å; F822-L947 HydrophobicContact CD2-CD1 4.35Å
823	G	86	Confident	75.1	Confident	4 Å²	4	49.8 Å²	49.8	4%	0.041	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	104.4	-144.6	-179.7	0	0	0	0	0	113.7
824	G	79.5	Confident	72.5	Confident	5 Å²	5	50.2 Å²	50.2	5%	0.052	30%	0.296	C	S	.	.			trans	-122.5	119.2	-173.3	0	0	0	0	0	114.2	A794	A794-G824 PolarHBondContact O-N 3.22Å
825	L	80.6	Confident	70	Confident	37 Å²	37	54 Å²	54	19%	0.194	32%	0.317	C	S	.	.			trans	-77	156.9	169.3	-73.9	166.4	0	0	0	111.9	M795 R920 L923 F941 L943	M795-L825 HydrophobicContact SD-CD2 3.63Å; L825-R920 PolarHBondContact O-NH1 2.99Å; L825-L923 HydrophobicContact CD2-CD2 4.36Å; L825-F941 HydrophobicContact CD1-CD1 4.03Å; L825-F941 HydrophobicContact CD1-CE1 4.38Å; L825-F941 HydrophobicContact CD2-CD1 4.17Å; L825-F941 HydrophobicContact CD2-CE1 4.17Å; L825-L943 HydrophobicContact CD1-CD1 3.92Å; L825-L943 HydrophobicContact CD1-CG 4.18Å; L825-L943 HydrophobicContact CG-CD1 4.19Å
826	P	75.2	Confident	67.1	Low	10 Å²	10	60.6 Å²	60.6	7%	0.065	34%	0.336	C	S	.	.			trans	-70.9	165.4	167.9	31.3	-35.8	0	0	0	111.9	L828 R920 L923 A924	P826-L828 HydrophobicContact CG-CD2 4.25Å; P826-L828 PolarHBondContact O-N 3.13Å; P826-R920 HydrophobicContact CB-CG 4.07Å; P826-L923 HydrophobicContact CG-CD2 4.36Å; P826-L923 HydrophobicContact CG-CG 4.25Å; P826-A924 HydrophobicContact CB-CB 3.99Å
827	P	67.7	Low	64.3	Low	51 Å²	51	64.2 Å²	64.2	33%	0.331	36%	0.362	S	S	.	.			trans	-71.2	85.6	178.1	-16.1	31.8	0	0	0	112.5	A829 S830 N898	P827-A829 VanDerWaalsContact C-N 3.32Å; P827-A829 PolarHBondContact O-N 3.1Å; P827-S830 PolarHBondContact O-OG 2.95Å; P827-N898 HydrophobicContact CG-CB 4.23Å
828	L	66.5	Low	61.3	Low	23 Å²	23	66 Å²	66	12%	0.12	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-63.2	-35.7	-178.4	-62.2	174.6	0	0	0	112.8	P826 S830 V831 L937 L938	P826-L828 HydrophobicContact CG-CD2 4.25Å; P826-L828 PolarHBondContact O-N 3.13Å; L828-S830 VanDerWaalsContact C-N 3.27Å; L828-S830 PolarHBondContact O-N 3.22Å; L828-V831 WeakPolarHBondContact O-CG2 3.4Å; L828-V831 PolarHBondContact O-N 3.34Å; L828-V831 VanDerWaalsContact O-N 3.15Å; L828-L937 HydrophobicContact CD1-CB 3.83Å; L828-L937 HydrophobicContact CD2-CB 4.26Å; L828-L937 HydrophobicContact CD2-CD1 4.45Å; L828-L938 HydrophobicContact CB-CD1 4.21Å; L828-L938 HydrophobicContact CD1-CB 4.22Å; L828-L938 HydrophobicContact CD1-CD1 4.4Å
829	A	51.9	Low	58.3	Low	71 Å²	71	71 Å²	71	59%	0.587	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-63.9	-22.5	-173.9	0	0	0	0	0	115.1	P827 V831	P827-A829 VanDerWaalsContact C-N 3.32Å; P827-A829 PolarHBondContact O-N 3.1Å; A829-V831 VanDerWaalsContact C-N 3.27Å; A829-V831 PolarHBondContact O-N 3.32Å
830	S	47.7	Very low	55.4	Low	52 Å²	52	75.4 Å²	75.4	36%	0.364	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-71	-20	176.7	35.4	0	0	0	0	113.7	P827 L828 Q832 K833	P827-S830 PolarHBondContact O-OG 2.95Å; L828-S830 VanDerWaalsContact C-N 3.27Å; L828-S830 PolarHBondContact O-N 3.22Å; S830-Q832 VanDerWaalsContact C-N 3.31Å; S830-Q832 PolarHBondContact O-N 3.29Å; S830-K833 PolarHBondContact O-N 3.06Å
831	V	46.4	Very low	52.3	Low	76 Å²	76	82.3 Å²	82.3	46%	0.461	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-69	-29.1	-179	-174.5	0	0	0	0	111.9	L828 A829 K833	L828-V831 WeakPolarHBondContact O-CG2 3.4Å; L828-V831 PolarHBondContact O-N 3.34Å; L828-V831 VanDerWaalsContact O-N 3.15Å; A829-V831 VanDerWaalsContact C-N 3.27Å; A829-V831 PolarHBondContact O-N 3.32Å; V831-K833 PolarHBondContact O-N 2.88Å
832	Q	39.7	Very low	49.5	Very low	126 Å²	126	85.2 Å²	85.2	59%	0.589	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-67.5	-15.1	-178.9	-76	-174.5	-27.8	0	0	114.6	S830 N834	S830-Q832 VanDerWaalsContact C-N 3.31Å; S830-Q832 PolarHBondContact O-N 3.29Å; Q832-N834 PolarHBondContact O-N 3.4Å
833	K	35.4	Very low	46.4	Very low	177 Å²	177	88.5 Å²	88.5	77%	0.77	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-82.1	0.8	-168.4	-88.5	-167.8	173.7	-176	0	116.7	S830 V831	S830-K833 PolarHBondContact O-N 3.06Å; V831-K833 PolarHBondContact O-N 2.88Å
834	N	31.7	Very low	43.6	Very low	94 Å²	94	99 Å²	99	50%	0.503	54%	0.536	S	S	.	.			trans	-156.7	78.9	165.3	-135.4	-20.8	0	0	0	115.3	Q832 Y836 S837	Q832-N834 PolarHBondContact O-N 3.4Å; N834-Y836 PolarHBondContact O-N 3.11Å; N834-Y836 VanDerWaalsContact O-N 3.15Å; N834-S837 WeakPolarHBondContact CB-OG 3.49Å; N834-S837 VanDerWaalsContact CG-CB 3.49Å; N834-S837 WeakPolarHBondContact ND2-CB 3.48Å; N834-S837 PolarHBondContact ND2-OG 3.32Å; N834-S837 VanDerWaalsContact ND2-OG 3.16Å
835	P	34	Very low	41	Very low	104 Å²	104	105 Å²	105	68%	0.675	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-13.8	177	-20.7	33.9	0	0	0	114.7
836	Y	31.8	Very low	38.5	Very low	204 Å²	204	112.9 Å²	112.9	80%	0.8	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	-8.1	-170.4	-67.5	-78.1	0	0	0	114.8	N834	N834-Y836 PolarHBondContact O-N 3.11Å; N834-Y836 VanDerWaalsContact O-N 3.15Å
837	S	31.5	Very low	36.2	Very low	78 Å²	78	125 Å²	125	55%	0.545	64%	0.64	S	S	.	*	S	Bend	trans	-92.6	3.2	-179.9	77.6	0	0	0	0	114.7	N834	N834-S837 WeakPolarHBondContact CB-OG 3.49Å; N834-S837 VanDerWaalsContact CG-CB 3.49Å; N834-S837 WeakPolarHBondContact ND2-CB 3.48Å; N834-S837 PolarHBondContact ND2-OG 3.32Å; N834-S837 VanDerWaalsContact ND2-OG 3.16Å
838	V	31.1	Very low	34.4	Very low	118 Å²	118	126.9 Å²	126.9	72%	0.715	65%	0.654	S	S	*	*			trans	-111.4	60.9	171.7	-168.3	0	0	0	0	108.5	M840	V838-M840 PolarHBondContact O-N 3.04Å
839	Q	27.6	Very low	32.4	Very low	184 Å²	184	134 Å²	134	86%	0.86	69%	0.687	S	S	*	*			trans	-61.9	119.5	164.4	-90.7	-170.7	-51.1	0	0	108.4	N841	Q839-N841 PolarHBondContact O-N 3.46Å; Q839-N841 VanDerWaalsContact O-N 3.11Å
840	M	26.5	Very low	31.2	Very low	125 Å²	125	137.5 Å²	137.5	62%	0.616	70%	0.696	S	S	*	*			trans	-64.7	108.5	-168.1	-73	159	64.6	0	0	111.7	V838 S842	V838-M840 PolarHBondContact O-N 3.04Å; M840-S842 PolarHBondContact O-N 3.28Å
841	N	25.6	Very low	30.4	Very low	179 Å²	179	144.3 Å²	144.3	96%	0.957	72%	0.722	S	S	*	*	S	Bend	trans	-79.2	32.8	164.7	-149.6	14.7	0	0	0	111.7	Q839	Q839-N841 PolarHBondContact O-N 3.46Å; Q839-N841 VanDerWaalsContact O-N 3.11Å
842	S	32.2	Very low	29.5	Very low	71 Å²	71	148.8 Å²	148.8	50%	0.497	74%	0.742	S	S	.	*			trans	-128.7	66.9	-178.9	60.5	0	0	0	0	108.3	M840 W844	M840-S842 PolarHBondContact O-N 3.28Å; S842-W844 PolarHBondContact O-N 3.06Å
843	G	25.6	Very low	28.9	Very low	69 Å²	69	148.4 Å²	148.4	71%	0.711	75%	0.749	S	S	*	*			trans	-72.5	83.5	-170.8	0	0	0	0	0	114.1
844	W	26.6	Very low	28.5	Very low	226 Å²	226	147.9 Å²	147.9	86%	0.856	75%	0.749	S	S	*	*			trans	-141.7	40.7	170.9	-75.2	111.3	0	0	0	112.6	S842	S842-W844 PolarHBondContact O-N 3.06Å
845	D	26.2	Very low	28.3	Very low	129 Å²	129	151 Å²	151	69%	0.69	76%	0.762	S	S	*	*	S	Bend	trans	-145.7	149.1	172.4	-100.9	-49.4	0	0	0	111
846	Y	27.4	Very low	27.9	Very low	204 Å²	204	152.6 Å²	152.6	80%	0.8	77%	0.765	S	S	*	*			trans	51.7	83.6	177.6	-75.7	-94.9	0	0	0	117.9
847	W	26.4	Very low	27.7	Very low	264 Å²	264	147.7 Å²	147.7	100%	1	76%	0.757	S	S	*	*			trans	-88.8	84.5	141.6	-86.9	75.6	0	0	0	109.2
848	S	30	Very low	27.4	Very low	90 Å²	90	151.4 Å²	151.4	63%	0.629	77%	0.77	S	S	*	*			trans	-86.6	150.4	155.4	56.3	0	0	0	0	109.4
849	E	25.9	Very low	27.2	Very low	174 Å²	174	150.8 Å²	150.8	81%	0.813	78%	0.777	S	S	*	*	S	Bend	trans	-68	163.6	-172.7	-62.6	169.3	128.3	0	0	113.4
850	N	26.6	Very low	27.2	Very low	144 Å²	144	151.3 Å²	151.3	77%	0.77	78%	0.777	S	S	*	*			trans	73.4	82.4	172.9	-47.8	-56.6	0	0	0	117.1
851	H	31.1	Very low	27.1	Very low	194 Å²	194	156.4 Å²	156.4	90%	0.898	79%	0.791	S	S	*	*				-170.6	107.4	120.1	-102.7	-67.8	0	0	0	111
852	L	26.2	Very low	27.1	Very low	170 Å²	170	156.4 Å²	156.4	89%	0.89	79%	0.787	S	S	*	*			trans	-113.7	98.7	-179.8	-171.5	96.1	0	0	0	111
853	T	27	Very low	26.8	Very low	119 Å²	119	160.2 Å²	160.2	73%	0.73	80%	0.797	S	S	*	*			trans	-167.3	143.2	160.4	24.5	0	0	0	0	112.6
854	H	28.1	Very low	26.9	Very low	165 Å²	165	165.3 Å²	165.3	76%	0.764	81%	0.805	S	S	*	*			trans	73.3	146.2	159.7	-85.4	-79.6	0	0	0	121.8
855	M	26.4	Very low	26.8	Very low	160 Å²	160	161.5 Å²	161.5	79%	0.788	80%	0.796	S	S	*	*			trans	56.9	85.8	169.2	-48.8	-44.6	179.7	0	0	116.5
856	N	27.1	Very low	26.9	Very low	138 Å²	138	162.2 Å²	162.2	74%	0.738	80%	0.8	S	S	*	*				77	122.4	53.4	-159.6	31.7	0	0	0	115.4
857	T	26.4	Very low	27	Very low	101 Å²	101	163.3 Å²	163.3	62%	0.62	81%	0.805	S	S	*	*			trans	40	100.1	164	50.4	0	0	0	0	119.8
858	N	25.7	Very low	27.2	Very low	155 Å²	155	156 Å²	156	83%	0.829	79%	0.789	S	S	*	*				166.1	96	113.1	-86	-40.7	0	0	0	112.7
859	A	27.6	Very low	27.1	Very low	105 Å²	105	157.7 Å²	157.7	87%	0.868	80%	0.798	S	S	*	*			trans	-135	66.4	168.3	0	0	0	0	0	110
860	K	27	Very low	27.3	Very low	195 Å²	195	158 Å²	158	85%	0.848	80%	0.802	S	S	*	*			trans	-74.8	145.5	169.3	-91.4	-176.7	175.9	176.2	0	109.8	M862	K860-M862 PolarHBondContact O-N 2.91Å
861	Y	24.8	Very low	27.6	Very low	232 Å²	232	154.8 Å²	154.8	91%	0.91	79%	0.789	S	S	*	*			trans	-40.4	126.2	166.9	-70.6	-99.8	0	0	0	111.8
862	M	25.6	Very low	27.5	Very low	180 Å²	180	152.9 Å²	152.9	89%	0.887	79%	0.785	S	S	*	*			trans	-118.3	100.7	167.6	-168.3	160.4	177.5	0	0	108.3	K860 M864	K860-M862 PolarHBondContact O-N 2.91Å; M862-M864 PolarHBondContact O-N 2.84Å
863	Q	25.7	Very low	27.8	Very low	151 Å²	151	150 Å²	150	71%	0.706	78%	0.775	S	S	*	*			trans	-65.9	125.4	171.8	-69.8	162.1	-111.2	0	0	108.6	E865	Q863-E865 VanDerWaalsContact C-N 3.32Å; Q863-E865 PolarHBondContact O-N 3.05Å; Q863-E865 VanDerWaalsContact O-N 3.16Å
864	M	26.4	Very low	27.9	Very low	175 Å²	175	149 Å²	149	86%	0.862	77%	0.769	S	S	*	*			trans	-83.4	81.5	165.6	-88.8	-170.8	163.3	0	0	109.9	M862	M862-M864 PolarHBondContact O-N 2.84Å
865	E	25.7	Very low	27.9	Very low	147 Å²	147	144.5 Å²	144.5	69%	0.687	77%	0.766	S	S	*	*			trans	-109.8	155.6	156.1	-67.2	-175.3	117.7	0	0	108.7	Q863	Q863-E865 VanDerWaalsContact C-N 3.32Å; Q863-E865 PolarHBondContact O-N 3.05Å; Q863-E865 VanDerWaalsContact O-N 3.16Å
866	D	27.3	Very low	28.2	Very low	144 Å²	144	144.1 Å²	144.1	77%	0.77	77%	0.773	S	S	*	*			trans	57.8	69	170.5	-57.8	-17.4	0	0	0	119.3	T868	D866-T868 PolarHBondContact O-N 2.83Å; D866-T868 VanDerWaalsContact O-N 3.15Å
867	Y	30.5	Very low	28.2	Very low	227 Å²	227	143.9 Å²	143.9	89%	0.89	78%	0.777	S	S	*	*			trans	-70.8	98.1	148.6	-112.3	-84.9	0	0	0	109.8
868	T	29.1	Very low	28.4	Very low	110 Å²	110	146 Å²	146	68%	0.675	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-104	139.1	166	48.7	0	0	0	0	110	D866	D866-T868 PolarHBondContact O-N 2.83Å; D866-T868 VanDerWaalsContact O-N 3.15Å
869	P	29.4	Very low	28.5	Very low	126 Å²	126	145.6 Å²	145.6	82%	0.818	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79.7	126.2	-176.5	30.6	-33.4	0	0	0	111.6
870	M	30.2	Very low	28.7	Very low	180 Å²	180	151.5 Å²	151.5	89%	0.887	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-70.6	133.8	168.4	-86.8	-71.7	-178.3	0	0	110.6
871	P	32	Very low	28.8	Very low	77 Å²	77	149 Å²	149	50%	0.5	79%	0.786	S	S	.	*	P	Polyproline II helix	trans	-85.3	149.9	-178.9	33.8	-34.7	0	0	0	112.8
872	N	28.7	Very low	29.2	Very low	153 Å²	153	145.7 Å²	145.7	82%	0.818	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-80	138.7	165.5	-71.7	-25.4	0	0	0	110.3
873	T	33.1	Very low	29.4	Very low	111 Å²	111	144.1 Å²	144.1	68%	0.681	78%	0.778	S	S	*	*			trans	-118.5	140.8	166.1	-37	0	0	0	0	108.5	E243	E243-T873 HydrophobicContact CG-CG2 4.19Å
874	T	29.5	Very low	29.7	Very low	98 Å²	98	144.8 Å²	144.8	60%	0.601	79%	0.787	S	S	*	*			trans	-112.4	150	-171.3	21.7	0	0	0	0	113	E243	E243-T874 WeakPolarHBondContact OE1-CA 2.88Å; E243-T874 PolarHBondContact OE1-N 3.44Å; E243-T874 PolarHBondContact OE1-OG1 3.16Å
875	G	28.3	Very low	29.9	Very low	69 Å²	69	142.4 Å²	142.4	71%	0.711	78%	0.782	S	S	*	*			trans	66.8	108.1	149.5	0	0	0	0	0	119
876	T	32	Very low	30.3	Very low	152 Å²	152	143.3 Å²	143.3	93%	0.933	79%	0.792	S	S	*	*				-152.5	145	117.9	-2	0	0	0	0	111.4
877	T	27.1	Very low	30.3	Very low	134 Å²	134	143.4 Å²	143.4	82%	0.822	79%	0.792	S	S	*	*			trans	-93.9	135.6	-173.7	48.3	0	0	0	0	112.3
878	T	31.2	Very low	30.5	Very low	145 Å²	145	141.5 Å²	141.5	89%	0.89	79%	0.791	S	S	*	*			trans	-150.3	137	147.2	10	0	0	0	0	109.6
879	N	27.8	Very low	30.6	Very low	147 Å²	147	143.1 Å²	143.1	79%	0.786	80%	0.796	S	S	*	*			trans	-67.2	140.8	171.3	-82.9	-29.1	0	0	0	110.3
880	Y	30.3	Very low	30.6	Very low	229 Å²	229	142.5 Å²	142.5	90%	0.898	80%	0.795	S	S	*	*			trans	-144.8	121.3	130.4	-119.3	-79	0	0	0	110.2
881	N	29.7	Very low	30.7	Very low	143 Å²	143	140 Å²	140	77%	0.765	79%	0.785	S	S	*	*			trans	-67.1	134.9	169	-75.1	-23.5	0	0	0	108.8
882	N	32.9	Very low	30.5	Very low	162 Å²	162	141.7 Å²	141.7	87%	0.866	80%	0.798	S	S	*	*			trans	-149.8	133.5	131.4	-133.2	-17.3	0	0	0	111.4
883	N	29.9	Very low	30.5	Very low	146 Å²	146	139.7 Å²	139.7	78%	0.781	79%	0.791	S	S	*	*			trans	-77.1	130.5	175.5	-66.1	-38	0	0	0	108.9
884	N	33.6	Very low	30.3	Very low	166 Å²	166	141.6 Å²	141.6	89%	0.888	80%	0.796	S	S	*	*			trans	-155.6	129.3	138.1	-106.9	-31.1	0	0	0	111.3
885	T	29.4	Very low	30.5	Very low	124 Å²	124	144.8 Å²	144.8	76%	0.761	80%	0.798	S	S	*	*			trans	-77	134	178	46.9	0	0	0	0	111.1
886	N	33.8	Very low	30.8	Very low	166 Å²	166	149.6 Å²	149.6	89%	0.888	80%	0.802	S	S	*	*			trans	-160.5	143.3	140.5	-98.9	-35.2	0	0	0	111.5
887	N	28.9	Very low	31.9	Very low	146 Å²	146	148 Å²	148	78%	0.781	79%	0.794	S	S	*	*			trans	-81.2	126	-171.3	-75.3	-43.6	0	0	0	112.8
888	H	34	Very low	33.4	Very low	188 Å²	188	147 Å²	147	87%	0.87	78%	0.784	S	S	*	*			trans	-153.6	86.3	149.6	-87.9	-58.9	0	0	0	110.8	S890	H888-S890 PolarHBondContact O-N 3.19Å; H888-S890 VanDerWaalsContact O-N 3.15Å
889	N	30.9	Very low	35.3	Very low	144 Å²	144	145.2 Å²	145.2	77%	0.77	77%	0.774	S	S	*	*			trans	-79.3	90.4	174	-83.5	-3.8	0	0	0	111.5	N891	N889-N891 VanDerWaalsContact C-N 3.31Å; N889-N891 PolarHBondContact O-N 3.4Å; N889-N891 VanDerWaalsContact O-N 3.13Å
890	S	30.2	Very low	37.7	Very low	113 Å²	113	140 Å²	140	79%	0.79	75%	0.749	S	S	*	*			trans	-80	74.7	165.5	43.5	0	0	0	0	110.9	H888 S892	H888-S890 PolarHBondContact O-N 3.19Å; H888-S890 VanDerWaalsContact O-N 3.15Å; S890-S892 PolarHBondContact O-N 3.22Å
891	N	30.7	Very low	40.2	Very low	128 Å²	128	131.5 Å²	131.5	68%	0.684	72%	0.721	S	S	*	*			trans	-66.2	95.6	-178.7	-78.7	-1.8	0	0	0	112.6	N889 V893	N889-N891 VanDerWaalsContact C-N 3.31Å; N889-N891 PolarHBondContact O-N 3.4Å; N889-N891 VanDerWaalsContact O-N 3.13Å; N891-V893 PolarHBondContact O-N 2.83Å
892	S	28.3	Very low	42.9	Very low	112 Å²	112	131.4 Å²	131.4	78%	0.783	71%	0.714	S	S	*	*			trans	-71.8	86.5	164.7	42.1	0	0	0	0	110.4	S890 I894	S890-S892 PolarHBondContact O-N 3.22Å; S892-I894 PolarHBondContact O-N 3.35Å
893	V	30	Very low	45.5	Very low	110 Å²	110	123.9 Å²	123.9	67%	0.667	67%	0.674	S	S	*	*			trans	-66.1	102.6	179.9	-179.4	0	0	0	0	110.5	N891 Y895	N891-V893 PolarHBondContact O-N 2.83Å; V893-Y895 PolarHBondContact O-N 3.39Å
894	I	29	Very low	48.1	Very low	151 Å²	151	124 Å²	124	77%	0.774	66%	0.664	S	S	*	*			trans	-68.7	109.8	168.6	-59.4	176	0	0	0	107.8	S892 Q896	S892-I894 PolarHBondContact O-N 3.35Å; I894-Q896 PolarHBondContact O-N 3.22Å
895	Y	32.5	Very low	50.8	Low	166 Å²	166	117.2 Å²	117.2	65%	0.651	63%	0.626	S	S	*	*			trans	-67.4	98.2	174	-92	-94.1	0	0	0	110.6	V893	V893-Y895 PolarHBondContact O-N 3.39Å
896	Q	35.6	Very low	53.8	Low	169 Å²	169	111.9 Å²	111.9	79%	0.79	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-75.7	123	156.8	-72.6	-173.7	-21.8	0	0	108.3	I894 N898	I894-Q896 PolarHBondContact O-N 3.22Å; Q896-N898 PolarHBondContact O-N 3.36Å
897	P	53.5	Low	56.6	Low	118 Å²	118	104 Å²	104	77%	0.766	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-69.4	128.5	176.7	27.9	-33.1	0	0	0	109.8
898	N	59.3	Low	59.7	Low	115 Å²	115	100 Å²	100	62%	0.615	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-53.3	132.9	176.9	-75.5	-12.5	0	0	0	110.4	P827 Q896 R920	P827-N898 HydrophobicContact CG-CB 4.23Å; Q896-N898 PolarHBondContact O-N 3.36Å; N898-R920 PolarHBondContact O-NH2 2.92Å
899	P	70.3	Confident	62.5	Low	106 Å²	106	91.1 Å²	91.1	69%	0.688	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-59	152.4	-176.6	23.4	-33.5	0	0	0	111.6	R920	P899-R920 PolarHBondContact O-NH2 2.76Å; P899-R920 VanDerWaalsContact O-NH2 3.16Å
900	P	78.8	Confident	65.4	Low	39 Å²	39	87.8 Å²	87.8	25%	0.253	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-60.7	135.2	171.2	25.2	-31.7	0	0	0	109.8	L791	L791-P900 HydrophobicContact CB-CB 4.38Å; L791-P900 HydrophobicContact CB-CG 4.03Å; L791-P900 HydrophobicContact CD1-CG 4.27Å; L791-P900 HydrophobicContact CD2-CG 4.27Å; L791-P900 WeakPolarHBondContact CD2-O 3.39Å; L791-P900 HydrophobicContact CG-CG 4.42Å
901	P	83	Confident	68.3	Low	49 Å²	49	85.1 Å²	85.1	32%	0.318	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-69.2	157.1	176	31.3	-35.6	0	0	0	110.4	L792 T948	L792-P901 HydrophobicContact CD1-CG 4.41Å; L792-P901 PolarHBondContact N-O 2.95Å; P901-T948 HydrophobicContact CB-CG2 3.68Å; P901-T948 HydrophobicContact CG-CG2 3.68Å
902	K	86.5	Confident	71	Confident	141 Å²	141	84.7 Å²	84.7	61%	0.613	44%	0.437	S	S	*	.	B	Isolated β-bridge	trans	-84	140.7	175	-68.8	-176.4	174.7	-170.8	0	111	G789 D790 L791	G789-K902 WeakPolarHBondContact O-CD 3.2Å; G789-K902 WeakPolarHBondContact O-CG 3.35Å; D790-K902 CarbonylContact O-C 3.48Å; D790-K902 VanDerWaalsContact O-CA 3.3Å; D790-K902 WeakPolarHBondContact O-CA 3.35Å; L791-K902 HydrophobicContact CD2-CG 3.82Å
903	S	88	Confident	73.9	Confident	4 Å²	4	79.4 Å²	79.4	3%	0.028	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-64.1	133.3	170.5	-165.8	0	0	0	0	110.6	G789 D790 F905	G789-S903 WeakPolarHBondContact CA-O 3.5Å; G789-S903 PolarHBondContact N-O 3.45Å; D790-S903 PolarHBondContact O-N 3.29Å; S903-F905 VanDerWaalsContact C-N 3.34Å; S903-F905 PolarHBondContact OG-N 2.91Å; S903-F905 PolarHBondContact OG-O 3.04Å
904	R	84.7	Confident	76.7	Confident	149 Å²	149	75 Å²	75	56%	0.562	37%	0.372	S	S	*	.	S	Bend	trans	-81	-17.6	169.7	-75.2	-85.2	-77.1	-179.3	-4	112.7	L947	R904-L947 PolarHBondContact N-O 3.48Å
905	F	89.8	Confident	79.7	Confident	23 Å²	23	67.8 Å²	67.8	10%	0.101	34%	0.335	C	S	.	.	S	Bend	trans	-133	156.2	-168.4	-45.8	-56.7	0	0	0	111.1	V805 V806 L813 S903 L945 L947 I949	V805-F905 HydrophobicContact CG1-CB 3.69Å; V805-F905 HydrophobicContact CG1-CD2 4.29Å; V805-F905 HydrophobicContact CG1-CG 4.21Å; V806-F905 CarbonylContact O-C 3.36Å; V806-F905 WeakPolarHBondContact O-CA 3.37Å; V806-F905 WeakPolarHBondContact O-CB 3.31Å; L813-F905 HydrophobicContact CD1-CD1 3.32Å; L813-F905 HydrophobicContact CD1-CD2 4.08Å; L813-F905 HydrophobicContact CD1-CE1 3.35Å; L813-F905 HydrophobicContact CD1-CE2 4.11Å; L813-F905 HydrophobicContact CD1-CG 3.7Å; L813-F905 HydrophobicContact CD1-CZ 3.76Å; S903-F905 VanDerWaalsContact C-N 3.34Å; S903-F905 PolarHBondContact OG-N 2.91Å; S903-F905 PolarHBondContact OG-O 3.04Å; F905-L945 HydrophobicContact CD2-CD2 4.39Å; F905-L947 HydrophobicContact CB-CD2 4.22Å; F905-L947 HydrophobicContact CD2-CD2 4.14Å; F905-I949 HydrophobicContact CE2-CD1 4.46Å; F905-I949 HydrophobicContact CZ-CD1 4.14Å
906	A	91.5	Very high	82.6	Confident	13 Å²	13	60.5 Å²	60.5	11%	0.107	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	156.2	166.1	0	0	0	0	0	110.5	V786 T788 V805 V806	V786-A906 CarbonylContact O-C 3.46Å; V786-A906 WeakPolarHBondContact O-CA 3.3Å; T788-A906 HydrophobicContact CG2-CB 4.28Å; V805-A906 WeakPolarHBondContact CA-O 3.39Å; V806-A906 PolarHBondContact N-O 3.02Å; V806-A906 PolarHBondContact O-N 3.41Å
907	V	93.2	Very high	85.4	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.1	170.5	-175.9	0	0	0	0	108.1	T784 L785 V786 L803 E804 V805 L816 F822 L947	T784-V907 CarbonylContact C-O 3.51Å; T784-V907 WeakPolarHBondContact CA-O 3.43Å; L785-V907 PolarHBondContact N-O 3.24Å; V786-V907 HydrophobicContact CB-CB 4.35Å; V786-V907 HydrophobicContact CB-CG2 4.25Å; V786-V907 PolarHBondContact O-N 3.2Å; L803-V907 HydrophobicContact CB-CG1 3.92Å; L803-V907 HydrophobicContact CD1-CG1 3.9Å; L803-V907 HydrophobicContact CG-CG1 4.47Å; E804-V907 WeakPolarHBondContact O-CA 3.44Å; V805-V907 HydrophobicContact CG2-CG2 4.35Å; L816-V907 HydrophobicContact CD1-CG1 4.27Å; F822-V907 HydrophobicContact CD2-CG2 4.4Å; F822-V907 HydrophobicContact CE2-CG1 4Å; F822-V907 HydrophobicContact CE2-CG2 4.35Å; F822-V907 HydrophobicContact CZ-CG1 4.39Å; V907-L947 HydrophobicContact CG2-CD1 4.06Å; V907-L947 HydrophobicContact CG2-CD2 4Å
908	R	93.2	Very high	87.3	Confident	62 Å²	62	49 Å²	49	23%	0.234	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	144.1	-175	-164.9	-171.2	-61.6	137.1	-11.2	110.1	S782 D783 T784 L803 E804 D810	S782-R908 WeakPolarHBondContact O-CG 3.38Å; D783-R908 CarbonylContact O-C 3.58Å; D783-R908 VanDerWaalsContact O-CA 3.27Å; D783-R908 WeakPolarHBondContact O-CA 3.37Å; D783-R908 WeakPolarHBondContact O-CG 3.21Å; T784-R908 HydrophobicContact CG2-CB 4.1Å; T784-R908 HydrophobicContact CG2-CG 3.96Å; L803-R908 CarbonylContact C-O 3.56Å; L803-R908 VanDerWaalsContact CA-O 3.24Å; L803-R908 WeakPolarHBondContact CA-O 3.35Å; E804-R908 HydrophobicContact CG-CB 3.85Å; E804-R908 WeakPolarHBondContact CG-O 3.35Å; E804-R908 PolarHBondContact N-O 3.46Å; E804-R908 PolarHBondContact O-N 3.03Å; E804-R908 VanDerWaalsContact OE1-CD 3.28Å; E804-R908 WeakPolarHBondContact OE1-CD 3.33Å; E804-R908 IonicContact OE1-CZ 3.61Å; E804-R908 IonicContact OE1-NE 2.71Å; E804-R908 IonicContact OE1-NH1 2.74Å; E804-R908 PolarHBondContact OE1-NH1 2.92Å; D810-R908 IonicContact OD1-CZ 3.46Å; D810-R908 IonicContact OD1-NH1 3.32Å; D810-R908 PolarHBondContact OD1-NH1 3.04Å; D810-R908 IonicContact OD1-NH2 2.67Å; D810-R908 PolarHBondContact OD1-NH2 3.36Å
909	A	92.9	Very high	88.8	Confident	2 Å²	2	46.2 Å²	46.2	2%	0.017	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	129.4	178.4	0	0	0	0	0	112	M779 P780 S782 D783 L803 A913	M779-A909 HydrophobicContact CB-CB 3.93Å; M779-A909 HydrophobicContact CE-CB 3.82Å; M779-A909 HydrophobicContact SD-CB 4.35Å; P780-A909 WeakPolarHBondContact O-CB 3.42Å; S782-A909 PolarHBondContact N-O 2.99Å; D783-A909 PolarHBondContact O-N 3.26Å; L803-A909 HydrophobicContact CD2-CB 3.75Å; A909-A913 HydrophobicContact CB-CB 4.45Å
910	L	91.5	Very high	89.7	Confident	74 Å²	74	42.7 Å²	42.7	39%	0.387	20%	0.201	S	C	.	.	S	Bend	trans	-85.2	-36	174.3	-70.7	171.7	0	0	0	111.6	S802 E804 V815	S802-L910 PolarHBondContact O-N 2.96Å; E804-L910 HydrophobicContact CB-CD1 4.15Å; E804-L910 HydrophobicContact CB-CD2 4.14Å; E804-L910 HydrophobicContact CB-CG 4.02Å; E804-L910 HydrophobicContact CG-CD2 3.92Å; E804-L910 HydrophobicContact CG-CG 4.03Å; E804-L910 WeakPolarHBondContact OE2-CD2 3.34Å; V815-L910 HydrophobicContact CG1-CD1 3.95Å; V815-L910 HydrophobicContact CG2-CD1 4.04Å
911	T	91.2	Very high	90.1	Very high	56 Å²	56	47.7 Å²	47.7	34%	0.344	22%	0.22	S	C	.	.	S	Bend	trans	-122.1	177.8	176.2	68.1	0	0	0	0	109.9	G801 S802 A913	G801-T911 WeakPolarHBondContact CA-OG1 3.48Å; S802-T911 PolarHBondContact N-OG1 2.88Å; S802-T911 VanDerWaalsContact N-OG1 3.08Å; T911-A913 PolarHBondContact O-N 3.45Å
912	Y	87.8	Confident	90.5	Very high	120 Å²	120	47.1 Å²	47.1	47%	0.471	22%	0.215	S	C	.	.			trans	-54.8	124.8	157.2	-65.9	-80.8	0	0	0	108.9	Q719 H778 M779 P780 P781 G801	Q719-Y912 HydrophobicContact CG-CE1 4.03Å; Q719-Y912 PolarHBondContact NE2-OH 2.98Å; Q719-Y912 VanDerWaalsContact NE2-OH 3.07Å; H778-Y912 AromaticContact NE2-CD1 3.82Å; M779-Y912 CarbonylContact O-C 3.59Å; M779-Y912 VanDerWaalsContact O-CA 3.3Å; M779-Y912 WeakPolarHBondContact O-CA 3.47Å; P780-Y912 HydrophobicContact CB-CD1 4.32Å; P780-Y912 HydrophobicContact CB-CE1 3.99Å; P781-Y912 HydrophobicContact CG-CD2 4.19Å; P781-Y912 HydrophobicContact CG-CE2 4.08Å; G801-Y912 WeakPolarHBondContact CA-O 3.29Å
913	A	90.1	Very high	90.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	133.5	-173.9	0	0	0	0	0	111.5	M779 K800 L803 A909 T911 V915	M779-A913 HydrophobicContact CB-CB 4.39Å; M779-A913 PolarHBondContact N-O 3Å; M779-A913 PolarHBondContact O-N 3.45Å; K800-A913 VanDerWaalsContact O-CA 3.27Å; K800-A913 WeakPolarHBondContact O-CA 3.49Å; L803-A913 HydrophobicContact CD2-CB 3.67Å; A909-A913 HydrophobicContact CB-CB 4.45Å; T911-A913 PolarHBondContact O-N 3.45Å; A913-V915 HydrophobicContact CB-CG2 4.49Å
914	D	89.5	Confident	90.5	Very high	18 Å²	18	42.2 Å²	42.2	10%	0.096	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	114.4	175.1	-67.1	-21.1	0	0	0	107.6	H723 H778 V799 K800	H723-D914 IonicContact CE1-OD1 3.67Å; H723-D914 PolarHBondContact CE1-OD1 3.44Å; H723-D914 VanDerWaalsContact CE1-OD1 3.24Å; H723-D914 IonicContact CE1-OD2 3.52Å; H723-D914 IonicContact ND1-OD1 2.71Å; H778-D914 IonicContact CE1-OD1 2.67Å; H778-D914 PolarHBondContact CE1-OD1 2.92Å; H778-D914 IonicContact CG-OD1 2.74Å; H778-D914 IonicContact ND1-OD1 3.17Å; H778-D914 PolarHBondContact ND1-OD1 3.3Å; V799-D914 WeakPolarHBondContact CA-O 3.39Å; V799-D914 HydrophobicContact CB-CB 4.04Å; V799-D914 VanDerWaalsContact CB-O 3.32Å; V799-D914 WeakPolarHBondContact CB-O 3.38Å; V799-D914 PolarHBondContact N-O 3.27Å; K800-D914 HydrophobicContact CB-CB 4.1Å; K800-D914 WeakPolarHBondContact CD-OD2 3.48Å; K800-D914 HydrophobicContact CG-CB 4.37Å; K800-D914 PolarHBondContact N-O 2.93Å; K800-D914 IonicContact NZ-OD2 2.7Å; K800-D914 PolarHBondContact NZ-OD2 3.47Å; K800-D914 PolarHBondContact O-N 3.49Å
915	V	91.7	Very high	90.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.3	-175.4	-172.7	0	0	0	0	109.7	S776 S777 M779 L785 Y796 Y797 L803 F822 A913	S776-V915 CarbonylContact C-O 3.57Å; S776-V915 WeakPolarHBondContact CA-O 3.47Å; S777-V915 PolarHBondContact N-O 2.91Å; S777-V915 PolarHBondContact O-N 3.35Å; M779-V915 HydrophobicContact SD-CG2 4.16Å; L785-V915 HydrophobicContact CD2-CG1 4.15Å; Y796-V915 HydrophobicContact CD1-CG1 3.83Å; Y796-V915 HydrophobicContact CG-CG1 4.35Å; Y797-V915 WeakPolarHBondContact O-CA 3.39Å; L803-V915 HydrophobicContact CD1-CG2 4.17Å; F822-V915 HydrophobicContact CE1-CG1 4.29Å; F822-V915 HydrophobicContact CZ-CG1 4.14Å; A913-V915 HydrophobicContact CB-CG2 4.49Å
916	Q	93.4	Very high	90.6	Very high	13 Å²	13	37.7 Å²	37.7	6%	0.061	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	144.1	173.4	-76.5	168.5	8.1	0	0	109.7	Y749 F752 I774 R775 Y796 Y797 V799	Y749-Q916 HydrophobicContact CD1-CG 4.11Å; Y749-Q916 HydrophobicContact CE1-CG 4.27Å; F752-Q916 HydrophobicContact CD2-CB 3.95Å; I774-Q916 HydrophobicContact CG2-CB 4.24Å; R775-Q916 CarbonylContact O-C 3.57Å; R775-Q916 WeakPolarHBondContact O-CA 3.45Å; Y796-Q916 CarbonylContact C-O 3.52Å; Y796-Q916 WeakPolarHBondContact CA-O 3.43Å; Y797-Q916 HydrophobicContact CD1-CB 4.46Å; Y797-Q916 PolarHBondContact N-O 2.92Å; Y797-Q916 PolarHBondContact O-N 3.03Å; V799-Q916 HydrophobicContact CG2-CB 3.97Å; V799-Q916 HydrophobicContact CG2-CG 3.56Å
917	F	92.9	Very high	90.3	Very high	43 Å²	43	37.6 Å²	37.6	19%	0.189	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	158.5	-176.6	70.7	-87.1	0	0	0	113.2	I774 R775 A794 M795 Y796	I774-F917 CarbonylContact C-O 3.57Å; I774-F917 WeakPolarHBondContact CA-O 3.26Å; R775-F917 HydrophobicContact CB-CD1 4.02Å; R775-F917 HydrophobicContact CB-CD2 4.24Å; R775-F917 HydrophobicContact CB-CE1 3.57Å; R775-F917 HydrophobicContact CB-CE2 3.81Å; R775-F917 HydrophobicContact CB-CG 4.34Å; R775-F917 HydrophobicContact CB-CZ 3.46Å; R775-F917 VanDerWaalsContact CB-CZ 3.46Å; R775-F917 HydrophobicContact CG-CE2 4.2Å; R775-F917 HydrophobicContact CG-CZ 4.15Å; R775-F917 PolarHBondContact N-O 3.28Å; R775-F917 PolarHBondContact O-N 3.28Å; A794-F917 HydrophobicContact CB-CD2 4.13Å; M795-F917 CarbonylContact O-C 3.57Å; M795-F917 WeakPolarHBondContact O-CA 3.4Å; M795-F917 WeakPolarHBondContact O-CB 3.36Å; Y796-F917 HydrophobicContact CD1-CB 3.48Å; Y796-F917 VanDerWaalsContact CD1-CB 3.48Å; Y796-F917 HydrophobicContact CD1-CG 4.2Å; Y796-F917 HydrophobicContact CE1-CB 3.8Å; Y796-F917 HydrophobicContact CE1-CD1 4.4Å; Y796-F917 HydrophobicContact CE1-CG 4.05Å; Y796-F917 HydrophobicContact CG-CB 4.19Å
918	I	93.6	Very high	89.9	Confident	2 Å²	2	42 Å²	42	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	135.4	169	-168.1	171.7	0	0	0	108.9	F752 I770 R773 A794 M795 D922 L923 L926	F752-I918 HydrophobicContact CZ-CG2 4.06Å; I770-I918 HydrophobicContact CG2-CD1 4.37Å; R773-I918 HydrophobicContact CB-CD1 4.01Å; R773-I918 HydrophobicContact CB-CG1 4.23Å; A794-I918 WeakPolarHBondContact CA-O 3.49Å; A794-I918 WeakPolarHBondContact CB-O 3.31Å; M795-I918 HydrophobicContact CB-CG2 4.26Å; M795-I918 HydrophobicContact CE-CG2 3.97Å; M795-I918 PolarHBondContact N-O 3.26Å; M795-I918 PolarHBondContact O-N 3Å; I918-D922 HydrophobicContact CG1-CB 4.33Å; I918-L923 HydrophobicContact CD1-CB 4.46Å; I918-L923 HydrophobicContact CD1-CD1 4.47Å; I918-L923 HydrophobicContact CG2-CB 4.43Å; I918-L923 HydrophobicContact CG2-CD2 4.23Å; I918-L926 HydrophobicContact CD1-CD1 3.86Å
919	D	92.3	Very high	89.6	Confident	57 Å²	57	43 Å²	43	31%	0.305	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	142.6	-179.2	-68.2	-49.7	0	0	0	111.3	H921 D922 L923	D919-H921 PolarHBondContact O-N 3.42Å; D919-D922 HydrophobicContact CB-CB 4.33Å; D919-D922 PolarHBondContact O-N 3.13Å; D919-L923 WeakPolarHBondContact O-CB 3.36Å; D919-L923 PolarHBondContact O-N 2.84Å
920	R	88.4	Confident	89.3	Confident	31 Å²	31	45.8 Å²	45.8	12%	0.117	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-28.3	-179	175.1	174.9	149.2	148.4	-16.6	112.2	T793 L825 P826 N898 P899 A924	T793-R920 WeakPolarHBondContact O-CB 3.29Å; T793-R920 PolarHBondContact O-N 3.01Å; L825-R920 PolarHBondContact O-NH1 2.99Å; P826-R920 HydrophobicContact CB-CG 4.07Å; N898-R920 PolarHBondContact O-NH2 2.92Å; P899-R920 PolarHBondContact O-NH2 2.76Å; P899-R920 VanDerWaalsContact O-NH2 3.16Å; R920-A924 WeakPolarHBondContact O-CB 3.41Å; R920-A924 PolarHBondContact O-N 3.13Å
921	H	87.9	Confident	88.9	Confident	144 Å²	144	46.1 Å²	46.1	67%	0.667	24%	0.241	S	C	*	.	H	α-helix	trans	-68.9	-52.8	173.4	-175.3	66.2	0	0	0	110.9	D919 L923 A924 E925	D919-H921 PolarHBondContact O-N 3.42Å; H921-L923 VanDerWaalsContact C-N 3.31Å; H921-L923 PolarHBondContact O-N 3.33Å; H921-A924 WeakPolarHBondContact O-CB 3.34Å; H921-A924 PolarHBondContact O-N 2.88Å; H921-A924 VanDerWaalsContact O-N 3.09Å; H921-E925 PolarHBondContact O-N 3.36Å
922	D	90.3	Very high	88.6	Confident	38 Å²	38	49.6 Å²	49.6	20%	0.203	25%	0.253	C	S	.	.	H	α-helix	trans	-57.7	-41.7	177.1	-82.4	36.7	0	0	0	112.3	R773 I918 D919 L926	R773-D922 HydrophobicContact CB-CB 4.29Å; R773-D922 WeakPolarHBondContact CD-OD2 3.45Å; R773-D922 PolarHBondContact NH1-O 3.42Å; I918-D922 HydrophobicContact CG1-CB 4.33Å; D919-D922 HydrophobicContact CB-CB 4.33Å; D919-D922 PolarHBondContact O-N 3.13Å; D922-L926 WeakPolarHBondContact O-CB 3.48Å; D922-L926 VanDerWaalsContact O-CG 3.29Å; D922-L926 WeakPolarHBondContact O-CG 3.32Å; D922-L926 PolarHBondContact O-N 3.4Å
923	L	89.4	Confident	88.5	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-69.7	-35	176.1	-174.6	58.4	0	0	0	112.5	M795 L825 P826 I918 D919 H921 C927 L933 L937	M795-L923 HydrophobicContact SD-CD2 4.1Å; L825-L923 HydrophobicContact CD2-CD2 4.36Å; P826-L923 HydrophobicContact CG-CD2 4.36Å; P826-L923 HydrophobicContact CG-CG 4.25Å; I918-L923 HydrophobicContact CD1-CB 4.46Å; I918-L923 HydrophobicContact CD1-CD1 4.47Å; I918-L923 HydrophobicContact CG2-CB 4.43Å; I918-L923 HydrophobicContact CG2-CD2 4.23Å; D919-L923 WeakPolarHBondContact O-CB 3.36Å; D919-L923 PolarHBondContact O-N 2.84Å; H921-L923 VanDerWaalsContact C-N 3.31Å; H921-L923 PolarHBondContact O-N 3.33Å; L923-C927 WeakPolarHBondContact O-CB 3.49Å; L923-C927 PolarHBondContact O-N 3.44Å; L923-C927 PolarHBondContact O-SG 3.3Å; L923-L933 HydrophobicContact CD1-CD2 4.34Å; L923-L937 HydrophobicContact CD1-CD1 4.13Å
924	A	86.3	Confident	88.1	Confident	39 Å²	39	44 Å²	44	32%	0.322	23%	0.232	S	C	.	.	H	α-helix	trans	-68.7	-40.9	174.8	0	0	0	0	0	112.1	P826 R920 H921 C927 S928	P826-A924 HydrophobicContact CB-CB 3.99Å; R920-A924 WeakPolarHBondContact O-CB 3.41Å; R920-A924 PolarHBondContact O-N 3.13Å; H921-A924 WeakPolarHBondContact O-CB 3.34Å; H921-A924 PolarHBondContact O-N 2.88Å; H921-A924 VanDerWaalsContact O-N 3.09Å; A924-C927 PolarHBondContact O-N 2.98Å; A924-S928 PolarHBondContact O-N 2.97Å
925	E	87.2	Confident	87.8	Confident	76 Å²	76	47.3 Å²	47.3	36%	0.355	25%	0.25	S	C	.	.	H	α-helix	trans	-62.5	-46.3	173.5	-167.9	-160.3	138.7	0	0	110.6	R773 H921 C927 S928 I929	R773-E925 IonicContact CZ-OE1 3.47Å; R773-E925 IonicContact CZ-OE2 3.41Å; R773-E925 IonicContact NH1-OE1 3.31Å; R773-E925 IonicContact NH1-OE2 2.92Å; R773-E925 PolarHBondContact NH1-OE2 3.47Å; R773-E925 IonicContact NH2-OE1 2.72Å; R773-E925 PolarHBondContact NH2-OE1 3.4Å; R773-E925 IonicContact NH2-OE2 3.61Å; R773-E925 PolarHBondContact NH2-OE2 3.02Å; H921-E925 PolarHBondContact O-N 3.36Å; E925-C927 VanDerWaalsContact C-N 3.29Å; E925-C927 PolarHBondContact O-N 3.35Å; E925-S928 WeakPolarHBondContact O-CA 3.39Å; E925-S928 WeakPolarHBondContact O-CB 3.47Å; E925-S928 PolarHBondContact O-N 3.32Å; E925-S928 PolarHBondContact O-OG 3.46Å; E925-I929 HydrophobicContact CG-CD1 4.13Å; E925-I929 WeakPolarHBondContact O-CG1 3.39Å; E925-I929 PolarHBondContact O-N 2.91Å
926	L	87.7	Confident	87.3	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-58	-39	173.8	-75.3	167.8	0	0	0	112.7	N769 I770 I918 D922 S928 I929 Y930 L933	N769-L926 HydrophobicContact CB-CD2 3.97Å; I770-L926 HydrophobicContact CB-CD1 4.44Å; I770-L926 HydrophobicContact CG1-CD1 3.95Å; I918-L926 HydrophobicContact CD1-CD1 3.86Å; D922-L926 WeakPolarHBondContact O-CB 3.48Å; D922-L926 VanDerWaalsContact O-CG 3.29Å; D922-L926 WeakPolarHBondContact O-CG 3.32Å; D922-L926 PolarHBondContact O-N 3.4Å; L926-S928 VanDerWaalsContact C-N 3.29Å; L926-S928 PolarHBondContact O-N 2.95Å; L926-I929 PolarHBondContact O-N 2.99Å; L926-Y930 HydrophobicContact CD2-CD2 4.37Å; L926-Y930 HydrophobicContact CD2-CE2 4.3Å; L926-Y930 WeakPolarHBondContact O-CB 3.32Å; L926-Y930 PolarHBondContact O-N 3.33Å; L926-L933 HydrophobicContact CB-CD2 3.9Å
927	C	86.5	Confident	86.9	Confident	11 Å²	11	50.2 Å²	50.2	7%	0.074	26%	0.26	C	S	.	.	H	α-helix	trans	-67	-27.5	173.7	-70.3	0	0	0	0	113.3	L923 A924 E925 Y930	L923-C927 WeakPolarHBondContact O-CB 3.49Å; L923-C927 PolarHBondContact O-N 3.44Å; L923-C927 PolarHBondContact O-SG 3.3Å; A924-C927 PolarHBondContact O-N 2.98Å; E925-C927 VanDerWaalsContact C-N 3.29Å; E925-C927 PolarHBondContact O-N 3.35Å; C927-Y930 CarbonylContact O-C 3.5Å
928	S	84.5	Confident	86.3	Confident	92 Å²	92	52.4 Å²	52.4	64%	0.643	27%	0.273	S	S	*	.	H	α-helix	trans	-78.9	-30.1	175.1	75.2	0	0	0	0	113.2	A924 E925 L926	A924-S928 PolarHBondContact O-N 2.97Å; E925-S928 WeakPolarHBondContact O-CA 3.39Å; E925-S928 WeakPolarHBondContact O-CB 3.47Å; E925-S928 PolarHBondContact O-N 3.32Å; E925-S928 PolarHBondContact O-OG 3.46Å; L926-S928 VanDerWaalsContact C-N 3.29Å; L926-S928 PolarHBondContact O-N 2.95Å
929	I	86.1	Confident	85.6	Confident	84 Å²	84	58 Å²	58	43%	0.431	30%	0.299	S	S	.	.	H	α-helix	trans	-79	-38.2	174.6	-62.8	165.6	0	0	0	110.8	E925 L926	E925-I929 HydrophobicContact CG-CD1 4.13Å; E925-I929 WeakPolarHBondContact O-CG1 3.39Å; E925-I929 PolarHBondContact O-N 2.91Å; L926-I929 PolarHBondContact O-N 2.99Å
930	Y	87.6	Confident	84.9	Confident	61 Å²	61	60.9 Å²	60.9	24%	0.239	31%	0.306	C	S	.	.			trans	-120.2	87.8	-177.7	-60.5	-71.8	0	0	0	110.3	C766 N769 L926 C927 E932 L933	C766-Y930 HydrophobicContact CB-CD1 4.08Å; C766-Y930 HydrophobicContact CB-CD2 4.26Å; C766-Y930 HydrophobicContact CB-CE1 4.1Å; C766-Y930 HydrophobicContact CB-CE2 4.26Å; C766-Y930 HydrophobicContact CB-CG 4.17Å; C766-Y930 VanDerWaalsContact SG-CD2 3.54Å; C766-Y930 VanDerWaalsContact SG-CG 3.57Å; N769-Y930 HydrophobicContact CB-CE2 4.21Å; N769-Y930 PolarHBondContact ND2-OH 3.15Å; L926-Y930 HydrophobicContact CD2-CD2 4.37Å; L926-Y930 HydrophobicContact CD2-CE2 4.3Å; L926-Y930 WeakPolarHBondContact O-CB 3.32Å; L926-Y930 PolarHBondContact O-N 3.33Å; C927-Y930 CarbonylContact O-C 3.5Å; Y930-E932 PolarHBondContact O-N 3.46Å; Y930-L933 VanDerWaalsContact O-CB 3.29Å; Y930-L933 WeakPolarHBondContact O-CB 3.5Å; Y930-L933 PolarHBondContact O-N 3.2Å
931	P	83.4	Confident	84.6	Confident	81 Å²	81	60.3 Å²	60.3	53%	0.526	30%	0.304	S	S	.	.	H	α-helix	trans	-59.8	-30.7	-178.9	22.3	-33.1	0	0	0	112.8	L933 S934 L935	P931-L933 VanDerWaalsContact C-N 3.28Å; P931-L933 PolarHBondContact O-N 3.49Å; P931-S934 PolarHBondContact O-N 3.05Å; P931-S934 VanDerWaalsContact O-N 3.14Å; P931-S934 PolarHBondContact O-OG 3.25Å; P931-L935 PolarHBondContact O-N 2.9Å
932	E	83.3	Confident	83.9	Confident	128 Å²	128	61.9 Å²	61.9	60%	0.598	31%	0.312	S	S	*	.	H	α-helix	trans	-57.3	-38.1	172.6	-62.6	-166.8	147	0	0	112.9	Y930 S934 L935 R936	Y930-E932 PolarHBondContact O-N 3.46Å; E932-S934 VanDerWaalsContact C-N 3.32Å; E932-S934 PolarHBondContact O-N 3.45Å; E932-L935 PolarHBondContact O-N 2.93Å; E932-R936 WeakPolarHBondContact O-CG 3.46Å; E932-R936 PolarHBondContact O-N 3.12Å
933	L	86	Confident	83.2	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-42.5	177	176.1	64.1	0	0	0	110.6	F759 L762 I770 L923 L926 Y930 P931 L935 R936 L937	F759-L933 HydrophobicContact CD1-CD1 4.43Å; F759-L933 HydrophobicContact CE1-CD1 4.24Å; L762-L933 HydrophobicContact CD1-CD1 3.7Å; L762-L933 HydrophobicContact CD2-CD1 4.44Å; I770-L933 HydrophobicContact CD1-CD1 4.18Å; I770-L933 HydrophobicContact CD1-CD2 4.25Å; I770-L933 HydrophobicContact CG1-CD2 4.47Å; L923-L933 HydrophobicContact CD1-CD2 4.34Å; L926-L933 HydrophobicContact CB-CD2 3.9Å; Y930-L933 VanDerWaalsContact O-CB 3.29Å; Y930-L933 WeakPolarHBondContact O-CB 3.5Å; Y930-L933 PolarHBondContact O-N 3.2Å; P931-L933 VanDerWaalsContact C-N 3.28Å; P931-L933 PolarHBondContact O-N 3.49Å; L933-L935 VanDerWaalsContact C-N 3.32Å; L933-L935 PolarHBondContact O-N 3.39Å; L933-R936 PolarHBondContact O-N 3.46Å; L933-L937 HydrophobicContact CD1-CD1 4.01Å; L933-L937 HydrophobicContact CD1-CG 4.09Å; L933-L937 HydrophobicContact CG-CD1 3.97Å; L933-L937 HydrophobicContact CG-CG 4.45Å; L933-L937 WeakPolarHBondContact O-CB 3.5Å; L933-L937 VanDerWaalsContact O-CG 3.28Å; L933-L937 WeakPolarHBondContact O-CG 3.45Å; L933-L937 PolarHBondContact O-N 3.01Å
934	S	81.9	Confident	82.5	Confident	4 Å²	4	65.7 Å²	65.7	3%	0.028	34%	0.335	C	S	.	.	H	α-helix	trans	-62.4	-39.3	178.6	79.4	0	0	0	0	112.3	P931 E932 L938	P931-S934 PolarHBondContact O-N 3.05Å; P931-S934 VanDerWaalsContact O-N 3.14Å; P931-S934 PolarHBondContact O-OG 3.25Å; E932-S934 VanDerWaalsContact C-N 3.32Å; E932-S934 PolarHBondContact O-N 3.45Å; S934-L938 WeakPolarHBondContact O-CB 3.25Å; S934-L938 PolarHBondContact O-N 2.89Å; S934-L938 VanDerWaalsContact O-N 3.13Å
935	L	82.7	Confident	81.7	Confident	87 Å²	87	65.4 Å²	65.4	46%	0.455	33%	0.328	S	S	.	.	H	α-helix	trans	-70	-44.2	176.4	-64.7	173.7	0	0	0	111.6	P931 E932 L933 L937 L938 E939	P931-L935 PolarHBondContact O-N 2.9Å; E932-L935 PolarHBondContact O-N 2.93Å; L933-L935 VanDerWaalsContact C-N 3.32Å; L933-L935 PolarHBondContact O-N 3.39Å; L935-L937 VanDerWaalsContact C-N 3.34Å; L935-L937 PolarHBondContact O-N 3.48Å; L935-L938 PolarHBondContact O-N 3.15Å; L935-L938 VanDerWaalsContact O-N 3.16Å; L935-E939 WeakPolarHBondContact O-CB 3.48Å; L935-E939 WeakPolarHBondContact O-CG 3.35Å; L935-E939 PolarHBondContact O-N 3.31Å
936	R	82.7	Confident	80.9	Confident	72 Å²	72	65.1 Å²	65.1	27%	0.272	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-35.7	177.8	-69.6	-56.4	-170.4	-155.9	0	113.2	A758 S761 L762 E932 L933 E939 R940	A758-R936 HydrophobicContact CB-CB 4.35Å; A758-R936 WeakPolarHBondContact CB-O 3.4Å; S761-R936 PolarHBondContact OG-NE 2.92Å; L762-R936 HydrophobicContact CD2-CG 4.27Å; E932-R936 WeakPolarHBondContact O-CG 3.46Å; E932-R936 PolarHBondContact O-N 3.12Å; L933-R936 PolarHBondContact O-N 3.46Å; R936-E939 IonicContact CZ-OE2 2.68Å; R936-E939 IonicContact NH1-OE1 2.69Å; R936-E939 IonicContact NH1-OE2 3.67Å; R936-E939 PolarHBondContact NH1-OE2 3.44Å; R936-R940 WeakPolarHBondContact O-CB 3.34Å; R936-R940 PolarHBondContact O-N 3.4Å
937	L	84.3	Confident	80.4	Confident	2 Å²	2	65.1 Å²	65.1	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-66.9	-39.6	172.4	-69.3	170.7	0	0	0	111.2	A758 F759 L828 L923 L933 L935 F941	A758-L937 HydrophobicContact CB-CD2 4.16Å; F759-L937 HydrophobicContact CE1-CD2 4.25Å; F759-L937 HydrophobicContact CZ-CD2 4.33Å; L828-L937 HydrophobicContact CD1-CB 3.83Å; L828-L937 HydrophobicContact CD2-CB 4.26Å; L828-L937 HydrophobicContact CD2-CD1 4.45Å; L923-L937 HydrophobicContact CD1-CD1 4.13Å; L933-L937 HydrophobicContact CD1-CD1 4.01Å; L933-L937 HydrophobicContact CD1-CG 4.09Å; L933-L937 HydrophobicContact CG-CD1 3.97Å; L933-L937 HydrophobicContact CG-CG 4.45Å; L933-L937 WeakPolarHBondContact O-CB 3.5Å; L933-L937 VanDerWaalsContact O-CG 3.28Å; L933-L937 WeakPolarHBondContact O-CG 3.45Å; L933-L937 PolarHBondContact O-N 3.01Å; L935-L937 VanDerWaalsContact C-N 3.34Å; L935-L937 PolarHBondContact O-N 3.48Å; L937-F941 HydrophobicContact CB-CB 4.38Å; L937-F941 HydrophobicContact CD2-CB 3.83Å; L937-F941 HydrophobicContact CD2-CD2 3.67Å; L937-F941 HydrophobicContact CD2-CE2 4.46Å; L937-F941 HydrophobicContact CD2-CG 3.8Å; L937-F941 VanDerWaalsContact O-CB 3.26Å; L937-F941 WeakPolarHBondContact O-CB 3.04Å; L937-F941 PolarHBondContact O-N 3.45Å
938	L	79.7	Confident	79.5	Confident	89 Å²	89	67.3 Å²	67.3	47%	0.466	35%	0.346	S	S	.	.	H	α-helix	trans	-70.6	-33.7	177	-170.9	65.2	0	0	0	113.1	L828 S934 L935	L828-L938 HydrophobicContact CB-CD1 4.21Å; L828-L938 HydrophobicContact CD1-CB 4.22Å; L828-L938 HydrophobicContact CD1-CD1 4.4Å; S934-L938 WeakPolarHBondContact O-CB 3.25Å; S934-L938 PolarHBondContact O-N 2.89Å; S934-L938 VanDerWaalsContact O-N 3.13Å; L935-L938 PolarHBondContact O-N 3.15Å; L935-L938 VanDerWaalsContact O-N 3.16Å
939	E	79.6	Confident	78.2	Confident	118 Å²	118	68.2 Å²	68.2	55%	0.551	34%	0.342	S	S	*	.	H	α-helix	trans	-82.4	-33.2	180	-75.5	179.4	179.9	0	0	114.6	L935 R936	L935-E939 WeakPolarHBondContact O-CB 3.48Å; L935-E939 WeakPolarHBondContact O-CG 3.35Å; L935-E939 PolarHBondContact O-N 3.31Å; R936-E939 IonicContact CZ-OE2 2.68Å; R936-E939 IonicContact NH1-OE1 2.69Å; R936-E939 IonicContact NH1-OE2 3.67Å; R936-E939 PolarHBondContact NH1-OE2 3.44Å
940	R	77.9	Confident	75.9	Confident	119 Å²	119	69.3 Å²	69.3	45%	0.449	36%	0.357	S	S	.	.	H	α-helix	trans	-142.3	12	-158.4	-53.9	-177.4	-179.1	-146.1	-14.6	115.3	S756 A757 A758 R936	S756-R940 PolarHBondContact OG-O 3.41Å; A757-R940 HydrophobicContact CB-CB 4.44Å; A758-R940 HydrophobicContact CB-CB 4.2Å; R936-R940 WeakPolarHBondContact O-CB 3.34Å; R936-R940 PolarHBondContact O-N 3.4Å
941	F	81.1	Confident	73.1	Confident	18 Å²	18	71.4 Å²	71.4	8%	0.079	38%	0.381	C	S	.	.			trans	-118	104.3	178.5	-165.9	-78.3	0	0	0	110.8	S756 A758 F759 M795 F821 L825 L937 L943	S756-F941 VanDerWaalsContact OG-CD2 3.29Å; S756-F941 WeakPolarHBondContact OG-CD2 3.48Å; A758-F941 HydrophobicContact CB-CB 4.14Å; A758-F941 HydrophobicContact CB-CD2 4.29Å; F759-F941 HydrophobicContact CE2-CD2 4.42Å; F759-F941 HydrophobicContact CE2-CE2 4.03Å; F759-F941 HydrophobicContact CZ-CD2 4.41Å; F759-F941 HydrophobicContact CZ-CE2 4.14Å; M795-F941 HydrophobicContact CE-CE2 4.03Å; M795-F941 HydrophobicContact CE-CZ 3.82Å; M795-F941 HydrophobicContact CG-CZ 4.23Å; M795-F941 HydrophobicContact SD-CE1 3.69Å; M795-F941 HydrophobicContact SD-CE2 3.94Å; M795-F941 HydrophobicContact SD-CZ 3.29Å; M795-F941 WeakPolarHBondContact SD-CZ 3.42Å; F821-F941 HydrophobicContact CB-CE1 4.2Å; F821-F941 HydrophobicContact CB-CZ 3.71Å; F821-F941 AromaticContact CD1-CE2 3.89Å; F821-F941 HydrophobicContact CD1-CE2 3.89Å; F821-F941 AromaticContact CD1-CZ 3.49Å; F821-F941 HydrophobicContact CD1-CZ 3.49Å; F821-F941 VanDerWaalsContact CD1-CZ 3.49Å; F821-F941 HydrophobicContact CD2-CE2 4.26Å; F821-F941 HydrophobicContact CD2-CZ 4.16Å; F821-F941 AromaticContact CE1-CE2 3.97Å; F821-F941 HydrophobicContact CE1-CE2 3.97Å; F821-F941 HydrophobicContact CE1-CZ 4.05Å; F821-F941 HydrophobicContact CE2-CE2 4.36Å; F821-F941 HydrophobicContact CG-CE1 4.46Å; F821-F941 HydrophobicContact CG-CE2 4.02Å; F821-F941 AromaticContact CG-CZ 3.53Å; F821-F941 HydrophobicContact CG-CZ 3.53Å; F821-F941 HydrophobicContact CZ-CE2 4.21Å; L825-F941 HydrophobicContact CD1-CD1 4.03Å; L825-F941 HydrophobicContact CD1-CE1 4.38Å; L825-F941 HydrophobicContact CD2-CD1 4.17Å; L825-F941 HydrophobicContact CD2-CE1 4.17Å; L937-F941 HydrophobicContact CB-CB 4.38Å; L937-F941 HydrophobicContact CD2-CB 3.83Å; L937-F941 HydrophobicContact CD2-CD2 3.67Å; L937-F941 HydrophobicContact CD2-CE2 4.46Å; L937-F941 HydrophobicContact CD2-CG 3.8Å; L937-F941 VanDerWaalsContact O-CB 3.26Å; L937-F941 WeakPolarHBondContact O-CB 3.04Å; L937-F941 PolarHBondContact O-N 3.45Å; F941-L943 HydrophobicContact CE1-CD2 3.77Å; F941-L943 HydrophobicContact CE1-CG 4.11Å
942	E	72.8	Confident	70.4	Confident	177 Å²	177	75 Å²	75	83%	0.827	40%	0.396	S	S	*	.			trans	-98.9	136.7	172.2	-64.8	175.4	170.4	0	0	108.9
943	L	77	Confident	67.8	Low	44 Å²	44	75.3 Å²	75.3	23%	0.23	41%	0.406	C	S	.	.			trans	-87.6	128.1	169.2	-71.7	164.6	0	0	0	107.8	F821 L825 F941 L945	F821-L943 HydrophobicContact CB-CD2 4.37Å; L825-L943 HydrophobicContact CD1-CD1 3.92Å; L825-L943 HydrophobicContact CD1-CG 4.18Å; L825-L943 HydrophobicContact CG-CD1 4.19Å; F941-L943 HydrophobicContact CE1-CD2 3.77Å; F941-L943 HydrophobicContact CE1-CG 4.11Å; L943-L945 PolarHBondContact O-N 2.94Å
944	T	75	Confident	64.9	Low	76 Å²	76	84.3 Å²	84.3	47%	0.466	45%	0.446	S	S	.	.	S	Bend	trans	-56.2	-37.9	-179.8	-50.3	0	0	0	0	111.4	L816 D820 F821	L816-T944 HydrophobicContact CD2-CG2 4.26Å; D820-T944 HydrophobicContact CB-CG2 4.21Å; D820-T944 WeakPolarHBondContact CB-OG1 3.32Å; D820-T944 WeakPolarHBondContact OD1-CB 3.28Å; D820-T944 WeakPolarHBondContact OD1-CG2 3.41Å; D820-T944 PolarHBondContact OD1-OG1 2.93Å; F821-T944 PolarHBondContact N-OG1 3.13Å; F821-T944 PolarHBondContact O-N 2.77Å
945	L	68.3	Low	62.1	Low	34 Å²	34	90 Å²	90	18%	0.178	48%	0.482	C	S	.	.	B	Isolated β-bridge	trans	-143.4	114	175.4	-162.1	153.8	0	0	0	110.9	V805 L816 F905 L943 L947	V805-L945 HydrophobicContact CB-CD1 4.17Å; V805-L945 HydrophobicContact CG1-CD1 4.33Å; V805-L945 HydrophobicContact CG1-CD2 3.99Å; V805-L945 HydrophobicContact CG2-CD1 4.08Å; L816-L945 HydrophobicContact CD2-CB 4.21Å; F905-L945 HydrophobicContact CD2-CD2 4.39Å; L943-L945 PolarHBondContact O-N 2.94Å; L945-L947 HydrophobicContact CD2-CD2 4.01Å; L945-L947 PolarHBondContact O-N 3.42Å
946	P	70.1	Confident	59.5	Low	69 Å²	69	92.4 Å²	92.4	45%	0.448	49%	0.494	S	S	.	.			trans	-75.2	113.2	176.8	29.3	-32.7	0	0	0	110.4	T948	P946-T948 PolarHBondContact O-N 3.24Å
947	L	77	Confident	56.7	Low	1 Å²	1	96.8 Å²	96.8	1%	0.005	52%	0.523	C	S	.	.	S	Bend	trans	-69.5	6.2	177.4	-64.8	177.8	0	0	0	113.9	L792 V805 F822 R904 F905 V907 L945	L792-L947 HydrophobicContact CD1-CB 3.76Å; L792-L947 HydrophobicContact CD2-CB 4.25Å; L792-L947 HydrophobicContact CD2-CD1 3.75Å; V805-L947 HydrophobicContact CG1-CD2 3.93Å; F822-L947 HydrophobicContact CD2-CD1 4.35Å; R904-L947 PolarHBondContact N-O 3.48Å; F905-L947 HydrophobicContact CB-CD2 4.22Å; F905-L947 HydrophobicContact CD2-CD2 4.14Å; V907-L947 HydrophobicContact CG2-CD1 4.06Å; V907-L947 HydrophobicContact CG2-CD2 4Å; L945-L947 HydrophobicContact CD2-CD2 4.01Å; L945-L947 PolarHBondContact O-N 3.42Å
948	T	69.4	Low	54.1	Low	58 Å²	58	102.1 Å²	102.1	36%	0.356	56%	0.556	S	S	.	*			trans	-130.9	116.8	-178.2	59.4	0	0	0	0	110.5	L792 P901 P946	L792-T948 HydrophobicContact CD1-CG2 3.47Å; L792-T948 VanDerWaalsContact CD1-CG2 3.47Å; P901-T948 HydrophobicContact CB-CG2 3.68Å; P901-T948 HydrophobicContact CG-CG2 3.68Å; P946-T948 PolarHBondContact O-N 3.24Å
949	I	55.7	Low	51.5	Low	110 Å²	110	103.8 Å²	103.8	56%	0.564	57%	0.57	S	S	*	*			trans	-114.1	111.7	167.3	-60.5	175.1	0	0	0	106.8	F905 S951	F905-I949 HydrophobicContact CE2-CD1 4.46Å; F905-I949 HydrophobicContact CZ-CD1 4.14Å; I949-S951 PolarHBondContact O-N 2.82Å
950	S	39.3	Very low	48.9	Very low	108 Å²	108	105 Å²	105	76%	0.755	58%	0.58	S	S	*	*			trans	-78.9	105	-176.4	51.4	0	0	0	0	111.1	D952	S950-D952 VanDerWaalsContact C-N 3.3Å; S950-D952 PolarHBondContact O-N 2.84Å
951	S	28	Very low	46.4	Very low	105 Å²	105	105.2 Å²	105.2	73%	0.734	60%	0.595	S	S	*	*			trans	-78.1	72.1	176.3	58.1	0	0	0	0	112	I949	I949-S951 PolarHBondContact O-N 2.82Å
952	D	27.3	Very low	43.8	Very low	156 Å²	156	111.5 Å²	111.5	83%	0.834	63%	0.629	S	S	*	*			trans	-158.6	58.1	169.2	-110.5	-27.9	0	0	0	113.9	S950	S950-D952 VanDerWaalsContact C-N 3.3Å; S950-D952 PolarHBondContact O-N 2.84Å
953	T	27.8	Very low	41.5	Very low	134 Å²	134	114.7 Å²	114.7	82%	0.822	63%	0.634	S	S	*	*			trans	-134.7	99.9	160.9	45.2	0	0	0	0	110.5
954	K	24.3	Very low	39	Very low	190 Å²	190	119 Å²	119	83%	0.826	67%	0.666	S	S	*	*			trans	-68.4	145.7	155.2	-71.7	179.3	178.4	175.8	0	108.3	I956	K954-I956 PolarHBondContact O-N 3.42Å
955	P	23.9	Very low	36.6	Very low	123 Å²	123	120.6 Å²	120.6	80%	0.799	68%	0.68	S	S	*	*			trans	-66.1	107.7	173.3	27.3	-33.1	0	0	0	109.5	N957	P955-N957 PolarHBondContact O-N 3Å
956	I	28	Very low	34.7	Very low	137 Å²	137	125.7 Å²	125.7	70%	0.703	71%	0.713	S	S	*	*			trans	-85.3	111.5	175.4	-65.2	179.2	0	0	0	108.2	K954 T958	K954-I956 PolarHBondContact O-N 3.42Å; I956-T958 HydrophobicContact CG2-CG2 3.98Å; I956-T958 PolarHBondContact O-N 3.41Å
957	N	23.4	Very low	32.6	Very low	164 Å²	164	130.1 Å²	130.1	88%	0.877	73%	0.731	S	S	*	*			trans	-70.8	90.2	170.1	-77.9	-16.2	0	0	0	110.2	P955	P955-N957 PolarHBondContact O-N 3Å
958	T	29.5	Very low	30.4	Very low	115 Å²	115	135.3 Å²	135.3	71%	0.706	77%	0.765	S	S	*	*			trans	-133.7	121.4	164.3	45.1	0	0	0	0	110.2	I956	I956-T958 HydrophobicContact CG2-CG2 3.98Å; I956-T958 PolarHBondContact O-N 3.41Å
959	T	25.4	Very low	28.6	Very low	124 Å²	124	138.5 Å²	138.5	76%	0.761	78%	0.78	S	S	*	*			trans	-78.1	161.4	174.7	42.4	0	0	0	0	112.1
960	N	24.6	Very low	27.3	Very low	144 Å²	144	140.7 Å²	140.7	77%	0.77	80%	0.798	S	S	*	*			trans	84.1	143.4	176.8	-48.4	-34.4	0	0	0	116.2
961	T	25.7	Very low	26.9	Very low	123 Å²	123	144.3 Å²	144.3	76%	0.755	80%	0.803	S	S	*	*			trans	48.8	113.5	164.8	51.6	0	0	0	0	116.5
962	D	27.2	Very low	27	Very low	149 Å²	149	143.5 Å²	143.5	80%	0.797	80%	0.798	S	S	*	*			cis	-159.9	177.4	40.3	-95.1	-38.6	0	0	0	114.5	C964	D962-C964 PolarHBondContact O-N 2.89Å
963	R	23.8	Very low	27.2	Very low	245 Å²	245	145.6 Å²	145.6	93%	0.925	80%	0.799	S	S	*	*			trans	-77.5	92.6	178.8	-67.6	179.4	176.9	174.8	-0.9	113.3
964	C	24.6	Very low	27.4	Very low	133 Å²	133	147 Å²	147	90%	0.899	80%	0.801	S	S	*	*			trans	-171.3	92.5	145.1	-113.4	0	0	0	0	111.3	D962	D962-C964 PolarHBondContact O-N 2.89Å
965	S	24.7	Very low	27.6	Very low	111 Å²	111	144.8 Å²	144.8	78%	0.776	80%	0.798	S	S	*	*			trans	-144.3	81.8	-175.4	47.2	0	0	0	0	113.1
966	T	28.2	Very low	27.9	Very low	140 Å²	140	142.4 Å²	142.4	86%	0.859	79%	0.789	S	S	*	*			trans	-133.4	74.2	166.2	51.2	0	0	0	0	110.8
967	I	26.9	Very low	28.1	Very low	162 Å²	162	142.8 Å²	142.8	83%	0.831	80%	0.798	S	S	*	*			trans	-119	118.7	161.9	-60.1	172.4	0	0	0	106.9
968	P	31.5	Very low	28.3	Very low	110 Å²	110	139.5 Å²	139.5	71%	0.714	79%	0.788	S	S	*	*			trans	-109.6	100.8	167.2	33.3	-22.4	0	0	0	111.5
969	N	30.6	Very low	28.3	Very low	125 Å²	125	138 Å²	138	67%	0.668	78%	0.782	S	S	*	*			trans	34.6	119.3	148.5	-58.4	-4	0	0	0	120.6	E971	N969-E971 PolarHBondContact O-N 2.81Å
970	V	29.6	Very low	28.4	Very low	157 Å²	157	142.7 Å²	142.7	95%	0.952	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	75.5	157.6	-176.3	0	0	0	0	109.9
971	E	30.4	Very low	28.6	Very low	183 Å²	183	144.6 Å²	144.6	86%	0.855	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.2	-0.7	167.8	-121.9	164.9	-160.6	0	0	113.6	N969	N969-E971 PolarHBondContact O-N 2.81Å
972	S	30.4	Very low	28.8	Very low	89 Å²	89	145.7 Å²	145.7	62%	0.622	79%	0.79	S	S	*	*	S	Bend	trans	-110.6	3.6	-174.2	57.9	0	0	0	0	115.3
973	F	31.1	Very low	28.8	Very low	199 Å²	199	144.1 Å²	144.1	87%	0.873	79%	0.785	S	S	*	*	S	Bend	trans	-88.6	1.4	-172	-152.9	-101.1	0	0	0	114.9
974	L	31.4	Very low	29	Very low	165 Å²	165	138.8 Å²	138.8	86%	0.864	78%	0.784	S	S	*	*	S	Bend	trans	-104.8	-11	-175.8	-86.2	163.5	0	0	0	115.4
975	D	29.1	Very low	29.2	Very low	142 Å²	142	137.6 Å²	137.6	76%	0.759	78%	0.777	S	S	*	*	S	Bend	trans	-111.2	5.1	-179.2	-84.9	-46	0	0	0	114.2	T977 S978	D975-T977 PolarHBondContact O-N 3.47Å; D975-S978 PolarHBondContact O-OG 3.49Å
976	A	30.7	Very low	29.4	Very low	74 Å²	74	140 Å²	140	61%	0.612	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-0.5	-168.4	0	0	0	0	0	116
977	T	30.7	Very low	29.4	Very low	144 Å²	144	141.1 Å²	141.1	88%	0.883	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	7.3	-174.3	47	0	0	0	0	114.7	D975	D975-T977 PolarHBondContact O-N 3.47Å
978	S	29.1	Very low	29.6	Very low	95 Å²	95	140.5 Å²	140.5	66%	0.664	78%	0.784	S	S	*	*	S	Bend	trans	-126.5	6.9	-163.3	60.9	0	0	0	0	116.4	D975	D975-S978 PolarHBondContact O-OG 3.49Å
979	S	29.1	Very low	29.6	Very low	84 Å²	84	138 Å²	138	59%	0.587	78%	0.779	S	S	*	*			trans	-151.8	50.3	-167.4	49.3	0	0	0	0	118.3
980	W	28.2	Very low	29.6	Very low	223 Å²	223	137.4 Å²	137.4	85%	0.845	78%	0.784	S	S	*	*			trans	-135.6	48.2	160.4	-84.6	95.9	0	0	0	114	V983	W980-V983 HydrophobicContact CZ3-CB 4.48Å; W980-V983 HydrophobicContact CZ3-CG2 4.2Å
981	H	28.4	Very low	29.6	Very low	183 Å²	183	139.1 Å²	139.1	85%	0.847	78%	0.779	S	S	*	*			trans	-80.4	156.3	141.8	-87.2	-99.5	0	0	0	108.5
982	I	29	Very low	29.7	Very low	147 Å²	147	135 Å²	135	75%	0.754	77%	0.771	S	S	*	*	S	Bend	trans	86.2	146	-168.1	-50.8	163.2	0	0	0	112.1
983	V	27.9	Very low	29.7	Very low	115 Å²	115	136.4 Å²	136.4	70%	0.697	78%	0.781	S	S	*	*	S	Bend	trans	69.2	41.9	-172.9	-151.8	0	0	0	0	115.8	W980	W980-V983 HydrophobicContact CZ3-CB 4.48Å; W980-V983 HydrophobicContact CZ3-CG2 4.2Å
984	C	27.6	Very low	29.9	Very low	133 Å²	133	133.3 Å²	133.3	90%	0.899	78%	0.78	S	S	*	*			trans	-139.1	38.5	162.2	-104.2	0	0	0	0	112.1
985	S	28.2	Very low	29.8	Very low	108 Å²	108	129.1 Å²	129.1	76%	0.755	78%	0.777	S	S	*	*			trans	-124	19.2	-169.1	-47.6	0	0	0	0	114.5
986	L	29.8	Very low	29.8	Very low	161 Å²	161	130.4 Å²	130.4	84%	0.843	78%	0.783	S	S	*	*	S	Bend	trans	-136.1	139.1	178.6	-78.1	170.9	0	0	0	110.9
987	L	28.7	Very low	29.6	Very low	164 Å²	164	131.8 Å²	131.8	86%	0.859	79%	0.788	S	S	*	*			trans	70	50.7	169.2	-52.6	177.6	0	0	0	117.4
988	T	31.2	Very low	29.7	Very low	149 Å²	149	134.4 Å²	134.4	91%	0.914	79%	0.787	S	S	*	*			trans	-88.5	125.9	141.8	42.2	0	0	0	0	109.9
989	G	30.1	Very low	29.5	Very low	59 Å²	59	141.2 Å²	141.2	61%	0.608	80%	0.799	S	S	*	*			trans	87.8	150.4	-178.5	0	0	0	0	0	114.6
990	S	32.2	Very low	29.8	Very low	111 Å²	111	142.4 Å²	142.4	78%	0.776	80%	0.804	S	S	*	*			cis	-158.9	137.8	-4.9	-86.9	0	0	0	0	112.3
991	F	29.5	Very low	29.7	Very low	193 Å²	193	136.5 Å²	136.5	85%	0.846	80%	0.797	S	S	*	*			trans	62.7	145	151.2	-86	-99.3	0	0	0	123.1
992	S	31.6	Very low	29.9	Very low	97 Å²	97	134.9 Å²	134.9	68%	0.678	80%	0.795	S	S	*	*			trans	68.1	97.5	149.7	54	0	0	0	0	122.3
993	S	31.2	Very low	29.8	Very low	119 Å²	119	134.6 Å²	134.6	83%	0.832	80%	0.795	S	S	*	*				73.6	155.7	110.9	-57.1	0	0	0	0	121.1
994	P	34.1	Very low	30	Very low	133 Å²	133	134.1 Å²	134.1	86%	0.864	80%	0.796	S	S	*	*			trans	-117.7	165.1	-144.3	41.2	-31.8	0	0	0	116.9
995	G	30.6	Very low	30.1	Very low	77 Å²	77	137.1 Å²	137.1	79%	0.794	79%	0.794	S	S	*	*			trans	-159.1	107.6	177.1	0	0	0	0	0	116.7
996	L	28.3	Very low	29.9	Very low	169 Å²	169	140.6 Å²	140.6	89%	0.885	80%	0.796	S	S	*	*			trans	0.4	131	155.9	-98.6	66.8	0	0	0	123
997	S	27	Very low	29.8	Very low	103 Å²	103	139.2 Å²	139.2	72%	0.72	80%	0.798	S	S	*	*				96.5	149	118.6	-154	0	0	0	0	123
998	K	31.2	Very low	29.6	Very low	199 Å²	199	139 Å²	139	87%	0.865	80%	0.795	S	S	*	*			trans	78.7	111	164.2	-74.2	170.4	-178	178.9	0	122.4
999	R	25.9	Very low	29.5	Very low	239 Å²	239	140.1 Å²	140.1	90%	0.902	79%	0.794	S	S	*	*			trans	-65.6	178	150.6	-89.5	-176.8	-176.9	-177.1	2.1	112.6
1000	P	34.4	Very low	29.4	Very low	108 Å²	108	143.1 Å²	143.1	70%	0.701	80%	0.796	S	S	*	*			cis	-136.6	-164.9	-17.1	32.4	-9.5	0	0	0	114.4
1001	S	27.9	Very low	29.1	Very low	99 Å²	99	145 Å²	145	69%	0.692	79%	0.793	S	S	*	*			trans	66.8	124.6	146.1	60.5	0	0	0	0	121.5
1002	D	32.7	Very low	28.9	Very low	150 Å²	150	141.7 Å²	141.7	80%	0.802	79%	0.788	S	S	*	*				-155.7	-177	98.7	-139.5	-34	0	0	0	112.8
1003	N	26.6	Very low	28.6	Very low	141 Å²	141	142.1 Å²	142.1	75%	0.754	79%	0.792	S	S	*	*			trans	-116.1	147	-160.6	-59.3	-96.4	0	0	0	114.6
1004	S	32.1	Very low	28.3	Very low	104 Å²	104	146.8 Å²	146.8	73%	0.727	79%	0.793	S	S	*	*			trans	-164.4	118.3	141.9	64.5	0	0	0	0	115.7
1005	K	29.4	Very low	27.9	Very low	197 Å²	197	149.8 Å²	149.8	86%	0.857	80%	0.795	S	S	*	*			trans	57.3	151.5	132.6	-63.3	177	-177.2	176.5	0	121.6
1006	F	24.1	Very low	27.6	Very low	181 Å²	181	152.1 Å²	152.1	79%	0.794	80%	0.799	S	S	*	*			cis	-174.6	128.3	-34.1	-139.6	-81.9	0	0	0	107.5
1007	C	27.2	Very low	27.5	Very low	132 Å²	132	155.5 Å²	155.5	89%	0.892	80%	0.8	S	S	*	*			trans	175.6	132.6	149.3	-105	0	0	0	0	109.8
1008	M	24.1	Very low	27.5	Very low	159 Å²	159	155.8 Å²	155.8	78%	0.783	80%	0.801	S	S	*	*			trans	-116.8	155.6	177.2	-60.9	-168	-58.2	0	0	110.8
1009	L	29.6	Very low	27.2	Very low	173 Å²	173	155.5 Å²	155.5	91%	0.906	80%	0.8	S	S	*	*			trans	-152.9	153.2	138	-106.1	168.1	0	0	0	108.9
1010	N	27.1	Very low	27.3	Very low	121 Å²	121	151.7 Å²	151.7	65%	0.647	80%	0.798	S	S	*	*			trans	-75.9	175.7	-173.8	-66.7	3.1	0	0	0	111.5
1011	E	27.4	Very low	27	Very low	150 Å²	150	151.7 Å²	151.7	70%	0.701	79%	0.792	S	S	*	*			cis	-159.6	140.9	22.9	-151.6	134.3	-104.1	0	0	114.6
1012	T	25.2	Very low	27.1	Very low	124 Å²	124	152.2 Å²	152.2	76%	0.761	79%	0.793	S	S	*	*			trans	58.2	135.9	153.6	51	0	0	0	0	123.8
1013	S	24.7	Very low	27.1	Very low	107 Å²	107	154.1 Å²	154.1	75%	0.748	79%	0.794	S	S	*	*			trans	88.3	141.8	155.2	85	0	0	0	0	119.4
1014	Y	24.7	Very low	27.3	Very low	217 Å²	217	154.4 Å²	154.4	85%	0.851	80%	0.795	S	S	*	*			trans	47.6	79.5	168.7	-70.2	-82.7	0	0	0	119.5
1015	Q	24.9	Very low	27.5	Very low	196 Å²	196	153.1 Å²	153.1	92%	0.916	80%	0.797	S	S	*	*				-174.8	123.3	126.1	-104.9	167.2	29.9	0	0	114.1
1016	S	25.8	Very low	27.7	Very low	126 Å²	126	150.7 Å²	150.7	88%	0.881	79%	0.787	S	S	*	*			trans	-151	40	156.6	60.6	0	0	0	0	112.5	C1018	S1016-C1018 PolarHBondContact O-N 2.94Å
1017	R	25.2	Very low	28.3	Very low	239 Å²	239	144.6 Å²	144.6	90%	0.902	77%	0.765	S	S	*	*			trans	-75.8	115.6	158.2	-82.8	-175.5	175	173.8	-0.8	108.3
1018	C	26.6	Very low	28.8	Very low	110 Å²	110	142.7 Å²	142.7	74%	0.743	75%	0.751	S	S	*	*			trans	-173.4	142.7	142	-101	0	0	0	0	111.4	S1016	S1016-C1018 PolarHBondContact O-N 2.94Å
1019	F	25.8	Very low	29.8	Very low	192 Å²	192	143.6 Å²	143.6	84%	0.842	75%	0.746	S	S	*	*			trans	54.9	96.5	172.2	-60	-72.2	0	0	0	118.2
1020	D	28.3	Very low	30.3	Very low	160 Å²	160	137.8 Å²	137.8	86%	0.856	71%	0.714	S	S	*	*				-144.5	164.6	118.4	-117.9	-37.9	0	0	0	110.8
1021	N	27.9	Very low	30.8	Very low	107 Å²	107	138 Å²	138	57%	0.572	72%	0.715	S	S	*	*			trans	-66.6	136.1	-162.4	-91.3	-65.9	0	0	0	115.9	F1023	N1021-F1023 PolarHBondContact O-N 3.31Å
1022	P	30.6	Very low	31.4	Very low	111 Å²	111	133 Å²	133	72%	0.721	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	10.9	171.5	35.1	-36.4	0	0	0	114.3
1023	F	31.2	Very low	31.9	Very low	189 Å²	189	133.9 Å²	133.9	83%	0.829	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	10.4	-171.5	-79.5	-73.4	0	0	0	114.9	N1021	N1021-F1023 PolarHBondContact O-N 3.31Å
1024	I	32	Very low	32.4	Very low	148 Å²	148	136.1 Å²	136.1	76%	0.759	67%	0.674	S	S	*	*	S	Bend	trans	-126.2	129.7	179.2	-57.3	177	0	0	0	108.9
1025	G	35.7	Very low	33.1	Very low	76 Å²	76	131.1 Å²	131.1	78%	0.784	66%	0.659	S	S	*	*			trans	110	-4	170	0	0	0	0	0	117.7
1026	K	33.4	Very low	33.5	Very low	146 Å²	146	126.1 Å²	126.1	64%	0.635	63%	0.631	S	S	*	*			trans	-72.8	136.7	170.5	-81.6	-173.4	162.9	-136.8	0	111.1	E1030	K1026-E1030 WeakPolarHBondContact CD-OE2 3.48Å; K1026-E1030 VanDerWaalsContact CE-OE2 3.23Å; K1026-E1030 WeakPolarHBondContact CE-OE2 3.37Å; K1026-E1030 IonicContact NZ-OE1 3.54Å; K1026-E1030 IonicContact NZ-OE2 3.66Å; K1026-E1030 PolarHBondContact NZ-OE2 3.47Å
1027	P	36.8	Very low	34	Very low	53 Å²	53	125.9 Å²	125.9	34%	0.344	62%	0.62	S	S	.	*			trans	-73.9	155.2	-175	31.4	-36.6	0	0	0	112.2	W1029 E1030	P1027-W1029 HydrophobicContact CG-CZ2 4.23Å; P1027-W1029 PolarHBondContact O-N 3.31Å; P1027-E1030 PolarHBondContact O-N 3.02Å
1028	P	37.2	Very low	34.4	Very low	92 Å²	92	119.2 Å²	119.2	60%	0.597	60%	0.597	S	S	*	*	H	α-helix	trans	-60.5	-15.3	-168.5	-27.2	36	0	0	0	116.8
1029	W	45.2	Very low	34.9	Very low	178 Å²	178	119.2 Å²	119.2	67%	0.674	59%	0.59	S	S	*	*	H	α-helix	trans	-83.5	-17.2	-177.9	57.1	-90	0	0	0	114.5	P1027 R1033	P1027-W1029 HydrophobicContact CG-CZ2 4.23Å; P1027-W1029 PolarHBondContact O-N 3.31Å; W1029-R1033 PolarHBondContact O-N 2.76Å
1030	E	41.6	Very low	35.5	Very low	51 Å²	51	118 Å²	118	24%	0.238	59%	0.587	C	S	.	*	H	α-helix	trans	-76.5	-35.2	170.4	-80.9	-152.2	124.3	0	0	112.5	K1026 P1027 E1032 R1033 Y1034	K1026-E1030 WeakPolarHBondContact CD-OE2 3.48Å; K1026-E1030 VanDerWaalsContact CE-OE2 3.23Å; K1026-E1030 WeakPolarHBondContact CE-OE2 3.37Å; K1026-E1030 IonicContact NZ-OE1 3.54Å; K1026-E1030 IonicContact NZ-OE2 3.66Å; K1026-E1030 PolarHBondContact NZ-OE2 3.47Å; P1027-E1030 PolarHBondContact O-N 3.02Å; E1030-E1032 VanDerWaalsContact C-N 3.32Å; E1030-E1032 PolarHBondContact O-N 3.45Å; E1030-R1033 VanDerWaalsContact O-CB 3.26Å; E1030-R1033 WeakPolarHBondContact O-CB 3.19Å; E1030-R1033 PolarHBondContact O-N 3.34Å; E1030-Y1034 WeakPolarHBondContact O-CD2 3.21Å; E1030-Y1034 PolarHBondContact O-N 2.8Å
1031	L	37.4	Very low	35.4	Very low	127 Å²	127	113.7 Å²	113.7	67%	0.665	58%	0.58	S	S	*	*	H	α-helix	trans	-61.3	-41.2	174.4	-93.1	158.3	0	0	0	111.4	R1033 Y1034 Q1035	L1031-R1033 PolarHBondContact O-N 3.11Å; L1031-Y1034 PolarHBondContact O-N 2.68Å; L1031-Q1035 PolarHBondContact O-N 3.44Å
1032	E	39.8	Very low	35.5	Very low	44 Å²	44	112.5 Å²	112.5	21%	0.206	59%	0.585	C	S	.	*	H	α-helix	trans	-61.2	-31.4	171.3	-75.6	-157.3	157.7	0	0	113.3	R357 E1030 Y1034 Q1035 R1036	R357-E1032 WeakPolarHBondContact CD-OE1 3.43Å; R357-E1032 IonicContact CZ-OE1 3.46Å; R357-E1032 IonicContact NE-OE1 3.72Å; R357-E1032 IonicContact NH1-OE1 2.73Å; R357-E1032 PolarHBondContact NH1-OE1 3.34Å; R357-E1032 IonicContact NH1-OE2 3.91Å; E1030-E1032 VanDerWaalsContact C-N 3.32Å; E1030-E1032 PolarHBondContact O-N 3.45Å; E1032-Y1034 PolarHBondContact O-N 2.99Å; E1032-Q1035 PolarHBondContact O-N 3.14Å; E1032-R1036 VanDerWaalsContact O-CB 3.29Å; E1032-R1036 WeakPolarHBondContact O-CB 3.33Å; E1032-R1036 VanDerWaalsContact O-CD 3.22Å; E1032-R1036 WeakPolarHBondContact O-CD 3.45Å; E1032-R1036 WeakPolarHBondContact O-CG 3.49Å; E1032-R1036 PolarHBondContact O-N 3.3Å; E1032-R1036 IonicContact OE2-CZ 3.84Å; E1032-R1036 IonicContact OE2-NE 3.88Å; E1032-R1036 IonicContact OE2-NH2 2.77Å; E1032-R1036 PolarHBondContact OE2-NH2 2.74Å
1033	R	35.3	Very low	35.4	Very low	143 Å²	143	112.9 Å²	112.9	54%	0.54	58%	0.58	S	S	.	*	H	α-helix	trans	-63.7	-30.7	178.4	-151.6	178.2	-167.8	-155.7	0.7	111.8	D764 W1029 E1030 L1031	D764-R1033 IonicContact OD2-NH1 3.58Å; W1029-R1033 PolarHBondContact O-N 2.76Å; E1030-R1033 VanDerWaalsContact O-CB 3.26Å; E1030-R1033 WeakPolarHBondContact O-CB 3.19Å; E1030-R1033 PolarHBondContact O-N 3.34Å; L1031-R1033 PolarHBondContact O-N 3.11Å
1034	Y	35.6	Very low	35.2	Very low	153 Å²	153	109.1 Å²	109.1	60%	0.6	58%	0.577	S	S	*	*	H	α-helix	trans	-82.7	-38.7	171.1	-70.1	-77.5	0	0	0	112.9	E1030 L1031 E1032 R1036 L1037 F1038	E1030-Y1034 WeakPolarHBondContact O-CD2 3.21Å; E1030-Y1034 PolarHBondContact O-N 2.8Å; L1031-Y1034 PolarHBondContact O-N 2.68Å; E1032-Y1034 PolarHBondContact O-N 2.99Å; Y1034-R1036 VanDerWaalsContact C-N 3.29Å; Y1034-R1036 PolarHBondContact O-N 3.02Å; Y1034-L1037 PolarHBondContact O-N 3.09Å; Y1034-F1038 PolarHBondContact O-N 2.69Å
1035	Q	38.4	Very low	35	Very low	113 Å²	113	108.5 Å²	108.5	53%	0.528	58%	0.575	S	S	.	*	H	α-helix	trans	-54.3	-47.1	173.2	-160.7	72.9	30.5	0	0	111.1	L1031 E1032 L1037 F1038 D1039	L1031-Q1035 PolarHBondContact O-N 3.44Å; E1032-Q1035 PolarHBondContact O-N 3.14Å; Q1035-L1037 PolarHBondContact O-N 3.11Å; Q1035-L1037 VanDerWaalsContact O-N 3.14Å; Q1035-F1038 CarbonylContact O-C 3.59Å; Q1035-F1038 WeakPolarHBondContact O-CA 3.27Å; Q1035-F1038 VanDerWaalsContact O-CB 3.3Å; Q1035-F1038 WeakPolarHBondContact O-CB 3.4Å; Q1035-F1038 PolarHBondContact O-N 3.45Å; Q1035-D1039 PolarHBondContact O-N 3.2Å; Q1035-D1039 VanDerWaalsContact O-OD2 3.1Å
1036	R	34.7	Very low	34.6	Very low	91 Å²	91	113.4 Å²	113.4	34%	0.343	58%	0.577	S	S	.	*	H	α-helix	trans	-63.7	-18.1	177.9	-66.1	164.6	-172.6	-136.7	6.9	114.6	F358 E1032 Y1034	F358-R1036 HydrophobicContact CE2-CG 3.53Å; F358-R1036 HydrophobicContact CZ-CB 4.5Å; F358-R1036 VanDerWaalsContact CZ-CD 3.45Å; F358-R1036 HydrophobicContact CZ-CG 3.53Å; E1032-R1036 VanDerWaalsContact O-CB 3.29Å; E1032-R1036 WeakPolarHBondContact O-CB 3.33Å; E1032-R1036 VanDerWaalsContact O-CD 3.22Å; E1032-R1036 WeakPolarHBondContact O-CD 3.45Å; E1032-R1036 WeakPolarHBondContact O-CG 3.49Å; E1032-R1036 PolarHBondContact O-N 3.3Å; E1032-R1036 IonicContact OE2-CZ 3.84Å; E1032-R1036 IonicContact OE2-NE 3.88Å; E1032-R1036 IonicContact OE2-NH2 2.77Å; E1032-R1036 PolarHBondContact OE2-NH2 2.74Å; Y1034-R1036 VanDerWaalsContact C-N 3.29Å; Y1034-R1036 PolarHBondContact O-N 3.02Å
1037	L	34.5	Very low	34.2	Very low	121 Å²	121	112.9 Å²	112.9	63%	0.634	58%	0.58	S	S	*	*	H	α-helix	trans	-91.6	-24.3	170.9	-76.1	164.9	0	0	0	112	Y1034 Q1035	Y1034-L1037 PolarHBondContact O-N 3.09Å; Q1035-L1037 PolarHBondContact O-N 3.11Å; Q1035-L1037 VanDerWaalsContact O-N 3.14Å
1038	F	33.8	Very low	33.7	Very low	99 Å²	99	116.8 Å²	116.8	43%	0.434	60%	0.604	S	S	.	*	H	α-helix	trans	-76	-40.1	171.4	-98.8	-107	0	0	0	112.8	Y1034 Q1035 H1040 G1041 L1043	Y1034-F1038 PolarHBondContact O-N 2.69Å; Q1035-F1038 CarbonylContact O-C 3.59Å; Q1035-F1038 WeakPolarHBondContact O-CA 3.27Å; Q1035-F1038 VanDerWaalsContact O-CB 3.3Å; Q1035-F1038 WeakPolarHBondContact O-CB 3.4Å; Q1035-F1038 PolarHBondContact O-N 3.45Å; F1038-H1040 PolarHBondContact O-N 2.86Å; F1038-H1040 VanDerWaalsContact O-N 3.11Å; F1038-G1041 PolarHBondContact O-N 3.09Å; F1038-L1043 HydrophobicContact CE1-CB 4.48Å; F1038-L1043 WeakPolarHBondContact CE1-O 3.5Å; F1038-L1043 HydrophobicContact CE2-CB 4.19Å; F1038-L1043 HydrophobicContact CZ-CB 3.97Å; F1038-L1043 VanDerWaalsContact CZ-O 3.3Å; F1038-L1043 WeakPolarHBondContact CZ-O 3.38Å
1039	D	37	Very low	33.3	Very low	109 Å²	109	116 Å²	116	58%	0.583	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-11.1	178.5	-55.7	-34.9	0	0	0	112.6	Q1035	Q1035-D1039 PolarHBondContact O-N 3.2Å; Q1035-D1039 VanDerWaalsContact O-OD2 3.1Å
1040	H	38.4	Very low	32.3	Very low	168 Å²	168	118.8 Å²	118.8	78%	0.778	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	23.3	167	-75.7	-34.6	0	0	0	114.5	F1038	F1038-H1040 PolarHBondContact O-N 2.86Å; F1038-H1040 VanDerWaalsContact O-N 3.11Å
1041	G	27.9	Very low	31.7	Very low	69 Å²	69	121.7 Å²	121.7	71%	0.711	65%	0.65	S	S	*	*	S	Bend	trans	75.7	43	141	0	0	0	0	0	117.3	F1038	F1038-G1041 PolarHBondContact O-N 3.09Å
1042	A	29.2	Very low	31.3	Very low	82 Å²	82	122.1 Å²	122.1	68%	0.678	65%	0.653	S	S	*	*			trans	-148.1	40.7	-179.9	0	0	0	0	0	116.7
1043	L	27.8	Very low	30.7	Very low	118 Å²	118	125.8 Å²	125.8	62%	0.618	68%	0.679	S	S	*	*			trans	-162.9	82.1	167.3	-114.3	162.2	0	0	0	114.1	F1038 L1045	F1038-L1043 HydrophobicContact CE1-CB 4.48Å; F1038-L1043 WeakPolarHBondContact CE1-O 3.5Å; F1038-L1043 HydrophobicContact CE2-CB 4.19Å; F1038-L1043 HydrophobicContact CZ-CB 3.97Å; F1038-L1043 VanDerWaalsContact CZ-O 3.3Å; F1038-L1043 WeakPolarHBondContact CZ-O 3.38Å; L1043-L1045 PolarHBondContact O-N 2.89Å
1044	S	28.3	Very low	30.4	Very low	111 Å²	111	128 Å²	128	78%	0.776	70%	0.695	S	S	*	*			trans	-79.1	114.2	164.2	49.4	0	0	0	0	110.3	H1046	S1044-H1046 PolarHBondContact O-N 2.97Å
1045	L	27	Very low	30.1	Very low	135 Å²	135	128 Å²	128	71%	0.707	70%	0.704	S	S	*	*			trans	-68.2	93.9	175	-103.9	147.9	0	0	0	110.8	L1043 L1047	L1043-L1045 PolarHBondContact O-N 2.89Å; L1045-L1047 HydrophobicContact CD2-CD1 4.23Å; L1045-L1047 PolarHBondContact O-N 3.45Å
1046	H	27.2	Very low	29.6	Very low	179 Å²	179	128 Å²	128	83%	0.829	71%	0.714	S	S	*	*			trans	-88	90.4	170.4	-130.6	-45.9	0	0	0	110.2	S1044	S1044-H1046 PolarHBondContact O-N 2.97Å
1047	L	24.8	Very low	29.2	Very low	134 Å²	134	129.9 Å²	129.9	70%	0.702	74%	0.735	S	S	*	*			trans	-112.7	148.9	165.2	-95.6	166.8	0	0	0	109.4	L1045	L1045-L1047 HydrophobicContact CD2-CD1 4.23Å; L1045-L1047 PolarHBondContact O-N 3.45Å
1048	T	27.3	Very low	28.8	Very low	136 Å²	136	129.1 Å²	129.1	83%	0.834	74%	0.739	S	S	*	*			trans	68.9	148.7	-172.9	78.3	0	0	0	0	115.3
1049	G	27.1	Very low	28.4	Very low	76 Å²	76	134 Å²	134	78%	0.784	76%	0.76	S	S	*	*			trans	121.3	63.5	173.5	0	0	0	0	0	116.6	S1051	G1049-S1051 PolarHBondContact O-N 2.85Å
1050	Y	25.1	Very low	28	Very low	236 Å²	236	136.3 Å²	136.3	93%	0.925	77%	0.771	S	S	*	*			trans	-72.2	117.9	169.5	-119.1	-99.5	0	0	0	110.8
1051	S	29.3	Very low	27.3	Very low	111 Å²	111	136 Å²	136	78%	0.776	78%	0.775	S	S	*	*			trans	-166	97.2	155.8	61.8	0	0	0	0	114.7	G1049	G1049-S1051 PolarHBondContact O-N 2.85Å
1052	N	27.8	Very low	27.2	Very low	136 Å²	136	138.3 Å²	138.3	73%	0.727	78%	0.775	S	S	*	*			trans	28	117.5	143.5	-65	-0.7	0	0	0	122.3
1053	T	27.2	Very low	27.1	Very low	121 Å²	121	141.6 Å²	141.6	74%	0.742	78%	0.781	S	S	*	*				56.9	121.6	127.5	66.9	0	0	0	0	121.1
1054	Q	30.9	Very low	27	Very low	189 Å²	189	147 Å²	147	88%	0.883	80%	0.795	S	S	*	*				-170.2	165.9	88.5	-95.4	-174.5	-4.6	0	0	112.1
1055	I	27.7	Very low	26.8	Very low	155 Å²	155	146 Å²	146	80%	0.795	79%	0.787	S	S	*	*			trans	-121.1	154.3	-164.5	-53.3	165.1	0	0	0	110.5
1056	P	28.5	Very low	26.8	Very low	113 Å²	113	146 Å²	146	73%	0.734	79%	0.788	S	S	*	*			trans	-129.7	125.2	135.7	7.2	15.2	0	0	0	112.4
1057	V	27.2	Very low	26.9	Very low	129 Å²	129	144.5 Å²	144.5	78%	0.782	79%	0.786	S	S	*	*				77.1	130.3	86	167.9	0	0	0	0	112.2
1058	C	25.5	Very low	27	Very low	106 Å²	106	145.4 Å²	145.4	72%	0.716	79%	0.792	S	S	*	*			cis	-128.1	149	14.9	-50.4	0	0	0	0	113.6
1059	F	25.2	Very low	27.1	Very low	202 Å²	202	143.2 Å²	143.2	89%	0.886	78%	0.782	S	S	*	*				179	127.6	112.7	-118.9	-88.5	0	0	0	110.5
1060	I	28.3	Very low	27.2	Very low	156 Å²	156	146.5 Å²	146.5	80%	0.8	78%	0.782	S	S	*	*			trans	164.6	114.3	146.9	-88.1	155.9	0	0	0	106.1
1061	D	23.9	Very low	27.4	Very low	161 Å²	161	141.6 Å²	141.6	86%	0.861	77%	0.771	S	S	*	*			trans	-133.2	84.1	168.2	-129.5	-21.6	0	0	0	105.8
1062	T	26.1	Very low	27.4	Very low	118 Å²	118	142.7 Å²	142.7	72%	0.724	77%	0.769	S	S	*	*			trans	-174.8	136.8	158.4	8.3	0	0	0	0	111.5
1063	L	25.9	Very low	27.6	Very low	152 Å²	152	142.9 Å²	142.9	80%	0.796	77%	0.77	S	S	*	*			trans	55.8	93.7	159.1	-54.1	173.4	0	0	0	116.9
1064	Y	25.9	Very low	27.8	Very low	231 Å²	231	143.1 Å²	143.1	91%	0.906	77%	0.771	S	S	*	*				-155.8	154.4	84.4	-114.2	-87.9	0	0	0	110.9
1065	S	25.7	Very low	27.8	Very low	89 Å²	89	139.7 Å²	139.7	62%	0.622	77%	0.768	S	S	*	*			trans	-126	136	179.5	176.8	0	0	0	0	109.1
1066	N	26.7	Very low	28	Very low	137 Å²	137	135.9 Å²	135.9	73%	0.733	77%	0.767	S	S	*	*			trans	64.8	146.1	169	-65.2	-4.9	0	0	0	115.5
1067	N	27.7	Very low	28.2	Very low	147 Å²	147	137 Å²	137	79%	0.786	77%	0.772	S	S	*	*			cis	-144.8	161.2	-0.8	-99.6	-24.6	0	0	0	108.5
1068	D	27.3	Very low	28.4	Very low	152 Å²	152	136.8 Å²	136.8	81%	0.813	77%	0.771	S	S	*	*			trans	-139.5	142.6	154.1	-151.2	-13.2	0	0	0	111.5
1069	S	30	Very low	28.7	Very low	91 Å²	91	136.3 Å²	136.3	64%	0.636	78%	0.775	S	S	*	*			trans	49.9	96.4	176.5	64.2	0	0	0	0	118.4
1070	N	28.4	Very low	29.3	Very low	144 Å²	144	132.7 Å²	132.7	77%	0.77	77%	0.771	S	S	*	*				178.3	132.4	105.4	-91.1	-54.9	0	0	0	114
1071	N	29.2	Very low	29.5	Very low	133 Å²	133	130.2 Å²	130.2	71%	0.711	77%	0.768	S	S	*	*			trans	63.6	113.1	156.7	-60.8	-21.2	0	0	0	121.5
1072	N	30.7	Very low	29.9	Very low	134 Å²	134	127.9 Å²	127.9	72%	0.717	76%	0.759	S	S	*	*			trans	80.8	104.1	136.2	-56.8	-12	0	0	0	121.9
1073	N	30.6	Very low	30.2	Very low	141 Å²	141	129.5 Å²	129.5	75%	0.754	76%	0.758	S	S	*	*			trans	88.9	135.6	130.1	-59.9	-11.8	0	0	0	123.2
1074	T	33.2	Very low	30.5	Very low	126 Å²	126	129 Å²	129	77%	0.773	75%	0.752	S	S	*	*			trans	75.2	84.5	145	43.6	0	0	0	0	123.2
1075	S	30.6	Very low	30.7	Very low	116 Å²	116	124.3 Å²	124.3	81%	0.811	74%	0.738	S	S	*	*				63.8	119.6	113.8	64.1	0	0	0	0	125
1076	G	31.7	Very low	31	Very low	76 Å²	76	127.3 Å²	127.3	78%	0.784	74%	0.742	S	S	*	*			trans	103.7	160.4	141.1	0	0	0	0	0	118.6
1077	V	32.5	Very low	31	Very low	136 Å²	136	125.3 Å²	125.3	82%	0.824	74%	0.739	S	S	*	*			cis	-161.5	137.9	-10.3	130.9	0	0	0	0	111.3
1078	T	32.3	Very low	31.1	Very low	124 Å²	124	125.1 Å²	125.1	76%	0.761	74%	0.743	S	S	*	*			trans	28.4	123.3	159.9	66.4	0	0	0	0	126.8
1079	A	30.6	Very low	31.1	Very low	97 Å²	97	123.9 Å²	123.9	80%	0.802	74%	0.741	S	S	*	*				74.6	159.2	113.6	0	0	0	0	0	125.3
1080	P	38.3	Very low	30.9	Very low	125 Å²	125	131.4 Å²	131.4	81%	0.812	76%	0.755	S	S	*	*			trans	-131.6	179	-164.4	45	-29.5	0	0	0	117.6
1081	S	33	Very low	30.7	Very low	104 Å²	104	134.3 Å²	134.3	73%	0.727	76%	0.761	S	S	*	*			trans	-169.1	116.5	158.4	62.8	0	0	0	0	119.4
1082	T	30.5	Very low	30.7	Very low	112 Å²	112	133.8 Å²	133.8	69%	0.687	77%	0.768	S	S	*	*				56.6	154.5	128.9	61.5	0	0	0	0	127.3
1083	H	34	Very low	30.5	Very low	152 Å²	152	135.9 Å²	135.9	70%	0.704	77%	0.773	S	S	*	*			trans	82.6	144.5	156	-61.8	-60.2	0	0	0	119.2
1084	Q	30.6	Very low	30.2	Very low	141 Å²	141	134.2 Å²	134.2	66%	0.659	77%	0.773	S	S	*	*			cis	-167	160.9	-9.9	-124.1	169.9	-12.4	0	0	115.5
1085	H	31.5	Very low	29.8	Very low	134 Å²	134	137.2 Å²	137.2	62%	0.62	78%	0.775	S	S	*	*			trans	73.6	130.3	145.7	-78.6	-62.4	0	0	0	127
1086	H	31.4	Very low	29.5	Very low	151 Å²	151	136.9 Å²	136.9	70%	0.699	77%	0.768	S	S	*	*			trans	80.2	92.7	137.8	-76.3	-56	0	0	0	126.2
1087	S	27.2	Very low	29.3	Very low	96 Å²	96	141.8 Å²	141.8	67%	0.671	77%	0.773	S	S	*	*				18.3	136	119.7	62.3	0	0	0	0	123.4
1088	V	29.8	Very low	29.1	Very low	143 Å²	143	141.7 Å²	141.7	87%	0.867	78%	0.777	S	S	*	*				-171.5	160.8	121.8	138.2	0	0	0	0	111.8
1089	T	25.9	Very low	28.9	Very low	125 Å²	125	140.3 Å²	140.3	77%	0.767	77%	0.772	S	S	*	*			trans	-103.4	153	-172.3	55.4	0	0	0	0	114.9
1090	R	26.7	Very low	28.7	Very low	250 Å²	250	141.1 Å²	141.1	94%	0.943	77%	0.768	S	S	*	*				-177.6	165	128.5	-103.7	172.8	-176.9	-165.4	0.3	114.8
1091	K	24.4	Very low	28.2	Very low	205 Å²	205	143.8 Å²	143.8	89%	0.891	77%	0.769	S	S	*	*			trans	-84.9	151	175.1	-52.3	172	177	-178.5	0	111.7
1092	S	29.6	Very low	28	Very low	121 Å²	121	144.3 Å²	144.3	85%	0.846	77%	0.772	S	S	*	*			trans	-168	158.1	134.7	53.9	0	0	0	0	112
1093	E	25.4	Very low	27.9	Very low	179 Å²	179	143.8 Å²	143.8	84%	0.836	77%	0.774	S	S	*	*			trans	-90.3	173.5	-165.9	-60.4	140.3	141.7	0	0	114.9
1094	S	25.2	Very low	27.5	Very low	106 Å²	106	143.4 Å²	143.4	74%	0.741	77%	0.772	S	S	*	*			trans	90.7	127.2	135.1	74.7	0	0	0	0	123.4
1095	F	24.4	Very low	27.3	Very low	189 Å²	189	144 Å²	144	83%	0.829	77%	0.772	S	S	*	*			trans	78	100.4	135.6	-87.2	-118.1	0	0	0	123.2
1096	T	25.4	Very low	27.2	Very low	108 Å²	108	145.3 Å²	145.3	66%	0.663	78%	0.784	S	S	*	*				81.3	116.9	107.9	-58.9	0	0	0	0	122
1097	M	25.8	Very low	27.1	Very low	180 Å²	180	146.3 Å²	146.3	89%	0.887	79%	0.789	S	S	*	*			trans	45.6	130.8	150.4	-75.9	-171.6	160.2	0	0	122
1098	C	28.6	Very low	27.2	Very low	133 Å²	133	147.6 Å²	147.6	90%	0.899	80%	0.797	S	S	*	*				-147.4	165.5	121.2	-144.4	0	0	0	0	111.2
1099	S	28.1	Very low	27.1	Very low	96 Å²	96	148.4 Å²	148.4	67%	0.671	80%	0.796	S	S	*	*			trans	-119.7	155	-177.3	50.3	0	0	0	0	110.7
1100	T	27.7	Very low	27.4	Very low	114 Å²	114	147.5 Å²	147.5	70%	0.699	79%	0.793	S	S	*	*				173.1	170.4	81.3	37.6	0	0	0	0	111.2
1101	H	27.5	Very low	27.6	Very low	180 Å²	180	142.8 Å²	142.8	83%	0.833	78%	0.784	S	S	*	*			trans	44.8	121.2	154.8	-74.6	-75.5	0	0	0	121.5
1102	S	27.7	Very low	27.9	Very low	115 Å²	115	139 Å²	139	80%	0.804	78%	0.779	S	S	*	*				171.4	153.1	91.3	-161.4	0	0	0	0	115.5
1103	S	28.9	Very low	28.1	Very low	102 Å²	102	138.5 Å²	138.5	71%	0.713	77%	0.773	S	S	*	*			trans	47.5	102.1	153.7	-158.7	0	0	0	0	123.7
1104	E	26.3	Very low	28.5	Very low	144 Å²	144	135.9 Å²	135.9	67%	0.673	77%	0.768	S	S	*	*				19.3	139.5	127.3	-62.7	-151.1	123.9	0	0	125.1
1105	K	25.8	Very low	29	Very low	153 Å²	153	136.1 Å²	136.1	67%	0.665	77%	0.765	S	S	*	*			trans	62.2	120.2	137.3	-66.4	164.7	-173	152	0	120.9
1106	N	30.2	Very low	29.1	Very low	161 Å²	161	135.5 Å²	135.5	86%	0.861	76%	0.762	S	S	*	*				-165.8	170.8	102.2	-103.8	-42.7	0	0	0	114.1
1107	H	27.7	Very low	29.5	Very low	173 Å²	173	137 Å²	137	80%	0.801	77%	0.772	S	S	*	*			trans	-94.1	148.7	-172.4	-70.2	-106.5	0	0	0	114.6
1108	S	30.7	Very low	29.7	Very low	122 Å²	122	136 Å²	136	85%	0.853	77%	0.765	S	S	*	*			trans	-160.1	141.4	133	31.9	0	0	0	0	113.5
1109	L	27	Very low	30	Very low	160 Å²	160	135.9 Å²	135.9	84%	0.838	76%	0.76	S	S	*	*			trans	-115.6	-172	167.5	-82.2	159	0	0	0	106.5
1110	P	32.8	Very low	29.9	Very low	107 Å²	107	138.9 Å²	138.9	70%	0.695	77%	0.768	S	S	*	*			cis	-120	-165.2	-12.6	25.1	-1.3	0	0	0	111.8
1111	I	30.6	Very low	30.1	Very low	151 Å²	151	142 Å²	142	77%	0.774	77%	0.774	S	S	*	*				-175.1	154.1	80.9	-85	165.1	0	0	0	110.9
1112	T	29.8	Very low	30.3	Very low	125 Å²	125	143.3 Å²	143.3	77%	0.767	78%	0.781	S	S	*	*			trans	-143.2	-171.2	170.1	60.1	0	0	0	0	107.1
1113	P	35.2	Very low	30.4	Very low	111 Å²	111	149.3 Å²	149.3	72%	0.721	79%	0.786	S	S	*	*			cis	-140	-138.5	1.2	44.6	-23.7	0	0	0	113.7
1114	V	32.5	Very low	30.4	Very low	123 Å²	123	156 Å²	156	75%	0.745	80%	0.795	S	S	*	*			trans	105.6	139.3	166.1	-178.3	0	0	0	0	116.3
1115	T	35.4	Very low	30.7	Very low	111 Å²	111	158.1 Å²	158.1	68%	0.681	81%	0.807	S	S	*	*				-153.1	131.4	-52.1	42.1	0	0	0	0	112.8
1116	K	28.5	Very low	30.8	Very low	176 Å²	176	162.5 Å²	162.5	77%	0.765	82%	0.82	S	S	*	*			trans	31.9	128.7	137.4	-58.6	175.5	178.9	173.7	0	122.8
1117	T	33.1	Very low	30.9	Very low	141 Å²	141	162.1 Å²	162.1	87%	0.865	81%	0.814	S	S	*	*				-163.9	120.6	114.6	30.2	0	0	0	0	106.9
1118	Q	29.6	Very low	31	Very low	158 Å²	158	164.3 Å²	164.3	74%	0.738	82%	0.816	S	S	*	*			cis	97.1	143	29.5	-162.6	171.5	16.7	0	0	113.7
1119	T	34.4	Very low	30.9	Very low	130 Å²	130	166.6 Å²	166.6	80%	0.798	82%	0.817	S	S	*	*			trans	87.7	138.2	-175.6	75.5	0	0	0	0	114.7
1120	L	27	Very low	31	Very low	159 Å²	159	163 Å²	163	83%	0.832	81%	0.811	S	S	*	*	S	Bend	cis	-158.3	89.9	-13.2	-163.6	127.8	0	0	0	113.5
1121	H	32.2	Very low	30.9	Very low	181 Å²	181	168.8 Å²	168.8	84%	0.838	82%	0.819	S	S	*	*			trans	-152	-18.8	160.9	-144.7	75.1	0	0	0	118.1	R1123	H1121-R1123 VanDerWaalsContact C-N 3.3Å; H1121-R1123 PolarHBondContact O-N 3.14Å
1122	E	30.8	Very low	31	Very low	206 Å²	206	168.4 Å²	168.4	96%	0.963	82%	0.818	S	S	*	*			trans	-69.4	80.7	174.5	-72.1	-165.1	112.7	0	0	112.2
1123	R	29.1	Very low	31.1	Very low	242 Å²	242	170.3 Å²	170.3	91%	0.913	82%	0.823	S	S	*	*			trans	-142.3	18	178.4	-133.4	179.2	-171.4	-170.2	2.2	116.8	H1121	H1121-R1123 VanDerWaalsContact C-N 3.3Å; H1121-R1123 PolarHBondContact O-N 3.14Å
1124	R	30.6	Very low	31.1	Very low	243 Å²	243	170 Å²	170	92%	0.917	82%	0.821	S	S	*	*	S	Bend	trans	-137.8	144.8	163.9	-81.5	-178	172.2	163.2	-2	111.1
1125	M	31	Very low	30.8	Very low	188 Å²	188	171.4 Å²	171.4	93%	0.926	83%	0.825	S	S	*	*	S	Bend	trans	65.8	61.5	174.9	-60.6	-162.6	175.1	0	0	118.9
1126	R	28.1	Very low	30.5	Very low	245 Å²	245	177.9 Å²	177.9	93%	0.925	84%	0.836	S	S	*	*			trans	-159.2	163.9	137.3	-111.6	165.5	-172.1	-175.3	2.2	111.2
1127	M	32.5	Very low	30.4	Very low	152 Å²	152	177.7 Å²	177.7	75%	0.749	84%	0.838	S	S	*	*			trans	74.7	134.5	-165.9	-58.2	-151	-67.4	0	0	114.4
1128	R	31.3	Very low	30.3	Very low	219 Å²	219	180 Å²	180	83%	0.826	84%	0.839	S	S	*	*			cis	-147.9	156.5	4.2	-118.1	160.8	-161.6	172.2	5	111.8
1129	L	28.1	Very low	30.2	Very low	170 Å²	170	181.4 Å²	181.4	89%	0.89	85%	0.846	S	S	*	*			trans	-82.1	156.2	174.1	-114.8	90.3	0	0	0	112.6
1130	A	28.9	Very low	30.1	Very low	85 Å²	85	182 Å²	182	70%	0.702	85%	0.849	S	S	*	*			trans	56.8	116.6	148.5	0	0	0	0	0	120.8
1131	R	29.9	Very low	30.5	Very low	229 Å²	229	179.4 Å²	179.4	86%	0.864	84%	0.842	S	S	*	*				-174.3	121.8	120.8	-100.9	167.7	-166.6	-177.2	4.5	113.5
1132	N	33.2	Very low	30.6	Very low	142 Å²	142	176 Å²	176	76%	0.759	84%	0.836	S	S	*	*			trans	67.6	158.8	141.7	-56.5	-2.9	0	0	0	122.2
1133	L	32.9	Very low	31.3	Very low	165 Å²	165	172.5 Å²	172.5	86%	0.864	83%	0.831	S	S	*	*			trans	83.1	145.1	163.2	-68.4	153.4	0	0	0	117.3
1134	P	33.3	Very low	31.5	Very low	104 Å²	104	166.3 Å²	166.3	68%	0.675	82%	0.82	S	S	*	*				-141.3	176.1	-119.9	43	-25.1	0	0	0	117.7
1135	N	26.2	Very low	31.7	Very low	154 Å²	154	161.4 Å²	161.4	82%	0.824	81%	0.811	S	S	*	*			trans	32.8	108	149	-65	-3.1	0	0	0	120.1
1136	R	29.2	Very low	31.9	Very low	247 Å²	247	157.9 Å²	157.9	93%	0.932	80%	0.802	S	S	*	*				-154.4	159.7	119.7	-119.7	174.7	178.7	173.8	-0.5	112.6
1137	Q	26.8	Very low	32	Very low	172 Å²	172	150.6 Å²	150.6	80%	0.804	79%	0.788	S	S	*	*			trans	-99.1	148.8	-170.9	-55.2	138.1	-65.2	0	0	111.5
1138	Q	31.7	Very low	32	Very low	190 Å²	190	151.7 Å²	151.7	89%	0.888	80%	0.795	S	S	*	*				-173.8	74.3	128.7	-102.9	167.6	-21.7	0	0	114.3
1139	Q	27.4	Very low	32	Very low	187 Å²	187	148.8 Å²	148.8	87%	0.874	80%	0.795	S	S	*	*			trans	9.3	116.1	132	-175.9	177.2	7.2	0	0	119.8
1140	V	33	Very low	32.4	Very low	141 Å²	141	146.5 Å²	146.5	86%	0.855	79%	0.788	S	S	*	*			trans	-143.4	134.7	147.8	-176.2	0	0	0	0	108.4
1141	P	34.5	Very low	32.8	Very low	106 Å²	106	148.3 Å²	148.3	69%	0.688	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-99.6	165.4	-175.6	38.4	-35.6	0	0	0	114.7
1142	P	34	Very low	33.3	Very low	109 Å²	109	142.8 Å²	142.8	71%	0.708	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-76.9	158.8	167.1	33.6	-35.4	0	0	0	112.8
1143	P	46.5	Very low	33.4	Very low	133 Å²	133	142.4 Å²	142.4	86%	0.864	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-82.4	173.6	-178.4	34.4	-36.7	0	0	0	114.6
1144	T	32.2	Very low	33.5	Very low	112 Å²	112	139.4 Å²	139.4	69%	0.687	78%	0.782	S	S	*	*			trans	-146.5	134.7	-148.9	-61.2	0	0	0	0	113.7
1145	I	34.8	Very low	33.4	Very low	140 Å²	140	139 Å²	139	72%	0.718	78%	0.782	S	S	*	*			trans	71.3	158.8	157.5	-84.7	169.8	0	0	0	116
1146	P	35.6	Very low	33.5	Very low	114 Å²	114	137.4 Å²	137.4	74%	0.74	78%	0.781	S	S	*	*			cis	-125.9	137.5	17.3	22.1	2	0	0	0	119.9
1147	S	30.1	Very low	33.5	Very low	92 Å²	92	131.2 Å²	131.2	64%	0.643	78%	0.775	S	S	*	*				25.5	125.4	115.2	-44.8	0	0	0	0	123.1
1148	I	32.8	Very low	33.7	Very low	175 Å²	175	128 Å²	128	90%	0.897	77%	0.771	S	S	*	*			trans	-178.9	142.5	143.2	-97.1	152.6	0	0	0	106.4
1149	L	31.5	Very low	33.7	Very low	158 Å²	158	123.4 Å²	123.4	83%	0.827	76%	0.76	S	S	*	*			cis	-157.6	147.2	-24.5	175.7	67.7	0	0	0	106.2
1150	V	36.1	Very low	33.9	Very low	121 Å²	121	121.4 Å²	121.4	73%	0.733	76%	0.76	S	S	*	*			trans	-134.1	143	-177.2	177.3	0	0	0	0	111.5
1151	P	37.1	Very low	33.8	Very low	123 Å²	123	119.3 Å²	119.3	80%	0.799	75%	0.752	S	S	*	*			trans	-121.9	133	151.6	35	-24.1	0	0	0	112.8
1152	P	40	Very low	33.6	Very low	114 Å²	114	120.3 Å²	120.3	74%	0.74	75%	0.752	S	S	*	*			trans	-115.1	158.2	178.6	39.5	-31.5	0	0	0	114.7
1153	T	36.8	Very low	33.4	Very low	134 Å²	134	121.8 Å²	121.8	82%	0.822	75%	0.753	S	S	*	*			trans	-151.1	121.8	166.1	22.6	0	0	0	0	113.9
1154	S	33.3	Very low	32.6	Very low	101 Å²	101	121 Å²	121	71%	0.706	75%	0.748	S	S	*	*			trans	26.9	145.8	130.3	54.3	0	0	0	0	122.2
1155	S	32.2	Very low	32.3	Very low	97 Å²	97	122.3 Å²	122.3	68%	0.678	76%	0.755	S	S	*	*			cis	179.4	150.1	-0.8	46.9	0	0	0	0	113.8
1156	C	28.6	Very low	32	Very low	119 Å²	119	125.6 Å²	125.6	80%	0.804	76%	0.764	S	S	*	*			trans	60.1	159	151.3	-61.8	0	0	0	0	119.3
1157	C	28.9	Very low	31.5	Very low	117 Å²	117	124.8 Å²	124.8	79%	0.791	76%	0.761	S	S	*	*			cis	-168.9	170.9	-17.9	-101.9	0	0	0	0	106.4
1158	S	30.2	Very low	31.3	Very low	105 Å²	105	126.1 Å²	126.1	73%	0.734	77%	0.766	S	S	*	*			cis	-157.5	-163.9	-14.5	51.2	0	0	0	0	105.6
1159	S	32.3	Very low	30.9	Very low	94 Å²	94	124.9 Å²	124.9	66%	0.657	76%	0.761	S	S	*	*			cis	-154.8	149.2	4.7	-17	0	0	0	0	107
1160	V	32.1	Very low	30.8	Very low	144 Å²	144	126.4 Å²	126.4	87%	0.873	76%	0.761	S	S	*	*				58.5	118.5	81.2	-175.1	0	0	0	0	113.1
1161	S	30.5	Very low	30.3	Very low	98 Å²	98	128.8 Å²	128.8	69%	0.685	77%	0.768	S	S	*	*			cis	-147.9	-166.9	20.8	62.1	0	0	0	0	111.5
1162	N	29.2	Very low	29.8	Very low	127 Å²	127	128.5 Å²	128.5	68%	0.679	76%	0.76	S	S	*	*			cis	-161.8	165.8	3.7	-137.1	-12.7	0	0	0	113
1163	L	29.7	Very low	29.2	Very low	140 Å²	140	129.1 Å²	129.1	73%	0.733	76%	0.763	S	S	*	*			trans	47.9	157.2	150.8	-64.6	166.4	0	0	0	122.6
1164	P	30	Very low	28.7	Very low	117 Å²	117	130.1 Å²	130.1	76%	0.76	76%	0.761	S	S	*	*			cis	-132	176.6	-39.9	38.3	-22.2	0	0	0	113.8
1165	V	26.5	Very low	28.3	Very low	138 Å²	138	132.2 Å²	132.2	84%	0.836	76%	0.762	S	S	*	*			trans	-88.2	144.4	-177.9	174.4	0	0	0	0	113.2
1166	K	28.2	Very low	28.1	Very low	210 Å²	210	135.9 Å²	135.9	91%	0.913	77%	0.768	S	S	*	*			trans	-139.6	158.5	151.9	-121.3	176.9	-176.9	178.5	0	110.8
1167	S	25.6	Very low	27.9	Very low	97 Å²	97	135 Å²	135	68%	0.678	76%	0.764	S	S	*	*			trans	-124	179.2	-159.5	53.1	0	0	0	0	114.4
1168	T	26	Very low	27.8	Very low	120 Å²	120	135.2 Å²	135.2	74%	0.736	77%	0.767	S	S	*	*			trans	73.8	113.7	169.7	56.7	0	0	0	0	118.8
1169	D	25	Very low	27.7	Very low	148 Å²	148	135.1 Å²	135.1	79%	0.791	76%	0.761	S	S	*	*			trans	52	101.1	133.4	-52.2	-14.2	0	0	0	120.7
1170	K	27.4	Very low	27.3	Very low	190 Å²	190	138.1 Å²	138.1	83%	0.826	77%	0.768	S	S	*	*			trans	-162	91.5	143	-108.6	159.2	-174.4	178.2	0	111.3
1171	I	26.4	Very low	27.2	Very low	171 Å²	171	141 Å²	141	88%	0.877	77%	0.765	S	S	*	*			trans	-88.5	105	161.5	-63.1	177	0	0	0	106.5	P1173	I1171-P1173 WeakPolarHBondContact O-CD 3.38Å
1172	N	27.9	Very low	27.1	Very low	118 Å²	118	143.9 Å²	143.9	63%	0.631	77%	0.768	S	S	*	*			trans	-78.5	126	177.6	-76.9	-11.1	0	0	0	110.6
1173	P	26.6	Very low	27	Very low	126 Å²	126	144.1 Å²	144.1	82%	0.818	78%	0.776	S	S	*	*			trans	-83.9	119.2	165.7	32.3	-29.8	0	0	0	110.4	I1171	I1171-P1173 WeakPolarHBondContact O-CD 3.38Å
1174	M	25.3	Very low	27.1	Very low	155 Å²	155	143 Å²	143	76%	0.764	78%	0.775	S	S	*	*			trans	-142.3	140.9	173.7	-78.2	-172.4	155.3	0	0	108.4
1175	I	26.1	Very low	27.2	Very low	145 Å²	145	143.9 Å²	143.9	74%	0.744	78%	0.779	S	S	*	*			cis	-143	160.4	-1.7	-107.2	155.2	0	0	0	109.9
1176	H	27	Very low	27.3	Very low	174 Å²	174	145.9 Å²	145.9	81%	0.806	78%	0.784	S	S	*	*			trans	-30.8	165.4	-176.8	-82.8	-142.5	0	0	0	122.6
1177	S	25.5	Very low	27.4	Very low	101 Å²	101	146.6 Å²	146.6	71%	0.706	78%	0.781	S	S	*	*			trans	91.9	30.6	144.1	77	0	0	0	0	122.3	V1179	S1177-V1179 VanDerWaalsContact C-N 3.26Å; S1177-V1179 PolarHBondContact O-N 3.48Å
1178	S	26.6	Very low	27.8	Very low	122 Å²	122	148.5 Å²	148.5	85%	0.853	78%	0.783	S	S	*	*			trans	-73.8	75.8	152.6	44.5	0	0	0	0	111.6	I1180	S1178-I1180 PolarHBondContact O-N 2.76Å
1179	V	27.9	Very low	27.9	Very low	103 Å²	103	149.8 Å²	149.8	62%	0.624	78%	0.783	S	S	*	*			trans	-69.5	119.3	-173.7	-173.6	0	0	0	0	112	S1177 Y1181	S1177-V1179 VanDerWaalsContact C-N 3.26Å; S1177-V1179 PolarHBondContact O-N 3.48Å; V1179-Y1181 HydrophobicContact CG1-CD2 3.6Å; V1179-Y1181 HydrophobicContact CG1-CE2 3.64Å
1180	I	24.1	Very low	28.3	Very low	156 Å²	156	149.4 Å²	149.4	80%	0.8	78%	0.781	S	S	*	*			trans	-76	124	167.7	-60	167.3	0	0	0	108.1	S1178	S1178-I1180 PolarHBondContact O-N 2.76Å
1181	Y	29.5	Very low	28.9	Very low	205 Å²	205	145.5 Å²	145.5	80%	0.804	77%	0.769	S	S	*	*			trans	-121.7	141	166	-100.8	-72.2	0	0	0	111.1	V1179	V1179-Y1181 HydrophobicContact CG1-CD2 3.6Å; V1179-Y1181 HydrophobicContact CG1-CE2 3.64Å
1182	Q	28.5	Very low	29.6	Very low	158 Å²	158	144.3 Å²	144.3	74%	0.738	76%	0.763	S	S	*	*			trans	-82.1	153	-170	-68	160.3	-97.1	0	0	112.4
1183	P	27.4	Very low	30.6	Very low	132 Å²	132	144.4 Å²	144.4	86%	0.857	76%	0.764	S	S	*	*			trans	-77.9	120.7	170.1	31.4	-32.1	0	0	0	110.4
1184	T	32.1	Very low	31.6	Very low	116 Å²	116	143.6 Å²	143.6	71%	0.712	75%	0.749	S	S	*	*			trans	-125.8	114.9	175.6	43.7	0	0	0	0	113
1185	T	32	Very low	32.5	Very low	137 Å²	137	142.1 Å²	142.1	84%	0.84	74%	0.741	S	S	*	*			trans	58.4	96.7	151.6	55.2	0	0	0	0	118.9
1186	L	28.5	Very low	33.8	Very low	179 Å²	179	142.3 Å²	142.3	94%	0.937	74%	0.736	S	S	*	*			trans	-57.7	132.4	150.1	-80.9	128.1	0	0	0	111.3
1187	R	31.1	Very low	35.3	Very low	225 Å²	225	141 Å²	141	85%	0.849	73%	0.73	S	S	*	*			trans	-158.2	142.4	144	-107.3	171.5	-164.9	178.2	3.9	109
1188	D	32.7	Very low	36.7	Very low	138 Å²	138	140.7 Å²	140.7	74%	0.738	72%	0.72	S	S	*	*			trans	64.1	140	170.8	-47	-30.2	0	0	0	117.7
1189	M	29	Very low	38.7	Very low	146 Å²	146	139.4 Å²	139.4	72%	0.719	70%	0.702	S	S	*	*			cis	-160	140.7	-34.8	-125.8	-161.9	-58.2	0	0	110.7
1190	N	33.4	Very low	40.5	Very low	140 Å²	140	137.5 Å²	137.5	75%	0.749	69%	0.688	S	S	*	*			trans	59.2	70	150.5	-53.6	-18	0	0	0	120.7
1191	N	40.5	Very low	42.4	Very low	109 Å²	109	135.3 Å²	135.3	58%	0.583	68%	0.678	S	S	*	*			trans	-149.6	117	153.6	-139.8	-5.2	0	0	0	113.9	N1193 E1194	N1191-N1193 VanDerWaalsContact C-N 3.33Å; N1191-N1193 PolarHBondContact O-N 3.45Å; N1191-E1194 PolarHBondContact ND2-OE1 3.21Å
1192	L	39.4	Very low	43.9	Very low	145 Å²	145	129.5 Å²	129.5	76%	0.759	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-4.3	-164.7	-144.8	83.5	0	0	0	115.5
1193	N	49.1	Very low	45.8	Very low	121 Å²	121	125.6 Å²	125.6	65%	0.647	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-33.8	-179.6	-77.7	-30.1	0	0	0	112.9	N1191 E1195 K1196	N1191-N1193 VanDerWaalsContact C-N 3.33Å; N1191-N1193 PolarHBondContact O-N 3.45Å; N1193-E1195 VanDerWaalsContact C-N 3.27Å; N1193-E1195 PolarHBondContact O-N 3.07Å; N1193-K1196 PolarHBondContact O-N 2.95Å
1194	E	47.1	Very low	47.8	Very low	109 Å²	109	125.1 Å²	125.1	51%	0.509	63%	0.631	S	S	.	*	H	α-helix	trans	-63.2	-34.2	-178.8	-68.4	167.4	-153.6	0	0	111.9	N1191 K1196 E1197 I1198	N1191-E1194 PolarHBondContact ND2-OE1 3.21Å; E1194-K1196 PolarHBondContact O-N 3.03Å; E1194-K1196 VanDerWaalsContact O-N 3.14Å; E1194-E1197 PolarHBondContact O-N 2.9Å; E1194-I1198 WeakPolarHBondContact O-CG1 3.21Å; E1194-I1198 PolarHBondContact O-N 3Å
1195	E	44.2	Very low	49.1	Very low	124 Å²	124	128.9 Å²	128.9	58%	0.579	63%	0.633	S	S	*	*	H	α-helix	trans	-55.4	-33.6	177.7	-165.6	174.9	-133.4	0	0	112.4	N1193 I1199	N1193-E1195 VanDerWaalsContact C-N 3.27Å; N1193-E1195 PolarHBondContact O-N 3.07Å; E1195-I1199 HydrophobicContact CG-CD1 4.26Å; E1195-I1199 WeakPolarHBondContact O-CB 3.35Å; E1195-I1199 WeakPolarHBondContact O-CD1 3.49Å; E1195-I1199 WeakPolarHBondContact O-CG1 3.48Å; E1195-I1199 PolarHBondContact O-N 3.28Å
1196	K	53.5	Low	50.6	Low	149 Å²	149	129.3 Å²	129.3	65%	0.648	62%	0.623	S	S	*	*	H	α-helix	trans	-74	-37.5	176.4	-73.3	175.8	-177.9	161	0	113.2	N1193 E1194 D1200	N1193-K1196 PolarHBondContact O-N 2.95Å; E1194-K1196 PolarHBondContact O-N 3.03Å; E1194-K1196 VanDerWaalsContact O-N 3.14Å; K1196-D1200 WeakPolarHBondContact O-CB 3.35Å; K1196-D1200 PolarHBondContact O-N 3.46Å
1197	E	59.6	Low	52.3	Low	146 Å²	146	123.1 Å²	123.1	68%	0.682	60%	0.598	S	S	*	*	H	α-helix	trans	-70.7	-38	174.8	-70.1	-147.9	113.2	0	0	111.4	E1194 D1200 L1201	E1194-E1197 PolarHBondContact O-N 2.9Å; E1197-D1200 PolarHBondContact O-N 3.18Å; E1197-L1201 VanDerWaalsContact O-CB 3.28Å; E1197-L1201 WeakPolarHBondContact O-CB 3.32Å; E1197-L1201 WeakPolarHBondContact O-CG 3.3Å; E1197-L1201 PolarHBondContact O-N 3.1Å
1198	I	55.1	Low	53.6	Low	95 Å²	95	117.1 Å²	117.1	49%	0.487	58%	0.583	S	S	.	*	H	α-helix	trans	-61.9	-43.8	173.6	-66.7	166.5	0	0	0	110.5	E1194 L1201 L1202	E1194-I1198 WeakPolarHBondContact O-CG1 3.21Å; E1194-I1198 PolarHBondContact O-N 3Å; I1198-L1201 PolarHBondContact O-N 3.17Å; I1198-L1202 HydrophobicContact CG2-CD1 3.97Å; I1198-L1202 HydrophobicContact CG2-CG 4.48Å; I1198-L1202 WeakPolarHBondContact O-CB 3.41Å; I1198-L1202 VanDerWaalsContact O-CG 3.25Å; I1198-L1202 WeakPolarHBondContact O-CG 3.5Å; I1198-L1202 PolarHBondContact O-N 3.46Å
1199	I	68.7	Low	55	Low	95 Å²	95	114 Å²	114	49%	0.487	57%	0.568	S	S	.	*	H	α-helix	trans	-62.3	-46.2	174.1	-72.6	165.1	0	0	0	111.3	E1195 L1201 L1202 V1203	E1195-I1199 HydrophobicContact CG-CD1 4.26Å; E1195-I1199 WeakPolarHBondContact O-CB 3.35Å; E1195-I1199 WeakPolarHBondContact O-CD1 3.49Å; E1195-I1199 WeakPolarHBondContact O-CG1 3.48Å; E1195-I1199 PolarHBondContact O-N 3.28Å; I1199-L1201 PolarHBondContact O-N 3.47Å; I1199-L1202 PolarHBondContact O-N 2.97Å; I1199-V1203 HydrophobicContact CG2-CG2 4.42Å; I1199-V1203 WeakPolarHBondContact O-CB 3.33Å; I1199-V1203 WeakPolarHBondContact O-CG2 3.41Å; I1199-V1203 PolarHBondContact O-N 2.88Å
1200	D	65.9	Low	56.4	Low	62 Å²	62	113 Å²	113	33%	0.332	56%	0.562	S	S	.	*	H	α-helix	trans	-68.7	-33.7	-179.4	-165.5	60.4	0	0	0	112.2	K1196 E1197 K1204	K1196-D1200 WeakPolarHBondContact O-CB 3.35Å; K1196-D1200 PolarHBondContact O-N 3.46Å; E1197-D1200 PolarHBondContact O-N 3.18Å; D1200-K1204 WeakPolarHBondContact O-CB 3.48Å; D1200-K1204 VanDerWaalsContact O-CD 3.29Å; D1200-K1204 WeakPolarHBondContact O-CD 3.35Å; D1200-K1204 WeakPolarHBondContact O-CG 3.41Å; D1200-K1204 PolarHBondContact O-N 3.38Å; D1200-K1204 WeakPolarHBondContact OD2-CE 3.04Å; D1200-K1204 IonicContact OD2-NZ 3.53Å; D1200-K1204 PolarHBondContact OD2-NZ 3.01Å
1201	L	64.2	Low	57.5	Low	110 Å²	110	111.6 Å²	111.6	58%	0.576	55%	0.549	S	S	*	.	H	α-helix	trans	-65.2	-44.3	169.3	-84.4	164.9	0	0	0	112.3	E1197 I1198 I1199 K1204 R1205	E1197-L1201 VanDerWaalsContact O-CB 3.28Å; E1197-L1201 WeakPolarHBondContact O-CB 3.32Å; E1197-L1201 WeakPolarHBondContact O-CG 3.3Å; E1197-L1201 PolarHBondContact O-N 3.1Å; I1198-L1201 PolarHBondContact O-N 3.17Å; I1199-L1201 PolarHBondContact O-N 3.47Å; L1201-K1204 PolarHBondContact O-N 3.05Å; L1201-R1205 VanDerWaalsContact O-CB 3.3Å; L1201-R1205 WeakPolarHBondContact O-CB 3.42Å; L1201-R1205 PolarHBondContact O-N 2.89Å
1202	L	59.8	Low	58.4	Low	84 Å²	84	112.6 Å²	112.6	44%	0.44	55%	0.551	S	S	.	*	H	α-helix	trans	-62.4	-46.4	175.5	-76.6	169	0	0	0	110.9	I1198 I1199 K1204 R1205 F1206	I1198-L1202 HydrophobicContact CG2-CD1 3.97Å; I1198-L1202 HydrophobicContact CG2-CG 4.48Å; I1198-L1202 WeakPolarHBondContact O-CB 3.41Å; I1198-L1202 VanDerWaalsContact O-CG 3.25Å; I1198-L1202 WeakPolarHBondContact O-CG 3.5Å; I1198-L1202 PolarHBondContact O-N 3.46Å; I1199-L1202 PolarHBondContact O-N 2.97Å; L1202-K1204 PolarHBondContact O-N 3.26Å; L1202-R1205 PolarHBondContact O-N 3.08Å; L1202-R1205 VanDerWaalsContact O-N 3.11Å; L1202-F1206 VanDerWaalsContact O-CD2 3.3Å; L1202-F1206 WeakPolarHBondContact O-CD2 3.28Å; L1202-F1206 PolarHBondContact O-N 3.14Å
1203	V	69.7	Low	59.4	Low	75 Å²	75	110.4 Å²	110.4	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-61	-44.9	176.5	169.8	0	0	0	0	111.3	I1199 R1205 F1206 A1207	I1199-V1203 HydrophobicContact CG2-CG2 4.42Å; I1199-V1203 WeakPolarHBondContact O-CB 3.33Å; I1199-V1203 WeakPolarHBondContact O-CG2 3.41Å; I1199-V1203 PolarHBondContact O-N 2.88Å; V1203-R1205 VanDerWaalsContact C-N 3.29Å; V1203-R1205 PolarHBondContact O-N 3.05Å; V1203-F1206 PolarHBondContact O-N 3.16Å; V1203-A1207 WeakPolarHBondContact O-CB 3.31Å; V1203-A1207 PolarHBondContact O-N 2.85Å
1204	K	68.4	Low	59.9	Low	122 Å²	122	110.4 Å²	110.4	53%	0.53	54%	0.535	S	S	.	.	H	α-helix	trans	-58.5	-40	172.5	-75.7	160.8	179.3	155.3	0	112.2	D1200 L1201 L1202 N1208	D1200-K1204 WeakPolarHBondContact O-CB 3.48Å; D1200-K1204 VanDerWaalsContact O-CD 3.29Å; D1200-K1204 WeakPolarHBondContact O-CD 3.35Å; D1200-K1204 WeakPolarHBondContact O-CG 3.41Å; D1200-K1204 PolarHBondContact O-N 3.38Å; D1200-K1204 WeakPolarHBondContact OD2-CE 3.04Å; D1200-K1204 IonicContact OD2-NZ 3.53Å; D1200-K1204 PolarHBondContact OD2-NZ 3.01Å; L1201-K1204 PolarHBondContact O-N 3.05Å; L1202-K1204 PolarHBondContact O-N 3.26Å; K1204-N1208 WeakPolarHBondContact O-CB 3.37Å; K1204-N1208 PolarHBondContact O-N 3.43Å; K1204-N1208 VanDerWaalsContact O-N 3.15Å
1205	R	59.1	Low	60.7	Low	195 Å²	195	109.4 Å²	109.4	74%	0.736	53%	0.533	S	S	*	.	H	α-helix	trans	-72.5	-43.9	-178.6	-162.8	170.7	-172.3	165.6	1.7	111.8	L1201 L1202 V1203 N1208 V1209	L1201-R1205 VanDerWaalsContact O-CB 3.3Å; L1201-R1205 WeakPolarHBondContact O-CB 3.42Å; L1201-R1205 PolarHBondContact O-N 2.89Å; L1202-R1205 PolarHBondContact O-N 3.08Å; L1202-R1205 VanDerWaalsContact O-N 3.11Å; V1203-R1205 VanDerWaalsContact C-N 3.29Å; V1203-R1205 PolarHBondContact O-N 3.05Å; R1205-N1208 PolarHBondContact O-N 3.21Å; R1205-V1209 WeakPolarHBondContact O-CG2 3.49Å; R1205-V1209 PolarHBondContact O-N 3.1Å
1206	F	63.3	Low	61.6	Low	146 Å²	146	108.2 Å²	108.2	64%	0.64	53%	0.53	S	S	*	.	H	α-helix	trans	-60.4	-48.8	173.1	-86.6	-70.9	0	0	0	111.6	L1202 V1203 N1208 V1209 E1210	L1202-F1206 VanDerWaalsContact O-CD2 3.3Å; L1202-F1206 WeakPolarHBondContact O-CD2 3.28Å; L1202-F1206 PolarHBondContact O-N 3.14Å; V1203-F1206 PolarHBondContact O-N 3.16Å; F1206-N1208 PolarHBondContact O-N 3.45Å; F1206-V1209 PolarHBondContact O-N 2.97Å; F1206-E1210 WeakPolarHBondContact O-CB 3.16Å; F1206-E1210 PolarHBondContact O-N 3.5Å
1207	A	64.9	Low	61.9	Low	50 Å²	50	106.1 Å²	106.1	41%	0.413	53%	0.526	S	S	.	.	H	α-helix	trans	-61.6	-28.1	177.5	0	0	0	0	0	113.2	V1203 K1211	V1203-A1207 WeakPolarHBondContact O-CB 3.31Å; V1203-A1207 PolarHBondContact O-N 2.85Å; A1207-K1211 VanDerWaalsContact O-CB 3.32Å; A1207-K1211 WeakPolarHBondContact O-CB 3.43Å; A1207-K1211 PolarHBondContact O-N 3.44Å
1208	N	58.9	Low	62.2	Low	98 Å²	98	103 Å²	103	52%	0.524	52%	0.516	S	S	.	.	H	α-helix	trans	-80.1	-31.6	174.7	-159.9	44.5	0	0	0	112.7	K1204 R1205 F1206 Q1212	K1204-N1208 WeakPolarHBondContact O-CB 3.37Å; K1204-N1208 PolarHBondContact O-N 3.43Å; K1204-N1208 VanDerWaalsContact O-N 3.15Å; R1205-N1208 PolarHBondContact O-N 3.21Å; F1206-N1208 PolarHBondContact O-N 3.45Å; N1208-Q1212 WeakPolarHBondContact O-CG 3.36Å; N1208-Q1212 PolarHBondContact O-N 3.49Å; N1208-Q1212 VanDerWaalsContact O-N 3.08Å
1209	V	60.8	Low	62.3	Low	72 Å²	72	105.7 Å²	105.7	44%	0.436	52%	0.52	S	S	.	.	H	α-helix	trans	-69.9	-46.3	172.1	168.8	0	0	0	0	110.8	R1205 F1206 K1211 Q1212 I1213	R1205-V1209 WeakPolarHBondContact O-CG2 3.49Å; R1205-V1209 PolarHBondContact O-N 3.1Å; F1206-V1209 PolarHBondContact O-N 2.97Å; V1209-K1211 VanDerWaalsContact C-N 3.3Å; V1209-K1211 PolarHBondContact O-N 3.17Å; V1209-Q1212 CarbonylContact O-C 3.58Å; V1209-Q1212 WeakPolarHBondContact O-CA 3.37Å; V1209-Q1212 WeakPolarHBondContact O-CB 3.26Å; V1209-Q1212 PolarHBondContact O-N 3.06Å; V1209-I1213 HydrophobicContact CG1-CD1 3.97Å; V1209-I1213 WeakPolarHBondContact O-CG1 3.3Å; V1209-I1213 PolarHBondContact O-N 3.33Å
1210	E	59.2	Low	62.3	Low	127 Å²	127	105.1 Å²	105.1	59%	0.593	52%	0.518	S	S	*	.	H	α-helix	trans	-53.5	-48.2	173.2	-176.9	173.3	-139.2	0	0	110.8	F1206 Q1212 I1213 E1214	F1206-E1210 WeakPolarHBondContact O-CB 3.16Å; F1206-E1210 PolarHBondContact O-N 3.5Å; E1210-Q1212 VanDerWaalsContact C-N 3.3Å; E1210-Q1212 PolarHBondContact O-N 3.36Å; E1210-I1213 WeakPolarHBondContact O-CA 3.31Å; E1210-I1213 WeakPolarHBondContact O-CB 3.39Å; E1210-I1213 PolarHBondContact O-N 2.99Å; E1210-E1214 PolarHBondContact O-N 3.3Å
1211	K	57.1	Low	62.3	Low	109 Å²	109	105.6 Å²	105.6	47%	0.474	53%	0.525	S	S	.	.	H	α-helix	trans	-64.9	-27.5	175.1	-160.7	-176.2	-177.4	-158.5	0	113.9	A1207 V1209 N1215	A1207-K1211 VanDerWaalsContact O-CB 3.32Å; A1207-K1211 WeakPolarHBondContact O-CB 3.43Å; A1207-K1211 PolarHBondContact O-N 3.44Å; V1209-K1211 VanDerWaalsContact C-N 3.3Å; V1209-K1211 PolarHBondContact O-N 3.17Å; K1211-N1215 PolarHBondContact O-N 2.96Å; K1211-N1215 PolarHBondContact O-ND2 3.24Å
1212	Q	59.7	Low	62.4	Low	131 Å²	131	103.6 Å²	103.6	61%	0.612	51%	0.513	S	S	*	.	H	α-helix	trans	-74.3	-35.3	170.2	-77.9	-169.6	0.1	0	0	112	N1208 V1209 E1210 N1215 L1216	N1208-Q1212 WeakPolarHBondContact O-CG 3.36Å; N1208-Q1212 PolarHBondContact O-N 3.49Å; N1208-Q1212 VanDerWaalsContact O-N 3.08Å; V1209-Q1212 CarbonylContact O-C 3.58Å; V1209-Q1212 WeakPolarHBondContact O-CA 3.37Å; V1209-Q1212 WeakPolarHBondContact O-CB 3.26Å; V1209-Q1212 PolarHBondContact O-N 3.06Å; E1210-Q1212 VanDerWaalsContact C-N 3.3Å; E1210-Q1212 PolarHBondContact O-N 3.36Å; Q1212-N1215 PolarHBondContact O-N 3.38Å; Q1212-L1216 WeakPolarHBondContact O-CB 3.49Å; Q1212-L1216 PolarHBondContact O-N 3.15Å
1213	I	58.8	Low	62.8	Low	98 Å²	98	102.7 Å²	102.7	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-46.6	174.3	-66.1	164.8	0	0	0	110.4	V1209 E1210 N1215 L1216 D1217	V1209-I1213 HydrophobicContact CG1-CD1 3.97Å; V1209-I1213 WeakPolarHBondContact O-CG1 3.3Å; V1209-I1213 PolarHBondContact O-N 3.33Å; E1210-I1213 WeakPolarHBondContact O-CA 3.31Å; E1210-I1213 WeakPolarHBondContact O-CB 3.39Å; E1210-I1213 PolarHBondContact O-N 2.99Å; I1213-N1215 VanDerWaalsContact C-N 3.32Å; I1213-N1215 PolarHBondContact O-N 3.24Å; I1213-L1216 WeakPolarHBondContact O-CA 3.49Å; I1213-L1216 WeakPolarHBondContact O-CB 3.26Å; I1213-L1216 PolarHBondContact O-N 3.08Å; I1213-D1217 PolarHBondContact O-N 3.11Å
1214	E	59.6	Low	62.9	Low	122 Å²	122	102.6 Å²	102.6	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-55.5	-45.6	173.5	-69.9	-175.7	136	0	0	112.1	E1210 L1216 D1217 V1218	E1210-E1214 PolarHBondContact O-N 3.3Å; E1214-L1216 VanDerWaalsContact C-N 3.28Å; E1214-L1216 PolarHBondContact O-N 2.92Å; E1214-D1217 PolarHBondContact O-N 2.68Å; E1214-V1218 WeakPolarHBondContact O-CG2 3.46Å; E1214-V1218 PolarHBondContact O-N 3.5Å
1215	N	63.8	Low	63.1	Low	87 Å²	87	99.8 Å²	99.8	47%	0.465	51%	0.507	S	S	.	.	H	α-helix	trans	-68	-28.4	177.2	-83.3	-85.6	0	0	0	112.6	K1211 Q1212 I1213 R1219	K1211-N1215 PolarHBondContact O-N 2.96Å; K1211-N1215 PolarHBondContact O-ND2 3.24Å; Q1212-N1215 PolarHBondContact O-N 3.38Å; I1213-N1215 VanDerWaalsContact C-N 3.32Å; I1213-N1215 PolarHBondContact O-N 3.24Å; N1215-R1219 WeakPolarHBondContact O-CB 3.49Å; N1215-R1219 WeakPolarHBondContact O-CD 3.44Å; N1215-R1219 WeakPolarHBondContact O-CG 3.28Å; N1215-R1219 PolarHBondContact O-N 3.48Å; N1215-R1219 VanDerWaalsContact O-N 3.11Å
1216	L	63.4	Low	63.7	Low	99 Å²	99	93.8 Å²	93.8	52%	0.518	49%	0.492	S	S	.	.	H	α-helix	trans	-73.8	-44	175.5	-168.8	67.7	0	0	0	111.2	Q1212 I1213 E1214 V1218 R1219 I1220	Q1212-L1216 WeakPolarHBondContact O-CB 3.49Å; Q1212-L1216 PolarHBondContact O-N 3.15Å; I1213-L1216 WeakPolarHBondContact O-CA 3.49Å; I1213-L1216 WeakPolarHBondContact O-CB 3.26Å; I1213-L1216 PolarHBondContact O-N 3.08Å; E1214-L1216 VanDerWaalsContact C-N 3.28Å; E1214-L1216 PolarHBondContact O-N 2.92Å; L1216-V1218 PolarHBondContact O-N 2.7Å; L1216-R1219 CarbonylContact O-C 3.56Å; L1216-R1219 WeakPolarHBondContact O-CB 3.39Å; L1216-R1219 PolarHBondContact O-N 2.98Å; L1216-R1219 VanDerWaalsContact O-N 3.17Å; L1216-I1220 HydrophobicContact CG-CD1 3.98Å; L1216-I1220 WeakPolarHBondContact O-CB 3.5Å; L1216-I1220 VanDerWaalsContact O-CG1 3.28Å; L1216-I1220 WeakPolarHBondContact O-CG1 3.21Å; L1216-I1220 PolarHBondContact O-N 3.14Å
1217	D	60.8	Low	64.2	Low	106 Å²	106	91.4 Å²	91.4	57%	0.567	49%	0.485	S	S	*	.	H	α-helix	trans	-63.1	-40.2	175.6	-103	2.1	0	0	0	111.9	I1213 E1214 I1220 S1221	I1213-D1217 PolarHBondContact O-N 3.11Å; E1214-D1217 PolarHBondContact O-N 2.68Å; D1217-I1220 PolarHBondContact O-N 3.27Å; D1217-S1221 VanDerWaalsContact O-CB 3.26Å; D1217-S1221 WeakPolarHBondContact O-CB 3.31Å; D1217-S1221 PolarHBondContact O-N 3.02Å
1218	V	65.4	Low	64.5	Low	80 Å²	80	93.3 Å²	93.3	49%	0.485	49%	0.487	S	S	.	.	H	α-helix	trans	-62.1	-43	172.3	171.5	0	0	0	0	111.1	E1214 L1216 S1221 Q1222	E1214-V1218 WeakPolarHBondContact O-CG2 3.46Å; E1214-V1218 PolarHBondContact O-N 3.5Å; L1216-V1218 PolarHBondContact O-N 2.7Å; V1218-S1221 PolarHBondContact O-N 2.72Å; V1218-Q1222 WeakPolarHBondContact O-CB 3.47Å; V1218-Q1222 VanDerWaalsContact O-CG 3.3Å; V1218-Q1222 WeakPolarHBondContact O-CG 3.32Å; V1218-Q1222 PolarHBondContact O-N 3.14Å
1219	R	56.4	Low	65	Low	151 Å²	151	94.7 Å²	94.7	57%	0.57	49%	0.491	S	S	*	.	H	α-helix	trans	-65.7	-39.5	175.8	-76.4	171.1	-178.3	-140.9	-2	112.6	N1215 L1216 S1223	N1215-R1219 WeakPolarHBondContact O-CB 3.49Å; N1215-R1219 WeakPolarHBondContact O-CD 3.44Å; N1215-R1219 WeakPolarHBondContact O-CG 3.28Å; N1215-R1219 PolarHBondContact O-N 3.48Å; N1215-R1219 VanDerWaalsContact O-N 3.11Å; L1216-R1219 CarbonylContact O-C 3.56Å; L1216-R1219 WeakPolarHBondContact O-CB 3.39Å; L1216-R1219 PolarHBondContact O-N 2.98Å; L1216-R1219 VanDerWaalsContact O-N 3.17Å; R1219-S1223 VanDerWaalsContact O-CB 3.29Å; R1219-S1223 WeakPolarHBondContact O-CB 3.42Å; R1219-S1223 PolarHBondContact O-N 3.5Å; R1219-S1223 PolarHBondContact O-OG 2.91Å
1220	I	68.7	Low	65.3	Low	84 Å²	84	96 Å²	96	43%	0.431	49%	0.492	S	S	.	.	H	α-helix	trans	-64.4	-48	175.6	-71.3	165.7	0	0	0	109.4	L1216 D1217 Q1222 S1223 V1224	L1216-I1220 HydrophobicContact CG-CD1 3.98Å; L1216-I1220 WeakPolarHBondContact O-CB 3.5Å; L1216-I1220 VanDerWaalsContact O-CG1 3.28Å; L1216-I1220 WeakPolarHBondContact O-CG1 3.21Å; L1216-I1220 PolarHBondContact O-N 3.14Å; D1217-I1220 PolarHBondContact O-N 3.27Å; I1220-Q1222 PolarHBondContact O-N 3.24Å; I1220-S1223 PolarHBondContact O-N 3.38Å; I1220-V1224 HydrophobicContact CG2-CG2 4.34Å; I1220-V1224 WeakPolarHBondContact O-CB 3.28Å; I1220-V1224 VanDerWaalsContact O-CG2 3.3Å; I1220-V1224 WeakPolarHBondContact O-CG2 3.4Å; I1220-V1224 PolarHBondContact O-N 3.06Å
1221	S	66.3	Low	65.8	Low	71 Å²	71	94.2 Å²	94.2	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-59	-46.2	176.9	-174.5	0	0	0	0	112.2	D1217 V1218 S1223 V1224 T1225	D1217-S1221 VanDerWaalsContact O-CB 3.26Å; D1217-S1221 WeakPolarHBondContact O-CB 3.31Å; D1217-S1221 PolarHBondContact O-N 3.02Å; V1218-S1221 PolarHBondContact O-N 2.72Å; S1221-S1223 PolarHBondContact O-N 3.06Å; S1221-V1224 PolarHBondContact O-N 3.36Å; S1221-T1225 WeakPolarHBondContact O-CG2 3.39Å; S1221-T1225 PolarHBondContact O-N 2.75Å; S1221-T1225 PolarHBondContact O-OG1 3.04Å; S1221-T1225 VanDerWaalsContact O-OG1 3.09Å
1222	Q	67.3	Low	66.1	Low	69 Å²	69	95.2 Å²	95.2	32%	0.322	49%	0.492	S	S	.	.	H	α-helix	trans	-63.8	-37.6	174.4	-75	176.4	-21.9	0	0	113.2	V1218 I1220 T1225 T1226	V1218-Q1222 WeakPolarHBondContact O-CB 3.47Å; V1218-Q1222 VanDerWaalsContact O-CG 3.3Å; V1218-Q1222 WeakPolarHBondContact O-CG 3.32Å; V1218-Q1222 PolarHBondContact O-N 3.14Å; I1220-Q1222 PolarHBondContact O-N 3.24Å; Q1222-T1225 WeakPolarHBondContact CA-OG1 3.37Å; Q1222-T1225 PolarHBondContact O-OG1 2.87Å; Q1222-T1226 VanDerWaalsContact O-CB 3.3Å; Q1222-T1226 WeakPolarHBondContact O-CB 3.4Å; Q1222-T1226 PolarHBondContact O-N 3.41Å; Q1222-T1226 PolarHBondContact O-OG1 3.14Å
1223	S	66.3	Low	66	Low	64 Å²	64	94.7 Å²	94.7	45%	0.448	49%	0.491	S	S	.	.	H	α-helix	trans	-67.8	-42.8	175.8	-58.3	0	0	0	0	111	R1219 I1220 S1221 T1226 I1227	R1219-S1223 VanDerWaalsContact O-CB 3.29Å; R1219-S1223 WeakPolarHBondContact O-CB 3.42Å; R1219-S1223 PolarHBondContact O-N 3.5Å; R1219-S1223 PolarHBondContact O-OG 2.91Å; I1220-S1223 PolarHBondContact O-N 3.38Å; S1221-S1223 PolarHBondContact O-N 3.06Å; S1223-T1226 PolarHBondContact O-N 3.42Å; S1223-I1227 WeakPolarHBondContact O-CB 3.46Å; S1223-I1227 WeakPolarHBondContact O-CD1 3.47Å; S1223-I1227 VanDerWaalsContact O-CG1 3.23Å; S1223-I1227 WeakPolarHBondContact O-CG1 3.34Å; S1223-I1227 PolarHBondContact O-N 2.71Å
1224	V	73.8	Confident	65.7	Low	73 Å²	73	96 Å²	96	44%	0.442	49%	0.494	S	S	.	.	H	α-helix	trans	-66	-43.6	177.6	169.6	0	0	0	0	111.3	I1220 S1221 I1227 L1228	I1220-V1224 HydrophobicContact CG2-CG2 4.34Å; I1220-V1224 WeakPolarHBondContact O-CB 3.28Å; I1220-V1224 VanDerWaalsContact O-CG2 3.3Å; I1220-V1224 WeakPolarHBondContact O-CG2 3.4Å; I1220-V1224 PolarHBondContact O-N 3.06Å; S1221-V1224 PolarHBondContact O-N 3.36Å; V1224-I1227 PolarHBondContact O-N 3.41Å; V1224-L1228 HydrophobicContact CG1-CD1 3.89Å; V1224-L1228 HydrophobicContact CG1-CG 4.38Å; V1224-L1228 WeakPolarHBondContact O-CB 3.25Å; V1224-L1228 VanDerWaalsContact O-CG 3.27Å; V1224-L1228 WeakPolarHBondContact O-CG 3.34Å; V1224-L1228 PolarHBondContact O-N 2.89Å
1225	T	71	Confident	65.5	Low	64 Å²	64	94 Å²	94	39%	0.393	49%	0.489	S	S	.	.	H	α-helix	trans	-67.7	-35.3	175.5	53.4	0	0	0	0	112.4	S1221 Q1222 L1228 Q1229	S1221-T1225 WeakPolarHBondContact O-CG2 3.39Å; S1221-T1225 PolarHBondContact O-N 2.75Å; S1221-T1225 PolarHBondContact O-OG1 3.04Å; S1221-T1225 VanDerWaalsContact O-OG1 3.09Å; Q1222-T1225 WeakPolarHBondContact CA-OG1 3.37Å; Q1222-T1225 PolarHBondContact O-OG1 2.87Å; T1225-L1228 PolarHBondContact O-N 3.36Å; T1225-Q1229 WeakPolarHBondContact O-CB 3.24Å; T1225-Q1229 WeakPolarHBondContact O-CG 3.33Å; T1225-Q1229 PolarHBondContact O-N 2.78Å
1226	T	72	Confident	64.8	Low	69 Å²	69	94.1 Å²	94.1	42%	0.423	49%	0.493	S	S	.	.	H	α-helix	trans	-65.1	-43.5	172.8	-57.5	0	0	0	0	111.5	Q1222 S1223 Q1229 Q1230	Q1222-T1226 VanDerWaalsContact O-CB 3.3Å; Q1222-T1226 WeakPolarHBondContact O-CB 3.4Å; Q1222-T1226 PolarHBondContact O-N 3.41Å; Q1222-T1226 PolarHBondContact O-OG1 3.14Å; S1223-T1226 PolarHBondContact O-N 3.42Å; T1226-Q1229 PolarHBondContact O-N 3.4Å; T1226-Q1230 WeakPolarHBondContact O-CG 3.42Å; T1226-Q1230 PolarHBondContact O-N 2.83Å
1227	I	73.4	Confident	63.8	Low	96 Å²	96	97.6 Å²	97.6	49%	0.492	50%	0.504	S	S	.	.	H	α-helix	trans	-65.5	-40.3	175.8	-71.4	164.8	0	0	0	110.8	S1223 V1224 Q1230 L1231	S1223-I1227 WeakPolarHBondContact O-CB 3.46Å; S1223-I1227 WeakPolarHBondContact O-CD1 3.47Å; S1223-I1227 VanDerWaalsContact O-CG1 3.23Å; S1223-I1227 WeakPolarHBondContact O-CG1 3.34Å; S1223-I1227 PolarHBondContact O-N 2.71Å; V1224-I1227 PolarHBondContact O-N 3.41Å; I1227-Q1230 PolarHBondContact O-N 3.05Å; I1227-L1231 HydrophobicContact CG2-CD1 3.92Å; I1227-L1231 HydrophobicContact CG2-CG 4.47Å; I1227-L1231 WeakPolarHBondContact O-CB 3.18Å; I1227-L1231 VanDerWaalsContact O-CG 3.32Å; I1227-L1231 WeakPolarHBondContact O-CG 3.36Å; I1227-L1231 PolarHBondContact O-N 2.56Å
1228	L	71.8	Confident	63.1	Low	90 Å²	90	99.9 Å²	99.9	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-44.3	174.6	-75.1	170.5	0	0	0	111.7	V1224 T1225 Q1230 L1231 E1232	V1224-L1228 HydrophobicContact CG1-CD1 3.89Å; V1224-L1228 HydrophobicContact CG1-CG 4.38Å; V1224-L1228 WeakPolarHBondContact O-CB 3.25Å; V1224-L1228 VanDerWaalsContact O-CG 3.27Å; V1224-L1228 WeakPolarHBondContact O-CG 3.34Å; V1224-L1228 PolarHBondContact O-N 2.89Å; T1225-L1228 PolarHBondContact O-N 3.36Å; L1228-Q1230 VanDerWaalsContact C-N 3.33Å; L1228-Q1230 PolarHBondContact O-N 2.93Å; L1228-L1231 CarbonylContact O-C 3.53Å; L1228-L1231 WeakPolarHBondContact O-CB 3.31Å; L1228-L1231 PolarHBondContact O-N 3.01Å; L1228-L1231 VanDerWaalsContact O-N 3.13Å; L1228-E1232 WeakPolarHBondContact O-CB 3.12Å; L1228-E1232 WeakPolarHBondContact O-CG 3.37Å; L1228-E1232 PolarHBondContact O-N 3.36Å
1229	Q	68.4	Low	62	Low	126 Å²	126	106.6 Å²	106.6	59%	0.589	53%	0.528	S	S	*	.	H	α-helix	trans	-62.3	-38.3	173.4	-79.1	-171.3	-35	0	0	112.4	T1225 T1226 L1231 M1233	T1225-Q1229 WeakPolarHBondContact O-CB 3.24Å; T1225-Q1229 WeakPolarHBondContact O-CG 3.33Å; T1225-Q1229 PolarHBondContact O-N 2.78Å; T1226-Q1229 PolarHBondContact O-N 3.4Å; Q1229-L1231 VanDerWaalsContact C-N 3.35Å; Q1229-M1233 WeakPolarHBondContact O-CB 3.49Å; Q1229-M1233 WeakPolarHBondContact O-CG 3.24Å; Q1229-M1233 PolarHBondContact O-N 3Å
1230	Q	69	Low	61	Low	101 Å²	101	103.7 Å²	103.7	47%	0.472	53%	0.531	S	S	.	.	H	α-helix	trans	-68	-33.4	173.2	-73	-170.8	22.7	0	0	112.8	T1226 I1227 L1228 K1234	T1226-Q1230 WeakPolarHBondContact O-CG 3.42Å; T1226-Q1230 PolarHBondContact O-N 2.83Å; I1227-Q1230 PolarHBondContact O-N 3.05Å; L1228-Q1230 VanDerWaalsContact C-N 3.33Å; L1228-Q1230 PolarHBondContact O-N 2.93Å; Q1230-K1234 WeakPolarHBondContact O-CB 3.4Å; Q1230-K1234 WeakPolarHBondContact O-CD 3.3Å; Q1230-K1234 VanDerWaalsContact O-CG 3.25Å; Q1230-K1234 WeakPolarHBondContact O-CG 3.32Å; Q1230-K1234 PolarHBondContact O-N 3.07Å; Q1230-K1234 VanDerWaalsContact O-N 3.13Å
1231	L	67.8	Low	59.4	Low	89 Å²	89	105.7 Å²	105.7	47%	0.466	54%	0.541	S	S	.	.	H	α-helix	trans	-70.7	-44.5	173.2	-77.3	166.6	0	0	0	111.3	I1227 L1228 Q1229 K1234 V1235	I1227-L1231 HydrophobicContact CG2-CD1 3.92Å; I1227-L1231 HydrophobicContact CG2-CG 4.47Å; I1227-L1231 WeakPolarHBondContact O-CB 3.18Å; I1227-L1231 VanDerWaalsContact O-CG 3.32Å; I1227-L1231 WeakPolarHBondContact O-CG 3.36Å; I1227-L1231 PolarHBondContact O-N 2.56Å; L1228-L1231 CarbonylContact O-C 3.53Å; L1228-L1231 WeakPolarHBondContact O-CB 3.31Å; L1228-L1231 PolarHBondContact O-N 3.01Å; L1228-L1231 VanDerWaalsContact O-N 3.13Å; Q1229-L1231 VanDerWaalsContact C-N 3.35Å; L1231-K1234 CarbonylContact O-C 3.5Å; L1231-K1234 WeakPolarHBondContact O-CB 3.31Å; L1231-K1234 PolarHBondContact O-N 2.98Å; L1231-K1234 VanDerWaalsContact O-N 3.11Å; L1231-V1235 WeakPolarHBondContact O-CB 3.37Å; L1231-V1235 VanDerWaalsContact O-CG2 3.3Å; L1231-V1235 WeakPolarHBondContact O-CG2 3.33Å; L1231-V1235 PolarHBondContact O-N 3.11Å
1232	E	64.5	Low	57.9	Low	129 Å²	129	107.7 Å²	107.7	60%	0.603	55%	0.552	S	S	*	*	H	α-helix	trans	-64.1	-41.2	175.5	-73.2	-169.9	139	0	0	111.7	L1228 K1234 V1235 T1236	L1228-E1232 WeakPolarHBondContact O-CB 3.12Å; L1228-E1232 WeakPolarHBondContact O-CG 3.37Å; L1228-E1232 PolarHBondContact O-N 3.36Å; E1232-K1234 VanDerWaalsContact C-N 3.25Å; E1232-K1234 PolarHBondContact O-N 3.17Å; E1232-V1235 PolarHBondContact O-N 3.32Å; E1232-T1236 WeakPolarHBondContact O-CB 3.42Å; E1232-T1236 VanDerWaalsContact O-CG2 3.31Å; E1232-T1236 WeakPolarHBondContact O-CG2 3.46Å; E1232-T1236 PolarHBondContact O-N 3.43Å; E1232-T1236 PolarHBondContact O-OG1 3.22Å
1233	M	58.1	Low	56.3	Low	120 Å²	120	117.1 Å²	117.1	59%	0.591	60%	0.6	S	S	*	*	H	α-helix	trans	-64.5	-26.9	172.3	-76.8	-166.6	-71.5	0	0	113.3	Q1229 T1236 K1237	Q1229-M1233 WeakPolarHBondContact O-CB 3.49Å; Q1229-M1233 WeakPolarHBondContact O-CG 3.24Å; Q1229-M1233 PolarHBondContact O-N 3Å; M1233-T1236 WeakPolarHBondContact CA-OG1 3.5Å; M1233-T1236 PolarHBondContact O-OG1 3.29Å; M1233-K1237 WeakPolarHBondContact O-CB 3.18Å
1234	K	51.9	Low	55.8	Low	127 Å²	127	119.8 Å²	119.8	55%	0.552	61%	0.607	S	S	*	*	H	α-helix	trans	-79.7	-41.4	172	-76.4	169.8	-179.8	172.5	0	112.1	Q1230 L1231 E1232 K1237 H1238	Q1230-K1234 WeakPolarHBondContact O-CB 3.4Å; Q1230-K1234 WeakPolarHBondContact O-CD 3.3Å; Q1230-K1234 VanDerWaalsContact O-CG 3.25Å; Q1230-K1234 WeakPolarHBondContact O-CG 3.32Å; Q1230-K1234 PolarHBondContact O-N 3.07Å; Q1230-K1234 VanDerWaalsContact O-N 3.13Å; L1231-K1234 CarbonylContact O-C 3.5Å; L1231-K1234 WeakPolarHBondContact O-CB 3.31Å; L1231-K1234 PolarHBondContact O-N 2.98Å; L1231-K1234 VanDerWaalsContact O-N 3.11Å; E1232-K1234 VanDerWaalsContact C-N 3.25Å; E1232-K1234 PolarHBondContact O-N 3.17Å; K1234-K1237 PolarHBondContact O-N 2.96Å; K1234-H1238 PolarHBondContact O-CD2 3.1Å; K1234-H1238 PolarHBondContact O-N 3.13Å; K1234-H1238 VanDerWaalsContact O-N 3.11Å
1235	V	54.8	Low	54.8	Low	78 Å²	78	122.3 Å²	122.3	47%	0.473	62%	0.616	S	S	.	*	H	α-helix	trans	-71.9	-39.9	-178.9	169.1	0	0	0	0	111.6	L1231 E1232 H1238 R1239	L1231-V1235 WeakPolarHBondContact O-CB 3.37Å; L1231-V1235 VanDerWaalsContact O-CG2 3.3Å; L1231-V1235 WeakPolarHBondContact O-CG2 3.33Å; L1231-V1235 PolarHBondContact O-N 3.11Å; E1232-V1235 PolarHBondContact O-N 3.32Å; V1235-H1238 CarbonylContact O-C 3.52Å; V1235-H1238 PolarHBondContact O-N 2.91Å; V1235-H1238 VanDerWaalsContact O-N 3.08Å; V1235-R1239 PolarHBondContact O-N 2.92Å
1236	T	49.2	Very low	53.9	Low	90 Å²	90	125.5 Å²	125.5	55%	0.552	63%	0.628	S	S	*	*	H	α-helix	trans	-62.7	-43.9	173.1	49.7	0	0	0	0	111.2	E1232 M1233 H1238 R1239 S1240	E1232-T1236 WeakPolarHBondContact O-CB 3.42Å; E1232-T1236 VanDerWaalsContact O-CG2 3.31Å; E1232-T1236 WeakPolarHBondContact O-CG2 3.46Å; E1232-T1236 PolarHBondContact O-N 3.43Å; E1232-T1236 PolarHBondContact O-OG1 3.22Å; M1233-T1236 WeakPolarHBondContact CA-OG1 3.5Å; M1233-T1236 PolarHBondContact O-OG1 3.29Å; T1236-H1238 PolarHBondContact O-N 3.03Å; T1236-R1239 PolarHBondContact O-N 3.22Å; T1236-R1239 VanDerWaalsContact O-N 3.15Å; T1236-S1240 PolarHBondContact O-N 3.13Å
1237	K	42.7	Very low	52.9	Low	172 Å²	172	128.8 Å²	128.8	75%	0.748	64%	0.64	S	S	*	*	H	α-helix	trans	-59.1	-25.6	169.9	-94.9	-173.7	169	-177.9	0	114.6	M1233 K1234	M1233-K1237 WeakPolarHBondContact O-CB 3.18Å; K1234-K1237 PolarHBondContact O-N 2.96Å
1238	H	46.7	Very low	51.6	Low	155 Å²	155	130.9 Å²	130.9	72%	0.718	65%	0.65	S	S	*	*	H	α-helix	trans	-93.6	-12.8	176.6	-91.5	-70.6	0	0	0	114.4	K1234 V1235 T1236	K1234-H1238 PolarHBondContact O-CD2 3.1Å; K1234-H1238 PolarHBondContact O-N 3.13Å; K1234-H1238 VanDerWaalsContact O-N 3.11Å; V1235-H1238 CarbonylContact O-C 3.52Å; V1235-H1238 PolarHBondContact O-N 2.91Å; V1235-H1238 VanDerWaalsContact O-N 3.08Å; T1236-H1238 PolarHBondContact O-N 3.03Å
1239	R	41.5	Very low	50.2	Low	220 Å²	220	133.6 Å²	133.6	83%	0.83	66%	0.662	S	S	*	*	H	α-helix	trans	-94	-9.2	179.2	-102.7	-177.3	169.7	177.3	-3.1	114.4	V1235 T1236 I1241	V1235-R1239 PolarHBondContact O-N 2.92Å; T1236-R1239 PolarHBondContact O-N 3.22Å; T1236-R1239 VanDerWaalsContact O-N 3.15Å; R1239-I1241 VanDerWaalsContact C-N 3.34Å; R1239-I1241 PolarHBondContact O-N 2.75Å
1240	S	36.3	Very low	48.9	Very low	90 Å²	90	134.1 Å²	134.1	63%	0.629	67%	0.667	S	S	*	*			trans	-94.4	46.7	179.9	64.7	0	0	0	0	113	T1236	T1236-S1240 PolarHBondContact O-N 3.13Å
1241	I	34	Very low	47.4	Very low	126 Å²	126	136.7 Å²	136.7	65%	0.646	68%	0.682	S	S	*	*			trans	-129.8	106.9	175.5	-55.2	179.5	0	0	0	107.6	R1239	R1239-I1241 VanDerWaalsContact C-N 3.34Å; R1239-I1241 PolarHBondContact O-N 2.75Å
1242	P	36.2	Very low	45.7	Very low	114 Å²	114	140.7 Å²	140.7	74%	0.74	70%	0.7	S	S	*	*			trans	-71.5	170.1	167.8	32.6	-34.2	0	0	0	110.9
1243	M	32.3	Very low	44	Very low	267 Å²	267	141.7 Å²	141.7	100%	1.315	71%	0.709	S	S	*	*			trans	-52.4	0	177	-87.9	-174.9	163.9	0	0	113.4

Retrieved 1,243 of 1,243 residues in 727.6 ms (Link to these results)

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