A0A096NI80_PAPAN Loading...

Peroxisomal ATPase PEX6

Component of the PEX1-PEX6 AAA ATPase complex, a protein dislocase complex that mediates the ATP-dependent extraction of the PEX5 receptor from peroxisomal membranes, an essential step for PEX5 recycling. Specifically recognizes PEX5 monoubiquitinated at 'Cys-11', and pulls it out of the peroxisome lumen through the PEX2-PEX10-PEX12 retrotranslocation channel. Extraction by the PEX1-PEX6 AAA ATPase complex is accompanied by unfolding of the TPR repeats and release of bound cargo from PEX5.

AlphaFold DB , UniProt , Accession A0A096NI80, Species PAPAN (Papio anubis, Olive baboon), Gene PEX6, Length 980 aa.

						>A0A096NI80_PAPAN|A0A096NI80|PEX6
MALAVLRVLEPFPTETPPLAVLLPPGGPWPAAGLGLVLALRPAGESPAGPALLVAALEGPGAGTEEQGPGPPQLLVSRALLRLLALGSGAWVRARPVRRPPALGWALLGTSLGPGLGPRVGPLLVRRGETLPVPGPRVLETRPALQGLLGPGTRLAVTELRGRARLCPESGDSSRPPPPPVVSSFAVSGTVRRLQGVLGGTGDSLGVSRSCLRGLGLFQGEWVWVARAGESSNTSRPHLARVQVLEPRWDLSDRLGPGSGQLGEPLADGLALVPATLAFNLGCDPLEVGELRIQRYLEGSIAPEDKGSCSLLPGPPFARELYIEIVSSPHYSTNGNYDGVLYRHFQIPRVVQEGDVLCVPTIGQVEILEGSPEKLPRWREMFFKVKKTAGEAPDGPASAYLADTTHTSLYMVGSTLSPVPWLPSEKSTLWSSLSPPGLEALVSELCAVLKPRLQPGGALLTGTSSVLLRGPPGCGKTTVVAAACSQLGLHLLKVPCSSLCADSSGAVETKLQAIFSRARRCRPAVLLLTAVDLLGRDRDGLGEDARVVAALRHLLLDEDPLNSCPPLMVVATTSRAQDLPADVQTAFPHELEVPALSEGQRLSILRALTAHLPLGQEVNLAQLARRCAGFVVGDLYALLTHSSRAACTRIKNLGLAGGLTEEDEGELCAAGFPLLAEDFGQALELQQTAHSQAVGAPKIPSVSWHDVGGLQEVKKEILETIQLPLEHPELLSLGLRRSGLLLHGPPGTGKTLLAKAVATECSLTFLSVKGPELINMYVGQSEENVREVFARARAAAPCIIFFDELDSLAPSRGRSGDSGGVMDRVVSQLLAELDGLHSTQDVFVIGATNRPDLLDPALLRPGRFDKLVFVGANEDRASQLRVLSAITRKFKLEPSVSLVNVLDCCPPQLTGADLYSLCSDAMTAALKRRVHDLEEGLEPGSSALMLTMEDLLQAAARLQPSVSEQELLRYKRIQHKFAAC
					

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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	46.5	Very low	58.3	Low	159 Å²	159	67.7 Å²	67.7	78%	0.783	35%	0.351	S	S	*	.				0	141.2	0	-106.4	-173.7	-80.6	0	0	107.4	R95	M1-R95 VanDerWaalsContact CE-NH2 3.33Å; M1-R95 HydrophobicContact CG-CG 3.49Å; M1-R95 VanDerWaalsContact CG-CG 3.49Å; M1-R95 HydrophobicContact SD-CG 4.22Å; M1-R95 PolarHBondContact SD-NE 2.75Å; M1-R95 PolarHBondContact SD-NH2 3.22Å; M1-R95 VanDerWaalsContact SD-NH2 3.45Å
2	A	52.8	Low	57.8	Low	16 Å²	16	65.4 Å²	65.4	13%	0.132	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	140.9	171.6	0	0	0	0	0	110.7	W29 P72 A94	A2-W29 HydrophobicContact CB-CH2 3.65Å; A2-W29 HydrophobicContact CB-CZ2 3.77Å; A2-P72 HydrophobicContact CB-CG 4.4Å; A2-A94 PolarHBondContact N-O 3.1Å; A2-A94 VanDerWaalsContact N-O 3.15Å; A2-A94 PolarHBondContact O-N 3.44Å
3	L	54.3	Low	57.6	Low	84 Å²	84	63.9 Å²	63.9	44%	0.44	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	125	163.7	-95.9	151.1	0	0	0	107.5	A43 P72 W91 R93	L3-A43 HydrophobicContact CD2-CB 3.94Å; L3-P72 WeakPolarHBondContact O-CD 3.08Å; L3-P72 WeakPolarHBondContact O-CG 3.35Å; L3-W91 HydrophobicContact CD2-CE3 4.04Å; L3-R93 HydrophobicContact CD2-CG 4.19Å; L3-R93 HydrophobicContact CG-CG 4.35Å
4	A	59.8	Low	56.7	Low	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	154.6	-176.1	0	0	0	0	0	111.1	P72 L74 V92	A4-P72 WeakPolarHBondContact CA-O 3.43Å; A4-P72 HydrophobicContact CB-CG 4.28Å; A4-P72 VanDerWaalsContact CB-O 3.28Å; A4-P72 WeakPolarHBondContact CB-O 3.3Å; A4-L74 HydrophobicContact CB-CD1 3.64Å; A4-L74 HydrophobicContact CB-CG 3.81Å; A4-V92 PolarHBondContact N-O 3.42Å; A4-V92 PolarHBondContact O-N 3.36Å
5	V	69.2	Low	55.7	Low	19 Å²	19	74.4 Å²	74.4	12%	0.115	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.5	179.9	-179.8	0	0	0	0	109.6	P71 P72 Q73 L74 W91	V5-P71 HydrophobicContact CG2-CB 4.5Å; V5-P71 HydrophobicContact CG2-CG 3.91Å; V5-P72 PolarHBondContact N-O 3.31Å; V5-P72 VanDerWaalsContact N-O 3.1Å; V5-Q73 WeakPolarHBondContact O-CA 3.46Å; V5-L74 PolarHBondContact O-N 3.31Å; V5-W91 HydrophobicContact CG2-CD2 3.86Å; V5-W91 HydrophobicContact CG2-CE3 4.02Å; V5-W91 HydrophobicContact CG2-CG 4.36Å; V5-W91 HydrophobicContact CG2-CH2 4.45Å; V5-W91 HydrophobicContact CG2-CZ2 4.26Å; V5-W91 HydrophobicContact CG2-CZ3 4.32Å
6	L	64.9	Low	54.9	Low	1 Å²	1	71.8 Å²	71.8	1%	0.005	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	128.8	176.2	-61.9	173.6	0	0	0	110.6	L40 L74 V76 L81 L86 G89 A90 V92	L6-L40 HydrophobicContact CD2-CD1 4.47Å; L6-L74 WeakPolarHBondContact CA-O 3.24Å; L6-L74 HydrophobicContact CD2-CB 3.94Å; L6-L74 HydrophobicContact CD2-CD1 4.2Å; L6-V76 HydrophobicContact CD2-CG2 3.77Å; L6-L81 HydrophobicContact CB-CD2 4.27Å; L6-L81 HydrophobicContact CD1-CD2 3.86Å; L6-L86 HydrophobicContact CD1-CB 4.28Å; L6-L86 HydrophobicContact CD1-CD1 3.69Å; L6-G89 WeakPolarHBondContact O-CA 3.42Å; L6-G89 PolarHBondContact O-N 3.03Å; L6-A90 HydrophobicContact CD1-CB 4.44Å; L6-A90 PolarHBondContact N-O 3.32Å; L6-V92 HydrophobicContact CD1-CG2 3.67Å; L6-V92 HydrophobicContact CG-CG2 3.86Å
7	R	66.1	Low	54.5	Low	119 Å²	119	72.5 Å²	72.5	45%	0.449	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	148.1	170.8	-79.1	-170.2	175.9	179.1	-9.8	111.6	Q73 L74 L75 V76	R7-Q73 VanDerWaalsContact CD-OE1 3.28Å; R7-L74 PolarHBondContact N-O 2.71Å; R7-L75 HydrophobicContact CB-CD2 4.16Å; R7-L75 WeakPolarHBondContact O-CA 3.4Å; R7-V76 PolarHBondContact O-N 3.47Å
8	V	64.2	Low	54.1	Low	46 Å²	46	73.2 Å²	73.2	28%	0.279	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	135.2	174.7	179.5	0	0	0	0	110.1	E10 V76 R78 L81	V8-E10 HydrophobicContact CG1-CG 4.18Å; V8-V76 WeakPolarHBondContact CA-O 3.45Å; V8-R78 HydrophobicContact CG1-CB 4.27Å; V8-L81 HydrophobicContact CG2-CD1 3.37Å
9	L	61.3	Low	53.8	Low	51 Å²	51	73.7 Å²	73.7	27%	0.267	40%	0.401	S	S	.	.			trans	-112.8	126.7	170.6	-172.2	77.9	0	0	0	109.3	F12 L22 L75	L9-F12 HydrophobicContact CB-CD2 3.91Å; L9-F12 HydrophobicContact CB-CE2 4.19Å; L9-F12 HydrophobicContact CD2-CD2 4.27Å; L9-L22 HydrophobicContact CD2-CD1 4.19Å; L9-L75 HydrophobicContact CB-CB 4.47Å; L9-L75 HydrophobicContact CB-CD2 4.45Å; L9-L75 HydrophobicContact CD1-CD1 4.39Å; L9-L75 HydrophobicContact CD2-CD1 4.46Å
10	E	50.4	Low	53.5	Low	125 Å²	125	70.3 Å²	70.3	58%	0.584	38%	0.383	S	S	*	.	S	Bend	trans	-136.8	128.6	171.5	-75.2	-179.8	-173.5	0	0	108.3	V8 R78	V8-E10 HydrophobicContact CG1-CG 4.18Å; E10-R78 WeakPolarHBondContact OE1-CD 3.46Å; E10-R78 IonicContact OE1-CZ 3.68Å; E10-R78 IonicContact OE1-NE 3.83Å; E10-R78 IonicContact OE1-NH1 2.77Å; E10-R78 PolarHBondContact OE1-NH1 2.88Å; E10-R78 IonicContact OE2-NH1 3.39Å; E10-R78 PolarHBondContact OE2-NH1 3.15Å
11	P	51.5	Low	53.7	Low	125 Å²	125	67 Å²	67	81%	0.812	37%	0.365	S	S	*	.	S	Bend	cis	-73.4	136.4	-5.2	31.7	-34.2	0	0	0	112.3
12	F	52.9	Low	54.1	Low	40 Å²	40	59.6 Å²	59.6	18%	0.175	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-76.2	136.2	174.3	-146.9	-95.6	0	0	0	109.5	L9 T14 T16 L22	L9-F12 HydrophobicContact CB-CD2 3.91Å; L9-F12 HydrophobicContact CB-CE2 4.19Å; L9-F12 HydrophobicContact CD2-CD2 4.27Å; F12-T14 PolarHBondContact O-N 3.31Å; F12-T16 WeakPolarHBondContact CD1-OG1 3.28Å; F12-T16 VanDerWaalsContact CE1-OG1 3.28Å; F12-T16 WeakPolarHBondContact CE1-OG1 3.31Å; F12-L22 HydrophobicContact CE1-CD1 3.9Å; F12-L22 HydrophobicContact CE1-CG 4.39Å; F12-L22 HydrophobicContact CE2-CD1 4.12Å; F12-L22 HydrophobicContact CZ-CD1 3.67Å; F12-L22 HydrophobicContact CZ-CG 4.05Å
13	P	54.6	Low	54.3	Low	46 Å²	46	58.9 Å²	58.9	30%	0.299	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-62.2	125	-173.8	21.5	-31.7	0	0	0	111.8	E15 T16 L22	P13-E15 PolarHBondContact O-N 3.14Å; P13-T16 HydrophobicContact CG-CG2 4.2Å; P13-T16 PolarHBondContact O-N 2.64Å; P13-T16 PolarHBondContact O-OG1 3.19Å; P13-L22 HydrophobicContact CG-CD1 3.62Å
14	T	44.8	Very low	54.3	Low	144 Å²	144	56.9 Å²	56.9	88%	0.883	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-14.1	-170	43.4	0	0	0	0	115.2	F12 T16	F12-T14 PolarHBondContact O-N 3.31Å; T14-T16 VanDerWaalsContact C-N 3.34Å
15	E	41.9	Very low	53.9	Low	141 Å²	141	61 Å²	61	66%	0.659	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-11	177.6	-60.2	-175.9	179.7	0	0	112.9	P13 L112	P13-E15 PolarHBondContact O-N 3.14Å; E15-L112 HydrophobicContact CG-CD1 4.46Å; E15-L112 WeakPolarHBondContact OE1-CD2 3.49Å
16	T	43.2	Very low	52.9	Low	32 Å²	32	64.3 Å²	64.3	20%	0.196	38%	0.379	C	S	.	.	S	Bend	trans	-102.5	139.6	-178.4	63.3	0	0	0	0	111.7	F12 P13 T14 L22	F12-T16 WeakPolarHBondContact CD1-OG1 3.28Å; F12-T16 VanDerWaalsContact CE1-OG1 3.28Å; F12-T16 WeakPolarHBondContact CE1-OG1 3.31Å; P13-T16 HydrophobicContact CG-CG2 4.2Å; P13-T16 PolarHBondContact O-N 2.64Å; P13-T16 PolarHBondContact O-OG1 3.19Å; T14-T16 VanDerWaalsContact C-N 3.34Å; T16-L22 HydrophobicContact CG2-CD2 4.33Å
17	P	48.7	Very low	52.5	Low	84 Å²	84	65.7 Å²	65.7	55%	0.545	39%	0.393	S	S	.	.			trans	-67.7	145.2	178.7	28.1	-33.1	0	0	0	110	L19 A20	P17-L19 PolarHBondContact O-N 3.42Å; P17-A20 HydrophobicContact CG-CB 3.95Å; P17-A20 PolarHBondContact O-N 3.05Å
18	P	46.4	Very low	51.7	Low	85 Å²	85	65 Å²	65	55%	0.552	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-2.2	-174.8	27.5	-36.6	0	0	0	114.4	S77	P18-S77 WeakPolarHBondContact O-CB 3.49Å; P18-S77 PolarHBondContact O-OG 3.21Å
19	L	47.9	Very low	51.1	Low	84 Å²	84	64.3 Å²	64.3	44%	0.44	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	8.3	176.9	-62.1	173.9	0	0	0	113.8	P17 L80 L83	P17-L19 PolarHBondContact O-N 3.42Å; L19-L80 HydrophobicContact CB-CD1 4.14Å; L19-L80 HydrophobicContact CD2-CB 4.41Å; L19-L80 HydrophobicContact CD2-CD1 4.06Å; L19-L80 HydrophobicContact CD2-CG 4.49Å; L19-L80 WeakPolarHBondContact O-CD1 3.47Å; L19-L83 HydrophobicContact CD2-CD1 3.53Å
20	A	49.5	Very low	50.4	Low	5 Å²	5	65.1 Å²	65.1	4%	0.041	41%	0.405	C	S	.	.			trans	-87.6	158.1	172.4	0	0	0	0	0	112.5	P17 V54	P17-A20 HydrophobicContact CG-CB 3.95Å; P17-A20 PolarHBondContact O-N 3.05Å; A20-V54 WeakPolarHBondContact CA-O 3.41Å
21	V	55.8	Low	50.1	Low	0 Å²	0	63.9 Å²	63.9	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.2	168.7	-177.7	0	0	0	0	109	L53 V54 A55 A56 L74 V76	V21-L53 HydrophobicContact CG2-CB 4.07Å; V21-L53 HydrophobicContact CG2-CD1 3.43Å; V21-L53 VanDerWaalsContact CG2-CD1 3.43Å; V21-L53 HydrophobicContact CG2-CG 4.42Å; V21-V54 PolarHBondContact N-O 3.05Å; V21-V54 VanDerWaalsContact N-O 3.11Å; V21-A55 HydrophobicContact CB-CB 4.37Å; V21-A55 CarbonylContact O-C 3.59Å; V21-A55 VanDerWaalsContact O-CA 3.23Å; V21-A55 WeakPolarHBondContact O-CA 3.49Å; V21-A56 PolarHBondContact O-N 3.4Å; V21-L74 HydrophobicContact CG1-CB 3.88Å; V21-L74 HydrophobicContact CG1-CD2 3.8Å; V21-L74 HydrophobicContact CG1-CG 4.3Å; V21-V76 HydrophobicContact CB-CG2 4.37Å; V21-V76 HydrophobicContact CG1-CG2 3.87Å; V21-V76 HydrophobicContact CG2-CG2 3.98Å
22	L	55.1	Low	49.3	Very low	4 Å²	4	61.7 Å²	61.7	2%	0.021	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132	174.2	-77.5	167.3	0	0	0	110.5	L9 F12 P13 T16 A56 E58 L75	L9-L22 HydrophobicContact CD2-CD1 4.19Å; F12-L22 HydrophobicContact CE1-CD1 3.9Å; F12-L22 HydrophobicContact CE1-CG 4.39Å; F12-L22 HydrophobicContact CE2-CD1 4.12Å; F12-L22 HydrophobicContact CZ-CD1 3.67Å; F12-L22 HydrophobicContact CZ-CG 4.05Å; P13-L22 HydrophobicContact CG-CD1 3.62Å; T16-L22 HydrophobicContact CG2-CD2 4.33Å; L22-A56 HydrophobicContact CD2-CB 4.23Å; L22-E58 HydrophobicContact CD2-CB 4.46Å; L22-L75 HydrophobicContact CB-CB 3.89Å; L22-L75 PolarHBondContact N-O 2.67Å; L22-L75 PolarHBondContact O-N 3.13Å
23	L	57.8	Low	48.5	Very low	1 Å²	1	63.4 Å²	63.4	1%	0.005	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	117.9	176.5	-74.5	163.8	0	0	0	109.1	W29 L36 A55 A56 L57 E58 L74	L23-W29 HydrophobicContact CD2-CD2 4.28Å; L23-W29 HydrophobicContact CD2-CG 4.21Å; L23-L36 HydrophobicContact CD1-CD2 3.83Å; L23-A55 HydrophobicContact CD1-CB 3.72Å; L23-A55 HydrophobicContact CG-CB 4.23Å; L23-A56 PolarHBondContact N-O 2.91Å; L23-L57 HydrophobicContact CB-CD1 3.97Å; L23-L57 HydrophobicContact CD1-CD1 4.25Å; L23-E58 PolarHBondContact O-N 3.34Å; L23-L74 HydrophobicContact CD2-CD2 3.44Å; L23-L74 VanDerWaalsContact CD2-CD2 3.44Å; L23-L74 HydrophobicContact CG-CD2 4.4Å
24	P	54.3	Low	47.7	Very low	42 Å²	42	69.1 Å²	69.1	27%	0.273	46%	0.464	S	S	.	.			trans	-68	146.2	175	28.2	-33.8	0	0	0	110.9	Q73	P24-Q73 WeakPolarHBondContact CD-O 3.29Å
25	P	51.2	Low	47.9	Very low	88 Å²	88	64.6 Å²	64.6	57%	0.571	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	138.1	175.4	26.4	-33.8	0	0	0	111
26	G	49.3	Very low	48.2	Very low	87 Å²	87	60 Å²	60	90%	0.897	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.6	-1.6	177.1	0	0	0	0	0	116.7
27	G	55.2	Low	48.5	Very low	30 Å²	30	60.1 Å²	60.1	31%	0.309	43%	0.427	S	S	.	.	S	Bend	trans	-73.7	169.4	171.2	0	0	0	0	0	114	W29	G27-W29 PolarHBondContact O-N 3.46Å
28	P	49.3	Very low	48.6	Very low	104 Å²	104	56.1 Å²	56.1	68%	0.675	40%	0.401	S	S	*	.	S	Bend	trans	-75.2	34.5	-178.6	34.8	-38.9	0	0	0	113.5
29	W	52.3	Low	48.8	Very low	32 Å²	32	53 Å²	53	12%	0.121	38%	0.383	C	S	.	.	S	Bend	trans	-103.8	142.8	-173.9	-53.4	106.9	0	0	0	109.7	A2 L23 G27 A31 L38 A94	A2-W29 HydrophobicContact CB-CH2 3.65Å; A2-W29 HydrophobicContact CB-CZ2 3.77Å; L23-W29 HydrophobicContact CD2-CD2 4.28Å; L23-W29 HydrophobicContact CD2-CG 4.21Å; G27-W29 PolarHBondContact O-N 3.46Å; W29-A31 PolarHBondContact O-N 2.97Å; W29-L38 HydrophobicContact CE3-CD2 4.49Å; W29-L38 HydrophobicContact CH2-CD2 4.4Å; W29-L38 HydrophobicContact CZ3-CD2 3.94Å; W29-A94 HydrophobicContact CH2-CB 3.7Å; W29-A94 HydrophobicContact CZ2-CB 4.42Å
30	P	46.8	Very low	49.1	Very low	68 Å²	68	49.4 Å²	49.4	44%	0.442	36%	0.364	S	S	.	.			trans	-63.7	121.8	-179.7	26.2	-33.6	0	0	0	110.6	A32 L36	P30-A32 PolarHBondContact O-N 3.33Å; P30-L36 HydrophobicContact CG-CD1 4.4Å
31	A	43.2	Very low	49.6	Very low	99 Å²	99	57 Å²	57	82%	0.818	39%	0.391	S	S	*	.			trans	-73.4	87.3	175.5	0	0	0	0	0	110.4	W29	W29-A31 PolarHBondContact O-N 2.97Å
32	A	35.4	Very low	49.7	Very low	80 Å²	80	58 Å²	58	66%	0.661	40%	0.398	S	S	*	.			trans	-142.7	137.4	173.5	0	0	0	0	0	110	P30	P30-A32 PolarHBondContact O-N 3.33Å
33	G	36.8	Very low	49.4	Very low	75 Å²	75	59.8 Å²	59.8	77%	0.773	41%	0.413	S	S	*	.	S	Bend	trans	-70.2	158.8	179.8	0	0	0	0	0	113.5
34	L	37.6	Very low	49.2	Very low	166 Å²	166	62.4 Å²	62.4	87%	0.869	44%	0.44	S	S	*	.	S	Bend	trans	68.2	94.1	175.8	-63.6	166.5	0	0	0	116.8
35	G	47.7	Very low	48.7	Very low	49 Å²	49	70.5 Å²	70.5	51%	0.505	47%	0.474	S	S	.	.			trans	77	63.1	145.7	0	0	0	0	0	117.5	V37	G35-V37 PolarHBondContact O-N 2.83Å
36	L	48.8	Very low	48.4	Very low	46 Å²	46	68.7 Å²	68.7	24%	0.241	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	118.5	174.2	-168.3	83.7	0	0	0	110.7	L23 P30 L38 A55 P96	L23-L36 HydrophobicContact CD1-CD2 3.83Å; P30-L36 HydrophobicContact CG-CD1 4.4Å; L36-L38 HydrophobicContact CD2-CD2 3.73Å; L36-L38 HydrophobicContact CD2-CG 4.14Å; L36-L38 HydrophobicContact CG-CD2 4.41Å; L36-A55 HydrophobicContact CB-CB 4.41Å; L36-A55 PolarHBondContact N-O 3.44Å; L36-A55 WeakPolarHBondContact O-CB 3.28Å; L36-A55 PolarHBondContact O-N 2.96Å; L36-P96 HydrophobicContact CD1-CB 3.96Å; L36-P96 HydrophobicContact CD2-CB 4.36Å; L36-P96 HydrophobicContact CG-CB 4.3Å
37	V	48.8	Very low	48.1	Very low	33 Å²	33	71.3 Å²	71.3	20%	0.2	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	123.1	171.9	-179.4	0	0	0	0	109.8	G35 L52 L53 P96 V97	G35-V37 PolarHBondContact O-N 2.83Å; V37-L52 HydrophobicContact CG1-CD2 4.04Å; V37-L53 CarbonylContact C-O 3.47Å; V37-L53 WeakPolarHBondContact CA-O 3.09Å; V37-P96 WeakPolarHBondContact O-CA 3.49Å; V37-V97 HydrophobicContact CB-CB 4.31Å; V37-V97 HydrophobicContact CG1-CB 4.36Å; V37-V97 HydrophobicContact CG1-CG2 4.42Å; V37-V97 PolarHBondContact O-N 2.68Å
38	L	51	Low	47.6	Very low	0 Å²	0	71 Å²	71	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.8	176.8	-68.9	178.9	0	0	0	110.8	W29 L36 L40 L52 L53 A55 L74 R95 P96	W29-L38 HydrophobicContact CE3-CD2 4.49Å; W29-L38 HydrophobicContact CH2-CD2 4.4Å; W29-L38 HydrophobicContact CZ3-CD2 3.94Å; L36-L38 HydrophobicContact CD2-CD2 3.73Å; L36-L38 HydrophobicContact CD2-CG 4.14Å; L36-L38 HydrophobicContact CG-CD2 4.41Å; L38-L40 HydrophobicContact CB-CD2 4.22Å; L38-L52 WeakPolarHBondContact O-CA 3.44Å; L38-L53 PolarHBondContact N-O 2.84Å; L38-L53 PolarHBondContact O-N 2.74Å; L38-A55 HydrophobicContact CD1-CB 3.78Å; L38-A55 HydrophobicContact CG-CB 4.05Å; L38-L74 HydrophobicContact CD1-CD2 4.28Å; L38-R95 CarbonylContact C-O 3.53Å; L38-R95 WeakPolarHBondContact CA-O 3.37Å; L38-P96 HydrophobicContact CD2-CB 4.24Å
39	A	52.1	Low	47.5	Very low	21 Å²	21	68.3 Å²	68.3	17%	0.174	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	120.9	160	0	0	0	0	0	108.9	L52 A94 R95 V97	A39-L52 HydrophobicContact CB-CD2 3.81Å; A39-A94 WeakPolarHBondContact O-CA 3.33Å; A39-R95 HydrophobicContact CB-CB 4.36Å; A39-R95 PolarHBondContact N-O 3.16Å; A39-R95 PolarHBondContact O-N 3.25Å; A39-V97 HydrophobicContact CB-CG2 4.2Å
40	L	54	Low	47.2	Very low	7 Å²	7	68.1 Å²	68.1	4%	0.037	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.3	178.9	-66.9	-164	0	0	0	110.1	L6 L38 P50 A51 L53 L74 V92 A94	L6-L40 HydrophobicContact CD2-CD1 4.47Å; L38-L40 HydrophobicContact CB-CD2 4.22Å; L40-P50 CarbonylContact O-C 3.46Å; L40-P50 VanDerWaalsContact O-CA 3.29Å; L40-P50 WeakPolarHBondContact O-CA 3.48Å; L40-A51 PolarHBondContact N-O 3.48Å; L40-A51 PolarHBondContact O-N 2.94Å; L40-L53 HydrophobicContact CD1-CD1 3.54Å; L40-L53 HydrophobicContact CD1-CG 4.39Å; L40-L53 HydrophobicContact CG-CD1 4.31Å; L40-L74 HydrophobicContact CD2-CD1 4.14Å; L40-V92 HydrophobicContact CB-CG1 3.64Å; L40-V92 HydrophobicContact CD1-CG1 4.2Å; L40-V92 HydrophobicContact CD2-CG1 3.84Å; L40-V92 HydrophobicContact CG-CG1 4.09Å; L40-A94 HydrophobicContact CD2-CB 3.55Å
41	R	58.8	Low	47.3	Very low	164 Å²	164	65.9 Å²	65.9	62%	0.619	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.4	170.1	-173.3	171.3	177.6	165.1	-2.1	109.8	P50 V92 R93	R41-P50 HydrophobicContact CB-CB 4.47Å; R41-V92 WeakPolarHBondContact O-CG1 3.49Å; R41-R93 PolarHBondContact N-O 3.47Å; R41-R93 PolarHBondContact O-N 2.97Å
42	P	57.4	Low	47.2	Very low	23 Å²	23	64.9 Å²	64.9	15%	0.149	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	144.4	175.1	-24	34.2	0	0	0	111.5	A48 L86	P42-A48 HydrophobicContact CG-CB 4.12Å; P42-A48 WeakPolarHBondContact CG-O 3.47Å; P42-L86 HydrophobicContact CG-CD2 4.28Å
43	A	50.2	Low	48	Very low	41 Å²	41	62 Å²	62	34%	0.339	40%	0.395	S	S	.	.	S	Bend	trans	-83.3	-9.1	-177.7	0	0	0	0	0	114.4	L3 W91	L3-A43 HydrophobicContact CD2-CB 3.94Å; A43-W91 HydrophobicContact CB-CB 3.97Å; A43-W91 WeakPolarHBondContact CB-O 3.46Å; A43-W91 PolarHBondContact N-O 3.18Å
44	G	53.4	Low	48.5	Very low	55 Å²	55	62.5 Å²	62.5	57%	0.567	38%	0.382	S	S	*	.	S	Bend	trans	-132	-177.6	177.8	0	0	0	0	0	112.8	S46	G44-S46 PolarHBondContact O-N 3Å
45	E	42.9	Very low	49	Very low	213 Å²	213	54.8 Å²	54.8	100%	0.995	34%	0.342	S	S	*	.	S	Bend	trans	-70.9	69.4	-177.7	-63.3	-176.6	162.5	0	0	112.7
46	S	46.1	Very low	49	Very low	49 Å²	49	54.1 Å²	54.1	34%	0.343	33%	0.332	S	S	.	.			trans	-96.7	143.3	168.8	179.5	0	0	0	0	109.9	G44 A48	G44-S46 PolarHBondContact O-N 3Å; S46-A48 PolarHBondContact O-N 2.91Å; S46-A48 VanDerWaalsContact O-N 3.12Å; S46-A48 WeakPolarHBondContact OG-CB 3.29Å; S46-A48 PolarHBondContact OG-N 3.29Å
47	P	42.1	Very low	49	Very low	143 Å²	143	56.6 Å²	56.6	93%	0.929	35%	0.345	S	S	*	.	S	Bend	trans	-68.3	-2.2	171.1	30.1	-36.5	0	0	0	113.6	G49	P47-G49 PolarHBondContact O-N 3.26Å
48	A	45.6	Very low	48.8	Very low	23 Å²	23	58.4 Å²	58.4	19%	0.19	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-74.4	117	175.8	0	0	0	0	0	111.7	P42 S46 L84 L86	P42-A48 HydrophobicContact CG-CB 4.12Å; P42-A48 WeakPolarHBondContact CG-O 3.47Å; S46-A48 PolarHBondContact O-N 2.91Å; S46-A48 VanDerWaalsContact O-N 3.12Å; S46-A48 WeakPolarHBondContact OG-CB 3.29Å; S46-A48 PolarHBondContact OG-N 3.29Å; A48-L84 WeakPolarHBondContact CB-O 3.47Å; A48-L86 HydrophobicContact CB-CD2 4.24Å
49	G	46.6	Very low	48.3	Very low	47 Å²	47	61 Å²	61	49%	0.485	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-68.1	168.1	173.7	0	0	0	0	0	113.6	P47	P47-G49 PolarHBondContact O-N 3.26Å
50	P	46.2	Very low	47.5	Very low	28 Å²	28	66.4 Å²	66.4	18%	0.182	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-65.3	141.2	177.4	27.8	-34.1	0	0	0	111.8	L40 R41 L149 T153	L40-P50 CarbonylContact O-C 3.46Å; L40-P50 VanDerWaalsContact O-CA 3.29Å; L40-P50 WeakPolarHBondContact O-CA 3.48Å; R41-P50 HydrophobicContact CB-CB 4.47Å; P50-L149 HydrophobicContact CB-CD2 4.27Å; P50-L149 HydrophobicContact CG-CB 4.33Å; P50-L149 HydrophobicContact CG-CD2 3.99Å; P50-L149 VanDerWaalsContact CG-O 3.28Å; P50-L149 WeakPolarHBondContact CG-O 3.35Å; P50-T153 HydrophobicContact CG-CG2 4.21Å; P50-T153 WeakPolarHBondContact O-CG2 3.4Å
51	A	48.2	Very low	46.4	Very low	21 Å²	21	69.5 Å²	69.5	17%	0.174	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.9	-177.2	0	0	0	0	0	111.9	L40 L84	L40-A51 PolarHBondContact N-O 3.48Å; L40-A51 PolarHBondContact O-N 2.94Å; A51-L84 HydrophobicContact CB-CD2 3.57Å
52	L	41.7	Very low	45.1	Very low	79 Å²	79	67.2 Å²	67.2	41%	0.414	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121.2	172.5	-75.4	164.8	0	0	0	109.3	V37 L38 A39 V97	V37-L52 HydrophobicContact CG1-CD2 4.04Å; L38-L52 WeakPolarHBondContact O-CA 3.44Å; A39-L52 HydrophobicContact CB-CD2 3.81Å; L52-V97 HydrophobicContact CD2-CG2 4.01Å
53	L	51.8	Low	43.7	Very low	20 Å²	20	69 Å²	69	11%	0.105	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.8	-179.4	-60	-176.3	0	0	0	111.3	V21 V37 L38 L40 L80 L84	V21-L53 HydrophobicContact CG2-CB 4.07Å; V21-L53 HydrophobicContact CG2-CD1 3.43Å; V21-L53 VanDerWaalsContact CG2-CD1 3.43Å; V21-L53 HydrophobicContact CG2-CG 4.42Å; V37-L53 CarbonylContact C-O 3.47Å; V37-L53 WeakPolarHBondContact CA-O 3.09Å; L38-L53 PolarHBondContact N-O 2.84Å; L38-L53 PolarHBondContact O-N 2.74Å; L40-L53 HydrophobicContact CD1-CD1 3.54Å; L40-L53 HydrophobicContact CD1-CG 4.39Å; L40-L53 HydrophobicContact CG-CD1 4.31Å; L53-L80 HydrophobicContact CD1-CD1 4.11Å; L53-L80 HydrophobicContact CD1-CD2 3.78Å; L53-L80 HydrophobicContact CD2-CD1 3.81Å; L53-L84 HydrophobicContact CD1-CD1 4.27Å
54	V	46.4	Very low	42.8	Very low	84 Å²	84	73.6 Å²	73.6	51%	0.509	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	126.7	169.8	-176	0	0	0	0	108.5	A20 V21	A20-V54 WeakPolarHBondContact CA-O 3.41Å; V21-V54 PolarHBondContact N-O 3.05Å; V21-V54 VanDerWaalsContact N-O 3.11Å
55	A	49.4	Very low	41.8	Very low	4 Å²	4	78.7 Å²	78.7	3%	0.033	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	137.7	176.1	0	0	0	0	0	111.2	V21 L23 L36 L38	V21-A55 HydrophobicContact CB-CB 4.37Å; V21-A55 CarbonylContact O-C 3.59Å; V21-A55 VanDerWaalsContact O-CA 3.23Å; V21-A55 WeakPolarHBondContact O-CA 3.49Å; L23-A55 HydrophobicContact CD1-CB 3.72Å; L23-A55 HydrophobicContact CG-CB 4.23Å; L36-A55 HydrophobicContact CB-CB 4.41Å; L36-A55 PolarHBondContact N-O 3.44Å; L36-A55 WeakPolarHBondContact O-CB 3.28Å; L36-A55 PolarHBondContact O-N 2.96Å; L38-A55 HydrophobicContact CD1-CB 3.78Å; L38-A55 HydrophobicContact CG-CB 4.05Å
56	A	46.5	Very low	41.9	Very low	35 Å²	35	78.1 Å²	78.1	29%	0.289	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	139.6	172.2	0	0	0	0	0	109.1	V21 L22 L23	V21-A56 PolarHBondContact O-N 3.4Å; L22-A56 HydrophobicContact CD2-CB 4.23Å; L23-A56 PolarHBondContact N-O 2.91Å
57	L	49.6	Very low	41.4	Very low	98 Å²	98	82.8 Å²	82.8	51%	0.513	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	131.4	172.3	-147.1	86.1	0	0	0	108.4	L23	L23-L57 HydrophobicContact CB-CD1 3.97Å; L23-L57 HydrophobicContact CD1-CD1 4.25Å
58	E	44.1	Very low	41.1	Very low	72 Å²	72	79.1 Å²	79.1	34%	0.336	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-76.7	130.3	174.3	-160.4	160.1	-154.7	0	0	109.5	L22 L23	L22-E58 HydrophobicContact CD2-CB 4.46Å; L23-E58 PolarHBondContact O-N 3.34Å
59	G	41.8	Very low	40.8	Very low	54 Å²	54	85.2 Å²	85.2	56%	0.557	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-69.2	159.5	178.8	0	0	0	0	0	111.8	G61	G59-G61 VanDerWaalsContact C-N 3.3Å; G59-G61 PolarHBondContact O-N 3Å
60	P	35.1	Very low	41	Very low	135 Å²	135	85.6 Å²	85.6	88%	0.877	56%	0.56	S	S	*	*			trans	-71	82.7	-178.2	29.8	-35.2	0	0	0	111.9
61	G	31.3	Very low	41.5	Very low	71 Å²	71	86.7 Å²	86.7	73%	0.732	57%	0.568	S	S	*	*			trans	-79.2	134.5	164.1	0	0	0	0	0	110.5	G59	G59-G61 VanDerWaalsContact C-N 3.3Å; G59-G61 PolarHBondContact O-N 3Å
62	A	30.1	Very low	42.1	Very low	116 Å²	116	87.2 Å²	87.2	96%	0.959	57%	0.569	S	S	*	*			trans	-76.7	126.8	-175.1	0	0	0	0	0	112.6
63	G	28.9	Very low	43.2	Very low	61 Å²	61	86.2 Å²	86.2	63%	0.629	56%	0.562	S	S	*	*			trans	142.2	96.4	159.5	0	0	0	0	0	116.2
64	T	30.8	Very low	43.8	Very low	137 Å²	137	85.2 Å²	85.2	84%	0.84	56%	0.557	S	S	*	*			trans	60	143.8	153.9	45.5	0	0	0	0	118
65	E	33.3	Very low	44.7	Very low	162 Å²	162	82.4 Å²	82.4	76%	0.757	54%	0.539	S	S	*	.			cis	-154.9	155.7	17.7	-133.9	164.9	-139.8	0	0	109	Q67	E65-Q67 PolarHBondContact O-N 3.46Å
66	E	44.1	Very low	45.5	Very low	202 Å²	202	82.2 Å²	82.2	94%	0.944	54%	0.538	S	S	*	.			trans	-66.9	113.1	175.7	-67.9	-176.8	142.8	0	0	111
67	Q	35.1	Very low	46.3	Very low	146 Å²	146	81 Å²	81	68%	0.682	53%	0.527	S	S	*	.			trans	-110.8	135.7	166	-70	-171.2	0.5	0	0	110.1	E65	E65-Q67 PolarHBondContact O-N 3.46Å
68	G	37.3	Very low	46.8	Very low	67 Å²	67	82.8 Å²	82.8	69%	0.691	53%	0.527	S	S	*	.			trans	-68	-165.3	-174.1	0	0	0	0	0	115.1	G70	G68-G70 VanDerWaalsContact C-N 3.28Å; G68-G70 PolarHBondContact O-N 3.07Å
69	P	39.3	Very low	47.3	Very low	150 Å²	150	81.6 Å²	81.6	97%	0.974	53%	0.53	S	S	*	.	S	Bend	trans	-74.1	72.3	-165.9	31.8	-37.3	0	0	0	113.3
70	G	49.8	Very low	48	Very low	55 Å²	55	79.2 Å²	79.2	57%	0.567	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-94.3	161.4	170.1	0	0	0	0	0	112.7	G68	G68-G70 VanDerWaalsContact C-N 3.28Å; G68-G70 PolarHBondContact O-N 3.07Å
71	P	56.2	Low	49.1	Very low	52 Å²	52	73.3 Å²	73.3	34%	0.338	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-63.4	146.5	172.5	28.8	-35.8	0	0	0	111	V5 Q73 W91	V5-P71 HydrophobicContact CG2-CB 4.5Å; V5-P71 HydrophobicContact CG2-CG 3.91Å; P71-Q73 PolarHBondContact O-N 3.2Å; P71-W91 HydrophobicContact CB-CH2 4.38Å; P71-W91 HydrophobicContact CB-CZ3 4.07Å; P71-W91 HydrophobicContact CG-CH2 3.79Å; P71-W91 HydrophobicContact CG-CZ3 3.96Å
72	P	62.1	Low	50.3	Low	32 Å²	32	79.3 Å²	79.3	21%	0.208	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-57.6	132.4	-178.3	22.2	-33.6	0	0	0	111.9	A2 L3 A4 V5	A2-P72 HydrophobicContact CB-CG 4.4Å; L3-P72 WeakPolarHBondContact O-CD 3.08Å; L3-P72 WeakPolarHBondContact O-CG 3.35Å; A4-P72 WeakPolarHBondContact CA-O 3.43Å; A4-P72 HydrophobicContact CB-CG 4.28Å; A4-P72 VanDerWaalsContact CB-O 3.28Å; A4-P72 WeakPolarHBondContact CB-O 3.3Å; V5-P72 PolarHBondContact N-O 3.31Å; V5-P72 VanDerWaalsContact N-O 3.1Å
73	Q	64.9	Low	51.3	Low	57 Å²	57	79.7 Å²	79.7	27%	0.266	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	137	179.3	-60.9	177.5	37.4	0	0	109.7	V5 R7 P24 P71	V5-Q73 WeakPolarHBondContact O-CA 3.46Å; R7-Q73 VanDerWaalsContact CD-OE1 3.28Å; P24-Q73 WeakPolarHBondContact CD-O 3.29Å; P71-Q73 PolarHBondContact O-N 3.2Å
74	L	64.4	Low	52.4	Low	0 Å²	0	78.4 Å²	78.4	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	116.8	172.5	-71.1	174	0	0	0	108.2	A4 V5 L6 R7 V21 L23 L38 L40 A94	A4-L74 HydrophobicContact CB-CD1 3.64Å; A4-L74 HydrophobicContact CB-CG 3.81Å; V5-L74 PolarHBondContact O-N 3.31Å; L6-L74 WeakPolarHBondContact CA-O 3.24Å; L6-L74 HydrophobicContact CD2-CB 3.94Å; L6-L74 HydrophobicContact CD2-CD1 4.2Å; R7-L74 PolarHBondContact N-O 2.71Å; V21-L74 HydrophobicContact CG1-CB 3.88Å; V21-L74 HydrophobicContact CG1-CD2 3.8Å; V21-L74 HydrophobicContact CG1-CG 4.3Å; L23-L74 HydrophobicContact CD2-CD2 3.44Å; L23-L74 VanDerWaalsContact CD2-CD2 3.44Å; L23-L74 HydrophobicContact CG-CD2 4.4Å; L38-L74 HydrophobicContact CD1-CD2 4.28Å; L40-L74 HydrophobicContact CD2-CD1 4.14Å; L74-A94 HydrophobicContact CD1-CB 4.44Å
75	L	65.6	Low	53.6	Low	25 Å²	25	75.8 Å²	75.8	13%	0.131	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	123.6	-177.5	-65.5	174.5	0	0	0	109.7	R7 L9 L22	R7-L75 HydrophobicContact CB-CD2 4.16Å; R7-L75 WeakPolarHBondContact O-CA 3.4Å; L9-L75 HydrophobicContact CB-CB 4.47Å; L9-L75 HydrophobicContact CB-CD2 4.45Å; L9-L75 HydrophobicContact CD1-CD1 4.39Å; L9-L75 HydrophobicContact CD2-CD1 4.46Å; L22-L75 HydrophobicContact CB-CB 3.89Å; L22-L75 PolarHBondContact N-O 2.67Å; L22-L75 PolarHBondContact O-N 3.13Å
76	V	64.6	Low	54.9	Low	0 Å²	0	69.3 Å²	69.3	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	142.3	-166.1	174.8	0	0	0	0	111.9	L6 R7 V8 V21 L80 L81	L6-V76 HydrophobicContact CD2-CG2 3.77Å; R7-V76 PolarHBondContact O-N 3.47Å; V8-V76 WeakPolarHBondContact CA-O 3.45Å; V21-V76 HydrophobicContact CB-CG2 4.37Å; V21-V76 HydrophobicContact CG1-CG2 3.87Å; V21-V76 HydrophobicContact CG2-CG2 3.98Å; V76-L80 HydrophobicContact CG1-CB 3.89Å; V76-L80 HydrophobicContact CG1-CD2 3.38Å; V76-L80 HydrophobicContact CG1-CG 4.2Å; V76-L81 HydrophobicContact CG1-CD2 4.12Å; V76-L81 HydrophobicContact CG1-CG 4.03Å
77	S	63.6	Low	55.4	Low	9 Å²	9	62 Å²	62	6%	0.063	37%	0.37	C	S	.	.			trans	-67.2	146.5	176.5	94.1	0	0	0	0	111.9	P18 A79 L80 L81	P18-S77 WeakPolarHBondContact O-CB 3.49Å; P18-S77 PolarHBondContact O-OG 3.21Å; S77-A79 PolarHBondContact O-N 3.32Å; S77-A79 VanDerWaalsContact O-N 3.16Å; S77-A79 PolarHBondContact OG-N 2.94Å; S77-L80 PolarHBondContact O-N 3.44Å; S77-L80 VanDerWaalsContact O-N 3.09Å; S77-L80 PolarHBondContact OG-N 3.44Å; S77-L80 VanDerWaalsContact OG-N 3.1Å; S77-L81 PolarHBondContact O-N 3.23Å
78	R	59.4	Low	56.5	Low	135 Å²	135	58.8 Å²	58.8	51%	0.509	37%	0.365	S	S	.	.	H	α-helix	trans	-63.5	-20.5	176.3	-154.7	166.2	-175.2	174.4	2.9	113.2	V8 E10 R82	V8-R78 HydrophobicContact CG1-CB 4.27Å; E10-R78 WeakPolarHBondContact OE1-CD 3.46Å; E10-R78 IonicContact OE1-CZ 3.68Å; E10-R78 IonicContact OE1-NE 3.83Å; E10-R78 IonicContact OE1-NH1 2.77Å; E10-R78 PolarHBondContact OE1-NH1 2.88Å; E10-R78 IonicContact OE2-NH1 3.39Å; E10-R78 PolarHBondContact OE2-NH1 3.15Å; R78-R82 WeakPolarHBondContact O-CG 3.35Å
79	A	55.5	Low	57.8	Low	48 Å²	48	57.4 Å²	57.4	40%	0.397	35%	0.35	S	S	.	.	H	α-helix	trans	-74.8	-40.9	173.2	0	0	0	0	0	111.9	S77 R82 L83	S77-A79 PolarHBondContact O-N 3.32Å; S77-A79 VanDerWaalsContact O-N 3.16Å; S77-A79 PolarHBondContact OG-N 2.94Å; A79-R82 PolarHBondContact O-N 3.26Å; A79-L83 PolarHBondContact O-N 3.37Å; A79-L83 VanDerWaalsContact O-N 3.15Å
80	L	56.5	Low	58.9	Low	4 Å²	4	51.4 Å²	51.4	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-71.4	-36.7	179.4	-172.6	140.6	0	0	0	112.3	L19 L53 V76 S77 R82 L83 L84	L19-L80 HydrophobicContact CB-CD1 4.14Å; L19-L80 HydrophobicContact CD2-CB 4.41Å; L19-L80 HydrophobicContact CD2-CD1 4.06Å; L19-L80 HydrophobicContact CD2-CG 4.49Å; L19-L80 WeakPolarHBondContact O-CD1 3.47Å; L53-L80 HydrophobicContact CD1-CD1 4.11Å; L53-L80 HydrophobicContact CD1-CD2 3.78Å; L53-L80 HydrophobicContact CD2-CD1 3.81Å; V76-L80 HydrophobicContact CG1-CB 3.89Å; V76-L80 HydrophobicContact CG1-CD2 3.38Å; V76-L80 HydrophobicContact CG1-CG 4.2Å; S77-L80 PolarHBondContact O-N 3.44Å; S77-L80 VanDerWaalsContact O-N 3.09Å; S77-L80 PolarHBondContact OG-N 3.44Å; S77-L80 VanDerWaalsContact OG-N 3.1Å; L80-R82 VanDerWaalsContact C-N 3.31Å; L80-R82 PolarHBondContact O-N 3Å; L80-L83 PolarHBondContact O-N 2.79Å; L80-L84 HydrophobicContact CD2-CD1 3.55Å; L80-L84 HydrophobicContact CD2-CG 4.01Å; L80-L84 PolarHBondContact O-N 2.88Å
81	L	58.3	Low	59.5	Low	10 Å²	10	55.6 Å²	55.6	5%	0.052	31%	0.312	C	S	.	.	H	α-helix	trans	-59.2	-40.3	171.9	-74.6	-174.3	0	0	0	112.8	L6 V8 V76 S77 L84 A85 L86	L6-L81 HydrophobicContact CB-CD2 4.27Å; L6-L81 HydrophobicContact CD1-CD2 3.86Å; V8-L81 HydrophobicContact CG2-CD1 3.37Å; V76-L81 HydrophobicContact CG1-CD2 4.12Å; V76-L81 HydrophobicContact CG1-CG 4.03Å; S77-L81 PolarHBondContact O-N 3.23Å; L81-L84 PolarHBondContact O-N 3.03Å; L81-A85 PolarHBondContact O-N 3.01Å; L81-L86 HydrophobicContact CD2-CB 4.27Å; L81-L86 PolarHBondContact O-N 3.1Å; L81-L86 VanDerWaalsContact O-N 3.08Å
82	R	56.8	Low	59.7	Low	197 Å²	197	53.1 Å²	53.1	74%	0.743	30%	0.296	S	S	*	.	H	α-helix	trans	-64.5	-39.2	174.7	-72.6	174.5	-179.8	171.7	1.3	112.1	R78 A79 L80 A85	R78-R82 WeakPolarHBondContact O-CG 3.35Å; A79-R82 PolarHBondContact O-N 3.26Å; L80-R82 VanDerWaalsContact C-N 3.31Å; L80-R82 PolarHBondContact O-N 3Å; R82-A85 PolarHBondContact O-N 2.83Å
83	L	51.4	Low	59.5	Low	125 Å²	125	58.1 Å²	58.1	65%	0.654	31%	0.311	S	S	*	.	H	α-helix	trans	-68.8	-34.9	177.2	-80.8	163.9	0	0	0	113.2	L19 A79 L80 A85	L19-L83 HydrophobicContact CD2-CD1 3.53Å; A79-L83 PolarHBondContact O-N 3.37Å; A79-L83 VanDerWaalsContact O-N 3.15Å; L80-L83 PolarHBondContact O-N 2.79Å; L83-A85 VanDerWaalsContact C-N 3.33Å
84	L	51.4	Low	58.9	Low	33 Å²	33	55.4 Å²	55.4	17%	0.173	30%	0.298	C	S	.	.	H	α-helix	trans	-83.4	-5.6	175.3	-65.4	-173.8	0	0	0	114	A48 A51 L53 L80 L81 L86	A48-L84 WeakPolarHBondContact CB-O 3.47Å; A51-L84 HydrophobicContact CB-CD2 3.57Å; L53-L84 HydrophobicContact CD1-CD1 4.27Å; L80-L84 HydrophobicContact CD2-CD1 3.55Å; L80-L84 HydrophobicContact CD2-CG 4.01Å; L80-L84 PolarHBondContact O-N 2.88Å; L81-L84 PolarHBondContact O-N 3.03Å; L84-L86 HydrophobicContact CB-CB 4.39Å; L84-L86 HydrophobicContact CB-CD1 4.05Å; L84-L86 HydrophobicContact CB-CG 4.05Å; L84-L86 HydrophobicContact CD1-CD1 4.16Å; L84-L86 PolarHBondContact O-N 2.77Å
85	A	56.1	Low	58.5	Low	82 Å²	82	60.6 Å²	60.6	68%	0.678	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	34.1	-170.7	0	0	0	0	0	113.9	L81 R82 L83	L81-A85 PolarHBondContact O-N 3.01Å; R82-A85 PolarHBondContact O-N 2.83Å; L83-A85 VanDerWaalsContact C-N 3.33Å
86	L	60.3	Low	57.6	Low	26 Å²	26	61.7 Å²	61.7	14%	0.136	33%	0.326	C	S	.	.			trans	-108.3	141	-179.9	-67.4	176.3	0	0	0	111.7	L6 P42 A48 L81 L84 A90 V92	L6-L86 HydrophobicContact CD1-CB 4.28Å; L6-L86 HydrophobicContact CD1-CD1 3.69Å; P42-L86 HydrophobicContact CG-CD2 4.28Å; A48-L86 HydrophobicContact CB-CD2 4.24Å; L81-L86 HydrophobicContact CD2-CB 4.27Å; L81-L86 PolarHBondContact O-N 3.1Å; L81-L86 VanDerWaalsContact O-N 3.08Å; L84-L86 HydrophobicContact CB-CB 4.39Å; L84-L86 HydrophobicContact CB-CD1 4.05Å; L84-L86 HydrophobicContact CB-CG 4.05Å; L84-L86 HydrophobicContact CD1-CD1 4.16Å; L84-L86 PolarHBondContact O-N 2.77Å; L86-A90 HydrophobicContact CB-CB 4.43Å; L86-A90 HydrophobicContact CD2-CB 4.49Å; L86-V92 HydrophobicContact CD1-CG2 4.34Å
87	G	54.7	Low	56.8	Low	48 Å²	48	63.9 Å²	63.9	50%	0.495	34%	0.339	S	S	.	.			trans	-77.6	154.4	172.9	0	0	0	0	0	113	G89 A90	G87-G89 PolarHBondContact O-N 3.07Å; G87-A90 VanDerWaalsContact O-CB 3.29Å; G87-A90 WeakPolarHBondContact O-CB 3.4Å; G87-A90 PolarHBondContact O-N 3Å
88	S	59.1	Low	55.6	Low	80 Å²	80	74.4 Å²	74.4	56%	0.559	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	129.6	166.7	-174.6	0	0	0	0	109.3
89	G	63.5	Low	54.5	Low	37 Å²	37	77.1 Å²	77.1	38%	0.381	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	1.6	-172.5	0	0	0	0	0	115.1	L6 G87	L6-G89 WeakPolarHBondContact O-CA 3.42Å; L6-G89 PolarHBondContact O-N 3.03Å; G87-G89 PolarHBondContact O-N 3.07Å
90	A	62.7	Low	53.4	Low	25 Å²	25	79 Å²	79	21%	0.207	40%	0.396	C	S	.	.			trans	-67.2	138.6	177.2	0	0	0	0	0	112.6	L6 L86 G87	L6-A90 HydrophobicContact CD1-CB 4.44Å; L6-A90 PolarHBondContact N-O 3.32Å; L86-A90 HydrophobicContact CB-CB 4.43Å; L86-A90 HydrophobicContact CD2-CB 4.49Å; G87-A90 VanDerWaalsContact O-CB 3.29Å; G87-A90 WeakPolarHBondContact O-CB 3.4Å; G87-A90 PolarHBondContact O-N 3Å
91	W	62.5	Low	52.2	Low	142 Å²	142	82.1 Å²	82.1	54%	0.538	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	130.6	176.2	-69.6	75.3	0	0	0	111.2	L3 V5 A43 P71	L3-W91 HydrophobicContact CD2-CE3 4.04Å; V5-W91 HydrophobicContact CG2-CD2 3.86Å; V5-W91 HydrophobicContact CG2-CE3 4.02Å; V5-W91 HydrophobicContact CG2-CG 4.36Å; V5-W91 HydrophobicContact CG2-CH2 4.45Å; V5-W91 HydrophobicContact CG2-CZ2 4.26Å; V5-W91 HydrophobicContact CG2-CZ3 4.32Å; A43-W91 HydrophobicContact CB-CB 3.97Å; A43-W91 WeakPolarHBondContact CB-O 3.46Å; A43-W91 PolarHBondContact N-O 3.18Å; P71-W91 HydrophobicContact CB-CH2 4.38Å; P71-W91 HydrophobicContact CB-CZ3 4.07Å; P71-W91 HydrophobicContact CG-CH2 3.79Å; P71-W91 HydrophobicContact CG-CZ3 3.96Å
92	V	60.1	Low	50.8	Low	1 Å²	1	86.2 Å²	86.2	1%	0.006	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	136.8	-173.2	-178.3	0	0	0	0	110.1	A4 L6 L40 R41 L86	A4-V92 PolarHBondContact N-O 3.42Å; A4-V92 PolarHBondContact O-N 3.36Å; L6-V92 HydrophobicContact CD1-CG2 3.67Å; L6-V92 HydrophobicContact CG-CG2 3.86Å; L40-V92 HydrophobicContact CB-CG1 3.64Å; L40-V92 HydrophobicContact CD1-CG1 4.2Å; L40-V92 HydrophobicContact CD2-CG1 3.84Å; L40-V92 HydrophobicContact CG-CG1 4.09Å; R41-V92 WeakPolarHBondContact O-CG1 3.49Å; L86-V92 HydrophobicContact CD1-CG2 4.34Å
93	R	57.4	Low	49.6	Very low	136 Å²	136	82.2 Å²	82.2	51%	0.513	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	117.6	168.8	-64.3	-178.3	-178.4	-177.9	1.6	108.4	L3 R41	L3-R93 HydrophobicContact CD2-CG 4.19Å; L3-R93 HydrophobicContact CG-CG 4.35Å; R41-R93 PolarHBondContact N-O 3.47Å; R41-R93 PolarHBondContact O-N 2.97Å
94	A	53.3	Low	48.5	Very low	0 Å²	0	80.2 Å²	80.2	0%	0	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133.4	-179.3	0	0	0	0	0	111.5	A2 W29 A39 L40 L74	A2-A94 PolarHBondContact N-O 3.1Å; A2-A94 VanDerWaalsContact N-O 3.15Å; A2-A94 PolarHBondContact O-N 3.44Å; W29-A94 HydrophobicContact CH2-CB 3.7Å; W29-A94 HydrophobicContact CZ2-CB 4.42Å; A39-A94 WeakPolarHBondContact O-CA 3.33Å; L40-A94 HydrophobicContact CD2-CB 3.55Å; L74-A94 HydrophobicContact CD1-CB 4.44Å
95	R	55.9	Low	47.4	Very low	109 Å²	109	86.3 Å²	86.3	41%	0.411	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	124.4	177.5	-69.9	-177.3	-178.6	-171.2	2	110.3	M1 L38 A39	M1-R95 VanDerWaalsContact CE-NH2 3.33Å; M1-R95 HydrophobicContact CG-CG 3.49Å; M1-R95 VanDerWaalsContact CG-CG 3.49Å; M1-R95 HydrophobicContact SD-CG 4.22Å; M1-R95 PolarHBondContact SD-NE 2.75Å; M1-R95 PolarHBondContact SD-NH2 3.22Å; M1-R95 VanDerWaalsContact SD-NH2 3.45Å; L38-R95 CarbonylContact C-O 3.53Å; L38-R95 WeakPolarHBondContact CA-O 3.37Å; A39-R95 HydrophobicContact CB-CB 4.36Å; A39-R95 PolarHBondContact N-O 3.16Å; A39-R95 PolarHBondContact O-N 3.25Å
96	P	46.2	Very low	45.8	Very low	49 Å²	49	87 Å²	87	32%	0.318	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129.1	172.4	31.3	-30.8	0	0	0	110.8	L36 V37 L38	L36-P96 HydrophobicContact CD1-CB 3.96Å; L36-P96 HydrophobicContact CD2-CB 4.36Å; L36-P96 HydrophobicContact CG-CB 4.3Å; V37-P96 WeakPolarHBondContact O-CA 3.49Å; L38-P96 HydrophobicContact CD2-CB 4.24Å
97	V	47.8	Very low	44.1	Very low	45 Å²	45	92.7 Å²	92.7	27%	0.273	51%	0.511	S	S	.	.			trans	-93	103.1	-179.7	-178.4	0	0	0	0	109	V37 A39 L52 R99	V37-V97 HydrophobicContact CB-CB 4.31Å; V37-V97 HydrophobicContact CG1-CB 4.36Å; V37-V97 HydrophobicContact CG1-CG2 4.42Å; V37-V97 PolarHBondContact O-N 2.68Å; A39-V97 HydrophobicContact CB-CG2 4.2Å; L52-V97 HydrophobicContact CD2-CG2 4.01Å; V97-R99 VanDerWaalsContact C-N 3.33Å; V97-R99 WeakPolarHBondContact CG1-O 3.46Å; V97-R99 PolarHBondContact O-N 2.71Å
98	R	39.6	Very low	42.6	Very low	231 Å²	231	98.5 Å²	98.5	87%	0.872	53%	0.53	S	S	*	.	S	Bend	trans	-74.4	-15.7	-175.8	-74.9	-174.3	173	-177.6	-2.5	115.1
99	R	36.3	Very low	40.8	Very low	191 Å²	191	97.8 Å²	97.8	72%	0.721	54%	0.535	S	S	*	.	S	Bend	trans	-140.3	104.6	169.9	-73.4	-177	175.5	-179.5	-3.9	108.2	V97	V97-R99 VanDerWaalsContact C-N 3.33Å; V97-R99 WeakPolarHBondContact CG1-O 3.46Å; V97-R99 PolarHBondContact O-N 2.71Å
100	P	31.8	Very low	38.9	Very low	88 Å²	88	102.5 Å²	102.5	57%	0.571	56%	0.557	S	S	*	*			trans	-65.8	144	170.4	28.1	-32.8	0	0	0	109.3
101	P	30.8	Very low	37	Very low	69 Å²	69	106.3 Å²	106.3	45%	0.448	58%	0.581	S	S	.	*			trans	-62.5	154.2	173.3	28.1	-34.7	0	0	0	110.2	L103	P101-L103 PolarHBondContact O-N 3.4Å
102	A	29	Very low	35.3	Very low	97 Å²	97	105.7 Å²	105.7	80%	0.802	59%	0.588	S	S	*	*			trans	-69.6	65.3	-177.6	0	0	0	0	0	113.7
103	L	31.3	Very low	33.6	Very low	113 Å²	113	107.9 Å²	107.9	59%	0.592	61%	0.611	S	S	*	*			trans	-84.1	118.6	154	-66.5	170.8	0	0	0	106.2	P101 W105	P101-L103 PolarHBondContact O-N 3.4Å; L103-W105 VanDerWaalsContact O-CD1 3.22Å; L103-W105 PolarHBondContact O-N 2.71Å
104	G	28.1	Very low	32.4	Very low	82 Å²	82	108 Å²	108	85%	0.845	63%	0.63	S	S	*	*			trans	-66.7	104.3	-172.1	0	0	0	0	0	112.7
105	W	28.8	Very low	31.2	Very low	161 Å²	161	111.1 Å²	111.1	61%	0.61	66%	0.661	S	S	*	*			trans	-135.8	129	171.1	-60.8	97.8	0	0	0	108.9	L103 L124 V157	L103-W105 VanDerWaalsContact O-CD1 3.22Å; L103-W105 PolarHBondContact O-N 2.71Å; W105-L124 HydrophobicContact CH2-CD2 4.31Å; W105-L124 HydrophobicContact CZ3-CD1 3.8Å; W105-L124 HydrophobicContact CZ3-CD2 3.92Å; W105-V157 HydrophobicContact CH2-CG1 3.52Å; W105-V157 HydrophobicContact CZ2-CG1 3.74Å
106	A	23.4	Very low	29.8	Very low	98 Å²	98	114.9 Å²	114.9	81%	0.81	69%	0.689	S	S	*	*			trans	-110.3	130.8	172.8	0	0	0	0	0	109
107	L	23.3	Very low	28.9	Very low	145 Å²	145	115.8 Å²	115.8	76%	0.759	71%	0.707	S	S	*	*			trans	-103.5	112	-179.5	-162.3	154.7	0	0	0	108.3
108	L	23	Very low	28.2	Very low	170 Å²	170	119.4 Å²	119.4	89%	0.89	73%	0.732	S	S	*	*			trans	-107.6	114.9	172.3	-77.5	169.2	0	0	0	108.6
109	G	22.7	Very low	27.4	Very low	65 Å²	65	119.9 Å²	119.9	67%	0.67	73%	0.733	S	S	*	*			trans	-80.9	156.6	176.6	0	0	0	0	0	112.7
110	T	23.6	Very low	26.8	Very low	136 Å²	136	117.3 Å²	117.3	83%	0.834	74%	0.739	S	S	*	*			trans	-143.1	137.5	161.1	50.2	0	0	0	0	109.6
111	S	22.9	Very low	26.5	Very low	104 Å²	104	115.6 Å²	115.6	73%	0.727	74%	0.737	S	S	*	*			trans	-72.5	157.3	171.7	48.1	0	0	0	0	112.5
112	L	25.7	Very low	26.2	Very low	129 Å²	129	115.5 Å²	115.5	68%	0.675	74%	0.736	S	S	*	*			trans	-69.1	154	-179.8	-96.1	98.3	0	0	0	114.5	E15	E15-L112 HydrophobicContact CG-CD1 4.46Å; E15-L112 WeakPolarHBondContact OE1-CD2 3.49Å
113	G	24.8	Very low	25.9	Very low	48 Å²	48	115.4 Å²	115.4	50%	0.495	72%	0.722	S	S	.	*			trans	-157.2	139.3	158.3	0	0	0	0	0	108.1
114	P	31.6	Very low	25.6	Very low	138 Å²	138	112.3 Å²	112.3	90%	0.896	71%	0.706	S	S	*	*			trans	-87.6	147.4	-160.9	33.8	-36.2	0	0	0	114
115	G	29.7	Very low	25.3	Very low	65 Å²	65	113.3 Å²	113.3	67%	0.67	70%	0.695	S	S	*	*			trans	137.1	127.5	159.5	0	0	0	0	0	116.5
116	L	25	Very low	25.2	Very low	188 Å²	188	115.7 Å²	115.7	98%	0.984	70%	0.704	S	S	*	*			trans	68.6	137.3	170	-68	102.8	0	0	0	119
117	G	28.3	Very low	25.2	Very low	69 Å²	69	117.1 Å²	117.1	71%	0.711	69%	0.688	S	S	*	*			trans	-97.5	-142.8	179.7	0	0	0	0	0	114
118	P	32.3	Very low	25.5	Very low	120 Å²	120	113.6 Å²	113.6	78%	0.779	69%	0.687	S	S	*	*				-116	140.8	-111.8	36.4	-28.9	0	0	0	114.8
119	R	23.6	Very low	25.5	Very low	241 Å²	241	114.6 Å²	114.6	91%	0.909	69%	0.687	S	S	*	*				179.5	133.6	129	-98.6	157.1	-172.3	-153	1.2	113.7
120	V	24	Very low	25.7	Very low	138 Å²	138	117.6 Å²	117.6	84%	0.836	69%	0.693	S	S	*	*			trans	57.7	91.8	160.1	-167.4	0	0	0	0	117.1
121	G	25.6	Very low	25.9	Very low	51 Å²	51	119.3 Å²	119.3	53%	0.526	70%	0.696	S	S	.	*			trans	-76.5	151	149.6	0	0	0	0	0	110.8
122	P	22.7	Very low	26.3	Very low	67 Å²	67	119 Å²	119	44%	0.435	69%	0.692	S	S	.	*			trans	-78.7	-149.1	168.4	27.2	-22.1	0	0	0	109.9	L160 R161	P122-L160 CarbonylContact O-C 3.5Å; P122-R161 HydrophobicContact CB-CB 4.4Å; P122-R161 HydrophobicContact CG-CB 4Å; P122-R161 PolarHBondContact O-N 2.96Å
123	L	23.1	Very low	26.3	Very low	95 Å²	95	119 Å²	119	50%	0.497	70%	0.697	S	S	.	*				-170.2	81.4	-73.9	-166.2	166.7	0	0	0	106.9	V125 R161	L123-V125 HydrophobicContact CD2-CG2 4.26Å; L123-R161 VanDerWaalsContact N-CG 3.29Å; L123-R161 WeakPolarHBondContact O-CD 3.44Å; L123-R161 WeakPolarHBondContact O-CG 3.44Å; L123-R161 PolarHBondContact O-NE 2.81Å; L123-R161 PolarHBondContact O-NH2 2.8Å
124	L	25.5	Very low	26.4	Very low	49 Å²	49	123 Å²	123	26%	0.257	71%	0.714	S	S	.	*			trans	-54.5	161.4	-177.1	-150.5	146.6	0	0	0	110.9	W105 E159 L160	W105-L124 HydrophobicContact CH2-CD2 4.31Å; W105-L124 HydrophobicContact CZ3-CD1 3.8Å; W105-L124 HydrophobicContact CZ3-CD2 3.92Å; L124-E159 VanDerWaalsContact C-CD 3.46Å; L124-E159 HydrophobicContact CB-CB 3.37Å; L124-E159 HydrophobicContact CB-CG 3.61Å; L124-E159 HydrophobicContact CD2-CG 4.32Å; L124-E159 WeakPolarHBondContact CD2-OE1 3.46Å; L124-E159 HydrophobicContact CG-CG 4.47Å; L124-E159 VanDerWaalsContact O-OE1 3.13Å; L124-L160 WeakPolarHBondContact CD1-O 3.4Å
125	V	22.7	Very low	26.4	Very low	102 Å²	102	119.1 Å²	119.1	62%	0.618	70%	0.698	S	S	*	*			trans	-153.2	139.1	174.8	179	0	0	0	0	110	L123 E159	L123-V125 HydrophobicContact CD2-CG2 4.26Å; V125-E159 PolarHBondContact N-OE1 3.38Å
126	R	25.9	Very low	26.2	Very low	212 Å²	212	122.8 Å²	122.8	80%	0.8	71%	0.71	S	S	*	*			trans	-85.2	135.6	169.3	-167.5	-177.4	-174	-158.4	2.1	111.6
127	R	23.5	Very low	26.2	Very low	127 Å²	127	125 Å²	125	48%	0.479	71%	0.706	S	S	.	*	S	Bend	trans	-88.7	121.7	178	-154.6	176.5	-171.2	-146.7	-8.1	110.3	E246	R127-E246 IonicContact CZ-OE2 2.8Å; R127-E246 IonicContact NH1-OE1 3.84Å; R127-E246 PolarHBondContact NH1-OE1 3.28Å; R127-E246 IonicContact NH1-OE2 3.96Å; R127-E246 PolarHBondContact NH1-OE2 2.92Å
128	G	28.4	Very low	26.1	Very low	71 Å²	71	127 Å²	127	73%	0.732	70%	0.704	S	S	*	*	S	Bend	trans	122.5	34.3	163.6	0	0	0	0	0	119.1
129	E	24.7	Very low	25.9	Very low	191 Å²	191	126.3 Å²	126.3	89%	0.893	69%	0.693	S	S	*	*			trans	-159.3	146.5	155.9	-120.3	168.3	-144.8	0	0	109.3
130	T	26.3	Very low	25.9	Very low	129 Å²	129	124 Å²	124	79%	0.791	69%	0.693	S	S	*	*			trans	-121.1	130.8	170.6	49.4	0	0	0	0	108.6
131	L	27.3	Very low	26.1	Very low	172 Å²	172	119.4 Å²	119.4	90%	0.901	67%	0.665	S	S	*	*			trans	175	165.9	146	-92.5	164.4	0	0	0	108.7
132	P	32.6	Very low	26.3	Very low	98 Å²	98	127 Å²	127	64%	0.636	68%	0.678	S	S	*	*			trans	-104.5	-173.4	-142.7	40.2	-38.5	0	0	0	115.6
133	V	24.8	Very low	26.7	Very low	129 Å²	129	128.8 Å²	128.8	78%	0.782	69%	0.689	S	S	*	*			trans	87.3	127.2	173.9	-169.6	0	0	0	0	114.7
134	P	27.9	Very low	27.2	Very low	131 Å²	131	128.8 Å²	128.8	85%	0.851	70%	0.703	S	S	*	*			trans	-82.8	129.3	177.7	32.7	-33.3	0	0	0	112.6
135	G	30.6	Very low	27.6	Very low	56 Å²	56	129 Å²	129	58%	0.577	70%	0.704	S	S	*	*			trans	176	150.1	170.6	0	0	0	0	0	111.2	R137	G135-R137 PolarHBondContact O-N 2.94Å
136	P	24.7	Very low	28.2	Very low	142 Å²	142	128.8 Å²	128.8	92%	0.922	70%	0.696	S	S	*	*			trans	-70.9	122.8	179.8	28.9	-33.2	0	0	0	110.5
137	R	26.1	Very low	28.7	Very low	234 Å²	234	121.8 Å²	121.8	88%	0.883	69%	0.69	S	S	*	*			trans	-108.8	140	172.8	-72.1	-169.6	176.4	-168	0.4	111.3	G135	G135-R137 PolarHBondContact O-N 2.94Å
138	V	25.8	Very low	29.4	Very low	112 Å²	112	120.5 Å²	120.5	68%	0.679	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-79.1	137.6	175.1	179.8	0	0	0	0	109
139	L	27.8	Very low	29.8	Very low	106 Å²	106	118.1 Å²	118.1	56%	0.555	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-99.7	117.8	172.6	-75.4	167.3	0	0	0	109.9
140	E	24.8	Very low	30.3	Very low	192 Å²	192	110.4 Å²	110.4	90%	0.897	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-80.7	145.1	167.8	-67.3	-173.5	151	0	0	110.9
141	T	27.4	Very low	30.5	Very low	41 Å²	41	110.2 Å²	110.2	25%	0.252	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-92.6	152.2	-172.9	49.1	0	0	0	0	112.6	L155	T141-L155 HydrophobicContact CG2-CD1 4.09Å
142	R	30.5	Very low	30.9	Very low	212 Å²	212	105.5 Å²	105.5	80%	0.8	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-62.1	150.5	170.8	-75.5	-177	175.3	178.8	-1.8	111	A144 L145	R142-A144 PolarHBondContact O-N 3.31Å; R142-L145 PolarHBondContact O-N 3.47Å
143	P	30.3	Very low	31	Very low	104 Å²	104	102.3 Å²	102.3	68%	0.675	61%	0.607	S	S	*	*	H	α-helix	trans	-56.2	-30.5	-174.4	18.8	-32.5	0	0	0	114.9	L145 Q146	P143-L145 PolarHBondContact O-N 3.19Å; P143-Q146 VanDerWaalsContact O-CB 3.22Å; P143-Q146 WeakPolarHBondContact O-CB 3.37Å; P143-Q146 PolarHBondContact O-N 3.05Å
144	A	33.8	Very low	31.3	Very low	94 Å²	94	106.7 Å²	106.7	78%	0.777	61%	0.61	S	S	*	*	H	α-helix	trans	-64.7	-18.9	177.5	0	0	0	0	0	114.9	R142	R142-A144 PolarHBondContact O-N 3.31Å
145	L	34.2	Very low	31.4	Very low	53 Å²	53	104.5 Å²	104.5	28%	0.277	59%	0.59	S	S	.	*	H	α-helix	trans	-97.2	-8.2	173.2	-81.2	166.2	0	0	0	112.8	R142 P143 L148 L149	R142-L145 PolarHBondContact O-N 3.47Å; P143-L145 PolarHBondContact O-N 3.19Å; L145-L148 PolarHBondContact O-N 3.12Å; L145-L149 HydrophobicContact CB-CD1 4.41Å; L145-L149 HydrophobicContact CD2-CD1 4.42Å; L145-L149 WeakPolarHBondContact O-CB 3.48Å; L145-L149 PolarHBondContact O-N 3.16Å; L145-L149 VanDerWaalsContact O-N 3.13Å
146	Q	35.1	Very low	31.2	Very low	98 Å²	98	106.6 Å²	106.6	46%	0.458	60%	0.602	S	S	.	*	H	α-helix	trans	-75.4	-33.8	-170.9	-154.3	166.6	11.2	0	0	112.1	P143 G150	P143-Q146 VanDerWaalsContact O-CB 3.22Å; P143-Q146 WeakPolarHBondContact O-CB 3.37Å; P143-Q146 PolarHBondContact O-N 3.05Å; Q146-G150 WeakPolarHBondContact O-CA 3.26Å; Q146-G150 PolarHBondContact O-N 2.81Å
147	G	36.3	Very low	31.3	Very low	66 Å²	66	103.8 Å²	103.8	68%	0.68	58%	0.582	S	S	*	*	H	α-helix	trans	-66.3	-38.9	170.4	0	0	0	0	0	113.2
148	L	37.5	Very low	31.3	Very low	100 Å²	100	98.1 Å²	98.1	52%	0.524	57%	0.574	S	S	.	*	H	α-helix	trans	-77.2	-26.5	-175.6	-130.8	163.4	0	0	0	113.3	L145	L145-L148 PolarHBondContact O-N 3.12Å
149	L	36.6	Very low	31.1	Very low	21 Å²	21	97.4 Å²	97.4	11%	0.11	56%	0.563	C	S	.	*	H	α-helix	trans	-116.9	-8.7	-173.1	-63	175.7	0	0	0	114.8	P50 L145 T153	P50-L149 HydrophobicContact CB-CD2 4.27Å; P50-L149 HydrophobicContact CG-CB 4.33Å; P50-L149 HydrophobicContact CG-CD2 3.99Å; P50-L149 VanDerWaalsContact CG-O 3.28Å; P50-L149 WeakPolarHBondContact CG-O 3.35Å; L145-L149 HydrophobicContact CB-CD1 4.41Å; L145-L149 HydrophobicContact CD2-CD1 4.42Å; L145-L149 WeakPolarHBondContact O-CB 3.48Å; L145-L149 PolarHBondContact O-N 3.16Å; L145-L149 VanDerWaalsContact O-N 3.13Å; L149-T153 HydrophobicContact CB-CG2 4.08Å; L149-T153 VanDerWaalsContact CB-OG1 3.31Å; L149-T153 WeakPolarHBondContact CB-OG1 3.48Å; L149-T153 PolarHBondContact O-OG1 3.45Å
150	G	35.4	Very low	30.9	Very low	28 Å²	28	99 Å²	99	29%	0.289	57%	0.571	S	S	.	*			trans	70.5	162.4	-177	0	0	0	0	0	114	Q146 G152 T153	Q146-G150 WeakPolarHBondContact O-CA 3.26Å; Q146-G150 PolarHBondContact O-N 2.81Å; G150-G152 PolarHBondContact O-N 2.92Å; G150-T153 PolarHBondContact O-OG1 2.82Å
151	P	31.9	Very low	30.9	Very low	125 Å²	125	96.1 Å²	96.1	81%	0.812	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	128.6	174	27.3	-33.2	0	0	0	111
152	G	34.6	Very low	30.8	Very low	73 Å²	73	98 Å²	98	75%	0.753	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	103.8	6.6	172.1	0	0	0	0	0	117	G150 R154	G150-G152 PolarHBondContact O-N 2.92Å; G152-R154 PolarHBondContact O-N 3.04Å
153	T	34.6	Very low	30.4	Very low	32 Å²	32	99.9 Å²	99.9	20%	0.196	59%	0.586	C	S	.	*	P	Polyproline II helix	trans	-64.9	128.1	178.1	-5.6	0	0	0	0	112.2	P50 L149 G150	P50-T153 HydrophobicContact CG-CG2 4.21Å; P50-T153 WeakPolarHBondContact O-CG2 3.4Å; L149-T153 HydrophobicContact CB-CG2 4.08Å; L149-T153 VanDerWaalsContact CB-OG1 3.31Å; L149-T153 WeakPolarHBondContact CB-OG1 3.48Å; L149-T153 PolarHBondContact O-OG1 3.45Å; G150-T153 PolarHBondContact O-OG1 2.82Å
154	R	30.9	Very low	30.2	Very low	221 Å²	221	100 Å²	100	83%	0.834	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-103.1	121.1	-179.1	-63.1	-179.8	-178.5	179.7	-0.4	111.1	G152	G152-R154 PolarHBondContact O-N 3.04Å
155	L	30	Very low	29.9	Very low	85 Å²	85	105.4 Å²	105.4	45%	0.445	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-93.7	127.4	171.9	-74.5	164.3	0	0	0	110.4	T141	T141-L155 HydrophobicContact CG2-CD1 4.09Å
156	A	27	Very low	29.6	Very low	99 Å²	99	111.1 Å²	111.1	82%	0.818	63%	0.626	S	S	*	*			trans	-108.6	128.5	170.8	0	0	0	0	0	109.7
157	V	26.8	Very low	29.1	Very low	84 Å²	84	112 Å²	112	51%	0.509	64%	0.642	S	S	.	*			trans	-129.5	131.4	-179.4	-179.1	0	0	0	0	108.4	W105	W105-V157 HydrophobicContact CH2-CG1 3.52Å; W105-V157 HydrophobicContact CZ2-CG1 3.74Å
158	T	25.6	Very low	28.9	Very low	115 Å²	115	115 Å²	115	71%	0.706	65%	0.649	S	S	*	*			trans	-133.7	158.1	178	51.8	0	0	0	0	111.4
159	E	21.8	Very low	28.5	Very low	96 Å²	96	119.7 Å²	119.7	45%	0.449	67%	0.668	S	S	.	*			trans	-119.7	124.2	-153	-73.1	-151.8	123	0	0	113.9	L124 V125	L124-E159 VanDerWaalsContact C-CD 3.46Å; L124-E159 HydrophobicContact CB-CB 3.37Å; L124-E159 HydrophobicContact CB-CG 3.61Å; L124-E159 HydrophobicContact CD2-CG 4.32Å; L124-E159 WeakPolarHBondContact CD2-OE1 3.46Å; L124-E159 HydrophobicContact CG-CG 4.47Å; L124-E159 VanDerWaalsContact O-OE1 3.13Å; V125-E159 PolarHBondContact N-OE1 3.38Å
160	L	24.7	Very low	28.1	Very low	139 Å²	139	124.4 Å²	124.4	73%	0.728	70%	0.703	S	S	*	*			trans	-133.5	140.8	176.2	-76.4	160	0	0	0	113	P122 L124	P122-L160 CarbonylContact O-C 3.5Å; L124-L160 WeakPolarHBondContact CD1-O 3.4Å
161	R	23.5	Very low	28	Very low	133 Å²	133	126.7 Å²	126.7	50%	0.502	73%	0.727	S	S	.	*			trans	-114.5	150.6	170.4	-80.1	174.9	-163.6	157.5	15.4	110.2	P122 L123	P122-R161 HydrophobicContact CB-CB 4.4Å; P122-R161 HydrophobicContact CG-CB 4Å; P122-R161 PolarHBondContact O-N 2.96Å; L123-R161 VanDerWaalsContact N-CG 3.29Å; L123-R161 WeakPolarHBondContact O-CD 3.44Å; L123-R161 WeakPolarHBondContact O-CG 3.44Å; L123-R161 PolarHBondContact O-NE 2.81Å; L123-R161 PolarHBondContact O-NH2 2.8Å
162	G	25.3	Very low	27.7	Very low	79 Å²	79	128.4 Å²	128.4	81%	0.814	73%	0.729	S	S	*	*			trans	-115	156.6	158	0	0	0	0	0	112.4
163	R	23.5	Very low	27.8	Very low	253 Å²	253	130.8 Å²	130.8	96%	0.955	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-94.4	144.4	167.4	-97.8	179.6	168.4	172	-4.7	109.6
164	A	26.1	Very low	27.7	Very low	105 Å²	105	134.3 Å²	134.3	87%	0.868	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-76	153.2	171.2	0	0	0	0	0	112.1
165	R	26.5	Very low	27.5	Very low	208 Å²	208	135.2 Å²	135.2	79%	0.785	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-82	156.6	178.6	-81.7	-177	173	165	-0.8	112.9
166	L	28.2	Very low	27.5	Very low	173 Å²	173	136.6 Å²	136.6	91%	0.906	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-75.3	159.2	169.5	-74.1	142.9	0	0	0	111.9
167	C	24.9	Very low	27.7	Very low	118 Å²	118	137.3 Å²	137.3	80%	0.797	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-75.7	161.1	164.6	-69	0	0	0	0	111.2
168	P	32.6	Very low	27.8	Very low	128 Å²	128	139 Å²	139	83%	0.831	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-74.7	162	-179.2	32.3	-36.2	0	0	0	113
169	E	28.3	Very low	27.9	Very low	199 Å²	199	138.8 Å²	138.8	93%	0.93	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-75.6	138.6	-174.3	-58.7	176.6	150.7	0	0	113
170	S	28.1	Very low	28.2	Very low	119 Å²	119	139.6 Å²	139.6	83%	0.832	80%	0.801	S	S	*	*			trans	-130	130.1	144.1	56	0	0	0	0	107.6
171	G	32.8	Very low	28.8	Very low	77 Å²	77	140.1 Å²	140.1	79%	0.794	81%	0.809	S	S	*	*			trans	-82.6	129	-172.1	0	0	0	0	0	112.2
172	D	26.9	Very low	29.1	Very low	161 Å²	161	139.6 Å²	139.6	86%	0.861	82%	0.821	S	S	*	*			trans	-156.1	121.3	148.1	-121	-20.6	0	0	0	110.9	S174	D172-S174 PolarHBondContact O-N 3.26Å
173	S	35.1	Very low	29.7	Very low	123 Å²	123	138.5 Å²	138.5	86%	0.86	80%	0.8	S	S	*	*			trans	-98.3	75.7	-168.5	47.4	0	0	0	0	112.9
174	S	32.3	Very low	30.4	Very low	105 Å²	105	130.8 Å²	130.8	73%	0.734	79%	0.785	S	S	*	*			trans	-167.4	61.4	167.2	50.4	0	0	0	0	115.9	D172	D172-S174 PolarHBondContact O-N 3.26Å
175	R	28.6	Very low	31.2	Very low	240 Å²	240	126.7 Å²	126.7	91%	0.906	75%	0.748	S	S	*	*			trans	-132.1	134.5	162.2	-72.8	-172.3	176.2	178.6	-0.1	111.9
176	P	29.6	Very low	31.6	Very low	115 Å²	115	120.6 Å²	120.6	75%	0.747	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-67.7	157.4	173.3	30.8	-34.8	0	0	0	110.3
177	P	31	Very low	32.2	Very low	114 Å²	114	117 Å²	117	74%	0.74	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-60.2	147	175.4	26.8	-35	0	0	0	110.7
178	P	29.4	Very low	32.9	Very low	118 Å²	118	116.2 Å²	116.2	77%	0.766	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-61.4	141.1	173.5	27.4	-34	0	0	0	109.9
179	P	27.1	Very low	33.8	Very low	111 Å²	111	112.3 Å²	112.3	72%	0.721	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-64.2	158.5	178.9	27.7	-34.8	0	0	0	111.4
180	P	28.5	Very low	35.2	Very low	114 Å²	114	105.2 Å²	105.2	74%	0.74	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-58.3	151	175.5	25.9	-35	0	0	0	111.4	V182	P180-V182 VanDerWaalsContact C-N 3.31Å; P180-V182 PolarHBondContact O-N 3.16Å
181	V	35.9	Very low	36.8	Very low	150 Å²	150	103 Å²	103	91%	0.909	66%	0.658	S	S	*	*			trans	-68.2	83.5	-173.9	-174.4	0	0	0	0	111.2
182	V	31.2	Very low	38.7	Very low	122 Å²	122	102.7 Å²	102.7	74%	0.739	63%	0.632	S	S	*	*			trans	-82.7	125.2	155.5	-176.5	0	0	0	0	106.5	P180 S184	P180-V182 VanDerWaalsContact C-N 3.31Å; P180-V182 PolarHBondContact O-N 3.16Å; V182-S184 PolarHBondContact O-N 3Å
183	S	37.3	Very low	41.2	Very low	55 Å²	55	102.1 Å²	102.1	39%	0.385	62%	0.618	S	S	.	*			trans	-63.8	135.6	-175.4	53.7	0	0	0	0	111.4	F185 A186	S183-F185 PolarHBondContact O-N 3.4Å; S183-A186 PolarHBondContact O-N 3.07Å
184	S	38.8	Very low	43.3	Very low	91 Å²	91	96.7 Å²	96.7	64%	0.636	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	12.7	168.5	56.3	0	0	0	0	113.3	V182	V182-S184 PolarHBondContact O-N 3Å
185	F	41.7	Very low	45.5	Very low	19 Å²	19	97.6 Å²	97.6	8%	0.083	57%	0.572	C	S	.	*	T	Hydrogen-bonded Turn	trans	-103.4	18	170.4	-124.3	-80.9	0	0	0	112.5	S183 V187 T190 R192 L215 R295	S183-F185 PolarHBondContact O-N 3.4Å; F185-V187 PolarHBondContact O-N 3.4Å; F185-T190 WeakPolarHBondContact CE1-OG1 3.43Å; F185-T190 WeakPolarHBondContact CZ-O 3.36Å; F185-R192 HydrophobicContact CE2-CG 4.14Å; F185-R192 VanDerWaalsContact CE2-NE 3.25Å; F185-R192 HydrophobicContact CZ-CG 4.34Å; F185-L215 WeakPolarHBondContact CD2-O 3.48Å; F185-L215 WeakPolarHBondContact CE2-O 3.11Å; F185-R295 HydrophobicContact CE1-CB 4.37Å
186	A	34.8	Very low	47.6	Very low	81 Å²	81	86.4 Å²	86.4	67%	0.669	53%	0.532	S	S	*	.			trans	-70.9	-1.3	172.1	0	0	0	0	0	114.1	S183	S183-A186 PolarHBondContact O-N 3.07Å
187	V	40.6	Very low	49.7	Very low	96 Å²	96	82.8 Å²	82.8	58%	0.582	51%	0.507	S	S	*	.	S	Bend	trans	-102	113	173.6	-175.3	0	0	0	0	109.5	F185 T190	F185-V187 PolarHBondContact O-N 3.4Å; V187-T190 HydrophobicContact CB-CG2 4.2Å; V187-T190 HydrophobicContact CG1-CG2 4.19Å; V187-T190 PolarHBondContact O-OG1 3.45Å
188	S	40.8	Very low	51.6	Low	103 Å²	103	78.8 Å²	78.8	72%	0.72	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	136.5	175.2	-172.7	0	0	0	0	111.6
189	G	51.2	Low	53.1	Low	45 Å²	45	73.9 Å²	73.9	46%	0.464	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	6.7	170.8	0	0	0	0	0	117.6	V191	G189-V191 PolarHBondContact O-N 3.26Å
190	T	56.5	Low	54.7	Low	51 Å²	51	70.2 Å²	70.2	31%	0.313	43%	0.432	S	S	.	.			trans	-71.4	101.7	177.4	50.9	0	0	0	0	112.6	F185 V187 R192	F185-T190 WeakPolarHBondContact CE1-OG1 3.43Å; F185-T190 WeakPolarHBondContact CZ-O 3.36Å; V187-T190 HydrophobicContact CB-CG2 4.2Å; V187-T190 HydrophobicContact CG1-CG2 4.19Å; V187-T190 PolarHBondContact O-OG1 3.45Å; T190-R192 PolarHBondContact O-N 3.26Å
191	V	63	Low	56	Low	73 Å²	73	70 Å²	70	44%	0.442	43%	0.429	S	S	.	.			trans	-71.6	124.4	170.7	-179.8	0	0	0	0	109.4	G189 R292	G189-V191 PolarHBondContact O-N 3.26Å; V191-R292 HydrophobicContact CG1-CB 3.74Å; V191-R292 HydrophobicContact CG1-CG 3.98Å
192	R	72.5	Confident	57.3	Low	69 Å²	69	64.5 Å²	64.5	26%	0.26	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	159.1	173.2	-63.9	-161	-176.9	-169.7	13.2	111.2	F185 T190 G214 L215 R292 I293	F185-R192 HydrophobicContact CE2-CG 4.14Å; F185-R192 VanDerWaalsContact CE2-NE 3.25Å; F185-R192 HydrophobicContact CZ-CG 4.34Å; T190-R192 PolarHBondContact O-N 3.26Å; R192-G214 PolarHBondContact NH1-O 3.29Å; R192-L215 HydrophobicContact CB-CD2 4.11Å; R192-R292 CarbonylContact O-C 3.45Å; R192-R292 WeakPolarHBondContact O-CA 3.38Å; R192-I293 PolarHBondContact N-O 3.16Å; R192-I293 PolarHBondContact O-N 2.68Å
193	R	79.4	Confident	58.9	Low	149 Å²	149	61.5 Å²	61.5	56%	0.562	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	136.9	-179.4	-52.3	-162.8	-166.1	177.5	7.6	110.5	E290 L291	R193-E290 HydrophobicContact CB-CG 3.86Å; R193-E290 WeakPolarHBondContact CB-OE1 3.36Å; R193-E290 WeakPolarHBondContact CD-OE1 3.48Å; R193-E290 WeakPolarHBondContact CD-OE2 3.21Å; R193-E290 HydrophobicContact CG-CG 4.46Å; R193-E290 IonicContact CZ-OE2 3.75Å; R193-E290 IonicContact NE-OE2 3.06Å; R193-E290 IonicContact NH1-OE1 2.67Å; R193-E290 IonicContact NH1-OE2 2.65Å; R193-E290 PolarHBondContact NH1-OE2 3.21Å; R193-L291 CarbonylContact C-O 3.57Å; R193-L291 VanDerWaalsContact CA-O 3.27Å; R193-L291 WeakPolarHBondContact CA-O 3.49Å
194	L	78.9	Confident	60.8	Low	10 Å²	10	59.3 Å²	59.3	5%	0.052	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	154.1	171.9	-65.4	-178.2	0	0	0	109.3	V207 L215 G269 A271 E290 L291 I293	L194-V207 HydrophobicContact CD1-CG1 4.13Å; L194-L215 HydrophobicContact CD1-CD1 3.81Å; L194-L215 HydrophobicContact CD2-CD1 4.37Å; L194-L215 HydrophobicContact CD2-CD2 4.22Å; L194-G269 WeakPolarHBondContact CA-O 3.47Å; L194-G269 WeakPolarHBondContact CB-O 3.35Å; L194-G269 WeakPolarHBondContact CD2-O 3.41Å; L194-A271 HydrophobicContact CB-CB 4.17Å; L194-A271 HydrophobicContact CD1-CB 3.84Å; L194-E290 CarbonylContact O-C 3.56Å; L194-E290 WeakPolarHBondContact O-CA 3.42Å; L194-L291 PolarHBondContact N-O 2.76Å; L194-L291 PolarHBondContact O-N 3.37Å; L194-I293 HydrophobicContact CB-CD1 4.16Å; L194-I293 HydrophobicContact CD1-CD1 3.31Å; L194-I293 HydrophobicContact CG-CD1 3.8Å
195	Q	79.2	Confident	62.8	Low	124 Å²	124	55 Å²	55	58%	0.579	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	120.8	170.9	-169.4	171.4	7.1	0	0	109.6	G269 L270 A271	Q195-G269 PolarHBondContact N-O 3.14Å; Q195-L270 HydrophobicContact CB-CD2 4.3Å; Q195-L270 HydrophobicContact CG-CD2 4.39Å; Q195-L270 WeakPolarHBondContact O-CA 3.47Å; Q195-A271 PolarHBondContact O-N 2.97Å
196	G	73.2	Confident	64.7	Low	5 Å²	5	54.1 Å²	54.1	5%	0.052	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	139	175.6	0	0	0	0	0	112.1	A271 G289	G196-A271 WeakPolarHBondContact CA-O 3.31Å; G196-G289 PolarHBondContact N-O 3.42Å
197	V	72.6	Confident	66.8	Low	38 Å²	38	50.3 Å²	50.3	23%	0.23	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	141.4	167.4	167.2	0	0	0	0	108.1	G199 L255 L270 A271 L272 V273	V197-G199 PolarHBondContact O-N 2.81Å; V197-L255 HydrophobicContact CG1-CD1 4Å; V197-L255 HydrophobicContact CG1-CD2 3.95Å; V197-L270 HydrophobicContact CB-CD2 4.19Å; V197-L270 HydrophobicContact CG2-CD2 3.4Å; V197-A271 PolarHBondContact N-O 2.94Å; V197-L272 HydrophobicContact CG1-CD2 4.37Å; V197-L272 CarbonylContact O-C 3.49Å; V197-L272 WeakPolarHBondContact O-CA 2.94Å; V197-V273 PolarHBondContact O-N 2.78Å
198	L	70.4	Confident	68.6	Low	30 Å²	30	46.2 Å²	46.2	16%	0.157	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	126.7	176.7	-78.5	-172.5	0	0	0	111.7	V273 A275 A278 P285 V288 L433	L198-V273 WeakPolarHBondContact CA-O 3.47Å; L198-A275 HydrophobicContact CD2-CB 4.44Å; L198-A278 HydrophobicContact CD2-CB 3.54Å; L198-P285 HydrophobicContact CD1-CB 3.86Å; L198-P285 WeakPolarHBondContact CD1-O 3.5Å; L198-P285 WeakPolarHBondContact CG-O 3.34Å; L198-V288 HydrophobicContact CD2-CG2 3.99Å; L198-V288 HydrophobicContact CG-CG2 3.9Å; L198-L433 HydrophobicContact CD1-CD1 3.89Å
199	G	62.1	Low	70	Confident	15 Å²	15	47.7 Å²	47.7	16%	0.155	27%	0.268	C	S	.	.			trans	168.8	155.9	176.1	0	0	0	0	0	112.6	V197 L272 V273	V197-G199 PolarHBondContact O-N 2.81Å; G199-L272 CarbonylContact O-C 3.6Å; G199-L272 VanDerWaalsContact O-C 3.23Å; G199-L272 WeakPolarHBondContact O-CB 3.49Å; G199-V273 PolarHBondContact N-O 2.93Å; G199-V273 CarbonylContact O-C 3.47Å; G199-V273 PolarHBondContact O-N 2.96Å; G199-V273 VanDerWaalsContact O-N 3.14Å
200	G	59.7	Low	70.8	Confident	34 Å²	34	48.1 Å²	48.1	35%	0.351	26%	0.264	S	S	.	.			trans	107.4	180	-175.7	0	0	0	0	0	113
201	T	56.2	Low	71.5	Confident	110 Å²	110	46.1 Å²	46.1	68%	0.675	25%	0.252	S	S	*	.	S	Bend	trans	-144.3	128.4	-173.2	52.7	0	0	0	0	110.4
202	G	64	Low	72.1	Confident	35 Å²	35	43.5 Å²	43.5	36%	0.361	24%	0.235	S	C	.	.	S	Bend	trans	83.2	-150.9	-175.4	0	0	0	0	0	112.2	P274	G202-P274 WeakPolarHBondContact O-CB 3.35Å; G202-P274 WeakPolarHBondContact O-CG 3.2Å
203	D	64.9	Low	72	Confident	58 Å²	58	50.1 Å²	50.1	31%	0.31	26%	0.26	S	S	.	.	S	Bend	trans	-105.3	24.5	-164.3	-41.1	-54.2	0	0	0	112.2	R349	D203-R349 IonicContact OD2-CZ 2.78Å; D203-R349 IonicContact OD2-NH1 2.65Å; D203-R349 PolarHBondContact OD2-NH1 2.74Å
204	S	77.3	Confident	71.5	Confident	9 Å²	9	45.1 Å²	45.1	6%	0.063	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	134.6	-173.7	55.5	0	0	0	0	113.7	R241 P274	S204-R241 CarbonylContact C-O 3.53Å; S204-R241 WeakPolarHBondContact CA-O 3.45Å; S204-R241 VanDerWaalsContact CB-O 3.25Å; S204-R241 WeakPolarHBondContact CB-O 3.41Å; S204-P274 WeakPolarHBondContact O-CD 3.35Å; S204-P274 WeakPolarHBondContact O-CG 3.28Å
205	L	80.4	Confident	71.1	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	118.4	173.8	-172	75.2	0	0	0	109.6	V207 V225 A240 R241 V242 Q243 A271 V273 I293	L205-V207 HydrophobicContact CD2-CG1 4.46Å; L205-V225 HydrophobicContact CD2-CG2 4.48Å; L205-A240 HydrophobicContact CB-CB 4.42Å; L205-R241 PolarHBondContact N-O 2.74Å; L205-V242 HydrophobicContact CD2-CG2 4.42Å; L205-Q243 PolarHBondContact O-N 3.14Å; L205-A271 HydrophobicContact CD1-CB 4.04Å; L205-A271 HydrophobicContact CD2-CB 4.39Å; L205-A271 HydrophobicContact CG-CB 4.27Å; L205-V273 HydrophobicContact CD1-CG2 3.84Å; L205-I293 HydrophobicContact CD2-CD1 3.69Å; L205-I293 HydrophobicContact CD2-CG1 4.45Å
206	G	80.8	Confident	70.5	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	128.5	177.5	0	0	0	0	0	112.7	Q243 A271 L272	G206-Q243 WeakPolarHBondContact CA-O 3.27Å; G206-A271 CarbonylContact O-C 3.58Å; G206-A271 WeakPolarHBondContact O-CA 3.48Å; G206-L272 PolarHBondContact N-O 3.33Å; G206-L272 PolarHBondContact O-N 2.99Å
207	V	79.2	Confident	70.4	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	155.5	175.6	-68.2	0	0	0	0	111.7	L194 L205 C211 L212 V242 Q243 V244 L245 A271	L194-V207 HydrophobicContact CD1-CG1 4.13Å; L205-V207 HydrophobicContact CD2-CG1 4.46Å; V207-C211 HydrophobicContact CB-CB 4.47Å; V207-L212 HydrophobicContact CG2-CB 3.91Å; V207-L212 HydrophobicContact CG2-CD1 4.05Å; V207-V242 HydrophobicContact CG1-CG1 4.44Å; V207-V242 HydrophobicContact CG2-CG1 3.46Å; V207-V242 VanDerWaalsContact CG2-CG1 3.46Å; V207-Q243 PolarHBondContact N-O 3.47Å; V207-V244 WeakPolarHBondContact O-CA 3.33Å; V207-L245 PolarHBondContact O-N 3.22Å; V207-A271 HydrophobicContact CG1-CB 4.12Å
208	S	77.5	Confident	70.4	Confident	10 Å²	10	44.9 Å²	44.9	7%	0.07	25%	0.254	C	S	.	.			trans	-67.2	156.8	173.7	79.6	0	0	0	0	111.5	S210 C211 L212 D268	S208-S210 VanDerWaalsContact C-N 3.26Å; S208-S210 PolarHBondContact O-N 3.44Å; S208-S210 PolarHBondContact OG-OG 2.92Å; S208-S210 VanDerWaalsContact OG-OG 3.13Å; S208-C211 PolarHBondContact O-N 3.43Å; S208-C211 WeakPolarHBondContact OG-CB 3.32Å; S208-C211 PolarHBondContact OG-N 2.79Å; S208-L212 WeakPolarHBondContact O-CB 3.19Å; S208-L212 PolarHBondContact O-N 3.06Å; S208-D268 PolarHBondContact OG-OD1 3.41Å
209	R	71	Confident	70.6	Confident	133 Å²	133	49 Å²	49	50%	0.502	27%	0.272	S	S	.	.	H	α-helix	trans	-61.2	-35.3	178.4	-70.5	-178.7	-175.5	-143	6.1	112.4	R213 V244 E246	R209-R213 VanDerWaalsContact O-CG 3.32Å; R209-R213 WeakPolarHBondContact O-CG 3.48Å; R209-R213 PolarHBondContact O-N 3.17Å; R209-V244 HydrophobicContact CG-CG1 3.38Å; R209-E246 IonicContact CZ-OE1 3.83Å; R209-E246 IonicContact NE-OE1 2.62Å; R209-E246 PolarHBondContact NE-OE1 3.15Å; R209-E246 IonicContact NH2-OE1 3.19Å; R209-E246 PolarHBondContact NH2-OE1 2.68Å; R209-E246 IonicContact NH2-OE2 2.67Å
210	S	67.9	Low	71.1	Confident	55 Å²	55	48.4 Å²	48.4	39%	0.385	27%	0.267	S	S	.	.	H	α-helix	trans	-74.2	-45.5	177.5	36.8	0	0	0	0	111.1	S208 L212 R213 G214 D268	S208-S210 VanDerWaalsContact C-N 3.26Å; S208-S210 PolarHBondContact O-N 3.44Å; S208-S210 PolarHBondContact OG-OG 2.92Å; S208-S210 VanDerWaalsContact OG-OG 3.13Å; S210-L212 PolarHBondContact O-N 3.29Å; S210-R213 PolarHBondContact O-N 3.31Å; S210-G214 PolarHBondContact O-N 3.32Å; S210-D268 WeakPolarHBondContact CB-OD1 3.44Å; S210-D268 PolarHBondContact OG-OD1 3.11Å
211	C	72.4	Confident	72	Confident	9 Å²	9	47.1 Å²	47.1	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-56.2	-49.1	172.4	-176.3	0	0	0	0	111.7	V207 S208 R213 G214 L215 D268	V207-C211 HydrophobicContact CB-CB 4.47Å; S208-C211 PolarHBondContact O-N 3.43Å; S208-C211 WeakPolarHBondContact OG-CB 3.32Å; S208-C211 PolarHBondContact OG-N 2.79Å; C211-R213 VanDerWaalsContact C-N 3.32Å; C211-R213 PolarHBondContact O-N 2.6Å; C211-G214 PolarHBondContact O-N 3.35Å; C211-G214 VanDerWaalsContact O-N 3.12Å; C211-L215 WeakPolarHBondContact O-CB 3.33Å; C211-L215 VanDerWaalsContact O-CG 3.24Å; C211-L215 WeakPolarHBondContact O-CG 3.36Å; C211-L215 PolarHBondContact O-N 3.29Å; C211-D268 PolarHBondContact N-OD1 3.25Å
212	L	74.3	Confident	73.1	Confident	17 Å²	17	44 Å²	44	9%	0.089	23%	0.227	C	C	.	.	H	α-helix	trans	-58.2	-40.4	177.1	-178.6	137	0	0	0	113	V207 S208 S210 G216 L217 V242 V244	V207-L212 HydrophobicContact CG2-CB 3.91Å; V207-L212 HydrophobicContact CG2-CD1 4.05Å; S208-L212 WeakPolarHBondContact O-CB 3.19Å; S208-L212 PolarHBondContact O-N 3.06Å; S210-L212 PolarHBondContact O-N 3.29Å; L212-G216 PolarHBondContact O-N 3Å; L212-G216 VanDerWaalsContact O-N 3.11Å; L212-L217 WeakPolarHBondContact CD2-O 3.44Å; L212-L217 WeakPolarHBondContact CG-O 3.34Å; L212-L217 PolarHBondContact O-N 2.95Å; L212-V242 HydrophobicContact CD1-CG1 4.09Å; L212-V244 HydrophobicContact CD1-CG2 3.87Å
213	R	71.2	Confident	74	Confident	208 Å²	208	42.3 Å²	42.3	79%	0.785	21%	0.21	S	C	*	.	H	α-helix	trans	-67.9	-42.6	174.1	-74.5	172.3	175	-171.1	-2.7	112.3	R209 S210 C211 L215 G216	R209-R213 VanDerWaalsContact O-CG 3.32Å; R209-R213 WeakPolarHBondContact O-CG 3.48Å; R209-R213 PolarHBondContact O-N 3.17Å; S210-R213 PolarHBondContact O-N 3.31Å; C211-R213 VanDerWaalsContact C-N 3.32Å; C211-R213 PolarHBondContact O-N 2.6Å; R213-L215 VanDerWaalsContact C-N 3.3Å; R213-L215 PolarHBondContact O-N 3.06Å; R213-G216 PolarHBondContact O-N 2.6Å
214	G	67.6	Low	74.8	Confident	45 Å²	45	41.8 Å²	41.8	46%	0.464	20%	0.204	S	C	.	.	H	α-helix	trans	-61.2	-40.6	175.8	0	0	0	0	0	111.9	R192 S210 C211 G216	R192-G214 PolarHBondContact NH1-O 3.29Å; S210-G214 PolarHBondContact O-N 3.32Å; C211-G214 PolarHBondContact O-N 3.35Å; C211-G214 VanDerWaalsContact O-N 3.12Å; G214-G216 VanDerWaalsContact C-N 3.25Å; G214-G216 PolarHBondContact O-N 3.11Å
215	L	70.9	Confident	75.1	Confident	10 Å²	10	41.4 Å²	41.4	5%	0.052	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-12.7	172.4	-67.6	170.4	0	0	0	113.8	F185 R192 L194 C211 R213 L217	F185-L215 WeakPolarHBondContact CD2-O 3.48Å; F185-L215 WeakPolarHBondContact CE2-O 3.11Å; R192-L215 HydrophobicContact CB-CD2 4.11Å; L194-L215 HydrophobicContact CD1-CD1 3.81Å; L194-L215 HydrophobicContact CD2-CD1 4.37Å; L194-L215 HydrophobicContact CD2-CD2 4.22Å; C211-L215 WeakPolarHBondContact O-CB 3.33Å; C211-L215 VanDerWaalsContact O-CG 3.24Å; C211-L215 WeakPolarHBondContact O-CG 3.36Å; C211-L215 PolarHBondContact O-N 3.29Å; R213-L215 VanDerWaalsContact C-N 3.3Å; R213-L215 PolarHBondContact O-N 3.06Å; L215-L217 HydrophobicContact CB-CD1 4.12Å; L215-L217 HydrophobicContact CB-CG 4.13Å; L215-L217 HydrophobicContact CD1-CD1 4.33Å; L215-L217 PolarHBondContact O-N 2.62Å
216	G	66.7	Low	75.2	Confident	19 Å²	19	42.2 Å²	42.2	20%	0.196	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	22.1	-179.8	0	0	0	0	0	114.9	L212 R213 G214	L212-G216 PolarHBondContact O-N 3Å; L212-G216 VanDerWaalsContact O-N 3.11Å; R213-G216 PolarHBondContact O-N 2.6Å; G214-G216 VanDerWaalsContact C-N 3.25Å; G214-G216 PolarHBondContact O-N 3.11Å
217	L	71.8	Confident	75.1	Confident	8 Å²	8	44.7 Å²	44.7	4%	0.042	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-96.7	157.8	179.1	-63.5	172.9	0	0	0	111.1	L212 L215 E221 V223 V242 R295	L212-L217 WeakPolarHBondContact CD2-O 3.44Å; L212-L217 WeakPolarHBondContact CG-O 3.34Å; L212-L217 PolarHBondContact O-N 2.95Å; L215-L217 HydrophobicContact CB-CD1 4.12Å; L215-L217 HydrophobicContact CB-CG 4.13Å; L215-L217 HydrophobicContact CD1-CD1 4.33Å; L215-L217 PolarHBondContact O-N 2.62Å; L217-E221 VanDerWaalsContact CA-OE2 3.27Å; L217-E221 WeakPolarHBondContact CA-OE2 3.47Å; L217-E221 WeakPolarHBondContact CD2-OE2 3.16Å; L217-V223 HydrophobicContact CD1-CG2 3.91Å; L217-V223 HydrophobicContact CD2-CG2 4.34Å; L217-V242 HydrophobicContact CD1-CG2 4.25Å; L217-R295 HydrophobicContact CD2-CG 4.45Å
218	F	71.4	Confident	74.5	Confident	134 Å²	134	45.5 Å²	45.5	59%	0.588	22%	0.224	S	C	*	.	P	Polyproline II helix	trans	-96.2	155.5	171.7	-64.7	-73.5	0	0	0	112.1	G220 E221 L312	F218-G220 PolarHBondContact O-N 3.06Å; F218-E221 HydrophobicContact CB-CG 4Å; F218-E221 PolarHBondContact N-OE2 3.18Å; F218-E221 PolarHBondContact O-N 3.49Å; F218-L312 HydrophobicContact CD2-CD2 4.42Å
219	Q	75.9	Confident	73.4	Confident	116 Å²	116	48.3 Å²	48.3	54%	0.542	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	120	177	-179.8	176.4	-13.7	0	0	110.1	V244	Q219-V244 HydrophobicContact CG-CG2 4.41Å
220	G	71.9	Confident	72.4	Confident	4 Å²	4	46.3 Å²	46.3	4%	0.041	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.2	10.7	179	0	0	0	0	0	115	F218 R241 V242	F218-G220 PolarHBondContact O-N 3.06Å; G220-R241 VanDerWaalsContact CA-NE 3.34Å; G220-R241 WeakPolarHBondContact O-CG 3.14Å; G220-R241 PolarHBondContact O-NE 3.05Å; G220-V242 VanDerWaalsContact CA-O 3.24Å; G220-V242 WeakPolarHBondContact CA-O 3.44Å; G220-V242 PolarHBondContact N-O 2.96Å
221	E	78.6	Confident	71.1	Confident	6 Å²	6	47.7 Å²	47.7	3%	0.028	26%	0.26	C	S	.	.			trans	-69.5	155.1	171.6	-86.5	-172.3	141.9	0	0	113.8	L217 F218 R241 V242 R295 L312	L217-E221 VanDerWaalsContact CA-OE2 3.27Å; L217-E221 WeakPolarHBondContact CA-OE2 3.47Å; L217-E221 WeakPolarHBondContact CD2-OE2 3.16Å; F218-E221 HydrophobicContact CB-CG 4Å; F218-E221 PolarHBondContact N-OE2 3.18Å; F218-E221 PolarHBondContact O-N 3.49Å; E221-R241 WeakPolarHBondContact O-CA 3.42Å; E221-V242 PolarHBondContact O-N 2.99Å; E221-R295 IonicContact OE1-CZ 3.91Å; E221-R295 IonicContact OE1-NE 3.87Å; E221-R295 IonicContact OE1-NH2 3.26Å; E221-R295 PolarHBondContact OE1-NH2 3.37Å; E221-L312 HydrophobicContact CG-CD1 4.27Å; E221-L312 HydrophobicContact CG-CD2 3.76Å
222	W	80.7	Confident	69.6	Low	45 Å²	45	52.6 Å²	52.6	17%	0.17	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135.5	176.9	-63.4	108.7	0	0	0	111.8	L239 R241 Y296 P315 V350 L401	W222-L239 HydrophobicContact CB-CD1 4.23Å; W222-L239 HydrophobicContact CE3-CD2 4.37Å; W222-L239 HydrophobicContact CE3-CG 4.16Å; W222-R241 HydrophobicContact CE3-CB 3.89Å; W222-R241 HydrophobicContact CE3-CG 4.42Å; W222-R241 HydrophobicContact CH2-CB 4.16Å; W222-R241 HydrophobicContact CZ3-CB 3.65Å; W222-R241 HydrophobicContact CZ3-CG 4.37Å; W222-Y296 HydrophobicContact CB-CD1 4.43Å; W222-Y296 HydrophobicContact CB-CG 4.16Å; W222-Y296 VanDerWaalsContact O-CB 3.26Å; W222-Y296 WeakPolarHBondContact O-CB 3.35Å; W222-Y296 PolarHBondContact O-N 3.2Å; W222-P315 HydrophobicContact CD2-CG 4.35Å; W222-P315 HydrophobicContact CZ2-CG 4.43Å; W222-V350 HydrophobicContact CE3-CG2 4.22Å; W222-V350 HydrophobicContact CH2-CG2 3.58Å; W222-V350 HydrophobicContact CZ3-CG2 3.28Å; W222-L401 HydrophobicContact CH2-CD2 4Å; W222-L401 HydrophobicContact CZ2-CD2 4.14Å
223	V	80.9	Confident	67.9	Low	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	134.2	-172.5	166.2	0	0	0	0	109.9	L217 V225 A240 V242 I293 Q294	L217-V223 HydrophobicContact CD1-CG2 3.91Å; L217-V223 HydrophobicContact CD2-CG2 4.34Å; V223-V225 HydrophobicContact CG1-CG2 4.14Å; V223-A240 PolarHBondContact N-O 2.83Å; V223-A240 PolarHBondContact O-N 2.92Å; V223-V242 HydrophobicContact CB-CG2 3.89Å; V223-V242 HydrophobicContact CG2-CG2 3.53Å; V223-I293 HydrophobicContact CG1-CB 4.15Å; V223-I293 HydrophobicContact CG1-CG1 4.04Å; V223-I293 HydrophobicContact CG1-CG2 3.65Å; V223-Q294 CarbonylContact C-O 3.56Å; V223-Q294 WeakPolarHBondContact CA-O 3.33Å; V223-Q294 WeakPolarHBondContact CG1-O 3.36Å
224	W	83.1	Confident	66.8	Low	47 Å²	47	53 Å²	53	18%	0.178	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	123.8	165.3	-67.5	114.1	0	0	0	110.1	P237 H238 L239 I293 Q294 Y296 A397 A399	W224-P237 HydrophobicContact CE3-CB 4.09Å; W224-H238 WeakPolarHBondContact CA-O 3.22Å; W224-L239 HydrophobicContact CD2-CD1 4.03Å; W224-L239 HydrophobicContact CE3-CB 4.03Å; W224-L239 HydrophobicContact CE3-CD1 4.19Å; W224-L239 HydrophobicContact CH2-CB 4.24Å; W224-L239 HydrophobicContact CZ2-CD1 4.4Å; W224-L239 HydrophobicContact CZ3-CB 3.78Å; W224-L239 HydrophobicContact CZ3-CD1 4.45Å; W224-I293 WeakPolarHBondContact O-CA 3.38Å; W224-Q294 HydrophobicContact CB-CB 4.37Å; W224-Q294 PolarHBondContact N-O 2.88Å; W224-Q294 PolarHBondContact O-N 3.25Å; W224-Y296 AromaticContact CE2-CD2 3.79Å; W224-Y296 AromaticContact CZ2-CD2 3.96Å; W224-Y296 HydrophobicContact CZ2-CD2 3.96Å; W224-Y296 AromaticContact CZ2-CE2 3.88Å; W224-Y296 HydrophobicContact CZ2-CE2 3.88Å; W224-Y296 AromaticContact NE1-CD2 3.5Å; W224-A397 WeakPolarHBondContact CH2-O 2.75Å; W224-A399 HydrophobicContact CH2-CB 3.77Å; W224-A399 HydrophobicContact CZ3-CB 4.23Å
225	V	83.1	Confident	66.3	Low	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	134.4	177.2	-172.2	0	0	0	0	108.9	L205 V223 P237 H238 A240 L281 L291 R292 I293	L205-V225 HydrophobicContact CD2-CG2 4.48Å; V223-V225 HydrophobicContact CG1-CG2 4.14Å; V225-P237 WeakPolarHBondContact O-CA 3.29Å; V225-H238 PolarHBondContact N-O 3.39Å; V225-H238 PolarHBondContact O-N 3.45Å; V225-A240 HydrophobicContact CG2-CB 3.75Å; V225-L281 HydrophobicContact CB-CD2 4.46Å; V225-L281 HydrophobicContact CG1-CD1 3.78Å; V225-L281 HydrophobicContact CG1-CD2 4.32Å; V225-L281 VanDerWaalsContact O-CD2 3.3Å; V225-L281 WeakPolarHBondContact O-CD2 3.47Å; V225-L291 HydrophobicContact CG1-CB 4.33Å; V225-L291 HydrophobicContact CG1-CD1 4.22Å; V225-L291 HydrophobicContact CG1-CD2 4.3Å; V225-R292 CarbonylContact C-O 3.57Å; V225-R292 WeakPolarHBondContact CA-O 3.39Å; V225-I293 HydrophobicContact CG2-CG1 4.32Å
226	A	82.4	Confident	66.1	Low	18 Å²	18	59.3 Å²	59.3	15%	0.149	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	151.7	174.7	0	0	0	0	0	111	P237 R292	A226-P237 HydrophobicContact CB-CB 4.39Å; A226-R292 PolarHBondContact N-O 3.2Å; A226-R292 PolarHBondContact O-N 3.16Å
227	R	78.6	Confident	66.6	Low	53 Å²	53	60.9 Å²	60.9	20%	0.2	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	136.6	175.8	-167.9	176	-178.4	177.8	-0.5	110.7	G282 D284	R227-G282 PolarHBondContact NH1-O 3.41Å; R227-D284 IonicContact NH2-OD2 3.21Å
228	A	65.7	Low	66.9	Low	19 Å²	19	61.3 Å²	61.3	16%	0.157	34%	0.337	C	S	.	.	S	Bend	trans	-89.1	119.3	171.3	0	0	0	0	0	110.1	E290 R292	A228-E290 HydrophobicContact CB-CB 4.05Å; A228-E290 HydrophobicContact CB-CG 4.2Å; A228-E290 WeakPolarHBondContact CB-O 3.45Å; A228-E290 PolarHBondContact N-O 3.01Å; A228-R292 HydrophobicContact CB-CG 3.95Å
229	G	55.1	Low	67.5	Low	68 Å²	68	55.1 Å²	55.1	70%	0.701	31%	0.31	S	S	*	.	S	Bend	trans	144.2	-27	167.8	0	0	0	0	0	115.4
230	E	49.6	Very low	67.8	Low	91 Å²	91	49.6 Å²	49.6	43%	0.425	28%	0.284	S	S	.	.	S	Bend	trans	-88.8	161.6	179.4	-66.3	-172.8	-176.6	0	0	113.1	T234	E230-T234 WeakPolarHBondContact OE2-CB 3.44Å; E230-T234 PolarHBondContact OE2-OG1 3.25Å
231	S	40.4	Very low	68.3	Low	85 Å²	85	54.6 Å²	54.6	59%	0.594	30%	0.302	S	S	*	.			trans	-65.6	151.4	171.3	56.5	0	0	0	0	110.6	N233 T234	S231-N233 PolarHBondContact O-N 2.85Å; S231-T234 PolarHBondContact O-N 3.24Å; S231-T234 PolarHBondContact O-OG1 2.88Å
232	S	41.9	Very low	68.2	Low	111 Å²	111	54.4 Å²	54.4	78%	0.776	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-0.4	-168.6	53.7	0	0	0	0	117.1
233	N	39.4	Very low	68.2	Low	146 Å²	146	55.3 Å²	55.3	78%	0.781	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-11.9	-170.1	-64.2	7.3	0	0	0	113.8	S231	S231-N233 PolarHBondContact O-N 2.85Å
234	T	47.7	Very low	67.7	Low	87 Å²	87	56.2 Å²	56.2	53%	0.534	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-49	-177.8	49.8	0	0	0	0	113.3	E230 S231 R236	E230-T234 WeakPolarHBondContact OE2-CB 3.44Å; E230-T234 PolarHBondContact OE2-OG1 3.25Å; S231-T234 PolarHBondContact O-N 3.24Å; S231-T234 PolarHBondContact O-OG1 2.88Å; T234-R236 PolarHBondContact O-N 3.27Å
235	S	56.2	Low	66.8	Low	27 Å²	27	56.2 Å²	56.2	19%	0.189	32%	0.316	C	S	.	.			trans	-85.1	102.4	-176.8	67	0	0	0	0	112.3
236	R	67.5	Low	65.3	Low	162 Å²	162	60.5 Å²	60.5	61%	0.611	34%	0.336	S	S	*	.			trans	-69.2	136.7	170.4	-67.6	-178	177	-170.6	-4.6	110.6	T234 H238 E353	T234-R236 PolarHBondContact O-N 3.27Å; R236-H238 PolarHBondContact O-CE1 2.89Å; R236-H238 PolarHBondContact O-ND1 3.1Å; R236-E353 PolarHBondContact NH1-O 3.29Å
237	P	75.8	Confident	63.5	Low	51 Å²	51	63.1 Å²	63.1	33%	0.331	35%	0.352	S	S	.	.			trans	-71.8	133.2	173	30.2	-33.4	0	0	0	110.3	W224 V225 A226 A397	W224-P237 HydrophobicContact CE3-CB 4.09Å; V225-P237 WeakPolarHBondContact O-CA 3.29Å; A226-P237 HydrophobicContact CB-CB 4.39Å; P237-A397 HydrophobicContact CG-CB 4.44Å
238	H	79.8	Confident	61.6	Low	17 Å²	17	68.9 Å²	68.9	8%	0.079	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	144.8	179.1	-68	75.6	0	0	0	111.4	W224 V225 R236 N280 L281 D355	W224-H238 WeakPolarHBondContact CA-O 3.22Å; V225-H238 PolarHBondContact N-O 3.39Å; V225-H238 PolarHBondContact O-N 3.45Å; R236-H238 PolarHBondContact O-CE1 2.89Å; R236-H238 PolarHBondContact O-ND1 3.1Å; H238-N280 PolarHBondContact CE1-O 2.84Å; H238-N280 PolarHBondContact NE2-O 2.8Å; H238-L281 HydrophobicContact CB-CD2 4.07Å; H238-D355 IonicContact CD2-OD1 2.92Å; H238-D355 PolarHBondContact CD2-OD1 3.49Å; H238-D355 IonicContact NE2-OD1 2.81Å; H238-D355 PolarHBondContact NE2-OD1 3.42Å
239	L	83.1	Confident	60	Low	5 Å²	5	77.4 Å²	77.4	3%	0.026	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	118.5	-177.9	-170.5	67.8	0	0	0	110.8	W222 W224 Y296 P315 V350 A399	W222-L239 HydrophobicContact CB-CD1 4.23Å; W222-L239 HydrophobicContact CE3-CD2 4.37Å; W222-L239 HydrophobicContact CE3-CG 4.16Å; W224-L239 HydrophobicContact CD2-CD1 4.03Å; W224-L239 HydrophobicContact CE3-CB 4.03Å; W224-L239 HydrophobicContact CE3-CD1 4.19Å; W224-L239 HydrophobicContact CH2-CB 4.24Å; W224-L239 HydrophobicContact CZ2-CD1 4.4Å; W224-L239 HydrophobicContact CZ3-CB 3.78Å; W224-L239 HydrophobicContact CZ3-CD1 4.45Å; L239-Y296 HydrophobicContact CD1-CD2 3.53Å; L239-Y296 HydrophobicContact CD1-CE2 4.28Å; L239-Y296 HydrophobicContact CD1-CG 4.11Å; L239-Y296 HydrophobicContact CD2-CD2 4.29Å; L239-Y296 HydrophobicContact CD2-CE2 4.28Å; L239-P315 HydrophobicContact CD2-CB 3.71Å; L239-P315 HydrophobicContact CD2-CG 3.61Å; L239-V350 HydrophobicContact CB-CG1 4.18Å; L239-A399 HydrophobicContact CB-CB 3.84Å; L239-A399 HydrophobicContact CD2-CB 3.77Å; L239-A399 HydrophobicContact CG-CB 4.45Å
240	A	82.2	Confident	59.1	Low	0 Å²	0	77 Å²	77	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	152.7	-178.4	0	0	0	0	0	111.7	L205 V223 V225 L277	L205-A240 HydrophobicContact CB-CB 4.42Å; V223-A240 PolarHBondContact N-O 2.83Å; V223-A240 PolarHBondContact O-N 2.92Å; V225-A240 HydrophobicContact CG2-CB 3.75Å; A240-L277 HydrophobicContact CB-CD1 3.75Å
241	R	81.8	Confident	58.5	Low	108 Å²	108	75 Å²	75	41%	0.408	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.3	171.6	-166.3	173.3	-179.5	-153.6	-3.9	111.1	S204 L205 G220 E221 W222	S204-R241 CarbonylContact C-O 3.53Å; S204-R241 WeakPolarHBondContact CA-O 3.45Å; S204-R241 VanDerWaalsContact CB-O 3.25Å; S204-R241 WeakPolarHBondContact CB-O 3.41Å; L205-R241 PolarHBondContact N-O 2.74Å; G220-R241 VanDerWaalsContact CA-NE 3.34Å; G220-R241 WeakPolarHBondContact O-CG 3.14Å; G220-R241 PolarHBondContact O-NE 3.05Å; E221-R241 WeakPolarHBondContact O-CA 3.42Å; W222-R241 HydrophobicContact CE3-CB 3.89Å; W222-R241 HydrophobicContact CE3-CG 4.42Å; W222-R241 HydrophobicContact CH2-CB 4.16Å; W222-R241 HydrophobicContact CZ3-CB 3.65Å; W222-R241 HydrophobicContact CZ3-CG 4.37Å
242	V	78.1	Confident	58.3	Low	2 Å²	2	74 Å²	74	1%	0.012	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	126.9	-179.4	-176.3	0	0	0	0	110.8	L205 V207 L212 L217 G220 E221 V223	L205-V242 HydrophobicContact CD2-CG2 4.42Å; V207-V242 HydrophobicContact CG1-CG1 4.44Å; V207-V242 HydrophobicContact CG2-CG1 3.46Å; V207-V242 VanDerWaalsContact CG2-CG1 3.46Å; L212-V242 HydrophobicContact CD1-CG1 4.09Å; L217-V242 HydrophobicContact CD1-CG2 4.25Å; G220-V242 VanDerWaalsContact CA-O 3.24Å; G220-V242 WeakPolarHBondContact CA-O 3.44Å; G220-V242 PolarHBondContact N-O 2.96Å; E221-V242 PolarHBondContact O-N 2.99Å; V223-V242 HydrophobicContact CB-CG2 3.89Å; V223-V242 HydrophobicContact CG2-CG2 3.53Å
243	Q	79.4	Confident	58.1	Low	65 Å²	65	72.8 Å²	72.8	30%	0.304	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	147.3	179.6	-66.1	-170.8	22.9	0	0	112.4	L205 G206 V207 L245	L205-Q243 PolarHBondContact O-N 3.14Å; G206-Q243 WeakPolarHBondContact CA-O 3.27Å; V207-Q243 PolarHBondContact N-O 3.47Å; Q243-L245 PolarHBondContact O-N 3.11Å
244	V	70.5	Confident	58	Low	18 Å²	18	70 Å²	70	11%	0.109	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	103.8	172.4	177.7	0	0	0	0	109.3	V207 R209 L212 Q219	V207-V244 WeakPolarHBondContact O-CA 3.33Å; R209-V244 HydrophobicContact CG-CG1 3.38Å; L212-V244 HydrophobicContact CD1-CG2 3.87Å; Q219-V244 HydrophobicContact CG-CG2 4.41Å
245	L	65.3	Low	57.7	Low	48 Å²	48	68 Å²	68	25%	0.251	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-96.5	123.6	169.1	-93.1	143	0	0	0	109.1	V207 Q243 L272	V207-L245 PolarHBondContact O-N 3.22Å; Q243-L245 PolarHBondContact O-N 3.11Å; L245-L272 HydrophobicContact CB-CD1 4.4Å
246	E	50.9	Low	56.7	Low	89 Å²	89	68 Å²	68	42%	0.416	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-86.3	140.5	166.4	-79.4	163.7	173.4	0	0	108.4	R127 R209 R248	R127-E246 IonicContact CZ-OE2 2.8Å; R127-E246 IonicContact NH1-OE1 3.84Å; R127-E246 PolarHBondContact NH1-OE1 3.28Å; R127-E246 IonicContact NH1-OE2 3.96Å; R127-E246 PolarHBondContact NH1-OE2 2.92Å; R209-E246 IonicContact CZ-OE1 3.83Å; R209-E246 IonicContact NE-OE1 2.62Å; R209-E246 PolarHBondContact NE-OE1 3.15Å; R209-E246 IonicContact NH2-OE1 3.19Å; R209-E246 PolarHBondContact NH2-OE1 2.68Å; R209-E246 IonicContact NH2-OE2 2.67Å; E246-R248 PolarHBondContact O-N 3.47Å
247	P	44.1	Very low	54.9	Low	74 Å²	74	65.8 Å²	65.8	48%	0.481	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-62.1	126.8	-176.6	25.5	-33	0	0	0	109.7	L251	P247-L251 HydrophobicContact CB-CD1 4.43Å
248	R	39.7	Very low	53	Low	174 Å²	174	67.2 Å²	67.2	66%	0.657	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-73.2	139.3	159.2	-66.1	-173.1	-177.9	-179.7	3.6	107.3	E246 D250 L251	E246-R248 PolarHBondContact O-N 3.47Å; R248-D250 HydrophobicContact CB-CB 4.37Å; R248-D250 PolarHBondContact O-N 3.1Å; R248-D250 VanDerWaalsContact O-N 3.14Å; R248-L251 WeakPolarHBondContact O-CB 3.42Å; R248-L251 PolarHBondContact O-N 3.21Å
249	W	32.7	Very low	51	Low	198 Å²	198	69 Å²	69	75%	0.75	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-58	-22.3	172.9	50.7	-91.7	0	0	0	112.4	L251 S252	W249-L251 PolarHBondContact O-N 3.39Å; W249-S252 PolarHBondContact O-OG 3.22Å
250	D	34.8	Very low	48.6	Very low	59 Å²	59	71.6 Å²	71.6	32%	0.316	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-66.8	-7.8	171.9	-71.9	-58.4	0	0	0	116	R248	R248-D250 HydrophobicContact CB-CB 4.37Å; R248-D250 PolarHBondContact O-N 3.1Å; R248-D250 VanDerWaalsContact O-N 3.14Å
251	L	36.8	Very low	46	Very low	48 Å²	48	80.9 Å²	80.9	25%	0.251	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-78.1	-24.7	-174.6	-77.5	165.4	0	0	0	113.7	P247 R248 W249 D253 L272	P247-L251 HydrophobicContact CB-CD1 4.43Å; R248-L251 WeakPolarHBondContact O-CB 3.42Å; R248-L251 PolarHBondContact O-N 3.21Å; W249-L251 PolarHBondContact O-N 3.39Å; L251-D253 PolarHBondContact O-N 3.2Å; L251-L272 HydrophobicContact CD1-CD1 4.44Å
252	S	36	Very low	43.7	Very low	64 Å²	64	79.7 Å²	79.7	45%	0.448	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-30.9	176.7	53.5	0	0	0	0	113.1	W249	W249-S252 PolarHBondContact O-OG 3.22Å
253	D	37.9	Very low	41.5	Very low	87 Å²	87	83.5 Å²	83.5	47%	0.465	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-0.3	-170.2	-66.1	12.5	0	0	0	113	L251 S431	L251-D253 PolarHBondContact O-N 3.2Å; D253-S431 PolarHBondContact O-OG 2.87Å
254	R	38.5	Very low	39.3	Very low	87 Å²	87	87.6 Å²	87.6	33%	0.328	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-31.7	178.1	-61.6	-170.4	-172.6	-147.6	-3.5	112.7	E425 S432	R254-E425 IonicContact CZ-OE1 2.86Å; R254-E425 IonicContact NH1-OE1 3.2Å; R254-E425 IonicContact NH2-OE1 3.78Å; R254-E425 PolarHBondContact NH2-OE1 3.22Å; R254-S432 WeakPolarHBondContact O-CB 3.49Å; R254-S432 PolarHBondContact O-OG 2.92Å
255	L	40.2	Very low	38.1	Very low	46 Å²	46	92 Å²	92	24%	0.241	53%	0.527	C	S	.	.	S	Bend	trans	-88.6	123.6	177.6	-59.2	169.1	0	0	0	108.5	V197 S259 L262	V197-L255 HydrophobicContact CG1-CD1 4Å; V197-L255 HydrophobicContact CG1-CD2 3.95Å; L255-S259 VanDerWaalsContact CB-OG 3.23Å; L255-S259 WeakPolarHBondContact CB-OG 3.41Å; L255-L262 HydrophobicContact CD1-CD1 4.37Å
256	G	36	Very low	37.4	Very low	25 Å²	25	90.5 Å²	90.5	26%	0.258	52%	0.519	S	S	.	.			trans	-66.3	176	-174.9	0	0	0	0	0	114	G258 S259	G256-G258 PolarHBondContact O-N 2.82Å; G256-S259 PolarHBondContact O-N 3.12Å; G256-S259 PolarHBondContact O-OG 2.98Å
257	P	30.3	Very low	37.6	Very low	116 Å²	116	89 Å²	89	75%	0.753	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-0.8	-170.4	26.5	-35.4	0	0	0	116.1
258	G	34.5	Very low	38.3	Very low	81 Å²	81	91 Å²	91	84%	0.835	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-11.2	173.2	0	0	0	0	0	115.5	G256	G256-G258 PolarHBondContact O-N 2.82Å
259	S	38.7	Very low	39.4	Very low	54 Å²	54	84 Å²	84	38%	0.378	51%	0.511	S	S	.	.	S	Bend	trans	-80.5	131.9	172.6	67.5	0	0	0	0	110.5	L255 G256	L255-S259 VanDerWaalsContact CB-OG 3.23Å; L255-S259 WeakPolarHBondContact CB-OG 3.41Å; G256-S259 PolarHBondContact O-N 3.12Å; G256-S259 PolarHBondContact O-OG 2.98Å
260	G	32.1	Very low	41.4	Very low	61 Å²	61	76.1 Å²	76.1	63%	0.629	48%	0.483	S	S	*	.			trans	-52.2	145.4	-177.5	0	0	0	0	0	113.6	L262	G260-L262 PolarHBondContact O-N 3.09Å
261	Q	26.9	Very low	43.5	Very low	194 Å²	194	73.3 Å²	73.3	91%	0.907	47%	0.468	S	S	*	.			trans	-51.9	93.7	-171.4	-67.9	175.7	-17.2	0	0	113.5	G263	Q261-G263 PolarHBondContact O-N 2.88Å
262	L	33.8	Very low	45.4	Very low	84 Å²	84	71.5 Å²	71.5	44%	0.44	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	56.8	176.5	-88.8	151.1	0	0	0	112	L255 G260 E264	L255-L262 HydrophobicContact CD1-CD1 4.37Å; G260-L262 PolarHBondContact O-N 3.09Å; L262-E264 VanDerWaalsContact C-N 3.3Å
263	G	32.5	Very low	47.5	Very low	82 Å²	82	68.5 Å²	68.5	85%	0.845	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-9	155.3	0	0	0	0	0	112.7	Q261	Q261-G263 PolarHBondContact O-N 2.88Å
264	E	33.8	Very low	49.5	Very low	151 Å²	151	64.5 Å²	64.5	71%	0.706	42%	0.417	S	S	*	.	S	Bend	trans	-103.7	157.1	-178.4	-66.7	-165	155	0	0	112	L262	L262-E264 VanDerWaalsContact C-N 3.3Å
265	P	44.5	Very low	51.2	Low	110 Å²	110	61.4 Å²	61.4	71%	0.714	41%	0.41	S	S	*	.	S	Bend	trans	-57.2	142.3	170.1	25.8	-35.5	0	0	0	111.1	A267	P265-A267 PolarHBondContact O-N 3.38Å
266	L	50.8	Low	53	Low	16 Å²	16	59.9 Å²	59.9	8%	0.084	40%	0.402	C	S	.	.			trans	-33.2	106.6	173.9	-96.9	151.9	0	0	0	112	L270 L272	L266-L270 HydrophobicContact CD2-CB 3.91Å; L266-L272 HydrophobicContact CD1-CD1 4.06Å; L266-L272 HydrophobicContact CD1-CG 4.48Å; L266-L272 HydrophobicContact CD2-CD2 4.33Å; L266-L272 HydrophobicContact CD2-CG 4.27Å
267	A	54.9	Low	55.1	Low	58 Å²	58	59.3 Å²	59.3	48%	0.479	39%	0.393	S	S	.	.			trans	-60.3	145.2	-173.7	0	0	0	0	0	111.5	P265 G269 L270	P265-A267 PolarHBondContact O-N 3.38Å; A267-G269 PolarHBondContact O-N 3.41Å; A267-L270 HydrophobicContact CB-CD1 4.22Å; A267-L270 PolarHBondContact O-N 2.89Å; A267-L270 VanDerWaalsContact O-N 3.13Å
268	D	58.3	Low	57.4	Low	116 Å²	116	54 Å²	54	62%	0.62	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	108.5	-176.1	-77.1	-24.3	0	0	0	110.9	S208 S210 C211	S208-D268 PolarHBondContact OG-OD1 3.41Å; S210-D268 WeakPolarHBondContact CB-OD1 3.44Å; S210-D268 PolarHBondContact OG-OD1 3.11Å; C211-D268 PolarHBondContact N-OD1 3.25Å
269	G	64.4	Low	59.5	Low	28 Å²	28	52.6 Å²	52.6	29%	0.289	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	130.6	-15.7	-174	0	0	0	0	0	114.2	L194 Q195 A267	L194-G269 WeakPolarHBondContact CA-O 3.47Å; L194-G269 WeakPolarHBondContact CB-O 3.35Å; L194-G269 WeakPolarHBondContact CD2-O 3.41Å; Q195-G269 PolarHBondContact N-O 3.14Å; A267-G269 PolarHBondContact O-N 3.41Å
270	L	74.6	Confident	61.6	Low	31 Å²	31	51.7 Å²	51.7	16%	0.162	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	141.7	176.7	-85.9	156.6	0	0	0	113.3	Q195 V197 L266 A267	Q195-L270 HydrophobicContact CB-CD2 4.3Å; Q195-L270 HydrophobicContact CG-CD2 4.39Å; Q195-L270 WeakPolarHBondContact O-CA 3.47Å; V197-L270 HydrophobicContact CB-CD2 4.19Å; V197-L270 HydrophobicContact CG2-CD2 3.4Å; L266-L270 HydrophobicContact CD2-CB 3.91Å; A267-L270 HydrophobicContact CB-CD1 4.22Å; A267-L270 PolarHBondContact O-N 2.89Å; A267-L270 VanDerWaalsContact O-N 3.13Å
271	A	77.7	Confident	63.7	Low	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	127.9	171.9	0	0	0	0	0	111.1	L194 Q195 G196 V197 L205 G206 V207	L194-A271 HydrophobicContact CB-CB 4.17Å; L194-A271 HydrophobicContact CD1-CB 3.84Å; Q195-A271 PolarHBondContact O-N 2.97Å; G196-A271 WeakPolarHBondContact CA-O 3.31Å; V197-A271 PolarHBondContact N-O 2.94Å; L205-A271 HydrophobicContact CD1-CB 4.04Å; L205-A271 HydrophobicContact CD2-CB 4.39Å; L205-A271 HydrophobicContact CG-CB 4.27Å; G206-A271 CarbonylContact O-C 3.58Å; G206-A271 WeakPolarHBondContact O-CA 3.48Å; V207-A271 HydrophobicContact CG1-CB 4.12Å
272	L	78	Confident	65.8	Low	11 Å²	11	42.1 Å²	42.1	6%	0.058	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	120.1	173.8	-64.7	-179.1	0	0	0	109.9	V197 G199 G206 L245 L251 L266	V197-L272 HydrophobicContact CG1-CD2 4.37Å; V197-L272 CarbonylContact O-C 3.49Å; V197-L272 WeakPolarHBondContact O-CA 2.94Å; G199-L272 CarbonylContact O-C 3.6Å; G199-L272 VanDerWaalsContact O-C 3.23Å; G199-L272 WeakPolarHBondContact O-CB 3.49Å; G206-L272 PolarHBondContact N-O 3.33Å; G206-L272 PolarHBondContact O-N 2.99Å; L245-L272 HydrophobicContact CB-CD1 4.4Å; L251-L272 HydrophobicContact CD1-CD1 4.44Å; L266-L272 HydrophobicContact CD1-CD1 4.06Å; L266-L272 HydrophobicContact CD1-CG 4.48Å; L266-L272 HydrophobicContact CD2-CD2 4.33Å; L266-L272 HydrophobicContact CD2-CG 4.27Å
273	V	79.2	Confident	67.5	Low	0 Å²	0	38.8 Å²	38.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124	-174.1	-170.4	0	0	0	0	110	V197 L198 G199 L205 L277 A278 V288 L291	V197-V273 PolarHBondContact O-N 2.78Å; L198-V273 WeakPolarHBondContact CA-O 3.47Å; G199-V273 PolarHBondContact N-O 2.93Å; G199-V273 CarbonylContact O-C 3.47Å; G199-V273 PolarHBondContact O-N 2.96Å; G199-V273 VanDerWaalsContact O-N 3.14Å; L205-V273 HydrophobicContact CD1-CG2 3.84Å; V273-L277 HydrophobicContact CG1-CB 4.41Å; V273-L277 HydrophobicContact CG1-CD2 3.65Å; V273-A278 HydrophobicContact CG1-CB 3.84Å; V273-V288 HydrophobicContact CB-CG1 4.37Å; V273-V288 HydrophobicContact CG2-CG1 4.03Å; V273-L291 HydrophobicContact CG2-CD1 3.65Å
274	P	78.8	Confident	69	Low	4 Å²	4	37.4 Å²	37.4	3%	0.026	23%	0.229	C	C	.	.			trans	-60.8	144	172.3	-22.9	33.5	0	0	0	112	G202 S204 T276 L277 A278	G202-P274 WeakPolarHBondContact O-CB 3.35Å; G202-P274 WeakPolarHBondContact O-CG 3.2Å; S204-P274 WeakPolarHBondContact O-CD 3.35Å; S204-P274 WeakPolarHBondContact O-CG 3.28Å; P274-T276 VanDerWaalsContact C-N 3.29Å; P274-T276 PolarHBondContact O-N 2.77Å; P274-L277 HydrophobicContact CB-CB 4.35Å; P274-L277 PolarHBondContact O-N 2.99Å; P274-A278 PolarHBondContact O-N 3.46Å
275	A	74.9	Confident	70.2	Confident	22 Å²	22	31.6 Å²	31.6	18%	0.182	21%	0.205	C	C	.	.	H	α-helix	trans	-60.8	-34.2	-175.7	0	0	0	0	0	113.8	L198 F279 W421	L198-A275 HydrophobicContact CD2-CB 4.44Å; A275-F279 VanDerWaalsContact O-CB 3.29Å; A275-F279 WeakPolarHBondContact O-CB 3.36Å; A275-F279 PolarHBondContact O-N 3.31Å; A275-W421 VanDerWaalsContact CB-O 3.32Å; A275-W421 WeakPolarHBondContact CB-O 3.38Å
276	T	78.7	Confident	70.9	Confident	14 Å²	14	31.1 Å²	31.1	9%	0.086	20%	0.196	C	C	.	.	H	α-helix	trans	-61.9	-46	172.4	45.3	0	0	0	0	112.1	P274 F279 N280 C358 P420	P274-T276 VanDerWaalsContact C-N 3.29Å; P274-T276 PolarHBondContact O-N 2.77Å; T276-F279 PolarHBondContact O-N 2.95Å; T276-N280 PolarHBondContact O-N 2.9Å; T276-C358 HydrophobicContact CG2-CB 3.46Å; T276-C358 VanDerWaalsContact CG2-CB 3.46Å; T276-P420 HydrophobicContact CG2-CG 4.25Å
277	L	79.8	Confident	71.6	Confident	13 Å²	13	37.6 Å²	37.6	7%	0.068	23%	0.225	C	C	.	.	H	α-helix	trans	-72.3	-38.5	-178.7	-168.1	135.8	0	0	0	111.8	A240 V273 P274 F279 N280 L281	A240-L277 HydrophobicContact CB-CD1 3.75Å; V273-L277 HydrophobicContact CG1-CB 4.41Å; V273-L277 HydrophobicContact CG1-CD2 3.65Å; P274-L277 HydrophobicContact CB-CB 4.35Å; P274-L277 PolarHBondContact O-N 2.99Å; L277-F279 VanDerWaalsContact C-N 3.31Å; L277-F279 PolarHBondContact O-N 2.96Å; L277-N280 PolarHBondContact O-N 3.31Å; L277-L281 HydrophobicContact CD2-CD1 3.57Å; L277-L281 HydrophobicContact CD2-CG 4.29Å; L277-L281 HydrophobicContact CG-CD1 4.5Å; L277-L281 WeakPolarHBondContact O-CB 3.47Å; L277-L281 VanDerWaalsContact O-CG 3.24Å; L277-L281 WeakPolarHBondContact O-CG 3.49Å; L277-L281 PolarHBondContact O-N 3.41Å
278	A	78.6	Confident	72	Confident	3 Å²	3	35 Å²	35	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-60.7	-41.3	172.1	0	0	0	0	0	111.8	L198 V273 P274 L281 G282 C283	L198-A278 HydrophobicContact CD2-CB 3.54Å; V273-A278 HydrophobicContact CG1-CB 3.84Å; P274-A278 PolarHBondContact O-N 3.46Å; A278-L281 PolarHBondContact O-N 3.49Å; A278-G282 PolarHBondContact O-N 3.45Å; A278-C283 HydrophobicContact CB-CB 4.32Å; A278-C283 WeakPolarHBondContact O-CB 3.43Å; A278-C283 PolarHBondContact O-N 2.89Å
279	F	79.1	Confident	72.5	Confident	52 Å²	52	30.9 Å²	30.9	23%	0.228	19%	0.189	C	C	.	.	H	α-helix	trans	-66.4	-46.3	176.9	177.2	-90.8	0	0	0	112.6	A275 T276 L277 L281 G282 V356 P418 P420	A275-F279 VanDerWaalsContact O-CB 3.29Å; A275-F279 WeakPolarHBondContact O-CB 3.36Å; A275-F279 PolarHBondContact O-N 3.31Å; T276-F279 PolarHBondContact O-N 2.95Å; L277-F279 VanDerWaalsContact C-N 3.31Å; L277-F279 PolarHBondContact O-N 2.96Å; F279-L281 VanDerWaalsContact C-N 3.27Å; F279-L281 PolarHBondContact O-N 3.17Å; F279-G282 PolarHBondContact O-N 2.94Å; F279-V356 HydrophobicContact CD1-CB 4.48Å; F279-V356 HydrophobicContact CE1-CB 4.19Å; F279-V356 HydrophobicContact CE1-CG2 3.88Å; F279-P418 HydrophobicContact CE2-CB 4.1Å; F279-P418 HydrophobicContact CE2-CG 4.43Å; F279-P418 VanDerWaalsContact CZ-C 3.42Å; F279-P418 HydrophobicContact CZ-CB 3.92Å; F279-P418 HydrophobicContact CZ-CG 3.94Å; F279-P418 VanDerWaalsContact CZ-O 3.32Å; F279-P418 WeakPolarHBondContact CZ-O 3.23Å; F279-P420 HydrophobicContact CB-CB 3.68Å; F279-P420 HydrophobicContact CB-CG 4.48Å; F279-P420 HydrophobicContact CD1-CB 4.31Å; F279-P420 HydrophobicContact CD1-CG 4.34Å; F279-P420 HydrophobicContact CD2-CB 4.18Å; F279-P420 HydrophobicContact CG-CB 3.8Å; F279-P420 HydrophobicContact CG-CG 4.32Å
280	N	81.8	Confident	73.2	Confident	35 Å²	35	33.5 Å²	33.5	19%	0.187	19%	0.194	C	C	.	.	H	α-helix	trans	-62.9	-34.5	176.8	-67.4	-11.9	0	0	0	111.5	H238 T276 L277 G282 V356	H238-N280 PolarHBondContact CE1-O 2.84Å; H238-N280 PolarHBondContact NE2-O 2.8Å; T276-N280 PolarHBondContact O-N 2.9Å; L277-N280 PolarHBondContact O-N 3.31Å; N280-G282 PolarHBondContact O-N 3.14Å; N280-V356 PolarHBondContact OD1-N 3.37Å; N280-V356 VanDerWaalsContact OD1-N 3.15Å
281	L	76.9	Confident	73.5	Confident	8 Å²	8	32 Å²	32	4%	0.042	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-8.6	171	-73.9	172.1	0	0	0	114.9	V225 H238 L277 A278 F279 C283 L291	V225-L281 HydrophobicContact CB-CD2 4.46Å; V225-L281 HydrophobicContact CG1-CD1 3.78Å; V225-L281 HydrophobicContact CG1-CD2 4.32Å; V225-L281 VanDerWaalsContact O-CD2 3.3Å; V225-L281 WeakPolarHBondContact O-CD2 3.47Å; H238-L281 HydrophobicContact CB-CD2 4.07Å; L277-L281 HydrophobicContact CD2-CD1 3.57Å; L277-L281 HydrophobicContact CD2-CG 4.29Å; L277-L281 HydrophobicContact CG-CD1 4.5Å; L277-L281 WeakPolarHBondContact O-CB 3.47Å; L277-L281 VanDerWaalsContact O-CG 3.24Å; L277-L281 WeakPolarHBondContact O-CG 3.49Å; L277-L281 PolarHBondContact O-N 3.41Å; A278-L281 PolarHBondContact O-N 3.49Å; F279-L281 VanDerWaalsContact C-N 3.27Å; F279-L281 PolarHBondContact O-N 3.17Å; L281-C283 VanDerWaalsContact C-N 3.32Å; L281-L291 HydrophobicContact CD1-CD2 4.2Å
282	G	71.4	Confident	73.7	Confident	47 Å²	47	36.7 Å²	36.7	49%	0.485	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	28.1	-174.5	0	0	0	0	0	113.7	R227 A278 F279 N280	R227-G282 PolarHBondContact NH1-O 3.41Å; A278-G282 PolarHBondContact O-N 3.45Å; F279-G282 PolarHBondContact O-N 2.94Å; N280-G282 PolarHBondContact O-N 3.14Å
283	C	68.7	Low	73.8	Confident	13 Å²	13	36.3 Å²	36.3	9%	0.088	20%	0.201	C	C	.	.			trans	-81.8	140.4	175.7	-72.2	0	0	0	0	111.5	A278 L281 V288	A278-C283 HydrophobicContact CB-CB 4.32Å; A278-C283 WeakPolarHBondContact O-CB 3.43Å; A278-C283 PolarHBondContact O-N 2.89Å; L281-C283 VanDerWaalsContact C-N 3.32Å; C283-V288 HydrophobicContact CB-CB 4.44Å; C283-V288 HydrophobicContact CB-CG1 3.99Å; C283-V288 PolarHBondContact SG-O 2.8Å
284	D	63.8	Low	73.9	Confident	53 Å²	53	40.3 Å²	40.3	28%	0.283	22%	0.22	S	C	.	.			trans	-67.9	136.3	168.4	-76.5	-59.6	0	0	0	108.9	R227 L286 E287 V288 K450	R227-D284 IonicContact NH2-OD2 3.21Å; D284-L286 VanDerWaalsContact C-N 3.3Å; D284-L286 PolarHBondContact O-N 3.3Å; D284-E287 CarbonylContact O-C 3.56Å; D284-E287 PolarHBondContact O-N 3.39Å; D284-V288 PolarHBondContact O-N 3.19Å; D284-K450 IonicContact OD1-NZ 2.8Å; D284-K450 PolarHBondContact OD1-NZ 3.32Å; D284-K450 IonicContact OD2-NZ 3.6Å; D284-K450 PolarHBondContact OD2-NZ 3.14Å
285	P	60.5	Low	73.7	Confident	30 Å²	30	43.3 Å²	43.3	20%	0.195	23%	0.231	C	C	.	.	S	Bend	trans	-71.1	-21.4	-170	25.7	-33.8	0	0	0	114.3	L198 L433 Q486	L198-P285 HydrophobicContact CD1-CB 3.86Å; L198-P285 WeakPolarHBondContact CD1-O 3.5Å; L198-P285 WeakPolarHBondContact CG-O 3.34Å; P285-L433 HydrophobicContact CB-CD1 4.03Å; P285-L433 HydrophobicContact CB-CD2 4.36Å; P285-Q486 VanDerWaalsContact CD-O 3.24Å; P285-Q486 WeakPolarHBondContact CD-O 3.44Å; P285-Q486 HydrophobicContact CG-CB 4.44Å; P285-Q486 WeakPolarHBondContact CG-O 3.49Å
286	L	58.6	Low	73.7	Confident	100 Å²	100	43.5 Å²	43.5	52%	0.524	23%	0.227	S	C	.	.	S	Bend	trans	-81.3	-32.8	173.1	-66.9	174.8	0	0	0	112.4	D284 L433 Q486	D284-L286 VanDerWaalsContact C-N 3.3Å; D284-L286 PolarHBondContact O-N 3.3Å; L286-L433 HydrophobicContact CD2-CB 3.75Å; L286-L433 HydrophobicContact CD2-CD1 4.05Å; L286-Q486 HydrophobicContact CD1-CG 4.4Å
287	E	64.3	Low	73.1	Confident	151 Å²	151	47.4 Å²	47.4	71%	0.706	25%	0.247	S	C	*	.			trans	-133.6	82.2	-175.1	-68.7	-171.5	179.1	0	0	110.2	D284 G289	D284-E287 CarbonylContact O-C 3.56Å; D284-E287 PolarHBondContact O-N 3.39Å; E287-G289 PolarHBondContact O-N 3.39Å
288	V	63.6	Low	71.9	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.024	27%	0.267	C	S	.	.			trans	-61.7	-26.3	177.2	-174.6	0	0	0	0	111.4	L198 V273 C283 D284 L291	L198-V288 HydrophobicContact CD2-CG2 3.99Å; L198-V288 HydrophobicContact CG-CG2 3.9Å; V273-V288 HydrophobicContact CB-CG1 4.37Å; V273-V288 HydrophobicContact CG2-CG1 4.03Å; C283-V288 HydrophobicContact CB-CB 4.44Å; C283-V288 HydrophobicContact CB-CG1 3.99Å; C283-V288 PolarHBondContact SG-O 2.8Å; D284-V288 PolarHBondContact O-N 3.19Å; V288-L291 HydrophobicContact CG1-CD1 4.26Å; V288-L291 HydrophobicContact CG1-CD2 4.34Å
289	G	68.8	Low	70.4	Confident	30 Å²	30	54.1 Å²	54.1	31%	0.309	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	79.2	-162.6	170.5	0	0	0	0	0	113.6	G196 E287	G196-G289 PolarHBondContact N-O 3.42Å; E287-G289 PolarHBondContact O-N 3.39Å
290	E	78.7	Confident	68.6	Low	83 Å²	83	57.3 Å²	57.3	39%	0.388	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	128.2	176.5	-170.1	-179.8	-135.4	0	0	110	R193 L194 A228	R193-E290 HydrophobicContact CB-CG 3.86Å; R193-E290 WeakPolarHBondContact CB-OE1 3.36Å; R193-E290 WeakPolarHBondContact CD-OE1 3.48Å; R193-E290 WeakPolarHBondContact CD-OE2 3.21Å; R193-E290 HydrophobicContact CG-CG 4.46Å; R193-E290 IonicContact CZ-OE2 3.75Å; R193-E290 IonicContact NE-OE2 3.06Å; R193-E290 IonicContact NH1-OE1 2.67Å; R193-E290 IonicContact NH1-OE2 2.65Å; R193-E290 PolarHBondContact NH1-OE2 3.21Å; L194-E290 CarbonylContact O-C 3.56Å; L194-E290 WeakPolarHBondContact O-CA 3.42Å; A228-E290 HydrophobicContact CB-CB 4.05Å; A228-E290 HydrophobicContact CB-CG 4.2Å; A228-E290 WeakPolarHBondContact CB-O 3.45Å; A228-E290 PolarHBondContact N-O 3.01Å
291	L	81.3	Confident	66.3	Low	0 Å²	0	62 Å²	62	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.8	-177.8	-64.6	177.4	0	0	0	110.7	R193 L194 V225 V273 L281 V288	R193-L291 CarbonylContact C-O 3.57Å; R193-L291 VanDerWaalsContact CA-O 3.27Å; R193-L291 WeakPolarHBondContact CA-O 3.49Å; L194-L291 PolarHBondContact N-O 2.76Å; L194-L291 PolarHBondContact O-N 3.37Å; V225-L291 HydrophobicContact CG1-CB 4.33Å; V225-L291 HydrophobicContact CG1-CD1 4.22Å; V225-L291 HydrophobicContact CG1-CD2 4.3Å; V273-L291 HydrophobicContact CG2-CD1 3.65Å; L281-L291 HydrophobicContact CD1-CD2 4.2Å; V288-L291 HydrophobicContact CG1-CD1 4.26Å; V288-L291 HydrophobicContact CG1-CD2 4.34Å
292	R	82.1	Confident	64.1	Low	98 Å²	98	65 Å²	65	37%	0.37	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	129.4	169.8	-67.4	177.4	-174.2	163.3	3.6	109.4	V191 R192 V225 A226 A228	V191-R292 HydrophobicContact CG1-CB 3.74Å; V191-R292 HydrophobicContact CG1-CG 3.98Å; R192-R292 CarbonylContact O-C 3.45Å; R192-R292 WeakPolarHBondContact O-CA 3.38Å; V225-R292 CarbonylContact C-O 3.57Å; V225-R292 WeakPolarHBondContact CA-O 3.39Å; A226-R292 PolarHBondContact N-O 3.2Å; A226-R292 PolarHBondContact O-N 3.16Å; A228-R292 HydrophobicContact CB-CG 3.95Å
293	I	81.3	Confident	62.5	Low	3 Å²	3	68.4 Å²	68.4	2%	0.015	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	124.6	-176.6	-85.7	161.8	0	0	0	108.9	R192 L194 L205 V223 W224 V225	R192-I293 PolarHBondContact N-O 3.16Å; R192-I293 PolarHBondContact O-N 2.68Å; L194-I293 HydrophobicContact CB-CD1 4.16Å; L194-I293 HydrophobicContact CD1-CD1 3.31Å; L194-I293 HydrophobicContact CG-CD1 3.8Å; L205-I293 HydrophobicContact CD2-CD1 3.69Å; L205-I293 HydrophobicContact CD2-CG1 4.45Å; V223-I293 HydrophobicContact CG1-CB 4.15Å; V223-I293 HydrophobicContact CG1-CG1 4.04Å; V223-I293 HydrophobicContact CG1-CG2 3.65Å; W224-I293 WeakPolarHBondContact O-CA 3.38Å; V225-I293 HydrophobicContact CG2-CG1 4.32Å
294	Q	79.9	Confident	60.9	Low	83 Å²	83	76.2 Å²	76.2	39%	0.388	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.5	179.4	179.7	174.5	-7.2	0	0	109.7	V223 W224	V223-Q294 CarbonylContact C-O 3.56Å; V223-Q294 WeakPolarHBondContact CA-O 3.33Å; V223-Q294 WeakPolarHBondContact CG1-O 3.36Å; W224-Q294 HydrophobicContact CB-CB 4.37Å; W224-Q294 PolarHBondContact N-O 2.88Å; W224-Q294 PolarHBondContact O-N 3.25Å
295	R	75.3	Confident	59.4	Low	68 Å²	68	80.9 Å²	80.9	26%	0.257	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	138.6	-179.9	-167.8	178.8	-173.7	176.7	1.5	111.2	F185 L217 E221	F185-R295 HydrophobicContact CE1-CB 4.37Å; L217-R295 HydrophobicContact CD2-CG 4.45Å; E221-R295 IonicContact OE1-CZ 3.91Å; E221-R295 IonicContact OE1-NE 3.87Å; E221-R295 IonicContact OE1-NH2 3.26Å; E221-R295 PolarHBondContact OE1-NH2 3.37Å
296	Y	74.7	Confident	58.4	Low	25 Å²	25	89.2 Å²	89.2	10%	0.098	48%	0.476	C	S	.	.			trans	-66.4	131.9	168.8	-175.1	-100.1	0	0	0	110.2	W222 W224 L239 E298	W222-Y296 HydrophobicContact CB-CD1 4.43Å; W222-Y296 HydrophobicContact CB-CG 4.16Å; W222-Y296 VanDerWaalsContact O-CB 3.26Å; W222-Y296 WeakPolarHBondContact O-CB 3.35Å; W222-Y296 PolarHBondContact O-N 3.2Å; W224-Y296 AromaticContact CE2-CD2 3.79Å; W224-Y296 AromaticContact CZ2-CD2 3.96Å; W224-Y296 HydrophobicContact CZ2-CD2 3.96Å; W224-Y296 AromaticContact CZ2-CE2 3.88Å; W224-Y296 HydrophobicContact CZ2-CE2 3.88Å; W224-Y296 AromaticContact NE1-CD2 3.5Å; L239-Y296 HydrophobicContact CD1-CD2 3.53Å; L239-Y296 HydrophobicContact CD1-CE2 4.28Å; L239-Y296 HydrophobicContact CD1-CG 4.11Å; L239-Y296 HydrophobicContact CD2-CD2 4.29Å; L239-Y296 HydrophobicContact CD2-CE2 4.28Å; Y296-E298 HydrophobicContact CE1-CG 4.17Å
297	L	65.8	Low	57.1	Low	97 Å²	97	86.9 Å²	86.9	51%	0.508	48%	0.476	S	S	.	.			trans	-136.8	131.5	175.7	-70.6	170.2	0	0	0	107.2
298	E	56	Low	55.8	Low	106 Å²	106	84.4 Å²	84.4	50%	0.495	48%	0.476	S	S	.	.			trans	-66.2	144.1	171.9	-84.7	173	118.6	0	0	110.9	Y296 S300	Y296-E298 HydrophobicContact CE1-CG 4.17Å; E298-S300 PolarHBondContact O-N 3.03Å
299	G	46.5	Very low	54.7	Low	50 Å²	50	90.3 Å²	90.3	52%	0.515	52%	0.516	S	S	.	.	S	Bend	trans	-66.6	118	175.8	0	0	0	0	0	111.1
300	S	40	Very low	53.3	Low	119 Å²	119	93.3 Å²	93.3	83%	0.832	53%	0.532	S	S	*	.			trans	50.3	80.6	166	58.7	0	0	0	0	117	E298	E298-S300 PolarHBondContact O-N 3.03Å
301	I	34.2	Very low	51.6	Low	133 Å²	133	96.7 Å²	96.7	68%	0.682	55%	0.552	S	S	*	*			trans	-92.8	135.7	145.9	-59.4	176.3	0	0	0	107.5
302	A	31.4	Very low	50.4	Low	73 Å²	73	100.7 Å²	100.7	60%	0.603	57%	0.573	S	S	*	*			trans	-61.9	149.9	-179.8	0	0	0	0	0	111.8	E304	A302-E304 PolarHBondContact O-N 3.3Å
303	P	38	Very low	49.3	Very low	118 Å²	118	98 Å²	98	77%	0.766	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	19.1	-163.8	32.1	-38.3	0	0	0	116.2
304	E	33.6	Very low	48.6	Very low	177 Å²	177	99.3 Å²	99.3	83%	0.827	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-29	-170.3	-59.4	-157	141.8	0	0	114.6	A302 K306	A302-E304 PolarHBondContact O-N 3.3Å; E304-K306 VanDerWaalsContact C-N 3.34Å; E304-K306 PolarHBondContact O-N 3.47Å
305	D	33.5	Very low	48.5	Very low	150 Å²	150	95.6 Å²	95.6	80%	0.802	57%	0.566	S	S	*	*			trans	-83.6	72.4	178.3	-82.5	-36	0	0	0	113	G307	D305-G307 PolarHBondContact O-N 2.96Å
306	K	38.8	Very low	48.8	Very low	205 Å²	205	94 Å²	94	89%	0.891	56%	0.564	S	S	*	*			trans	-77.4	52.6	165.1	-72.5	-178.1	-180	171.3	0	112	E304	E304-K306 VanDerWaalsContact C-N 3.34Å; E304-K306 PolarHBondContact O-N 3.47Å
307	G	31.5	Very low	49.2	Very low	51 Å²	51	97 Å²	97	53%	0.526	58%	0.578	S	S	.	*			trans	-95.1	135.7	167.7	0	0	0	0	0	111.1	D305 C309	D305-G307 PolarHBondContact O-N 2.96Å; G307-C309 PolarHBondContact O-N 2.94Å
308	S	37.2	Very low	50.1	Low	100 Å²	100	92.4 Å²	92.4	70%	0.699	55%	0.554	S	S	*	*			trans	-17.7	107.6	176.7	180	0	0	0	0	116	S310	S308-S310 PolarHBondContact O-N 3Å; S308-S310 PolarHBondContact O-OG 3.18Å; S308-S310 PolarHBondContact OG-OG 2.79Å
309	C	41	Very low	51.6	Low	127 Å²	127	93.9 Å²	93.9	86%	0.858	56%	0.555	S	S	*	*			trans	-73.3	58	174.8	-50.9	0	0	0	0	112.2	G307	G307-C309 PolarHBondContact O-N 2.94Å
310	S	38.3	Very low	53.6	Low	94 Å²	94	94.8 Å²	94.8	66%	0.657	55%	0.546	S	S	*	.			trans	-91.5	-2.5	179.4	35.8	0	0	0	0	113.8	S308	S308-S310 PolarHBondContact O-N 3Å; S308-S310 PolarHBondContact O-OG 3.18Å; S308-S310 PolarHBondContact OG-OG 2.79Å
311	L	44.6	Very low	55.9	Low	154 Å²	154	89.2 Å²	89.2	81%	0.806	51%	0.507	S	S	*	.	S	Bend	trans	-100.8	128.1	169.6	-63.4	175.6	0	0	0	108.8	P313	L311-P313 WeakPolarHBondContact O-CD 3.37Å
312	L	54.8	Low	58.5	Low	84 Å²	84	85.7 Å²	85.7	44%	0.44	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-76.7	117	173.5	-57.9	-179.8	0	0	0	107.9	F218 E221 G314	F218-L312 HydrophobicContact CD2-CD2 4.42Å; E221-L312 HydrophobicContact CG-CD1 4.27Å; E221-L312 HydrophobicContact CG-CD2 3.76Å; L312-G314 PolarHBondContact O-N 3.3Å
313	P	59.6	Low	61.4	Low	41 Å²	41	82.2 Å²	82.2	27%	0.266	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-63.7	130.8	177.5	26.7	-33.4	0	0	0	109.2	L311	L311-P313 WeakPolarHBondContact O-CD 3.37Å
314	G	67.1	Low	63.8	Low	31 Å²	31	77.5 Å²	77.5	32%	0.32	42%	0.424	S	S	.	.			trans	-118.8	150.6	-177.9	0	0	0	0	0	111.5	L312	L312-G314 PolarHBondContact O-N 3.3Å
315	P	77.3	Confident	66.4	Low	5 Å²	5	69.2 Å²	69.2	3%	0.032	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-61.4	149	173.8	26.5	-35.6	0	0	0	112.2	W222 L239 L401	W222-P315 HydrophobicContact CD2-CG 4.35Å; W222-P315 HydrophobicContact CZ2-CG 4.43Å; L239-P315 HydrophobicContact CD2-CB 3.71Å; L239-P315 HydrophobicContact CD2-CG 3.61Å; P315-L401 HydrophobicContact CG-CD1 4.07Å; P315-L401 HydrophobicContact CG-CD2 4.19Å; P315-L401 HydrophobicContact CG-CG 3.85Å
316	P	81.9	Confident	68.9	Low	34 Å²	34	62 Å²	62	22%	0.221	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-68.1	157.7	178.7	28.8	-35.4	0	0	0	112.3	A392 Y400 L401	P316-A392 HydrophobicContact CG-CB 4.43Å; P316-Y400 HydrophobicContact CB-CD1 4.5Å; P316-Y400 HydrophobicContact CG-CD1 3.91Å; P316-Y400 HydrophobicContact CG-CE1 4.07Å; P316-Y400 CarbonylContact O-C 3.54Å; P316-Y400 VanDerWaalsContact O-CA 3.27Å; P316-Y400 WeakPolarHBondContact O-CA 3.28Å; P316-L401 PolarHBondContact O-N 3.45Å
317	F	82.8	Confident	71	Confident	88 Å²	88	52.9 Å²	52.9	39%	0.386	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-78.3	142.9	172.5	-68.4	-87.9	0	0	0	111.4	P348 L401 D403 H406	F317-P348 HydrophobicContact CE1-CB 4.45Å; F317-L401 WeakPolarHBondContact CA-O 3.13Å; F317-L401 HydrophobicContact CD1-CB 3.62Å; F317-L401 HydrophobicContact CE1-CB 3.8Å; F317-L401 HydrophobicContact CE1-CD1 4.21Å; F317-L401 HydrophobicContact CG-CB 4.26Å; F317-L401 HydrophobicContact CZ-CD1 4.21Å; F317-D403 HydrophobicContact CE1-CB 4.4Å; F317-H406 HydrophobicContact CB-CB 4.11Å; F317-H406 HydrophobicContact CD1-CB 4.28Å; F317-H406 HydrophobicContact CG-CB 4.27Å
318	A	85.3	Confident	73.4	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.008	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-72.4	147.3	170.7	0	0	0	0	0	110.6	A389 Y400 L401 T407	A318-A389 CarbonylContact C-O 3.59Å; A318-A389 WeakPolarHBondContact CA-O 3.47Å; A318-Y400 HydrophobicContact CB-CG 4.21Å; A318-L401 PolarHBondContact N-O 3.42Å; A318-T407 HydrophobicContact CB-CG2 4.3Å; A318-T407 WeakPolarHBondContact O-CB 3.49Å; A318-T407 WeakPolarHBondContact O-CG2 3.44Å
319	R	86.3	Confident	75.1	Confident	136 Å²	136	46.8 Å²	46.8	51%	0.513	26%	0.258	S	S	.	.	S	Bend	trans	-87.9	-40.1	165.4	-72.9	-175.8	169.7	157.8	3.1	111.6	A389 E391 S408	R319-A389 PolarHBondContact N-O 3.29Å; R319-E391 IonicContact CZ-OE1 3.12Å; R319-E391 IonicContact CZ-OE2 3.5Å; R319-E391 IonicContact NH1-OE1 2.69Å; R319-E391 PolarHBondContact NH1-OE1 2.91Å; R319-E391 IonicContact NH1-OE2 3.83Å; R319-E391 IonicContact NH2-OE1 2.82Å; R319-E391 PolarHBondContact NH2-OE1 3.4Å; R319-E391 IonicContact NH2-OE2 2.78Å; R319-E391 PolarHBondContact NH2-OE2 3.33Å; R319-S408 PolarHBondContact O-N 2.84Å
320	E	88.8	Confident	76.5	Confident	70 Å²	70	46.5 Å²	46.5	33%	0.327	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134.5	-178.3	-55	175.7	164.7	0	0	110	Y322 A389 S408 Y410	E320-Y322 HydrophobicContact CB-CE2 4Å; E320-Y322 PolarHBondContact OE2-OH 3.18Å; E320-A389 HydrophobicContact CB-CB 4.19Å; E320-A389 PolarHBondContact N-O 3.3Å; E320-A389 PolarHBondContact O-N 3.35Å; E320-S408 WeakPolarHBondContact CA-O 3.34Å; E320-Y410 HydrophobicContact CB-CE2 4.23Å; E320-Y410 HydrophobicContact CG-CE2 4.22Å
321	L	88.4	Confident	78.3	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	114.6	178.4	173.3	61.6	0	0	0	109.4	I323 F345 V351 V385 T388 A402 S408 L409 Y410	L321-I323 HydrophobicContact CD1-CG2 4.12Å; L321-I323 HydrophobicContact CD2-CG2 4.36Å; L321-I323 HydrophobicContact CG-CG2 4.02Å; L321-F345 HydrophobicContact CD2-CE1 4.27Å; L321-F345 HydrophobicContact CD2-CE2 4.49Å; L321-F345 HydrophobicContact CD2-CZ 3.92Å; L321-V351 HydrophobicContact CD1-CB 4.29Å; L321-V351 HydrophobicContact CD1-CG1 4.43Å; L321-V351 HydrophobicContact CD1-CG2 4.16Å; L321-V351 HydrophobicContact CD2-CG1 4.33Å; L321-V385 HydrophobicContact CD1-CG1 3.81Å; L321-V385 HydrophobicContact CD1-CG2 4.4Å; L321-T388 HydrophobicContact CD1-CG2 3.86Å; L321-A402 HydrophobicContact CD2-CB 3.92Å; L321-S408 PolarHBondContact N-O 2.94Å; L321-L409 HydrophobicContact CD2-CD1 4.46Å; L321-L409 WeakPolarHBondContact O-CA 3.21Å; L321-Y410 PolarHBondContact O-N 2.84Å
322	Y	89.6	Confident	79.7	Confident	60 Å²	60	38.2 Å²	38.2	24%	0.235	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.6	176.5	-64.1	-87.7	0	0	0	110.2	E320 K386 K387 Y410 V412	E320-Y322 HydrophobicContact CB-CE2 4Å; E320-Y322 PolarHBondContact OE2-OH 3.18Å; Y322-K386 PolarHBondContact O-N 3.45Å; Y322-K387 HydrophobicContact CD2-CB 3.94Å; Y322-K387 HydrophobicContact CD2-CD 4.19Å; Y322-K387 HydrophobicContact CD2-CG 4.31Å; Y322-K387 HydrophobicContact CE2-CD 4.36Å; Y322-K387 HydrophobicContact CG-CB 4.37Å; Y322-K387 PolarHBondContact N-O 3.48Å; Y322-K387 PolarHBondContact O-N 3.19Å; Y322-Y410 WeakPolarHBondContact CA-O 3.42Å; Y322-Y410 HydrophobicContact CD1-CD2 4.07Å; Y322-Y410 HydrophobicContact CD1-CG 4.08Å; Y322-Y410 AromaticContact CE1-CD2 3.62Å; Y322-Y410 HydrophobicContact CE1-CD2 3.62Å; Y322-Y410 HydrophobicContact CE1-CE2 4.45Å; Y322-Y410 AromaticContact CE1-CG 3.74Å; Y322-Y410 HydrophobicContact CE1-CG 3.74Å; Y322-Y410 HydrophobicContact CE2-CD2 4.38Å; Y322-Y410 AromaticContact CZ-CD2 3.8Å; Y322-V412 HydrophobicContact CD1-CG2 3.65Å; Y322-V412 HydrophobicContact CG-CG2 4.38Å
323	I	90.7	Very high	80.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	153.1	177	61.7	168	0	0	0	112.3	L321 L341 F383 K384 V385 L409 Y410 M411 V412	L321-I323 HydrophobicContact CD1-CG2 4.12Å; L321-I323 HydrophobicContact CD2-CG2 4.36Å; L321-I323 HydrophobicContact CG-CG2 4.02Å; I323-L341 HydrophobicContact CD1-CD1 3.89Å; I323-L341 HydrophobicContact CD1-CD2 3.82Å; I323-F383 HydrophobicContact CD1-CB 4.3Å; I323-F383 HydrophobicContact CD1-CD1 3.86Å; I323-F383 HydrophobicContact CD1-CE1 4.49Å; I323-F383 HydrophobicContact CD1-CG 4.2Å; I323-K384 CarbonylContact C-O 3.56Å; I323-K384 WeakPolarHBondContact CA-O 3.25Å; I323-V385 HydrophobicContact CG2-CG2 4.37Å; I323-L409 HydrophobicContact CD1-CD1 4.08Å; I323-L409 HydrophobicContact CD1-CD2 3.86Å; I323-L409 HydrophobicContact CD1-CG 4.22Å; I323-L409 HydrophobicContact CG1-CD2 3.95Å; I323-L409 HydrophobicContact CG1-CG 4.33Å; I323-Y410 PolarHBondContact N-O 2.68Å; I323-M411 CarbonylContact O-C 3.57Å; I323-M411 WeakPolarHBondContact O-CA 3.39Å; I323-V412 PolarHBondContact O-N 3.04Å
324	E	89.8	Confident	81.2	Confident	19 Å²	19	41.4 Å²	41.4	9%	0.089	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.4	176.5	-59.9	-179.4	120.6	0	0	108.8	F383 K384 K386 V412 G413 T415	E324-F383 CarbonylContact O-C 3.57Å; E324-F383 WeakPolarHBondContact O-CA 3.29Å; E324-K384 PolarHBondContact N-O 2.89Å; E324-K384 PolarHBondContact O-N 2.73Å; E324-K386 VanDerWaalsContact CD-CD 3.47Å; E324-K386 HydrophobicContact CG-CB 4.21Å; E324-K386 HydrophobicContact CG-CD 4.22Å; E324-K386 WeakPolarHBondContact OE1-CD 3.49Å; E324-K386 WeakPolarHBondContact OE1-CE 3.23Å; E324-K386 IonicContact OE1-NZ 3.28Å; E324-K386 PolarHBondContact OE1-NZ 3.05Å; E324-K386 WeakPolarHBondContact OE2-CD 3.39Å; E324-K386 WeakPolarHBondContact OE2-CE 3.47Å; E324-K386 WeakPolarHBondContact OE2-CG 3.25Å; E324-K386 IonicContact OE2-NZ 3.9Å; E324-V412 HydrophobicContact CG-CB 4.06Å; E324-V412 VanDerWaalsContact OE1-O 3.06Å; E324-G413 WeakPolarHBondContact CA-O 3.41Å; E324-T415 HydrophobicContact CB-CG2 3.55Å; E324-T415 VanDerWaalsContact CD-CG2 3.47Å; E324-T415 HydrophobicContact CG-CG2 4.09Å; E324-T415 WeakPolarHBondContact OE2-CG2 3.47Å
325	I	87.8	Confident	81.4	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	134.4	179	-171.1	166.1	0	0	0	110.2	S327 Y331 T333 Y337 F383 G413 S414 T415	I325-S327 PolarHBondContact O-N 3.12Å; I325-Y331 HydrophobicContact CD1-CD2 4.1Å; I325-Y331 HydrophobicContact CD1-CE2 3.89Å; I325-Y331 HydrophobicContact CG1-CE2 3.86Å; I325-T333 HydrophobicContact CG2-CG2 4.19Å; I325-Y337 HydrophobicContact CD1-CD1 4.39Å; I325-Y337 HydrophobicContact CD1-CD2 4.35Å; I325-Y337 HydrophobicContact CD1-CE1 3.78Å; I325-Y337 HydrophobicContact CD1-CE2 3.75Å; I325-Y337 VanDerWaalsContact CD1-CZ 3.44Å; I325-F383 HydrophobicContact CB-CD1 4.04Å; I325-F383 HydrophobicContact CB-CE1 3.94Å; I325-F383 HydrophobicContact CD1-CE1 4.06Å; I325-F383 HydrophobicContact CD1-CZ 4.31Å; I325-F383 HydrophobicContact CG1-CD1 4.26Å; I325-F383 HydrophobicContact CG1-CE1 3.95Å; I325-F383 HydrophobicContact CG1-CZ 4.48Å; I325-G413 PolarHBondContact N-O 2.95Å; I325-S414 CarbonylContact O-C 3.6Å; I325-S414 WeakPolarHBondContact O-CA 3.44Å; I325-S414 WeakPolarHBondContact O-CB 3.32Å; I325-T415 PolarHBondContact O-N 2.76Å
326	V	85.9	Confident	81.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	125.2	178.7	-178.9	0	0	0	0	109.4	S328 Y331 F382 K384 S417 V419	V326-S328 PolarHBondContact O-N 3.3Å; V326-Y331 WeakPolarHBondContact O-CE2 3.48Å; V326-Y331 PolarHBondContact O-OH 3.44Å; V326-F382 HydrophobicContact CB-CB 4.1Å; V326-F382 HydrophobicContact CG2-CB 4.05Å; V326-F382 PolarHBondContact N-O 3.36Å; V326-K384 HydrophobicContact CG2-CB 4.29Å; V326-S417 WeakPolarHBondContact CG1-OG 3.44Å; V326-S417 WeakPolarHBondContact CG2-OG 3.3Å; V326-V419 HydrophobicContact CG1-CG2 3.9Å
327	S	83.1	Confident	81.2	Confident	13 Å²	13	45.6 Å²	45.6	9%	0.091	24%	0.236	C	C	.	.			trans	-69.5	95.4	-179.1	-66.4	0	0	0	0	111.7	I325 S414 T415 R520 C521	I325-S327 PolarHBondContact O-N 3.12Å; S327-S414 PolarHBondContact OG-OG 3.42Å; S327-T415 PolarHBondContact N-O 2.98Å; S327-R520 WeakPolarHBondContact CB-O 3.38Å; S327-C521 WeakPolarHBondContact O-CA 3.48Å
328	S	80.8	Confident	81.1	Confident	9 Å²	9	46.4 Å²	46.4	6%	0.063	25%	0.245	C	C	.	.			trans	-102.3	158.9	178.5	89.1	0	0	0	0	112.7	V326 H330 Y331	V326-S328 PolarHBondContact O-N 3.3Å; S328-H330 PolarHBondContact O-N 2.91Å; S328-H330 PolarHBondContact OG-N 2.9Å; S328-H330 VanDerWaalsContact OG-N 3.16Å; S328-Y331 WeakPolarHBondContact OG-CD1 3.37Å; S328-Y331 WeakPolarHBondContact OG-CE1 3.46Å; S328-Y331 WeakPolarHBondContact OG-CE2 3.38Å; S328-Y331 VanDerWaalsContact OG-CZ 3.28Å; S328-Y331 PolarHBondContact OG-N 3.27Å
329	P	73.8	Confident	80.9	Confident	14 Å²	14	48.3 Å²	48.3	9%	0.091	27%	0.265	C	S	.	.	S	Bend	trans	-74.3	-12.6	171.1	31.1	-35.4	0	0	0	113.1	H490 L492 R517	P329-H490 HydrophobicContact CG-CB 4.33Å; P329-L492 HydrophobicContact CB-CB 4.39Å; P329-L492 HydrophobicContact CB-CD1 3.91Å; P329-R517 PolarHBondContact O-NH2 2.66Å
330	H	70.6	Confident	80.6	Confident	121 Å²	121	42.1 Å²	42.1	56%	0.56	24%	0.242	S	C	*	.	S	Bend	trans	-89.7	-34.8	-169.6	-65	-59.4	0	0	0	113.6	S328 W378	S328-H330 PolarHBondContact O-N 2.91Å; S328-H330 PolarHBondContact OG-N 2.9Å; S328-H330 VanDerWaalsContact OG-N 3.16Å; H330-W378 PolarHBondContact O-NE1 3.34Å
331	Y	75.8	Confident	80.4	Confident	13 Å²	13	39 Å²	39	5%	0.051	23%	0.228	C	C	.	.	S	Bend	trans	-128.2	153.2	-179.7	51.1	-104.6	0	0	0	111.9	I325 V326 S328 M381 F382	I325-Y331 HydrophobicContact CD1-CD2 4.1Å; I325-Y331 HydrophobicContact CD1-CE2 3.89Å; I325-Y331 HydrophobicContact CG1-CE2 3.86Å; V326-Y331 WeakPolarHBondContact O-CE2 3.48Å; V326-Y331 PolarHBondContact O-OH 3.44Å; S328-Y331 WeakPolarHBondContact OG-CD1 3.37Å; S328-Y331 WeakPolarHBondContact OG-CE1 3.46Å; S328-Y331 WeakPolarHBondContact OG-CE2 3.38Å; S328-Y331 VanDerWaalsContact OG-CZ 3.28Å; S328-Y331 PolarHBondContact OG-N 3.27Å; Y331-M381 HydrophobicContact CD1-CG 4.15Å; Y331-M381 HydrophobicContact CE1-CB 4.38Å; Y331-M381 HydrophobicContact CE1-CG 4.36Å; Y331-M381 HydrophobicContact CG-CG 4.44Å; Y331-F382 HydrophobicContact CE1-CD2 4.25Å; Y331-F382 PolarHBondContact OH-N 3.22Å; Y331-F382 PolarHBondContact OH-O 3.41Å
332	S	73.4	Confident	80.2	Confident	60 Å²	60	45.8 Å²	45.8	42%	0.42	25%	0.254	S	S	.	.			trans	-68.7	154.9	172.6	-175.7	0	0	0	0	110.7	N334 Y337	S332-N334 PolarHBondContact OG-N 3.41Å; S332-Y337 PolarHBondContact O-OH 3.27Å
333	T	74.1	Confident	79.9	Confident	51 Å²	51	49 Å²	49	31%	0.313	27%	0.266	S	S	.	.	S	Bend	trans	-90.9	-10.7	169.5	50.9	0	0	0	0	113.6	I325 Y337	I325-T333 HydrophobicContact CG2-CG2 4.19Å; T333-Y337 WeakPolarHBondContact CA-OH 3.48Å; T333-Y337 PolarHBondContact O-OH 2.62Å
334	N	72.4	Confident	79.6	Confident	142 Å²	142	49.6 Å²	49.6	76%	0.759	27%	0.269	S	S	*	.	S	Bend	trans	-108.8	21.1	-168.7	-60.4	12.3	0	0	0	112.9	S332 Y337	S332-N334 PolarHBondContact OG-N 3.41Å; N334-Y337 PolarHBondContact N-OH 3.28Å
335	G	71.6	Confident	79.5	Confident	41 Å²	41	49 Å²	49	42%	0.423	27%	0.266	S	S	.	.	S	Bend	trans	-86	173.1	177.2	0	0	0	0	0	113	Y337	G335-Y337 PolarHBondContact N-OH 3.4Å; G335-Y337 WeakPolarHBondContact O-CD2 3.24Å; G335-Y337 WeakPolarHBondContact O-CE2 3.39Å
336	N	74.9	Confident	79.3	Confident	114 Å²	114	54 Å²	54	61%	0.61	29%	0.289	S	S	*	.			trans	-91.4	127	163.5	-175.3	-21	0	0	0	108.7	D338	N336-D338 WeakPolarHBondContact OD1-CB 3.3Å; N336-D338 VanDerWaalsContact OD1-CG 3.28Å; N336-D338 PolarHBondContact OD1-N 3.17Å; N336-D338 PolarHBondContact OD1-OD2 3.41Å
337	Y	80.4	Confident	79.1	Confident	3 Å²	3	59.1 Å²	59.1	1%	0.012	32%	0.315	C	S	.	.			trans	-117.8	0.9	-177.6	-46.2	-79.3	0	0	0	113.5	I325 S332 T333 N334 G335 G339 V340 L341 M381 F383 M411	I325-Y337 HydrophobicContact CD1-CD1 4.39Å; I325-Y337 HydrophobicContact CD1-CD2 4.35Å; I325-Y337 HydrophobicContact CD1-CE1 3.78Å; I325-Y337 HydrophobicContact CD1-CE2 3.75Å; I325-Y337 VanDerWaalsContact CD1-CZ 3.44Å; S332-Y337 PolarHBondContact O-OH 3.27Å; T333-Y337 WeakPolarHBondContact CA-OH 3.48Å; T333-Y337 PolarHBondContact O-OH 2.62Å; N334-Y337 PolarHBondContact N-OH 3.28Å; G335-Y337 PolarHBondContact N-OH 3.4Å; G335-Y337 WeakPolarHBondContact O-CD2 3.24Å; G335-Y337 WeakPolarHBondContact O-CE2 3.39Å; Y337-G339 VanDerWaalsContact C-N 3.33Å; Y337-G339 PolarHBondContact O-N 3.16Å; Y337-V340 WeakPolarHBondContact O-CA 3.39Å; Y337-V340 WeakPolarHBondContact O-CB 3.24Å; Y337-V340 PolarHBondContact O-N 3Å; Y337-L341 PolarHBondContact O-N 3.07Å; Y337-M381 HydrophobicContact CD1-CE 3.88Å; Y337-M381 HydrophobicContact CD1-SD 3.66Å; Y337-M381 HydrophobicContact CE1-CE 3.82Å; Y337-M381 HydrophobicContact CE1-SD 4.01Å; Y337-F383 HydrophobicContact CD1-CZ 4.4Å; Y337-F383 HydrophobicContact CG-CZ 4.18Å; Y337-M411 HydrophobicContact CD2-CE 3.9Å; Y337-M411 HydrophobicContact CD2-SD 4Å; Y337-M411 HydrophobicContact CE2-SD 4.46Å; Y337-M411 HydrophobicContact CG-CE 4.5Å
338	D	80.4	Confident	79	Confident	104 Å²	104	61.8 Å²	61.8	56%	0.556	33%	0.332	S	S	*	.	H	α-helix	trans	-58.8	-44.2	-168.6	-61.3	-18.4	0	0	0	111.6	N336 V340 L341 Y342	N336-D338 WeakPolarHBondContact OD1-CB 3.3Å; N336-D338 VanDerWaalsContact OD1-CG 3.28Å; N336-D338 PolarHBondContact OD1-N 3.17Å; N336-D338 PolarHBondContact OD1-OD2 3.41Å; D338-V340 VanDerWaalsContact C-N 3.29Å; D338-V340 PolarHBondContact O-N 3.42Å; D338-L341 PolarHBondContact O-N 3.18Å; D338-Y342 VanDerWaalsContact O-CB 3.27Å; D338-Y342 WeakPolarHBondContact O-CB 3.43Å; D338-Y342 PolarHBondContact O-N 2.88Å
339	G	79.3	Confident	79.1	Confident	42 Å²	42	63.8 Å²	63.8	43%	0.433	34%	0.339	S	S	.	.	H	α-helix	trans	-66.9	-25.2	176.7	0	0	0	0	0	114.3	Y337 Q364	Y337-G339 VanDerWaalsContact C-N 3.33Å; Y337-G339 PolarHBondContact O-N 3.16Å; G339-Q364 VanDerWaalsContact C-NE2 3.31Å; G339-Q364 PolarHBondContact O-NE2 3.32Å; G339-Q364 VanDerWaalsContact O-NE2 3.07Å
340	V	80.7	Confident	79.6	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.03	34%	0.338	C	S	.	.	H	α-helix	trans	-75.1	-49.8	174.6	-157.7	0	0	0	0	109.6	Y337 D338 R343 H344 V359 T361 I367	Y337-V340 WeakPolarHBondContact O-CA 3.39Å; Y337-V340 WeakPolarHBondContact O-CB 3.24Å; Y337-V340 PolarHBondContact O-N 3Å; D338-V340 VanDerWaalsContact C-N 3.29Å; D338-V340 PolarHBondContact O-N 3.42Å; V340-R343 PolarHBondContact O-N 2.78Å; V340-H344 PolarHBondContact O-N 3.35Å; V340-V359 HydrophobicContact CB-CG1 4.37Å; V340-V359 HydrophobicContact CG1-CG1 3.47Å; V340-V359 VanDerWaalsContact CG1-CG1 3.47Å; V340-T361 HydrophobicContact CG1-CG2 3.72Å; V340-I367 HydrophobicContact CG2-CD1 3.45Å; V340-I367 VanDerWaalsContact CG2-CD1 3.45Å
341	L	84.9	Confident	80.3	Confident	6 Å²	6	58 Å²	58	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-42.6	-178.4	-67.9	167.7	0	0	0	111	I323 Y337 D338 R343 H344 F345 V359 F383 L409 M411	I323-L341 HydrophobicContact CD1-CD1 3.89Å; I323-L341 HydrophobicContact CD1-CD2 3.82Å; Y337-L341 PolarHBondContact O-N 3.07Å; D338-L341 PolarHBondContact O-N 3.18Å; L341-R343 PolarHBondContact O-N 3.11Å; L341-H344 WeakPolarHBondContact O-CB 3.41Å; L341-H344 PolarHBondContact O-N 3.16Å; L341-F345 HydrophobicContact CD2-CE2 4.29Å; L341-F345 VanDerWaalsContact O-CD2 3.28Å; L341-F345 WeakPolarHBondContact O-CD2 3.44Å; L341-F345 PolarHBondContact O-N 3.49Å; L341-V359 HydrophobicContact CD2-CG2 4.32Å; L341-F383 HydrophobicContact CD1-CE1 4.42Å; L341-F383 HydrophobicContact CD1-CZ 4.49Å; L341-F383 HydrophobicContact CD2-CD2 4.09Å; L341-F383 HydrophobicContact CD2-CE1 4.35Å; L341-F383 HydrophobicContact CD2-CE2 3.9Å; L341-F383 HydrophobicContact CD2-CG 4.38Å; L341-F383 HydrophobicContact CD2-CZ 4.04Å; L341-F383 HydrophobicContact CG-CZ 4.41Å; L341-L409 HydrophobicContact CB-CD1 4.4Å; L341-L409 HydrophobicContact CD1-CD2 4.28Å; L341-M411 HydrophobicContact CD1-CE 3.58Å
342	Y	84.8	Confident	80.8	Confident	142 Å²	142	58 Å²	58	56%	0.557	31%	0.312	S	S	*	.	H	α-helix	trans	-55.9	-48.9	174.6	-176	-101.8	0	0	0	111.9	D338 H344 F345 Q346 T404	D338-Y342 VanDerWaalsContact O-CB 3.27Å; D338-Y342 WeakPolarHBondContact O-CB 3.43Å; D338-Y342 PolarHBondContact O-N 2.88Å; Y342-H344 VanDerWaalsContact C-N 3.29Å; Y342-H344 PolarHBondContact O-N 3.01Å; Y342-F345 PolarHBondContact O-N 2.8Å; Y342-Q346 HydrophobicContact CE1-CG 4.47Å; Y342-Q346 WeakPolarHBondContact O-CG 3.42Å; Y342-Q346 PolarHBondContact O-N 3.24Å; Y342-T404 HydrophobicContact CD2-CG2 3.78Å; Y342-T404 HydrophobicContact CE2-CG2 3.66Å
343	R	83.3	Confident	81.3	Confident	127 Å²	127	58.6 Å²	58.6	48%	0.479	31%	0.308	S	S	.	.	H	α-helix	trans	-63.5	-34	175.6	176.8	177.7	-88.7	171.4	-0.5	112.4	V340 L341	V340-R343 PolarHBondContact O-N 2.78Å; L341-R343 PolarHBondContact O-N 3.11Å
344	H	83.6	Confident	81.7	Confident	14 Å²	14	57.9 Å²	57.9	7%	0.065	31%	0.311	C	S	.	.	H	α-helix	trans	-67.8	-40.4	-179.5	-172.1	77.4	0	0	0	113.1	V340 L341 Y342 R349 C358 V359	V340-H344 PolarHBondContact O-N 3.35Å; L341-H344 WeakPolarHBondContact O-CB 3.41Å; L341-H344 PolarHBondContact O-N 3.16Å; Y342-H344 VanDerWaalsContact C-N 3.29Å; Y342-H344 PolarHBondContact O-N 3.01Å; H344-R349 VanDerWaalsContact NE2-CD 3.25Å; H344-R349 WeakPolarHBondContact NE2-CD 3.37Å; H344-R349 PolarHBondContact NE2-NE 3.45Å; H344-R349 PolarHBondContact O-NE 3.48Å; H344-C358 PolarHBondContact CE1-O 2.96Å; H344-C358 VanDerWaalsContact CE1-O 3.24Å; H344-V359 HydrophobicContact CB-CG1 3.97Å; H344-V359 HydrophobicContact CB-CG2 4.46Å
345	F	86.8	Confident	82.3	Confident	7 Å²	7	51.8 Å²	51.8	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-91.7	4.4	-179.2	-67.2	-68.7	0	0	0	114.5	L321 L341 Y342 I347 V351 L357 A402 D403 T404 L409	L321-F345 HydrophobicContact CD2-CE1 4.27Å; L321-F345 HydrophobicContact CD2-CE2 4.49Å; L321-F345 HydrophobicContact CD2-CZ 3.92Å; L341-F345 HydrophobicContact CD2-CE2 4.29Å; L341-F345 VanDerWaalsContact O-CD2 3.28Å; L341-F345 WeakPolarHBondContact O-CD2 3.44Å; L341-F345 PolarHBondContact O-N 3.49Å; Y342-F345 PolarHBondContact O-N 2.8Å; F345-I347 PolarHBondContact O-N 2.72Å; F345-I347 VanDerWaalsContact O-N 3.17Å; F345-V351 HydrophobicContact CE1-CG1 4.29Å; F345-L357 HydrophobicContact CZ-CD1 3.92Å; F345-A402 HydrophobicContact CD1-CB 3.76Å; F345-A402 HydrophobicContact CE1-CB 3.66Å; F345-D403 VanDerWaalsContact O-OD1 3.1Å; F345-T404 HydrophobicContact CB-CG2 4.4Å; F345-L409 HydrophobicContact CD2-CD1 3.89Å; F345-L409 HydrophobicContact CE2-CD1 3.55Å; F345-L409 HydrophobicContact CZ-CD1 4.47Å
346	Q	84.6	Confident	83	Confident	105 Å²	105	50.2 Å²	50.2	49%	0.491	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-18	166.9	-84.5	170.7	9.1	0	0	113.6	Y342	Y342-Q346 HydrophobicContact CE1-CG 4.47Å; Y342-Q346 WeakPolarHBondContact O-CG 3.42Å; Y342-Q346 PolarHBondContact O-N 3.24Å
347	I	81.4	Confident	83.5	Confident	109 Å²	109	45.5 Å²	45.5	56%	0.559	24%	0.235	S	C	*	.	S	Bend	trans	-114.2	128.3	170.8	-60.4	172.6	0	0	0	105.6	F345 R349	F345-I347 PolarHBondContact O-N 2.72Å; F345-I347 VanDerWaalsContact O-N 3.17Å; I347-R349 PolarHBondContact O-N 3.42Å
348	P	81.1	Confident	83.6	Confident	69 Å²	69	46.3 Å²	46.3	45%	0.448	24%	0.241	S	C	.	.			trans	-62.6	129.1	-179.4	23.6	-33.4	0	0	0	111.1	F317 A402 D403	F317-P348 HydrophobicContact CE1-CB 4.45Å; P348-A402 VanDerWaalsContact CA-O 3.31Å; P348-A402 WeakPolarHBondContact CA-O 3.47Å; P348-D403 HydrophobicContact CB-CB 4.24Å
349	R	83.5	Confident	83.8	Confident	51 Å²	51	41.4 Å²	41.4	19%	0.192	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	151.8	-177.3	-71.6	177	-170	-77.9	-3.1	111.8	D203 H344 I347 L401 A402	D203-R349 IonicContact OD2-CZ 2.78Å; D203-R349 IonicContact OD2-NH1 2.65Å; D203-R349 PolarHBondContact OD2-NH1 2.74Å; H344-R349 VanDerWaalsContact NE2-CD 3.25Å; H344-R349 WeakPolarHBondContact NE2-CD 3.37Å; H344-R349 PolarHBondContact NE2-NE 3.45Å; H344-R349 PolarHBondContact O-NE 3.48Å; I347-R349 PolarHBondContact O-N 3.42Å; R349-L401 CarbonylContact O-C 3.56Å; R349-L401 WeakPolarHBondContact O-CA 3.47Å; R349-A402 PolarHBondContact N-O 2.84Å; R349-A402 PolarHBondContact O-N 3.47Å
350	V	84.6	Confident	83.6	Confident	14 Å²	14	42.4 Å²	42.4	9%	0.085	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	137.5	170.5	178	0	0	0	0	109.4	W222 L239 Q352 A399 Y400 L401	W222-V350 HydrophobicContact CE3-CG2 4.22Å; W222-V350 HydrophobicContact CH2-CG2 3.58Å; W222-V350 HydrophobicContact CZ3-CG2 3.28Å; L239-V350 HydrophobicContact CB-CG1 4.18Å; V350-Q352 HydrophobicContact CG1-CG 4.16Å; V350-A399 HydrophobicContact CG1-CB 4.47Å; V350-Y400 CarbonylContact C-O 3.17Å; V350-Y400 WeakPolarHBondContact CA-O 3.48Å; V350-L401 HydrophobicContact CG2-CD2 3.97Å
351	V	85.1	Confident	83.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.9	170.5	-67.2	0	0	0	0	109.6	L321 F345 L357 V385 T388 Y400 A402	L321-V351 HydrophobicContact CD1-CB 4.29Å; L321-V351 HydrophobicContact CD1-CG1 4.43Å; L321-V351 HydrophobicContact CD1-CG2 4.16Å; L321-V351 HydrophobicContact CD2-CG1 4.33Å; F345-V351 HydrophobicContact CE1-CG1 4.29Å; V351-L357 HydrophobicContact CG1-CD1 4.19Å; V351-L357 HydrophobicContact CG1-CD2 4.34Å; V351-V385 HydrophobicContact CB-CG2 4.4Å; V351-V385 HydrophobicContact CG1-CG2 4.5Å; V351-T388 HydrophobicContact CG2-CG2 4.14Å; V351-Y400 PolarHBondContact N-O 2.89Å; V351-Y400 PolarHBondContact O-N 3.38Å; V351-A402 HydrophobicContact CG1-CB 3.9Å; V351-A402 HydrophobicContact CG2-CB 3.93Å
352	Q	85.9	Confident	82	Confident	11 Å²	11	48.2 Å²	48.2	5%	0.051	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	154.9	173.4	-48.1	-172.9	-120.6	0	0	110.6	V350 G354 D355 V385 A399	V350-Q352 HydrophobicContact CG1-CG 4.16Å; Q352-G354 PolarHBondContact O-N 3.39Å; Q352-D355 WeakPolarHBondContact CB-OD2 3.31Å; Q352-D355 PolarHBondContact N-OD2 3.03Å; Q352-D355 WeakPolarHBondContact O-CB 3.33Å; Q352-D355 PolarHBondContact O-N 3.23Å; Q352-V385 VanDerWaalsContact O-CB 3.29Å; Q352-V385 WeakPolarHBondContact O-CB 3.41Å; Q352-V385 WeakPolarHBondContact O-CG1 3.26Å; Q352-A399 HydrophobicContact CG-CB 3.74Å
353	E	84.8	Confident	80.6	Confident	74 Å²	74	44.6 Å²	44.6	35%	0.346	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	115.7	-179.6	-59.7	-164.8	147.8	0	0	112.2	R236 K387 T388	R236-E353 PolarHBondContact NH1-O 3.29Å; E353-K387 VanDerWaalsContact OE1-CA 3.23Å; E353-K387 WeakPolarHBondContact OE1-CA 3.44Å; E353-K387 WeakPolarHBondContact OE1-CG 3.41Å; E353-T388 HydrophobicContact CG-CG2 4.41Å; E353-T388 WeakPolarHBondContact CG-OG1 3.44Å; E353-T388 PolarHBondContact OE1-N 3.13Å
354	G	80.7	Confident	79.2	Confident	36 Å²	36	41.2 Å²	41.2	37%	0.371	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	111.6	-18.5	-177.2	0	0	0	0	0	114.6	Q352 K384 V385	Q352-G354 PolarHBondContact O-N 3.39Å; G354-K384 WeakPolarHBondContact O-CE 3.48Å; G354-V385 WeakPolarHBondContact CA-O 3.39Å; G354-V385 PolarHBondContact N-O 3.23Å
355	D	85.4	Confident	77.5	Confident	13 Å²	13	46 Å²	46	7%	0.07	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-63.2	146.6	-174.6	-73.5	1.9	0	0	0	113.2	H238 Q352 K384 V385	H238-D355 IonicContact CD2-OD1 2.92Å; H238-D355 PolarHBondContact CD2-OD1 3.49Å; H238-D355 IonicContact NE2-OD1 2.81Å; H238-D355 PolarHBondContact NE2-OD1 3.42Å; Q352-D355 WeakPolarHBondContact CB-OD2 3.31Å; Q352-D355 PolarHBondContact N-OD2 3.03Å; Q352-D355 WeakPolarHBondContact O-CB 3.33Å; Q352-D355 PolarHBondContact O-N 3.23Å; D355-K384 WeakPolarHBondContact O-CA 3.43Å; D355-V385 HydrophobicContact CB-CG2 4.38Å; D355-V385 PolarHBondContact O-N 2.87Å
356	V	86.4	Confident	75.7	Confident	8 Å²	8	54.3 Å²	54.3	5%	0.048	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	120	167.4	-179.2	0	0	0	0	109.8	F279 N280 F382	F279-V356 HydrophobicContact CD1-CB 4.48Å; F279-V356 HydrophobicContact CE1-CB 4.19Å; F279-V356 HydrophobicContact CE1-CG2 3.88Å; N280-V356 PolarHBondContact OD1-N 3.37Å; N280-V356 VanDerWaalsContact OD1-N 3.15Å; V356-F382 HydrophobicContact CG1-CB 4.1Å; V356-F382 HydrophobicContact CG1-CD1 4.13Å
357	L	85.9	Confident	74	Confident	15 Å²	15	51.4 Å²	51.4	8%	0.079	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	132.8	176.2	-57.2	178	0	0	0	110.2	F345 V351 F382 F383 V385	F345-L357 HydrophobicContact CZ-CD1 3.92Å; V351-L357 HydrophobicContact CG1-CD1 4.19Å; V351-L357 HydrophobicContact CG1-CD2 4.34Å; L357-F382 WeakPolarHBondContact O-CA 3.44Å; L357-F383 PolarHBondContact N-O 2.97Å; L357-F383 PolarHBondContact O-N 3.07Å; L357-F383 VanDerWaalsContact O-N 3.09Å; L357-V385 HydrophobicContact CD1-CG2 3.82Å; L357-V385 HydrophobicContact CD2-CG2 4.47Å; L357-V385 HydrophobicContact CG-CG2 3.98Å
358	C	83.3	Confident	72.6	Confident	20 Å²	20	48.2 Å²	48.2	14%	0.135	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	112.6	174	179.4	0	0	0	0	110.5	T276 H344 P360 F382 L422	T276-C358 HydrophobicContact CG2-CB 3.46Å; T276-C358 VanDerWaalsContact CG2-CB 3.46Å; H344-C358 PolarHBondContact CE1-O 2.96Å; H344-C358 VanDerWaalsContact CE1-O 3.24Å; C358-P360 WeakPolarHBondContact O-CD 3.46Å; C358-F382 HydrophobicContact CB-CD1 4.19Å; C358-F382 HydrophobicContact CB-CE1 3.89Å; C358-L422 HydrophobicContact CB-CD1 4.32Å
359	V	83.3	Confident	70.6	Confident	1 Å²	1	54 Å²	54	1%	0.006	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	110.4	-174.8	178.4	0	0	0	0	110.1	V340 L341 H344 E380 M381 F383	V340-V359 HydrophobicContact CB-CG1 4.37Å; V340-V359 HydrophobicContact CG1-CG1 3.47Å; V340-V359 VanDerWaalsContact CG1-CG1 3.47Å; L341-V359 HydrophobicContact CD2-CG2 4.32Å; H344-V359 HydrophobicContact CB-CG1 3.97Å; H344-V359 HydrophobicContact CB-CG2 4.46Å; V359-E380 CarbonylContact O-C 3.56Å; V359-E380 WeakPolarHBondContact O-CA 3.47Å; V359-M381 PolarHBondContact N-O 3.38Å; V359-M381 PolarHBondContact O-N 2.81Å; V359-F383 HydrophobicContact CB-CD2 4.17Å; V359-F383 HydrophobicContact CB-CE2 4.05Å; V359-F383 HydrophobicContact CG2-CD2 3.62Å; V359-F383 HydrophobicContact CG2-CE2 3.92Å
360	P	75.6	Confident	68.5	Low	63 Å²	63	55.2 Å²	55.2	41%	0.409	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	128.5	179.3	30	-33.6	0	0	0	112.2	C358 I362 R379	C358-P360 WeakPolarHBondContact O-CD 3.46Å; P360-I362 VanDerWaalsContact C-N 3.35Å; P360-R379 CarbonylContact C-O 3.58Å; P360-R379 WeakPolarHBondContact CA-O 3.33Å
361	T	70.5	Confident	66.5	Low	11 Å²	11	57 Å²	57	7%	0.067	34%	0.342	C	S	.	.			trans	-93.8	16.2	-179.1	47.2	0	0	0	0	113.3	V340 G363 W378 R379 M381	V340-T361 HydrophobicContact CG1-CG2 3.72Å; T361-G363 PolarHBondContact O-N 3.11Å; T361-W378 PolarHBondContact OG1-O 3.33Å; T361-R379 PolarHBondContact N-O 2.82Å; T361-R379 VanDerWaalsContact OG1-CA 3.29Å; T361-R379 WeakPolarHBondContact OG1-CA 3.46Å; T361-R379 PolarHBondContact OG1-N 3.01Å; T361-R379 PolarHBondContact OG1-O 2.9Å; T361-M381 HydrophobicContact CG2-CE 3.97Å; T361-M381 HydrophobicContact CG2-CG 3.88Å; T361-M381 HydrophobicContact CG2-SD 3.77Å
362	I	62.4	Low	64.3	Low	123 Å²	123	63.6 Å²	63.6	63%	0.631	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	117.7	-177.2	-60	174.3	0	0	0	110	P360	P360-I362 VanDerWaalsContact C-N 3.35Å
363	G	53.5	Low	62	Low	65 Å²	65	71.2 Å²	71.2	67%	0.67	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.1	20.1	174.3	0	0	0	0	0	115.9	T361	T361-G363 PolarHBondContact O-N 3.11Å
364	Q	53.8	Low	59.8	Low	57 Å²	57	77 Å²	77	27%	0.266	44%	0.444	S	S	.	.			trans	-117.6	132	166.4	-80.2	161.6	-26.3	0	0	110	G339 I367	G339-Q364 VanDerWaalsContact C-NE2 3.31Å; G339-Q364 PolarHBondContact O-NE2 3.32Å; G339-Q364 VanDerWaalsContact O-NE2 3.07Å; Q364-I367 HydrophobicContact CB-CD1 4.4Å
365	V	49.7	Very low	57.8	Low	114 Å²	114	81.7 Å²	81.7	69%	0.691	46%	0.46	S	S	*	.			trans	-102	-27.9	-179.5	-179.2	0	0	0	0	111.3	I367 L368	V365-I367 PolarHBondContact O-N 2.84Å; V365-I367 VanDerWaalsContact O-N 3.14Å; V365-L368 HydrophobicContact CG1-CD1 4.35Å; V365-L368 WeakPolarHBondContact O-CB 3.49Å; V365-L368 WeakPolarHBondContact O-CD1 3.45Å; V365-L368 WeakPolarHBondContact O-CG 3.45Å; V365-L368 PolarHBondContact O-N 2.95Å
366	E	47.4	Very low	55.9	Low	181 Å²	181	83 Å²	83	85%	0.846	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-69.8	-11.6	-169.1	-64.7	166.5	-177.1	0	0	114.9	L368	E366-L368 VanDerWaalsContact C-N 3.29Å; E366-L368 PolarHBondContact O-N 2.82Å
367	I	50.6	Low	54.1	Low	45 Å²	45	93 Å²	93	23%	0.231	51%	0.506	C	S	.	.	G	3₁₀ helix	trans	-84.7	-4.9	-179.7	-60.4	172	0	0	0	111.6	V340 Q364 V365 W378 M381	V340-I367 HydrophobicContact CG2-CD1 3.45Å; V340-I367 VanDerWaalsContact CG2-CD1 3.45Å; Q364-I367 HydrophobicContact CB-CD1 4.4Å; V365-I367 PolarHBondContact O-N 2.84Å; V365-I367 VanDerWaalsContact O-N 3.14Å; I367-W378 HydrophobicContact CG2-CE3 3.62Å; I367-W378 HydrophobicContact CG2-CZ3 3.43Å; I367-W378 VanDerWaalsContact CG2-CZ3 3.43Å; I367-M381 HydrophobicContact CG2-CE 4.17Å
368	L	50.3	Low	52.7	Low	42 Å²	42	95.1 Å²	95.1	22%	0.22	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-86.8	-5.1	-168.1	-71.1	167.1	0	0	0	116.3	V365 E366 G370 L375 P376	V365-L368 HydrophobicContact CG1-CD1 4.35Å; V365-L368 WeakPolarHBondContact O-CB 3.49Å; V365-L368 WeakPolarHBondContact O-CD1 3.45Å; V365-L368 WeakPolarHBondContact O-CG 3.45Å; V365-L368 PolarHBondContact O-N 2.95Å; E366-L368 VanDerWaalsContact C-N 3.29Å; E366-L368 PolarHBondContact O-N 2.82Å; L368-G370 VanDerWaalsContact C-N 3.29Å; L368-G370 PolarHBondContact O-N 3.1Å; L368-L375 HydrophobicContact CB-CD2 4.38Å; L368-L375 HydrophobicContact CD1-CD2 4.19Å; L368-L375 HydrophobicContact CD2-CD2 4.5Å; L368-P376 WeakPolarHBondContact CD2-O 3.49Å
369	E	39.9	Very low	51.5	Low	190 Å²	190	98.4 Å²	98.4	89%	0.888	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-82.1	4.6	-169.6	-60.6	-165.3	146.4	0	0	115.3
370	G	40.4	Very low	51.1	Low	76 Å²	76	100.9 Å²	100.9	78%	0.784	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-88.1	-9.3	-169.8	0	0	0	0	0	118.2	L368	L368-G370 VanDerWaalsContact C-N 3.29Å; L368-G370 PolarHBondContact O-N 3.1Å
371	S	40.6	Very low	51.3	Low	52 Å²	52	97.9 Å²	97.9	36%	0.364	51%	0.514	S	S	.	.			trans	-153.4	129.4	-176.6	62.6	0	0	0	0	114.2	E373	S371-E373 VanDerWaalsContact C-N 3.28Å; S371-E373 PolarHBondContact O-N 3.06Å
372	P	39.3	Very low	52	Low	138 Å²	138	98.4 Å²	98.4	90%	0.896	52%	0.516	S	S	*	.	S	Bend	trans	-73.6	-14.2	-179.2	30.1	-35.6	0	0	0	114.1	K374	P372-K374 PolarHBondContact O-N 3.22Å; P372-K374 VanDerWaalsContact O-N 3.14Å
373	E	37.3	Very low	53.2	Low	172 Å²	172	92.6 Å²	92.6	80%	0.804	49%	0.486	S	S	*	.	S	Bend	trans	-84	88	178.3	-66.4	-170.2	-178.8	0	0	111.9	S371	S371-E373 VanDerWaalsContact C-N 3.28Å; S371-E373 PolarHBondContact O-N 3.06Å
374	K	39.8	Very low	54.9	Low	194 Å²	194	92.7 Å²	92.7	84%	0.843	47%	0.468	S	S	*	.	S	Bend	trans	55.2	85.4	164.5	-61.9	177.4	179.8	174.2	0	116.2	P372 P376	P372-K374 PolarHBondContact O-N 3.22Å; P372-K374 VanDerWaalsContact O-N 3.14Å; K374-P376 WeakPolarHBondContact O-CD 3.44Å
375	L	37.4	Very low	56.6	Low	135 Å²	135	90 Å²	90	71%	0.707	46%	0.455	S	S	*	.			trans	7.8	75.7	156.8	-81.1	162.2	0	0	0	115.4	L368 R377	L368-L375 HydrophobicContact CB-CD2 4.38Å; L368-L375 HydrophobicContact CD1-CD2 4.19Å; L368-L375 HydrophobicContact CD2-CD2 4.5Å; L375-R377 PolarHBondContact O-N 3.31Å
376	P	45.4	Very low	58.3	Low	41 Å²	41	89.6 Å²	89.6	27%	0.266	44%	0.444	S	S	.	.			trans	-80.3	99	179.8	32.1	-31.4	0	0	0	107.3	L368 K374 W378	L368-P376 WeakPolarHBondContact CD2-O 3.49Å; K374-P376 WeakPolarHBondContact O-CD 3.44Å; P376-W378 HydrophobicContact CG-CZ2 4.44Å; P376-W378 PolarHBondContact O-N 2.88Å
377	R	49.3	Very low	60.1	Low	217 Å²	217	86 Å²	86	82%	0.819	43%	0.426	S	S	*	.			trans	-65.4	80.5	167	-72.5	-176.3	178.7	173.8	0.1	108.8	L375 R379	L375-R377 PolarHBondContact O-N 3.31Å; R377-R379 PolarHBondContact O-N 2.94Å
378	W	56.2	Low	61.7	Low	60 Å²	60	84.1 Å²	84.1	23%	0.227	42%	0.417	C	S	.	.			trans	-52.1	130.6	166.9	-55.7	-24.2	0	0	0	107.3	H330 T361 I367 P376 M381	H330-W378 PolarHBondContact O-NE1 3.34Å; T361-W378 PolarHBondContact OG1-O 3.33Å; I367-W378 HydrophobicContact CG2-CE3 3.62Å; I367-W378 HydrophobicContact CG2-CZ3 3.43Å; I367-W378 VanDerWaalsContact CG2-CZ3 3.43Å; P376-W378 HydrophobicContact CG-CZ2 4.44Å; P376-W378 PolarHBondContact O-N 2.88Å; W378-M381 HydrophobicContact CD2-CE 4.49Å; W378-M381 HydrophobicContact CE3-CE 3.45Å; W378-M381 VanDerWaalsContact CE3-CE 3.45Å; W378-M381 HydrophobicContact CZ3-CE 3.87Å
379	R	59.6	Low	63.2	Low	90 Å²	90	83.4 Å²	83.4	34%	0.34	42%	0.417	S	S	.	.			trans	-106.4	-30.9	-179.4	-70.9	-177.3	177.7	-174.7	0.5	112.7	P360 T361 R377 S424	P360-R379 CarbonylContact C-O 3.58Å; P360-R379 WeakPolarHBondContact CA-O 3.33Å; T361-R379 PolarHBondContact N-O 2.82Å; T361-R379 VanDerWaalsContact OG1-CA 3.29Å; T361-R379 WeakPolarHBondContact OG1-CA 3.46Å; T361-R379 PolarHBondContact OG1-N 3.01Å; T361-R379 PolarHBondContact OG1-O 2.9Å; R377-R379 PolarHBondContact O-N 2.94Å; R379-S424 WeakPolarHBondContact CD-OG 3.47Å; R379-S424 PolarHBondContact NH1-OG 3.18Å; R379-S424 VanDerWaalsContact NH1-OG 3.12Å
380	E	73.4	Confident	64.8	Low	52 Å²	52	75.7 Å²	75.7	24%	0.243	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	138.9	-172	-76.1	152.3	-159.9	0	0	108.4	V359 F382 L422	V359-E380 CarbonylContact O-C 3.56Å; V359-E380 WeakPolarHBondContact O-CA 3.47Å; E380-F382 HydrophobicContact CB-CZ 4.44Å; E380-L422 WeakPolarHBondContact OE2-CB 3.3Å
381	M	79.8	Confident	65.9	Low	0 Å²	0	78.3 Å²	78.3	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	154.5	173.4	-71.9	177.9	171.8	0	0	109.5	Y331 Y337 V359 T361 I367 W378 F383	Y331-M381 HydrophobicContact CD1-CG 4.15Å; Y331-M381 HydrophobicContact CE1-CB 4.38Å; Y331-M381 HydrophobicContact CE1-CG 4.36Å; Y331-M381 HydrophobicContact CG-CG 4.44Å; Y337-M381 HydrophobicContact CD1-CE 3.88Å; Y337-M381 HydrophobicContact CD1-SD 3.66Å; Y337-M381 HydrophobicContact CE1-CE 3.82Å; Y337-M381 HydrophobicContact CE1-SD 4.01Å; V359-M381 PolarHBondContact N-O 3.38Å; V359-M381 PolarHBondContact O-N 2.81Å; T361-M381 HydrophobicContact CG2-CE 3.97Å; T361-M381 HydrophobicContact CG2-CG 3.88Å; T361-M381 HydrophobicContact CG2-SD 3.77Å; I367-M381 HydrophobicContact CG2-CE 4.17Å; W378-M381 HydrophobicContact CD2-CE 4.49Å; W378-M381 HydrophobicContact CE3-CE 3.45Å; W378-M381 VanDerWaalsContact CE3-CE 3.45Å; W378-M381 HydrophobicContact CZ3-CE 3.87Å; M381-F383 HydrophobicContact CB-CE2 3.81Å; M381-F383 HydrophobicContact CB-CZ 4.46Å; M381-F383 HydrophobicContact SD-CZ 4.44Å
382	F	86	Confident	66.7	Low	23 Å²	23	78.6 Å²	78.6	10%	0.101	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.4	-177.4	-57.4	-76.8	0	0	0	111.2	V326 Y331 V356 L357 C358 E380 V419 P420 L422	V326-F382 HydrophobicContact CB-CB 4.1Å; V326-F382 HydrophobicContact CG2-CB 4.05Å; V326-F382 PolarHBondContact N-O 3.36Å; Y331-F382 HydrophobicContact CE1-CD2 4.25Å; Y331-F382 PolarHBondContact OH-N 3.22Å; Y331-F382 PolarHBondContact OH-O 3.41Å; V356-F382 HydrophobicContact CG1-CB 4.1Å; V356-F382 HydrophobicContact CG1-CD1 4.13Å; L357-F382 WeakPolarHBondContact O-CA 3.44Å; C358-F382 HydrophobicContact CB-CD1 4.19Å; C358-F382 HydrophobicContact CB-CE1 3.89Å; E380-F382 HydrophobicContact CB-CZ 4.44Å; F382-V419 HydrophobicContact CB-CG2 3.98Å; F382-V419 HydrophobicContact CD1-CG1 3.93Å; F382-V419 HydrophobicContact CD1-CG2 4.47Å; F382-V419 HydrophobicContact CD2-CB 4.39Å; F382-V419 HydrophobicContact CD2-CG1 3.48Å; F382-V419 VanDerWaalsContact CD2-CG1 3.48Å; F382-V419 HydrophobicContact CD2-CG2 3.92Å; F382-V419 HydrophobicContact CE1-CG1 3.8Å; F382-V419 HydrophobicContact CE2-CG1 3.35Å; F382-V419 HydrophobicContact CG-CB 4.48Å; F382-V419 HydrophobicContact CG-CG1 3.78Å; F382-V419 HydrophobicContact CG-CG2 3.84Å; F382-V419 HydrophobicContact CZ-CG1 3.51Å; F382-P420 HydrophobicContact CD1-CG 4.24Å; F382-P420 HydrophobicContact CE1-CG 3.87Å; F382-L422 HydrophobicContact CE1-CD1 3.64Å; F382-L422 HydrophobicContact CZ-CD1 3.75Å
383	F	87.8	Confident	67.3	Low	1 Å²	1	76.3 Å²	76.3	0%	0.004	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.7	177.6	-63.4	-91.5	0	0	0	108.9	I323 E324 I325 Y337 L341 L357 V359 M381 M411	I323-F383 HydrophobicContact CD1-CB 4.3Å; I323-F383 HydrophobicContact CD1-CD1 3.86Å; I323-F383 HydrophobicContact CD1-CE1 4.49Å; I323-F383 HydrophobicContact CD1-CG 4.2Å; E324-F383 CarbonylContact O-C 3.57Å; E324-F383 WeakPolarHBondContact O-CA 3.29Å; I325-F383 HydrophobicContact CB-CD1 4.04Å; I325-F383 HydrophobicContact CB-CE1 3.94Å; I325-F383 HydrophobicContact CD1-CE1 4.06Å; I325-F383 HydrophobicContact CD1-CZ 4.31Å; I325-F383 HydrophobicContact CG1-CD1 4.26Å; I325-F383 HydrophobicContact CG1-CE1 3.95Å; I325-F383 HydrophobicContact CG1-CZ 4.48Å; Y337-F383 HydrophobicContact CD1-CZ 4.4Å; Y337-F383 HydrophobicContact CG-CZ 4.18Å; L341-F383 HydrophobicContact CD1-CE1 4.42Å; L341-F383 HydrophobicContact CD1-CZ 4.49Å; L341-F383 HydrophobicContact CD2-CD2 4.09Å; L341-F383 HydrophobicContact CD2-CE1 4.35Å; L341-F383 HydrophobicContact CD2-CE2 3.9Å; L341-F383 HydrophobicContact CD2-CG 4.38Å; L341-F383 HydrophobicContact CD2-CZ 4.04Å; L341-F383 HydrophobicContact CG-CZ 4.41Å; L357-F383 PolarHBondContact N-O 2.97Å; L357-F383 PolarHBondContact O-N 3.07Å; L357-F383 VanDerWaalsContact O-N 3.09Å; V359-F383 HydrophobicContact CB-CD2 4.17Å; V359-F383 HydrophobicContact CB-CE2 4.05Å; V359-F383 HydrophobicContact CG2-CD2 3.62Å; V359-F383 HydrophobicContact CG2-CE2 3.92Å; M381-F383 HydrophobicContact CB-CE2 3.81Å; M381-F383 HydrophobicContact CB-CZ 4.46Å; M381-F383 HydrophobicContact SD-CZ 4.44Å; F383-M411 HydrophobicContact CE1-CE 4.16Å
384	K	89	Confident	67.7	Low	66 Å²	66	76.8 Å²	76.8	29%	0.287	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	132.9	176.3	-170.8	173.7	-178.1	177.6	0	110.2	I323 E324 V326 G354 D355 K386	I323-K384 CarbonylContact C-O 3.56Å; I323-K384 WeakPolarHBondContact CA-O 3.25Å; E324-K384 PolarHBondContact N-O 2.89Å; E324-K384 PolarHBondContact O-N 2.73Å; V326-K384 HydrophobicContact CG2-CB 4.29Å; G354-K384 WeakPolarHBondContact O-CE 3.48Å; D355-K384 WeakPolarHBondContact O-CA 3.43Å; K384-K386 PolarHBondContact O-N 2.9Å
385	V	88.6	Confident	68.1	Low	0 Å²	0	69.7 Å²	69.7	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	115.6	173.3	-178.2	0	0	0	0	108.8	L321 I323 V351 Q352 G354 D355 L357 T388	L321-V385 HydrophobicContact CD1-CG1 3.81Å; L321-V385 HydrophobicContact CD1-CG2 4.4Å; I323-V385 HydrophobicContact CG2-CG2 4.37Å; V351-V385 HydrophobicContact CB-CG2 4.4Å; V351-V385 HydrophobicContact CG1-CG2 4.5Å; Q352-V385 VanDerWaalsContact O-CB 3.29Å; Q352-V385 WeakPolarHBondContact O-CB 3.41Å; Q352-V385 WeakPolarHBondContact O-CG1 3.26Å; G354-V385 WeakPolarHBondContact CA-O 3.39Å; G354-V385 PolarHBondContact N-O 3.23Å; D355-V385 HydrophobicContact CB-CG2 4.38Å; D355-V385 PolarHBondContact O-N 2.87Å; L357-V385 HydrophobicContact CD1-CG2 3.82Å; L357-V385 HydrophobicContact CD2-CG2 4.47Å; L357-V385 HydrophobicContact CG-CG2 3.98Å; V385-T388 HydrophobicContact CG1-CG2 3.73Å
386	K	86.3	Confident	68.5	Low	107 Å²	107	70.2 Å²	70.2	47%	0.465	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-45.5	-179.7	-169.4	-174.3	-153.1	156.2	0	112.3	Y322 E324 K384	Y322-K386 PolarHBondContact O-N 3.45Å; E324-K386 VanDerWaalsContact CD-CD 3.47Å; E324-K386 HydrophobicContact CG-CB 4.21Å; E324-K386 HydrophobicContact CG-CD 4.22Å; E324-K386 WeakPolarHBondContact OE1-CD 3.49Å; E324-K386 WeakPolarHBondContact OE1-CE 3.23Å; E324-K386 IonicContact OE1-NZ 3.28Å; E324-K386 PolarHBondContact OE1-NZ 3.05Å; E324-K386 WeakPolarHBondContact OE2-CD 3.39Å; E324-K386 WeakPolarHBondContact OE2-CE 3.47Å; E324-K386 WeakPolarHBondContact OE2-CG 3.25Å; E324-K386 IonicContact OE2-NZ 3.9Å; K384-K386 PolarHBondContact O-N 2.9Å
387	K	85.4	Confident	68.9	Low	104 Å²	104	69.6 Å²	69.6	45%	0.452	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	143.2	-174.9	-171.7	-172.2	176.6	-164.1	0	110.9	Y322 E353	Y322-K387 HydrophobicContact CD2-CB 3.94Å; Y322-K387 HydrophobicContact CD2-CD 4.19Å; Y322-K387 HydrophobicContact CD2-CG 4.31Å; Y322-K387 HydrophobicContact CE2-CD 4.36Å; Y322-K387 HydrophobicContact CG-CB 4.37Å; Y322-K387 PolarHBondContact N-O 3.48Å; Y322-K387 PolarHBondContact O-N 3.19Å; E353-K387 VanDerWaalsContact OE1-CA 3.23Å; E353-K387 WeakPolarHBondContact OE1-CA 3.44Å; E353-K387 WeakPolarHBondContact OE1-CG 3.41Å
388	T	84.6	Confident	69.8	Low	7 Å²	7	61.3 Å²	61.3	4%	0.043	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.3	171.6	53.6	0	0	0	0	110	L321 V351 E353 V385 Y400	L321-T388 HydrophobicContact CD1-CG2 3.86Å; V351-T388 HydrophobicContact CG2-CG2 4.14Å; E353-T388 HydrophobicContact CG-CG2 4.41Å; E353-T388 WeakPolarHBondContact CG-OG1 3.44Å; E353-T388 PolarHBondContact OE1-N 3.13Å; V385-T388 HydrophobicContact CG1-CG2 3.73Å; T388-Y400 HydrophobicContact CG2-CD2 4.36Å; T388-Y400 WeakPolarHBondContact OG1-CD2 3.38Å; T388-Y400 WeakPolarHBondContact OG1-CE2 3.45Å
389	A	80.8	Confident	70.7	Confident	27 Å²	27	58.9 Å²	58.9	22%	0.223	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	138.2	173.3	0	0	0	0	0	110.6	A318 R319 E320	A318-A389 CarbonylContact C-O 3.59Å; A318-A389 WeakPolarHBondContact CA-O 3.47Å; R319-A389 PolarHBondContact N-O 3.29Å; E320-A389 HydrophobicContact CB-CB 4.19Å; E320-A389 PolarHBondContact N-O 3.3Å; E320-A389 PolarHBondContact O-N 3.35Å
390	G	74.8	Confident	71.9	Confident	28 Å²	28	55.3 Å²	55.3	29%	0.289	33%	0.325	S	S	.	.			trans	-169.1	176	179.9	0	0	0	0	0	111.9
391	E	63.1	Low	72.4	Confident	131 Å²	131	53.7 Å²	53.7	61%	0.612	32%	0.318	S	S	*	.	S	Bend	trans	-97.2	102.7	176.7	-77.5	175.4	172.1	0	0	110.7	R319	R319-E391 IonicContact CZ-OE1 3.12Å; R319-E391 IonicContact CZ-OE2 3.5Å; R319-E391 IonicContact NH1-OE1 2.69Å; R319-E391 PolarHBondContact NH1-OE1 2.91Å; R319-E391 IonicContact NH1-OE2 3.83Å; R319-E391 IonicContact NH2-OE1 2.82Å; R319-E391 PolarHBondContact NH2-OE1 3.4Å; R319-E391 IonicContact NH2-OE2 2.78Å; R319-E391 PolarHBondContact NH2-OE2 3.33Å
392	A	57.5	Low	72.7	Confident	57 Å²	57	53.7 Å²	53.7	47%	0.471	32%	0.318	S	S	.	.	S	Bend	trans	150.5	166.7	153	0	0	0	0	0	111.1	P316	P316-A392 HydrophobicContact CG-CB 4.43Å
393	P	51.1	Low	72.8	Confident	90 Å²	90	53.6 Å²	53.6	58%	0.584	32%	0.318	S	S	*	.				-93.4	165.7	-100.5	36.8	-24.6	0	0	0	113.8	G395	P393-G395 PolarHBondContact O-N 3.03Å
394	D	44.9	Very low	72.7	Confident	183 Å²	183	56.2 Å²	56.2	98%	0.979	34%	0.335	S	S	*	.			trans	-58.6	103.1	178.7	-65.4	-59.8	0	0	0	112.7
395	G	49.4	Very low	72.5	Confident	45 Å²	45	57.7 Å²	57.7	46%	0.464	35%	0.349	S	S	.	.			trans	-148.3	158.1	176	0	0	0	0	0	111.1	P393 A397	P393-G395 PolarHBondContact O-N 3.03Å; G395-A397 PolarHBondContact O-N 3.38Å
396	P	45.9	Very low	72.2	Confident	146 Å²	146	63.2 Å²	63.2	95%	0.948	38%	0.375	S	S	*	.	S	Bend	trans	-70.3	1.3	-163.2	26.4	-35.3	0	0	0	116.7
397	A	54	Low	72.3	Confident	27 Å²	27	59 Å²	59	22%	0.223	36%	0.358	C	S	.	.	S	Bend	trans	-157.7	100.8	167	0	0	0	0	0	109.7	W224 P237 G395 A399	W224-A397 WeakPolarHBondContact CH2-O 2.75Å; P237-A397 HydrophobicContact CG-CB 4.44Å; G395-A397 PolarHBondContact O-N 3.38Å; A397-A399 PolarHBondContact O-N 3.42Å
398	S	67.6	Low	72.4	Confident	44 Å²	44	57 Å²	57	31%	0.308	36%	0.357	S	S	.	.			trans	-78.4	120	173.5	49	0	0	0	0	110.3
399	A	76.1	Confident	72.5	Confident	8 Å²	8	59.6 Å²	59.6	7%	0.066	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130.9	175.4	0	0	0	0	0	109.3	W224 L239 V350 Q352 A397	W224-A399 HydrophobicContact CH2-CB 3.77Å; W224-A399 HydrophobicContact CZ3-CB 4.23Å; L239-A399 HydrophobicContact CB-CB 3.84Å; L239-A399 HydrophobicContact CD2-CB 3.77Å; L239-A399 HydrophobicContact CG-CB 4.45Å; V350-A399 HydrophobicContact CG1-CB 4.47Å; Q352-A399 HydrophobicContact CG-CB 3.74Å; A397-A399 PolarHBondContact O-N 3.42Å
400	Y	83.8	Confident	72.9	Confident	16 Å²	16	63.1 Å²	63.1	6%	0.063	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	161.1	-175.9	-60.9	-83	0	0	0	111.7	P316 A318 V350 V351 T388	P316-Y400 HydrophobicContact CB-CD1 4.5Å; P316-Y400 HydrophobicContact CG-CD1 3.91Å; P316-Y400 HydrophobicContact CG-CE1 4.07Å; P316-Y400 CarbonylContact O-C 3.54Å; P316-Y400 VanDerWaalsContact O-CA 3.27Å; P316-Y400 WeakPolarHBondContact O-CA 3.28Å; A318-Y400 HydrophobicContact CB-CG 4.21Å; V350-Y400 CarbonylContact C-O 3.17Å; V350-Y400 WeakPolarHBondContact CA-O 3.48Å; V351-Y400 PolarHBondContact N-O 2.89Å; V351-Y400 PolarHBondContact O-N 3.38Å; T388-Y400 HydrophobicContact CG2-CD2 4.36Å; T388-Y400 WeakPolarHBondContact OG1-CD2 3.38Å; T388-Y400 WeakPolarHBondContact OG1-CE2 3.45Å
401	L	84.8	Confident	73.5	Confident	17 Å²	17	65.3 Å²	65.3	9%	0.089	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.1	166	-66.7	171.8	0	0	0	111.5	W222 P315 P316 F317 A318 R349 V350	W222-L401 HydrophobicContact CH2-CD2 4Å; W222-L401 HydrophobicContact CZ2-CD2 4.14Å; P315-L401 HydrophobicContact CG-CD1 4.07Å; P315-L401 HydrophobicContact CG-CD2 4.19Å; P315-L401 HydrophobicContact CG-CG 3.85Å; P316-L401 PolarHBondContact O-N 3.45Å; F317-L401 WeakPolarHBondContact CA-O 3.13Å; F317-L401 HydrophobicContact CD1-CB 3.62Å; F317-L401 HydrophobicContact CE1-CB 3.8Å; F317-L401 HydrophobicContact CE1-CD1 4.21Å; F317-L401 HydrophobicContact CG-CB 4.26Å; F317-L401 HydrophobicContact CZ-CD1 4.21Å; A318-L401 PolarHBondContact N-O 3.42Å; R349-L401 CarbonylContact O-C 3.56Å; R349-L401 WeakPolarHBondContact O-CA 3.47Å; V350-L401 HydrophobicContact CG2-CD2 3.97Å
402	A	85.9	Confident	74.2	Confident	0 Å²	0	62 Å²	62	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131.5	172.2	0	0	0	0	0	111.1	L321 F345 P348 R349 V351	L321-A402 HydrophobicContact CD2-CB 3.92Å; F345-A402 HydrophobicContact CD1-CB 3.76Å; F345-A402 HydrophobicContact CE1-CB 3.66Å; P348-A402 VanDerWaalsContact CA-O 3.31Å; P348-A402 WeakPolarHBondContact CA-O 3.47Å; R349-A402 PolarHBondContact N-O 2.84Å; R349-A402 PolarHBondContact O-N 3.47Å; V351-A402 HydrophobicContact CG1-CB 3.9Å; V351-A402 HydrophobicContact CG2-CB 3.93Å
403	D	87.4	Confident	75.4	Confident	22 Å²	22	61.5 Å²	61.5	12%	0.118	37%	0.371	C	S	.	.			trans	-154	152.9	179.6	176.9	27.4	0	0	0	109.6	F317 F345 P348 T405 T407	F317-D403 HydrophobicContact CE1-CB 4.4Å; F345-D403 VanDerWaalsContact O-OD1 3.1Å; P348-D403 HydrophobicContact CB-CB 4.24Å; D403-T405 PolarHBondContact O-N 3.24Å; D403-T405 VanDerWaalsContact O-N 3.16Å; D403-T405 PolarHBondContact OD2-OG1 3.16Å; D403-T407 PolarHBondContact N-OG1 2.9Å; D403-T407 WeakPolarHBondContact O-CB 3.46Å; D403-T407 PolarHBondContact O-N 3.35Å; D403-T407 PolarHBondContact O-OG1 2.93Å
404	T	85.9	Confident	76.9	Confident	56 Å²	56	60.2 Å²	60.2	34%	0.344	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-23.3	175.8	55.8	0	0	0	0	115.9	Y342 F345	Y342-T404 HydrophobicContact CD2-CG2 3.78Å; Y342-T404 HydrophobicContact CE2-CG2 3.66Å; F345-T404 HydrophobicContact CB-CG2 4.4Å
405	T	85.6	Confident	78.7	Confident	96 Å²	96	52.5 Å²	52.5	59%	0.589	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-31.8	-173.2	59.9	0	0	0	0	114.4	D403	D403-T405 PolarHBondContact O-N 3.24Å; D403-T405 VanDerWaalsContact O-N 3.16Å; D403-T405 PolarHBondContact OD2-OG1 3.16Å
406	H	81.8	Confident	80.2	Confident	116 Å²	116	54 Å²	54	54%	0.537	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112	-16.2	-170.8	-68.9	-61.5	0	0	0	113.9	F317	F317-H406 HydrophobicContact CB-CB 4.11Å; F317-H406 HydrophobicContact CD1-CB 4.28Å; F317-H406 HydrophobicContact CG-CB 4.27Å
407	T	87.5	Confident	81.8	Confident	20 Å²	20	47.3 Å²	47.3	12%	0.123	28%	0.277	C	S	.	.			trans	-123.8	129.7	-163.6	80.4	0	0	0	0	112.3	A318 D403	A318-T407 HydrophobicContact CB-CG2 4.3Å; A318-T407 WeakPolarHBondContact O-CB 3.49Å; A318-T407 WeakPolarHBondContact O-CG2 3.44Å; D403-T407 PolarHBondContact N-OG1 2.9Å; D403-T407 WeakPolarHBondContact O-CB 3.46Å; D403-T407 PolarHBondContact O-N 3.35Å; D403-T407 PolarHBondContact O-OG1 2.93Å
408	S	88.2	Confident	82.9	Confident	60 Å²	60	48.4 Å²	48.4	42%	0.42	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	118.2	175.2	-64.4	0	0	0	0	110.1	R319 E320 L321	R319-S408 PolarHBondContact O-N 2.84Å; E320-S408 WeakPolarHBondContact CA-O 3.34Å; L321-S408 PolarHBondContact N-O 2.94Å
409	L	87.6	Confident	83.4	Confident	62 Å²	62	47.1 Å²	47.1	33%	0.325	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	128.4	-177.2	-173.2	161	0	0	0	111.1	L321 I323 L341 F345	L321-L409 HydrophobicContact CD2-CD1 4.46Å; L321-L409 WeakPolarHBondContact O-CA 3.21Å; I323-L409 HydrophobicContact CD1-CD1 4.08Å; I323-L409 HydrophobicContact CD1-CD2 3.86Å; I323-L409 HydrophobicContact CD1-CG 4.22Å; I323-L409 HydrophobicContact CG1-CD2 3.95Å; I323-L409 HydrophobicContact CG1-CG 4.33Å; L341-L409 HydrophobicContact CB-CD1 4.4Å; L341-L409 HydrophobicContact CD1-CD2 4.28Å; F345-L409 HydrophobicContact CD2-CD1 3.89Å; F345-L409 HydrophobicContact CE2-CD1 3.55Å; F345-L409 HydrophobicContact CZ-CD1 4.47Å
410	Y	88.3	Confident	83.2	Confident	102 Å²	102	47 Å²	47	40%	0.4	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	132.2	176.7	-60	-77.9	0	0	0	110.8	E320 L321 Y322 I323	E320-Y410 HydrophobicContact CB-CE2 4.23Å; E320-Y410 HydrophobicContact CG-CE2 4.22Å; L321-Y410 PolarHBondContact O-N 2.84Å; Y322-Y410 WeakPolarHBondContact CA-O 3.42Å; Y322-Y410 HydrophobicContact CD1-CD2 4.07Å; Y322-Y410 HydrophobicContact CD1-CG 4.08Å; Y322-Y410 AromaticContact CE1-CD2 3.62Å; Y322-Y410 HydrophobicContact CE1-CD2 3.62Å; Y322-Y410 HydrophobicContact CE1-CE2 4.45Å; Y322-Y410 AromaticContact CE1-CG 3.74Å; Y322-Y410 HydrophobicContact CE1-CG 3.74Å; Y322-Y410 HydrophobicContact CE2-CD2 4.38Å; Y322-Y410 AromaticContact CZ-CD2 3.8Å; I323-Y410 PolarHBondContact N-O 2.68Å
411	M	86.4	Confident	82.3	Confident	73 Å²	73	48.6 Å²	48.6	36%	0.36	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	121.6	175.7	-165.4	176.7	-57.1	0	0	110.9	I323 Y337 L341 F383	I323-M411 CarbonylContact O-C 3.57Å; I323-M411 WeakPolarHBondContact O-CA 3.39Å; Y337-M411 HydrophobicContact CD2-CE 3.9Å; Y337-M411 HydrophobicContact CD2-SD 4Å; Y337-M411 HydrophobicContact CE2-SD 4.46Å; Y337-M411 HydrophobicContact CG-CE 4.5Å; L341-M411 HydrophobicContact CD1-CE 3.58Å; F383-M411 HydrophobicContact CE1-CE 4.16Å
412	V	79.1	Confident	81.1	Confident	62 Å²	62	49.9 Å²	49.9	38%	0.376	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	49.5	-170.1	-163.1	0	0	0	0	111.8	Y322 I323 E324	Y322-V412 HydrophobicContact CD1-CG2 3.65Å; Y322-V412 HydrophobicContact CG-CG2 4.38Å; I323-V412 PolarHBondContact O-N 3.04Å; E324-V412 HydrophobicContact CG-CB 4.06Å; E324-V412 VanDerWaalsContact OE1-O 3.06Å
413	G	81.8	Confident	79.5	Confident	47 Å²	47	52.3 Å²	52.3	49%	0.485	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	75.8	-144.7	-179.3	0	0	0	0	0	113.1	E324 I325	E324-G413 WeakPolarHBondContact CA-O 3.41Å; I325-G413 PolarHBondContact N-O 2.95Å
414	S	83.8	Confident	77.5	Confident	63 Å²	63	52.6 Å²	52.6	44%	0.441	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.6	-169.4	66.1	0	0	0	0	113.9	I325 S327	I325-S414 CarbonylContact O-C 3.6Å; I325-S414 WeakPolarHBondContact O-CA 3.44Å; I325-S414 WeakPolarHBondContact O-CB 3.32Å; S327-S414 PolarHBondContact OG-OG 3.42Å
415	T	82.4	Confident	75.5	Confident	21 Å²	21	56.9 Å²	56.9	13%	0.129	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	153.1	-178.8	46.2	0	0	0	0	113.5	E324 I325 S327	E324-T415 HydrophobicContact CB-CG2 3.55Å; E324-T415 VanDerWaalsContact CD-CG2 3.47Å; E324-T415 HydrophobicContact CG-CG2 4.09Å; E324-T415 WeakPolarHBondContact OE2-CG2 3.47Å; I325-T415 PolarHBondContact O-N 2.76Å; S327-T415 PolarHBondContact N-O 2.98Å
416	L	81.3	Confident	73.5	Confident	75 Å²	75	60.4 Å²	60.4	39%	0.393	33%	0.327	S	S	.	.			trans	-97	109.3	169.7	-61.9	-178.4	0	0	0	108.3	R520 R522	L416-R520 VanDerWaalsContact CD2-O 3.28Å; L416-R520 WeakPolarHBondContact CD2-O 3.36Å; L416-R522 CarbonylContact C-O 3.58Å; L416-R522 WeakPolarHBondContact CA-O 3.39Å; L416-R522 VanDerWaalsContact CB-O 3.28Å; L416-R522 WeakPolarHBondContact CB-O 3.44Å; L416-R522 HydrophobicContact CD1-CB 4.37Å; L416-R522 HydrophobicContact CD2-CB 4.49Å
417	S	79.1	Confident	71.6	Confident	6 Å²	6	60 Å²	60	4%	0.042	34%	0.337	C	S	.	.			trans	-151.3	149.6	177.1	67.8	0	0	0	0	112.2	V326 H490 P523	V326-S417 WeakPolarHBondContact CG1-OG 3.44Å; V326-S417 WeakPolarHBondContact CG2-OG 3.3Å; S417-H490 PolarHBondContact O-NE2 3.02Å; S417-P523 VanDerWaalsContact C-CD 3.45Å
418	P	77.5	Confident	69.7	Low	50 Å²	50	62.6 Å²	62.6	33%	0.325	35%	0.353	S	S	.	.			trans	-61.4	165.3	166	24.9	-27.8	0	0	0	110.2	F279 G488 P523	F279-P418 HydrophobicContact CE2-CB 4.1Å; F279-P418 HydrophobicContact CE2-CG 4.43Å; F279-P418 VanDerWaalsContact CZ-C 3.42Å; F279-P418 HydrophobicContact CZ-CB 3.92Å; F279-P418 HydrophobicContact CZ-CG 3.94Å; F279-P418 VanDerWaalsContact CZ-O 3.32Å; F279-P418 WeakPolarHBondContact CZ-O 3.23Å; P418-G488 CarbonylContact C-O 3.56Å; P418-G488 VanDerWaalsContact CA-O 3.31Å; P418-G488 WeakPolarHBondContact CA-O 3.14Å; P418-G488 WeakPolarHBondContact CB-O 3.42Å; P418-P523 HydrophobicContact CB-CG 3.9Å; P418-P523 HydrophobicContact CG-CG 4.23Å
419	V	77.8	Confident	67.9	Low	17 Å²	17	64 Å²	64	10%	0.103	36%	0.355	C	S	.	.			trans	-136.3	140	-171.4	154.6	0	0	0	0	110.5	V326 F382 G488 H490	V326-V419 HydrophobicContact CG1-CG2 3.9Å; F382-V419 HydrophobicContact CB-CG2 3.98Å; F382-V419 HydrophobicContact CD1-CG1 3.93Å; F382-V419 HydrophobicContact CD1-CG2 4.47Å; F382-V419 HydrophobicContact CD2-CB 4.39Å; F382-V419 HydrophobicContact CD2-CG1 3.48Å; F382-V419 VanDerWaalsContact CD2-CG1 3.48Å; F382-V419 HydrophobicContact CD2-CG2 3.92Å; F382-V419 HydrophobicContact CE1-CG1 3.8Å; F382-V419 HydrophobicContact CE2-CG1 3.35Å; F382-V419 HydrophobicContact CG-CB 4.48Å; F382-V419 HydrophobicContact CG-CG1 3.78Å; F382-V419 HydrophobicContact CG-CG2 3.84Å; F382-V419 HydrophobicContact CZ-CG1 3.51Å; V419-G488 PolarHBondContact N-O 3.12Å; V419-G488 CarbonylContact O-C 3.45Å; V419-G488 WeakPolarHBondContact O-CA 3.26Å; V419-H490 VanDerWaalsContact CG2-CE1 3.5Å; V419-H490 WeakPolarHBondContact CG2-CE1 3.39Å
420	P	70.7	Confident	66.4	Low	5 Å²	5	62.2 Å²	62.2	3%	0.032	34%	0.344	C	S	.	.			trans	-61.2	137.9	174.5	23.6	-33	0	0	0	111.5	T276 F279 F382 L422	T276-P420 HydrophobicContact CG2-CG 4.25Å; F279-P420 HydrophobicContact CB-CB 3.68Å; F279-P420 HydrophobicContact CB-CG 4.48Å; F279-P420 HydrophobicContact CD1-CB 4.31Å; F279-P420 HydrophobicContact CD1-CG 4.34Å; F279-P420 HydrophobicContact CD2-CB 4.18Å; F279-P420 HydrophobicContact CG-CB 3.8Å; F279-P420 HydrophobicContact CG-CG 4.32Å; F382-P420 HydrophobicContact CD1-CG 4.24Å; F382-P420 HydrophobicContact CE1-CG 3.87Å; P420-L422 HydrophobicContact CB-CD1 4.44Å; P420-L422 HydrophobicContact CG-CD1 4.23Å
421	W	64.8	Low	64.6	Low	51 Å²	51	59.6 Å²	59.6	19%	0.193	34%	0.341	C	S	.	.			trans	-73.1	128	164.5	178.7	82.8	0	0	0	110.4	A275 P423 L433 S485	A275-W421 VanDerWaalsContact CB-O 3.32Å; A275-W421 WeakPolarHBondContact CB-O 3.38Å; W421-P423 HydrophobicContact CH2-CB 3.55Å; W421-P423 HydrophobicContact CH2-CG 4.28Å; W421-P423 HydrophobicContact CZ2-CB 4.11Å; W421-P423 HydrophobicContact CZ3-CB 3.76Å; W421-P423 HydrophobicContact CZ3-CG 3.98Å; W421-L433 HydrophobicContact CD2-CD2 3.59Å; W421-L433 HydrophobicContact CD2-CG 4.47Å; W421-L433 HydrophobicContact CE3-CD2 3.35Å; W421-L433 HydrophobicContact CE3-CG 3.88Å; W421-L433 HydrophobicContact CG-CD2 4.19Å; W421-L433 HydrophobicContact CH2-CD2 3.98Å; W421-L433 HydrophobicContact CH2-CG 3.83Å; W421-L433 HydrophobicContact CZ2-CD2 4.24Å; W421-L433 HydrophobicContact CZ2-CG 4.48Å; W421-L433 HydrophobicContact CZ3-CD1 4.21Å; W421-L433 HydrophobicContact CZ3-CD2 3.56Å; W421-L433 HydrophobicContact CZ3-CG 3.52Å; W421-S485 WeakPolarHBondContact CB-O 3.47Å; W421-S485 PolarHBondContact NE1-OG 3.04Å
422	L	60.5	Low	63.3	Low	43 Å²	43	57.3 Å²	57.3	23%	0.225	33%	0.332	C	S	.	.			trans	-113.3	133.7	168.3	-72.5	107.6	0	0	0	110.4	C358 E380 F382 P420 S424	C358-L422 HydrophobicContact CB-CD1 4.32Å; E380-L422 WeakPolarHBondContact OE2-CB 3.3Å; F382-L422 HydrophobicContact CE1-CD1 3.64Å; F382-L422 HydrophobicContact CZ-CD1 3.75Å; P420-L422 HydrophobicContact CB-CD1 4.44Å; P420-L422 HydrophobicContact CG-CD1 4.23Å; L422-S424 VanDerWaalsContact C-N 3.26Å; L422-S424 PolarHBondContact O-N 2.87Å
423	P	51.8	Low	62.3	Low	51 Å²	51	55.2 Å²	55.2	33%	0.331	32%	0.319	S	S	.	.			trans	-71.6	78.4	174.5	27.5	-32.3	0	0	0	110.9	W421 E425	W421-P423 HydrophobicContact CH2-CB 3.55Å; W421-P423 HydrophobicContact CH2-CG 4.28Å; W421-P423 HydrophobicContact CZ2-CB 4.11Å; W421-P423 HydrophobicContact CZ3-CB 3.76Å; W421-P423 HydrophobicContact CZ3-CG 3.98Å; P423-E425 PolarHBondContact O-N 3.14Å
424	S	45.7	Very low	61.3	Low	29 Å²	29	53.7 Å²	53.7	20%	0.203	30%	0.301	C	S	.	.			trans	-73.2	108.3	173.4	-157.4	0	0	0	0	110.1	R379 L422 K426 S427	R379-S424 WeakPolarHBondContact CD-OG 3.47Å; R379-S424 PolarHBondContact NH1-OG 3.18Å; R379-S424 VanDerWaalsContact NH1-OG 3.12Å; L422-S424 VanDerWaalsContact C-N 3.26Å; L422-S424 PolarHBondContact O-N 2.87Å; S424-K426 PolarHBondContact O-N 3.17Å; S424-S427 PolarHBondContact O-N 3.46Å
425	E	44.3	Very low	60.8	Low	145 Å²	145	50.9 Å²	50.9	68%	0.678	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	7.9	-162.2	-57.7	-175.4	147.1	0	0	118.3	R254 P423	R254-E425 IonicContact CZ-OE1 2.86Å; R254-E425 IonicContact NH1-OE1 3.2Å; R254-E425 IonicContact NH2-OE1 3.78Å; R254-E425 PolarHBondContact NH2-OE1 3.22Å; P423-E425 PolarHBondContact O-N 3.14Å
426	K	42.5	Very low	60.3	Low	171 Å²	171	50.7 Å²	50.7	74%	0.743	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.3	6	-178.1	-53.7	-170.7	174.3	-174.3	0	116.4	S424	S424-K426 PolarHBondContact O-N 3.17Å
427	S	41.8	Very low	59.9	Low	107 Å²	107	47.9 Å²	47.9	75%	0.748	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-19.8	-176.4	-163.3	0	0	0	0	115.1	S424	S424-S427 PolarHBondContact O-N 3.46Å
428	T	48.8	Very low	59.9	Low	75 Å²	75	48 Å²	48	46%	0.46	27%	0.269	S	S	.	.	S	Bend	trans	-112.5	143.1	176.1	45.3	0	0	0	0	109.2	W430	T428-W430 WeakPolarHBondContact CB-O 3.31Å; T428-W430 PolarHBondContact O-N 3.31Å; T428-W430 VanDerWaalsContact O-N 3.14Å; T428-W430 PolarHBondContact OG1-O 3.39Å
429	L	50	Low	60.1	Low	89 Å²	89	49.2 Å²	49.2	47%	0.466	27%	0.27	S	S	.	.	S	Bend	trans	-64.4	-11.6	172.8	-67.9	173.2	0	0	0	112.9	Y636	L429-Y636 HydrophobicContact CD1-CD2 4.28Å; L429-Y636 HydrophobicContact CD1-CE2 4.47Å; L429-Y636 HydrophobicContact CD2-CD2 4.03Å; L429-Y636 HydrophobicContact CD2-CE2 3.47Å; L429-Y636 VanDerWaalsContact CD2-CE2 3.47Å
430	W	56.2	Low	60.4	Low	24 Å²	24	52 Å²	52	9%	0.091	30%	0.295	C	S	.	.			trans	-121.4	134.2	-173.9	-49.4	113.1	0	0	0	109.6	T428 S432 P435 P436 I604 A607 L608 V632	T428-W430 WeakPolarHBondContact CB-O 3.31Å; T428-W430 PolarHBondContact O-N 3.31Å; T428-W430 VanDerWaalsContact O-N 3.14Å; T428-W430 PolarHBondContact OG1-O 3.39Å; W430-S432 VanDerWaalsContact C-N 3.29Å; W430-P435 HydrophobicContact CD2-CB 4.46Å; W430-P435 HydrophobicContact CG-CB 4.31Å; W430-P436 HydrophobicContact CE3-CG 4.18Å; W430-P436 HydrophobicContact CZ3-CG 4.02Å; W430-I604 HydrophobicContact CH2-CB 4.38Å; W430-I604 HydrophobicContact CH2-CG2 3.88Å; W430-A607 HydrophobicContact CE3-CB 3.89Å; W430-A607 HydrophobicContact CZ3-CB 3.57Å; W430-L608 HydrophobicContact CE3-CD2 4.27Å; W430-L608 HydrophobicContact CH2-CD1 4.06Å; W430-L608 HydrophobicContact CH2-CD2 3.48Å; W430-L608 VanDerWaalsContact CH2-CD2 3.48Å; W430-L608 HydrophobicContact CH2-CG 3.47Å; W430-L608 VanDerWaalsContact CH2-CG 3.47Å; W430-L608 HydrophobicContact CZ2-CD2 4.05Å; W430-L608 HydrophobicContact CZ2-CG 4.41Å; W430-L608 HydrophobicContact CZ3-CD2 3.58Å; W430-L608 HydrophobicContact CZ3-CG 3.64Å; W430-V632 HydrophobicContact CZ2-CG1 4.29Å
431	S	49.8	Very low	61.1	Low	47 Å²	47	52.8 Å²	52.8	33%	0.329	30%	0.299	S	S	.	.	S	Bend	trans	-74.3	-18.5	171.5	52.9	0	0	0	0	113.3	D253	D253-S431 PolarHBondContact O-OG 2.87Å
432	S	58.8	Low	62.1	Low	26 Å²	26	50.4 Å²	50.4	18%	0.182	29%	0.29	C	S	.	.	S	Bend	trans	-106.1	158.8	-172.4	-154.4	0	0	0	0	113.4	R254 W430 S434	R254-S432 WeakPolarHBondContact O-CB 3.49Å; R254-S432 PolarHBondContact O-OG 2.92Å; W430-S432 VanDerWaalsContact C-N 3.29Å; S432-S434 PolarHBondContact O-N 3.31Å
433	L	58	Low	63.3	Low	18 Å²	18	52.1 Å²	52.1	9%	0.094	31%	0.305	C	S	.	.	S	Bend	trans	-65.2	-17.4	179.6	-85.3	161.6	0	0	0	114.1	L198 P285 L286 W421 Q486	L198-L433 HydrophobicContact CD1-CD1 3.89Å; P285-L433 HydrophobicContact CB-CD1 4.03Å; P285-L433 HydrophobicContact CB-CD2 4.36Å; L286-L433 HydrophobicContact CD2-CB 3.75Å; L286-L433 HydrophobicContact CD2-CD1 4.05Å; W421-L433 HydrophobicContact CD2-CD2 3.59Å; W421-L433 HydrophobicContact CD2-CG 4.47Å; W421-L433 HydrophobicContact CE3-CD2 3.35Å; W421-L433 HydrophobicContact CE3-CG 3.88Å; W421-L433 HydrophobicContact CG-CD2 4.19Å; W421-L433 HydrophobicContact CH2-CD2 3.98Å; W421-L433 HydrophobicContact CH2-CG 3.83Å; W421-L433 HydrophobicContact CZ2-CD2 4.24Å; W421-L433 HydrophobicContact CZ2-CG 4.48Å; W421-L433 HydrophobicContact CZ3-CD1 4.21Å; W421-L433 HydrophobicContact CZ3-CD2 3.56Å; W421-L433 HydrophobicContact CZ3-CG 3.52Å; L433-Q486 HydrophobicContact CD2-CG 4.49Å; L433-Q486 PolarHBondContact O-NE2 2.96Å
434	S	61.9	Low	64.9	Low	15 Å²	15	54.2 Å²	54.2	11%	0.105	31%	0.311	C	S	.	.	S	Bend	trans	-128.1	130.6	174.9	53.2	0	0	0	0	110.2	S432 P436	S432-S434 PolarHBondContact O-N 3.31Å; S434-P436 WeakPolarHBondContact O-CD 3.45Å
435	P	72.6	Confident	66.9	Low	4 Å²	4	52.9 Å²	52.9	3%	0.026	30%	0.302	C	S	.	.			trans	-63.6	119.8	168.3	24.1	-31.7	0	0	0	108.9	W430 G437 L438 V442 A482	W430-P435 HydrophobicContact CD2-CB 4.46Å; W430-P435 HydrophobicContact CG-CB 4.31Å; P435-G437 PolarHBondContact O-N 3.06Å; P435-L438 HydrophobicContact CG-CB 4.13Å; P435-L438 PolarHBondContact O-N 2.97Å; P435-L438 VanDerWaalsContact O-N 3.15Å; P435-V442 HydrophobicContact CG-CG2 4.18Å; P435-A482 HydrophobicContact CG-CB 4.27Å
436	P	72.2	Confident	68.8	Low	17 Å²	17	46.7 Å²	46.7	11%	0.11	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	139.1	-174.6	22.7	-31.3	0	0	0	110.5	W430 S434 L438 I604 A607	W430-P436 HydrophobicContact CE3-CG 4.18Å; W430-P436 HydrophobicContact CZ3-CG 4.02Å; S434-P436 WeakPolarHBondContact O-CD 3.45Å; P436-L438 VanDerWaalsContact C-N 3.28Å; P436-L438 PolarHBondContact O-N 3.16Å; P436-I604 WeakPolarHBondContact O-CG1 3.38Å; P436-A607 HydrophobicContact CG-CB 3.54Å
437	G	72.3	Confident	70.8	Confident	15 Å²	15	41.6 Å²	41.6	16%	0.155	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-13.8	-177	0	0	0	0	0	116	P435 Q600	P435-G437 PolarHBondContact O-N 3.06Å; G437-Q600 WeakPolarHBondContact O-CG 3.33Å; G437-Q600 PolarHBondContact O-NE2 3.44Å
438	L	79.9	Confident	72.7	Confident	9 Å²	9	38.5 Å²	38.5	5%	0.047	24%	0.24	C	C	.	.			trans	-108.6	12.9	172.6	-63.6	176.1	0	0	0	112.9	P435 P436 A440 L441 V442 V479 L596 V632	P435-L438 HydrophobicContact CG-CB 4.13Å; P435-L438 PolarHBondContact O-N 2.97Å; P435-L438 VanDerWaalsContact O-N 3.15Å; P436-L438 VanDerWaalsContact C-N 3.28Å; P436-L438 PolarHBondContact O-N 3.16Å; L438-A440 VanDerWaalsContact C-N 3.33Å; L438-A440 PolarHBondContact O-N 3.22Å; L438-L441 HydrophobicContact CD2-CD1 4Å; L438-L441 PolarHBondContact O-N 3.31Å; L438-V442 PolarHBondContact O-N 3.32Å; L438-V479 HydrophobicContact CB-CG2 4.16Å; L438-V479 HydrophobicContact CD1-CG2 3.86Å; L438-L596 HydrophobicContact CD2-CD2 3.92Å; L438-V632 HydrophobicContact CD1-CG2 4.15Å
439	E	81.9	Confident	74.3	Confident	75 Å²	75	35.2 Å²	35.2	35%	0.35	22%	0.22	S	C	.	.	H	α-helix	trans	-60.4	-38.3	-171.6	-56.3	-178.6	164.8	0	0	112.9	V442 S443	E439-V442 PolarHBondContact O-N 2.97Å; E439-S443 WeakPolarHBondContact O-CB 3.47Å; E439-S443 PolarHBondContact O-N 3.43Å
440	A	83.9	Confident	75.7	Confident	76 Å²	76	34.6 Å²	34.6	63%	0.628	21%	0.214	S	C	*	.	H	α-helix	trans	-60.4	-45.8	177.1	0	0	0	0	0	112.6	L438 V442 S443 E444	L438-A440 VanDerWaalsContact C-N 3.33Å; L438-A440 PolarHBondContact O-N 3.22Å; A440-V442 VanDerWaalsContact C-N 3.35Å; A440-V442 PolarHBondContact O-N 3.44Å; A440-S443 WeakPolarHBondContact O-CB 2.95Å; A440-S443 PolarHBondContact O-N 3.11Å; A440-E444 WeakPolarHBondContact O-CB 3.48Å; A440-E444 PolarHBondContact O-N 3.38Å
441	L	84.6	Confident	76.6	Confident	21 Å²	21	36.2 Å²	36.2	11%	0.11	23%	0.227	C	C	.	.	H	α-helix	trans	-68.2	-34.4	178.6	-63.4	168.5	0	0	0	112.3	L438 L445 V479 V593	L438-L441 HydrophobicContact CD2-CD1 4Å; L438-L441 PolarHBondContact O-N 3.31Å; L441-L445 VanDerWaalsContact O-CB 3.28Å; L441-L445 WeakPolarHBondContact O-CB 3.45Å; L441-L445 PolarHBondContact O-N 3.49Å; L441-V479 HydrophobicContact CB-CG1 4.27Å; L441-V593 HydrophobicContact CD1-CB 4.3Å; L441-V593 HydrophobicContact CD1-CG1 3.87Å; L441-V593 HydrophobicContact CD1-CG2 4.21Å
442	V	86.6	Confident	77.6	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-43	174	178.3	0	0	0	0	109.8	P435 L438 E439 A440 L445 C446 V479 A482 A483	P435-V442 HydrophobicContact CG-CG2 4.18Å; L438-V442 PolarHBondContact O-N 3.32Å; E439-V442 PolarHBondContact O-N 2.97Å; A440-V442 VanDerWaalsContact C-N 3.35Å; A440-V442 PolarHBondContact O-N 3.44Å; V442-L445 PolarHBondContact O-N 3.49Å; V442-C446 VanDerWaalsContact O-CB 3.28Å; V442-C446 WeakPolarHBondContact O-CB 3.35Å; V442-C446 PolarHBondContact O-N 2.75Å; V442-C446 PolarHBondContact O-SG 3.14Å; V442-V479 HydrophobicContact CG2-CB 4.35Å; V442-V479 HydrophobicContact CG2-CG1 3.92Å; V442-V479 HydrophobicContact CG2-CG2 4.38Å; V442-A482 HydrophobicContact CG1-CB 4.18Å; V442-A482 HydrophobicContact CG2-CB 4.08Å; V442-A483 HydrophobicContact CG1-CB 4.32Å
443	S	85.8	Confident	78.1	Confident	79 Å²	79	37.9 Å²	37.9	55%	0.552	23%	0.226	S	C	*	.	H	α-helix	trans	-61.5	-44.9	175.5	-170.3	0	0	0	0	112.2	E439 A440 C446 A447	E439-S443 WeakPolarHBondContact O-CB 3.47Å; E439-S443 PolarHBondContact O-N 3.43Å; A440-S443 WeakPolarHBondContact O-CB 2.95Å; A440-S443 PolarHBondContact O-N 3.11Å; S443-C446 PolarHBondContact O-N 3.1Å; S443-A447 WeakPolarHBondContact O-CB 3.44Å; S443-A447 PolarHBondContact O-N 3.2Å
444	E	85.9	Confident	78.7	Confident	96 Å²	96	42.8 Å²	42.8	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-63.3	-47.5	176.7	-175.1	174.4	-155.5	0	0	112.1	A440 C446 A447 V448 L591	A440-E444 WeakPolarHBondContact O-CB 3.48Å; A440-E444 PolarHBondContact O-N 3.38Å; E444-C446 VanDerWaalsContact C-N 3.32Å; E444-C446 PolarHBondContact O-N 3.46Å; E444-A447 WeakPolarHBondContact O-CB 3.49Å; E444-A447 PolarHBondContact O-N 3.14Å; E444-A447 VanDerWaalsContact O-N 3.1Å; E444-V448 WeakPolarHBondContact O-CG2 3.17Å; E444-V448 PolarHBondContact O-N 2.99Å; E444-L591 HydrophobicContact CG-CD2 3.95Å; E444-L591 WeakPolarHBondContact OE1-CD2 3.42Å
445	L	87.7	Confident	78.4	Confident	1 Å²	1	49 Å²	49	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-40.5	174.9	-177.4	60.5	0	0	0	111.4	L441 V442 A447 V448 L449 V466 V479 V480 A483 L591	L441-L445 VanDerWaalsContact O-CB 3.28Å; L441-L445 WeakPolarHBondContact O-CB 3.45Å; L441-L445 PolarHBondContact O-N 3.49Å; V442-L445 PolarHBondContact O-N 3.49Å; L445-A447 VanDerWaalsContact C-N 3.34Å; L445-A447 PolarHBondContact O-N 3.06Å; L445-V448 PolarHBondContact O-N 3.42Å; L445-L449 HydrophobicContact CD1-CD1 4.01Å; L445-L449 HydrophobicContact CD1-CG 4.25Å; L445-L449 HydrophobicContact CG-CD1 3.99Å; L445-L449 VanDerWaalsContact O-CG 3.26Å; L445-L449 WeakPolarHBondContact O-CG 3.4Å; L445-L449 PolarHBondContact O-N 3.07Å; L445-V466 HydrophobicContact CD1-CG1 4.19Å; L445-V479 HydrophobicContact CD2-CG1 4.13Å; L445-V480 HydrophobicContact CD2-CG2 4.03Å; L445-A483 HydrophobicContact CB-CB 4.36Å; L445-A483 HydrophobicContact CD2-CB 3.64Å; L445-A483 HydrophobicContact CG-CB 3.93Å; L445-L591 HydrophobicContact CB-CD1 4.43Å; L445-L591 HydrophobicContact CD1-CD1 4.15Å
446	C	84.7	Confident	77.4	Confident	14 Å²	14	51 Å²	51	10%	0.095	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-37.7	172.9	-76.4	0	0	0	0	112.3	V442 S443 E444 L449 K450	V442-C446 VanDerWaalsContact O-CB 3.28Å; V442-C446 WeakPolarHBondContact O-CB 3.35Å; V442-C446 PolarHBondContact O-N 2.75Å; V442-C446 PolarHBondContact O-SG 3.14Å; S443-C446 PolarHBondContact O-N 3.1Å; E444-C446 VanDerWaalsContact C-N 3.32Å; E444-C446 PolarHBondContact O-N 3.46Å; C446-L449 PolarHBondContact O-N 2.92Å; C446-K450 WeakPolarHBondContact O-CB 3.35Å; C446-K450 PolarHBondContact O-N 3.23Å
447	A	83.3	Confident	76.6	Confident	64 Å²	64	50.7 Å²	50.7	53%	0.529	31%	0.31	S	S	.	.	H	α-helix	trans	-66.6	-34	176.2	0	0	0	0	0	112.7	S443 E444 L445 P451	S443-A447 WeakPolarHBondContact O-CB 3.44Å; S443-A447 PolarHBondContact O-N 3.2Å; E444-A447 WeakPolarHBondContact O-CB 3.49Å; E444-A447 PolarHBondContact O-N 3.14Å; E444-A447 VanDerWaalsContact O-N 3.1Å; L445-A447 VanDerWaalsContact C-N 3.34Å; L445-A447 PolarHBondContact O-N 3.06Å; A447-P451 WeakPolarHBondContact O-CD 3.41Å; A447-P451 WeakPolarHBondContact O-CG 3.43Å
448	V	82.7	Confident	75.6	Confident	43 Å²	43	53.9 Å²	53.9	26%	0.261	34%	0.335	S	S	.	.	H	α-helix	trans	-69.9	-39.9	173.2	173.9	0	0	0	0	111.7	E444 L445 V466	E444-V448 WeakPolarHBondContact O-CG2 3.17Å; E444-V448 PolarHBondContact O-N 2.99Å; L445-V448 PolarHBondContact O-N 3.42Å; V448-V466 HydrophobicContact CG1-CG2 3.92Å
449	L	81.9	Confident	74.2	Confident	6 Å²	6	60.7 Å²	60.7	3%	0.031	37%	0.371	C	S	.	.	H	α-helix	trans	-85.6	-35.4	-174.1	-60.9	174.8	0	0	0	113.8	L445 C446 R452 L487 M568	L445-L449 HydrophobicContact CD1-CD1 4.01Å; L445-L449 HydrophobicContact CD1-CG 4.25Å; L445-L449 HydrophobicContact CG-CD1 3.99Å; L445-L449 VanDerWaalsContact O-CG 3.26Å; L445-L449 WeakPolarHBondContact O-CG 3.4Å; L445-L449 PolarHBondContact O-N 3.07Å; C446-L449 PolarHBondContact O-N 2.92Å; L449-R452 PolarHBondContact O-N 3.4Å; L449-L487 HydrophobicContact CB-CD1 3.59Å; L449-L487 HydrophobicContact CD1-CD1 4.07Å; L449-L487 HydrophobicContact CG-CD1 4.49Å; L449-M568 HydrophobicContact CB-SD 4.25Å; L449-M568 HydrophobicContact CD2-CB 4.44Å; L449-M568 HydrophobicContact CD2-CG 4.35Å; L449-M568 HydrophobicContact CD2-SD 3.76Å; L449-M568 HydrophobicContact CG-SD 4.45Å
450	K	78.6	Confident	72.9	Confident	76 Å²	76	61.3 Å²	61.3	33%	0.33	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-58.5	-40.7	-173.7	-173.3	164	-178.1	161.6	0	114.9	D284 C446 R452 L453 L487	D284-K450 IonicContact OD1-NZ 2.8Å; D284-K450 PolarHBondContact OD1-NZ 3.32Å; D284-K450 IonicContact OD2-NZ 3.6Å; D284-K450 PolarHBondContact OD2-NZ 3.14Å; C446-K450 WeakPolarHBondContact O-CB 3.35Å; C446-K450 PolarHBondContact O-N 3.23Å; K450-R452 PolarHBondContact O-N 3.49Å; K450-L453 PolarHBondContact O-N 3.39Å; K450-L453 VanDerWaalsContact O-N 3.12Å; K450-L487 HydrophobicContact CB-CD2 4.13Å; K450-L487 HydrophobicContact CD-CD2 4.46Å; K450-L487 HydrophobicContact CG-CD2 4.42Å
451	P	76	Confident	71.2	Confident	57 Å²	57	64.4 Å²	64.4	37%	0.37	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-60.8	-27.3	179.4	-25.4	35.2	0	0	0	114.3	A447 L453 L460	A447-P451 WeakPolarHBondContact O-CD 3.41Å; A447-P451 WeakPolarHBondContact O-CG 3.43Å; P451-L453 VanDerWaalsContact C-N 3.34Å; P451-L460 HydrophobicContact CB-CD1 4.29Å
452	R	69.8	Low	69.8	Low	47 Å²	47	65.2 Å²	65.2	18%	0.177	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-80.6	-12.6	-179.7	-63.5	-64.6	-171.7	119.6	11.5	113.6	L449 K450 L460 G462 P566 M568	L449-R452 PolarHBondContact O-N 3.4Å; K450-R452 PolarHBondContact O-N 3.49Å; R452-L460 PolarHBondContact NH1-O 3.22Å; R452-G462 VanDerWaalsContact CZ-O 3.31Å; R452-G462 PolarHBondContact NH1-O 3.04Å; R452-G462 PolarHBondContact NH2-O 2.95Å; R452-P566 HydrophobicContact CB-CG 4.46Å; R452-M568 HydrophobicContact CB-CE 3.59Å
453	L	70.8	Confident	68.5	Low	61 Å²	61	66.2 Å²	66.2	32%	0.319	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-16.2	177.7	-59	176.5	0	0	0	113	K450 P451 L487 L489 M568	K450-L453 PolarHBondContact O-N 3.39Å; K450-L453 VanDerWaalsContact O-N 3.12Å; P451-L453 VanDerWaalsContact C-N 3.34Å; L453-L487 HydrophobicContact CD1-CB 4.09Å; L453-L487 HydrophobicContact CD1-CD1 4.37Å; L453-L487 HydrophobicContact CD1-CD2 4.22Å; L453-L487 HydrophobicContact CD1-CG 4.46Å; L453-L489 HydrophobicContact CD1-CD1 4.27Å; L453-L489 HydrophobicContact CD1-CD2 4.01Å; L453-L489 HydrophobicContact CD1-CG 4.44Å; L453-L489 HydrophobicContact CD2-CD1 4.45Å; L453-L489 HydrophobicContact CD2-CD2 3.69Å; L453-M568 HydrophobicContact CD2-CE 3.58Å; L453-M568 HydrophobicContact CG-CE 4.06Å
454	Q	68.9	Low	67.6	Low	121 Å²	121	63.2 Å²	63.2	57%	0.565	39%	0.386	S	S	*	.	S	Bend	trans	-77.2	145.3	-177.5	-68.4	-176.6	-22.8	0	0	111.8	G456 G457	Q454-G456 VanDerWaalsContact C-N 3.28Å; Q454-G456 PolarHBondContact O-N 3.16Å; Q454-G457 PolarHBondContact O-N 2.93Å
455	P	56.1	Low	67.5	Low	145 Å²	145	58.8 Å²	58.8	94%	0.942	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	85.3	175	28.9	-34.5	0	0	0	110.6
456	G	52.9	Low	67.5	Low	48 Å²	48	58.8 Å²	58.8	50%	0.495	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	154.6	-23.6	-170.2	0	0	0	0	0	112.7	Q454 A458 L459	Q454-G456 VanDerWaalsContact C-N 3.28Å; Q454-G456 PolarHBondContact O-N 3.16Å; G456-A458 PolarHBondContact O-N 3.49Å; G456-L459 PolarHBondContact O-N 3.37Å
457	G	53.8	Low	67.8	Low	10 Å²	10	58.1 Å²	58.1	10%	0.103	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-62.6	-9.9	177.1	0	0	0	0	0	115.3	Q454 L459 L460	Q454-G457 PolarHBondContact O-N 2.93Å; G457-L459 PolarHBondContact O-N 3.06Å; G457-L460 WeakPolarHBondContact O-CB 3.49Å; G457-L460 PolarHBondContact O-N 2.84Å; G457-L460 VanDerWaalsContact O-N 3.17Å
458	A	51.3	Low	68.1	Low	81 Å²	81	55.3 Å²	55.3	67%	0.669	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-66	-14.3	172.6	0	0	0	0	0	113.9	G456	G456-A458 PolarHBondContact O-N 3.49Å
459	L	50.5	Low	68.4	Low	153 Å²	153	55.3 Å²	55.3	80%	0.801	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-83.7	-10.8	173.7	-67.6	169.9	0	0	0	113.4	G456 G457 T461	G456-L459 PolarHBondContact O-N 3.37Å; G457-L459 PolarHBondContact O-N 3.06Å; L459-T461 PolarHBondContact O-N 3.38Å; L459-T461 VanDerWaalsContact O-N 3.1Å
460	L	56.1	Low	68.6	Low	88 Å²	88	55.3 Å²	55.3	46%	0.461	33%	0.334	S	S	.	.			trans	-80.8	88.8	177.1	-68	170.2	0	0	0	109.8	P451 R452 G457 G462	P451-L460 HydrophobicContact CB-CD1 4.29Å; R452-L460 PolarHBondContact NH1-O 3.22Å; G457-L460 WeakPolarHBondContact O-CB 3.49Å; G457-L460 PolarHBondContact O-N 2.84Å; G457-L460 VanDerWaalsContact O-N 3.17Å; L460-G462 PolarHBondContact O-N 3.26Å
461	T	47.4	Very low	68.7	Low	140 Å²	140	54.7 Å²	54.7	86%	0.859	34%	0.338	S	S	*	.			trans	-66.9	118.6	175.8	52.9	0	0	0	0	111.2	L459	L459-T461 PolarHBondContact O-N 3.38Å; L459-T461 VanDerWaalsContact O-N 3.1Å
462	G	54.9	Low	69	Low	39 Å²	39	56.8 Å²	56.8	40%	0.402	35%	0.351	S	S	.	.	S	Bend	trans	140.9	147.2	175.3	0	0	0	0	0	112.3	R452 L460	R452-G462 VanDerWaalsContact CZ-O 3.31Å; R452-G462 PolarHBondContact NH1-O 3.04Å; R452-G462 PolarHBondContact NH2-O 2.95Å; L460-G462 PolarHBondContact O-N 3.26Å
463	T	59.4	Low	69.4	Low	21 Å²	21	56.7 Å²	56.7	13%	0.129	37%	0.365	C	S	.	.			trans	-61	135.9	-172.4	52.9	0	0	0	0	112.8	S465 L555 L556 E558	T463-S465 WeakPolarHBondContact CB-OG 3.48Å; T463-S465 PolarHBondContact O-N 3.19Å; T463-S465 PolarHBondContact OG1-OG 3.41Å; T463-L555 WeakPolarHBondContact CG2-O 3.41Å; T463-L556 HydrophobicContact CG2-CD2 3.95Å; T463-E558 WeakPolarHBondContact CA-OE1 3.4Å
464	S	66.3	Low	70	Confident	17 Å²	17	54.2 Å²	54.2	12%	0.119	35%	0.353	C	S	.	.			trans	-85.2	55.2	174.7	61	0	0	0	0	112.1	L567 V569	S464-L567 PolarHBondContact OG-O 3Å; S464-L567 VanDerWaalsContact OG-O 3.12Å; S464-V569 PolarHBondContact O-N 2.94Å
465	S	83.4	Confident	70.7	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.014	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	124.9	-178.6	42.6	0	0	0	0	111.5	T463 V569 A586 P588	T463-S465 WeakPolarHBondContact CB-OG 3.48Å; T463-S465 PolarHBondContact O-N 3.19Å; T463-S465 PolarHBondContact OG1-OG 3.41Å; S465-V569 CarbonylContact C-O 3.47Å; S465-V569 VanDerWaalsContact CA-O 3.3Å; S465-V569 WeakPolarHBondContact CA-O 3.3Å; S465-A586 WeakPolarHBondContact CB-O 3.43Å; S465-A586 PolarHBondContact OG-O 2.85Å; S465-P588 WeakPolarHBondContact O-CD 3.29Å; S465-P588 WeakPolarHBondContact OG-CD 3.4Å
466	V	89.1	Confident	72.2	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.012	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.8	179.3	-174.5	0	0	0	0	110.6	L445 V448 V569 V570 A571 H589 L591	L445-V466 HydrophobicContact CD1-CG1 4.19Å; V448-V466 HydrophobicContact CG1-CG2 3.92Å; V466-V569 PolarHBondContact N-O 3.34Å; V466-V570 HydrophobicContact CB-CG2 4.34Å; V466-V570 CarbonylContact O-C 3.56Å; V466-V570 WeakPolarHBondContact O-CA 3.13Å; V466-A571 PolarHBondContact O-N 3.42Å; V466-H589 WeakPolarHBondContact CA-O 3.41Å; V466-H589 HydrophobicContact CG1-CB 4.34Å; V466-H589 HydrophobicContact CG2-CB 4.26Å; V466-L591 HydrophobicContact CG1-CD1 3.94Å; V466-L591 HydrophobicContact CG1-CG 4.27Å
467	L	90.3	Very high	73.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	116	176.9	-178.2	63.2	0	0	0	111	R469 A571 T573 L579 F587 H589 E590 L591	L467-R469 HydrophobicContact CD2-CG 4.46Å; L467-R469 HydrophobicContact CG-CG 4.29Å; L467-A571 HydrophobicContact CD1-CB 3.72Å; L467-T573 HydrophobicContact CD1-CG2 4Å; L467-T573 HydrophobicContact CG-CG2 4.37Å; L467-L579 HydrophobicContact CD1-CD2 4.2Å; L467-L579 HydrophobicContact CD2-CD2 3.84Å; L467-F587 HydrophobicContact CB-CB 3.77Å; L467-F587 HydrophobicContact CB-CD1 4Å; L467-F587 HydrophobicContact CB-CD2 4.36Å; L467-F587 HydrophobicContact CB-CG 3.78Å; L467-H589 PolarHBondContact N-O 2.95Å; L467-E590 WeakPolarHBondContact O-CA 3.47Å; L467-L591 PolarHBondContact O-N 3.28Å
468	L	90.8	Very high	75.4	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	119	174.1	-74.9	163.9	0	0	0	111.3	K476 V480 V570 A571 T572 T573 L591	L468-K476 HydrophobicContact CB-CD 4.01Å; L468-K476 HydrophobicContact CB-CG 4.31Å; L468-K476 WeakPolarHBondContact O-CD 3.41Å; L468-V480 HydrophobicContact CD1-CG2 3.26Å; L468-V570 HydrophobicContact CD1-CG1 3.65Å; L468-V570 HydrophobicContact CG-CG1 4.26Å; L468-A571 PolarHBondContact N-O 3.15Å; L468-T572 HydrophobicContact CB-CG2 4.31Å; L468-T572 WeakPolarHBondContact O-CA 3.48Å; L468-T573 PolarHBondContact O-N 3.05Å; L468-L591 CarbonylContact C-O 3.57Å; L468-L591 WeakPolarHBondContact CA-O 3.44Å; L468-L591 HydrophobicContact CD2-CB 3.74Å; L468-L591 HydrophobicContact CD2-CD1 4.36Å
469	R	88.4	Confident	77.1	Confident	44 Å²	44	40.3 Å²	40.3	17%	0.166	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	159.6	-179.3	-66.7	175.2	168.9	179.3	-3.1	111.6	L467 T573 A576 E590 L591 V593	L467-R469 HydrophobicContact CD2-CG 4.46Å; L467-R469 HydrophobicContact CG-CG 4.29Å; R469-T573 HydrophobicContact CB-CG2 4.43Å; R469-T573 HydrophobicContact CG-CG2 3.73Å; R469-A576 VanDerWaalsContact CZ-CB 3.42Å; R469-E590 IonicContact CZ-OE1 3.2Å; R469-E590 IonicContact CZ-OE2 3.49Å; R469-E590 IonicContact NE-OE1 2.86Å; R469-E590 IonicContact NE-OE2 3.63Å; R469-E590 IonicContact NH1-OE1 3.21Å; R469-E590 IonicContact NH1-OE2 3.88Å; R469-E590 PolarHBondContact NH1-OE2 2.86Å; R469-E590 IonicContact NH2-OE1 2.72Å; R469-E590 PolarHBondContact NH2-OE1 3.46Å; R469-E590 IonicContact NH2-OE2 2.75Å; R469-E590 PolarHBondContact NH2-OE2 2.65Å; R469-L591 PolarHBondContact N-O 2.96Å; R469-V593 PolarHBondContact O-N 3.32Å
470	G	85.1	Confident	78.9	Confident	6 Å²	6	33 Å²	33	6%	0.062	22%	0.216	C	C	.	.	S	Bend	trans	133.1	174.2	173.9	0	0	0	0	0	112.9	K476 S574	G470-K476 PolarHBondContact O-NZ 2.82Å; G470-S574 CarbonylContact C-O 3.34Å; G470-S574 WeakPolarHBondContact O-CA 3.37Å
471	P	81.3	Confident	80.3	Confident	63 Å²	63	30.1 Å²	30.1	41%	0.409	21%	0.205	S	C	.	.			trans	-62.3	158	-172.5	22.8	-32.5	0	0	0	113.7	C474 K476 V631	P471-C474 HydrophobicContact CG-CB 4.21Å; P471-C474 PolarHBondContact O-SG 2.61Å; P471-K476 PolarHBondContact O-NZ 3.1Å; P471-V631 HydrophobicContact CG-CG2 4.46Å
472	P	82.4	Confident	82	Confident	100 Å²	100	24 Å²	24	65%	0.649	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	146.6	171.2	26.3	-34.1	0	0	0	110.6	C474	P472-C474 VanDerWaalsContact C-N 3.33Å; P472-C474 PolarHBondContact O-N 3.07Å
473	G	79.3	Confident	83.4	Confident	46 Å²	46	22.1 Å²	22.1	47%	0.474	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	-6.7	178.5	0	0	0	0	0	117	G475 G633	G473-G475 PolarHBondContact O-N 3.43Å; G473-G633 PolarHBondContact O-N 3.32Å
474	C	82.9	Confident	84.5	Confident	9 Å²	9	21.3 Å²	21.3	6%	0.061	14%	0.144	C	C	.	.	S	Bend	trans	-71.5	12.5	-176.1	64.9	0	0	0	0	116.5	P471 P472 K476 V593 V631	P471-C474 HydrophobicContact CG-CB 4.21Å; P471-C474 PolarHBondContact O-SG 2.61Å; P472-C474 VanDerWaalsContact C-N 3.33Å; P472-C474 PolarHBondContact O-N 3.07Å; C474-K476 PolarHBondContact SG-NZ 3.29Å; C474-V593 HydrophobicContact CB-CG1 3.93Å; C474-V631 HydrophobicContact CB-CG1 3.55Å
475	G	83.9	Confident	85.1	Confident	9 Å²	9	21.8 Å²	21.8	9%	0.093	15%	0.148	C	C	.	.	S	Bend	trans	78.5	17.3	176.6	0	0	0	0	0	114.9	G473 T477 T478 V479	G473-G475 PolarHBondContact O-N 3.43Å; G475-T477 PolarHBondContact O-N 2.91Å; G475-T477 VanDerWaalsContact O-N 3.17Å; G475-T478 WeakPolarHBondContact CA-OG1 3.47Å; G475-T478 CarbonylContact O-C 3.53Å; G475-T478 WeakPolarHBondContact O-CA 3.22Å; G475-T478 PolarHBondContact O-N 3.38Å; G475-T478 PolarHBondContact O-OG1 3.44Å; G475-V479 WeakPolarHBondContact O-CG2 3.21Å; G475-V479 PolarHBondContact O-N 3.11Å
476	K	87.6	Confident	84.8	Confident	17 Å²	17	22.6 Å²	22.6	7%	0.074	15%	0.151	C	C	.	.	H	α-helix	trans	-46.3	-46.5	173.2	-71	-174.6	-71.3	-86	0	112.6	L468 G470 P471 C474 T478 V479 V480 T572 T573 V593	L468-K476 HydrophobicContact CB-CD 4.01Å; L468-K476 HydrophobicContact CB-CG 4.31Å; L468-K476 WeakPolarHBondContact O-CD 3.41Å; G470-K476 PolarHBondContact O-NZ 2.82Å; P471-K476 PolarHBondContact O-NZ 3.1Å; C474-K476 PolarHBondContact SG-NZ 3.29Å; K476-T478 PolarHBondContact O-N 3.28Å; K476-V479 PolarHBondContact O-N 3.35Å; K476-V480 WeakPolarHBondContact O-CG2 3.46Å; K476-V480 PolarHBondContact O-N 2.93Å; K476-V480 VanDerWaalsContact O-N 3.13Å; K476-T572 HydrophobicContact CB-CG2 3.88Å; K476-T572 HydrophobicContact CD-CG2 4.35Å; K476-T573 WeakPolarHBondContact CE-O 3.44Å; K476-T573 PolarHBondContact NZ-O 2.84Å; K476-V593 HydrophobicContact CG-CG2 3.81Å
477	T	87.4	Confident	84.2	Confident	48 Å²	48	23.8 Å²	23.8	29%	0.294	16%	0.157	S	C	.	.	H	α-helix	trans	-67.7	-31.9	177.8	54	0	0	0	0	113.5	G475 A481 L527 T529	G475-T477 PolarHBondContact O-N 2.91Å; G475-T477 VanDerWaalsContact O-N 3.17Å; T477-A481 VanDerWaalsContact O-CB 3.3Å; T477-A481 WeakPolarHBondContact O-CB 3.27Å; T477-A481 PolarHBondContact O-N 3.42Å; T477-L527 HydrophobicContact CG2-CD2 4.32Å; T477-T529 HydrophobicContact CG2-CG2 3.68Å
478	T	85.4	Confident	83.6	Confident	37 Å²	37	24.1 Å²	24.1	23%	0.227	16%	0.161	C	C	.	.	H	α-helix	trans	-77.4	-32.4	176	46.7	0	0	0	0	112.6	G475 K476 A481 A482	G475-T478 WeakPolarHBondContact CA-OG1 3.47Å; G475-T478 CarbonylContact O-C 3.53Å; G475-T478 WeakPolarHBondContact O-CA 3.22Å; G475-T478 PolarHBondContact O-N 3.38Å; G475-T478 PolarHBondContact O-OG1 3.44Å; K476-T478 PolarHBondContact O-N 3.28Å; T478-A481 PolarHBondContact O-N 2.81Å; T478-A482 VanDerWaalsContact O-CB 3.31Å; T478-A482 WeakPolarHBondContact O-CB 3.37Å; T478-A482 PolarHBondContact O-N 2.95Å
479	V	87.8	Confident	83.2	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-63.6	-49.4	172	171	0	0	0	0	110.2	L438 L441 V442 L445 G475 K476 A481 A482 A483	L438-V479 HydrophobicContact CB-CG2 4.16Å; L438-V479 HydrophobicContact CD1-CG2 3.86Å; L441-V479 HydrophobicContact CB-CG1 4.27Å; V442-V479 HydrophobicContact CG2-CB 4.35Å; V442-V479 HydrophobicContact CG2-CG1 3.92Å; V442-V479 HydrophobicContact CG2-CG2 4.38Å; L445-V479 HydrophobicContact CD2-CG1 4.13Å; G475-V479 WeakPolarHBondContact O-CG2 3.21Å; G475-V479 PolarHBondContact O-N 3.11Å; K476-V479 PolarHBondContact O-N 3.35Å; V479-A481 PolarHBondContact O-N 2.79Å; V479-A482 PolarHBondContact O-N 3.44Å; V479-A483 PolarHBondContact O-N 3.4Å
480	V	88.3	Confident	83	Confident	1 Å²	1	23 Å²	23	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-62.2	-43.6	176.4	-179.9	0	0	0	0	111.3	L445 L468 K476 A482 A483 C484 L491 V525 L527 V570	L445-V480 HydrophobicContact CD2-CG2 4.03Å; L468-V480 HydrophobicContact CD1-CG2 3.26Å; K476-V480 WeakPolarHBondContact O-CG2 3.46Å; K476-V480 PolarHBondContact O-N 2.93Å; K476-V480 VanDerWaalsContact O-N 3.13Å; V480-A482 VanDerWaalsContact C-N 3.32Å; V480-A482 PolarHBondContact O-N 2.93Å; V480-A483 PolarHBondContact O-N 2.89Å; V480-C484 WeakPolarHBondContact O-CB 3.36Å; V480-C484 PolarHBondContact O-N 2.83Å; V480-C484 PolarHBondContact O-SG 3.49Å; V480-L491 HydrophobicContact CG1-CD1 3.98Å; V480-V525 HydrophobicContact CG1-CG1 4.23Å; V480-L527 HydrophobicContact CB-CD1 4.33Å; V480-L527 HydrophobicContact CB-CD2 4.09Å; V480-L527 HydrophobicContact CG1-CB 4.44Å; V480-L527 HydrophobicContact CG1-CD1 4.18Å; V480-L527 HydrophobicContact CG1-CD2 4.01Å; V480-L527 HydrophobicContact CG1-CG 4.43Å; V480-L527 HydrophobicContact CG2-CD1 4.05Å; V480-V570 HydrophobicContact CG2-CB 4.5Å; V480-V570 HydrophobicContact CG2-CG1 3.7Å
481	A	85	Confident	83	Confident	27 Å²	27	24.5 Å²	24.5	22%	0.223	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-38.2	177.3	0	0	0	0	0	112.9	T477 T478 V479 S485 L491	T477-A481 VanDerWaalsContact O-CB 3.3Å; T477-A481 WeakPolarHBondContact O-CB 3.27Å; T477-A481 PolarHBondContact O-N 3.42Å; T478-A481 PolarHBondContact O-N 2.81Å; V479-A481 PolarHBondContact O-N 2.79Å; A481-S485 VanDerWaalsContact O-CB 3.31Å; A481-S485 WeakPolarHBondContact O-CB 3.43Å; A481-S485 PolarHBondContact O-N 2.8Å; A481-S485 PolarHBondContact O-OG 2.65Å; A481-L491 HydrophobicContact CB-CD2 3.84Å
482	A	82.3	Confident	83.3	Confident	11 Å²	11	22 Å²	22	9%	0.091	15%	0.148	C	C	.	.	H	α-helix	trans	-67.4	-44.4	174.5	0	0	0	0	0	111.9	P435 V442 T478 V479 V480 S485 Q486	P435-A482 HydrophobicContact CG-CB 4.27Å; V442-A482 HydrophobicContact CG1-CB 4.18Å; V442-A482 HydrophobicContact CG2-CB 4.08Å; T478-A482 VanDerWaalsContact O-CB 3.31Å; T478-A482 WeakPolarHBondContact O-CB 3.37Å; T478-A482 PolarHBondContact O-N 2.95Å; V479-A482 PolarHBondContact O-N 3.44Å; V480-A482 VanDerWaalsContact C-N 3.32Å; V480-A482 PolarHBondContact O-N 2.93Å; A482-S485 WeakPolarHBondContact O-CB 3.28Å; A482-S485 PolarHBondContact O-N 2.92Å; A482-Q486 WeakPolarHBondContact O-CG 3.45Å; A482-Q486 PolarHBondContact O-N 3.23Å
483	A	84.6	Confident	83.6	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.8	-44.2	176.9	0	0	0	0	0	112.3	V442 L445 V479 V480 S485 Q486 L487	V442-A483 HydrophobicContact CG1-CB 4.32Å; L445-A483 HydrophobicContact CB-CB 4.36Å; L445-A483 HydrophobicContact CD2-CB 3.64Å; L445-A483 HydrophobicContact CG-CB 3.93Å; V479-A483 PolarHBondContact O-N 3.4Å; V480-A483 PolarHBondContact O-N 2.89Å; A483-S485 VanDerWaalsContact C-N 3.29Å; A483-S485 PolarHBondContact O-N 2.72Å; A483-Q486 PolarHBondContact O-N 3.02Å; A483-L487 WeakPolarHBondContact O-CB 3.19Å; A483-L487 WeakPolarHBondContact O-CG 3.46Å; A483-L487 PolarHBondContact O-N 3.16Å
484	C	83.6	Confident	84	Confident	3 Å²	3	21.3 Å²	21.3	2%	0.02	12%	0.122	C	C	.	.	H	α-helix	trans	-61.2	-38.8	173.3	-64.2	0	0	0	0	112	V480 L487 G488 L489 L491 V525	V480-C484 WeakPolarHBondContact O-CB 3.36Å; V480-C484 PolarHBondContact O-N 2.83Å; V480-C484 PolarHBondContact O-SG 3.49Å; C484-L487 PolarHBondContact O-N 3.33Å; C484-G488 PolarHBondContact O-N 3.12Å; C484-L489 HydrophobicContact CB-CB 4.34Å; C484-L489 PolarHBondContact O-N 3.2Å; C484-L491 HydrophobicContact CB-CB 4.4Å; C484-V525 WeakPolarHBondContact SG-CG2 3.35Å
485	S	78.8	Confident	84.2	Confident	28 Å²	28	23.3 Å²	23.3	20%	0.196	14%	0.135	C	C	.	.	H	α-helix	trans	-64.1	-41.7	175.9	-62.5	0	0	0	0	112.1	W421 A481 A482 A483 L487	W421-S485 WeakPolarHBondContact CB-O 3.47Å; W421-S485 PolarHBondContact NE1-OG 3.04Å; A481-S485 VanDerWaalsContact O-CB 3.31Å; A481-S485 WeakPolarHBondContact O-CB 3.43Å; A481-S485 PolarHBondContact O-N 2.8Å; A481-S485 PolarHBondContact O-OG 2.65Å; A482-S485 WeakPolarHBondContact O-CB 3.28Å; A482-S485 PolarHBondContact O-N 2.92Å; A483-S485 VanDerWaalsContact C-N 3.29Å; A483-S485 PolarHBondContact O-N 2.72Å; S485-L487 VanDerWaalsContact C-N 3.33Å
486	Q	76.3	Confident	84.2	Confident	19 Å²	19	22.9 Å²	22.9	9%	0.089	13%	0.131	C	C	.	.	H	α-helix	trans	-69.9	-29.2	177.6	-71.2	178.7	16.6	0	0	113.1	P285 L286 L433 A482 A483	P285-Q486 VanDerWaalsContact CD-O 3.24Å; P285-Q486 WeakPolarHBondContact CD-O 3.44Å; P285-Q486 HydrophobicContact CG-CB 4.44Å; P285-Q486 WeakPolarHBondContact CG-O 3.49Å; L286-Q486 HydrophobicContact CD1-CG 4.4Å; L433-Q486 HydrophobicContact CD2-CG 4.49Å; L433-Q486 PolarHBondContact O-NE2 2.96Å; A482-Q486 WeakPolarHBondContact O-CG 3.45Å; A482-Q486 PolarHBondContact O-N 3.23Å; A483-Q486 PolarHBondContact O-N 3.02Å
487	L	76.9	Confident	84	Confident	26 Å²	26	25.9 Å²	25.9	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-95.6	-1.9	179.6	-63.3	174.4	0	0	0	114	L449 K450 L453 A483 C484 S485 L489	L449-L487 HydrophobicContact CB-CD1 3.59Å; L449-L487 HydrophobicContact CD1-CD1 4.07Å; L449-L487 HydrophobicContact CG-CD1 4.49Å; K450-L487 HydrophobicContact CB-CD2 4.13Å; K450-L487 HydrophobicContact CD-CD2 4.46Å; K450-L487 HydrophobicContact CG-CD2 4.42Å; L453-L487 HydrophobicContact CD1-CB 4.09Å; L453-L487 HydrophobicContact CD1-CD1 4.37Å; L453-L487 HydrophobicContact CD1-CD2 4.22Å; L453-L487 HydrophobicContact CD1-CG 4.46Å; A483-L487 WeakPolarHBondContact O-CB 3.19Å; A483-L487 WeakPolarHBondContact O-CG 3.46Å; A483-L487 PolarHBondContact O-N 3.16Å; C484-L487 PolarHBondContact O-N 3.33Å; S485-L487 VanDerWaalsContact C-N 3.33Å; L487-L489 VanDerWaalsContact C-N 3.34Å; L487-L489 HydrophobicContact CB-CD1 3.85Å; L487-L489 HydrophobicContact CB-CG 3.74Å; L487-L489 HydrophobicContact CD1-CD1 4.04Å; L487-L489 PolarHBondContact O-N 3.17Å
488	G	76.9	Confident	83.9	Confident	8 Å²	8	26.5 Å²	26.5	8%	0.082	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	30.8	-177.5	0	0	0	0	0	114.6	P418 V419 C484	P418-G488 CarbonylContact C-O 3.56Å; P418-G488 VanDerWaalsContact CA-O 3.31Å; P418-G488 WeakPolarHBondContact CA-O 3.14Å; P418-G488 WeakPolarHBondContact CB-O 3.42Å; V419-G488 PolarHBondContact N-O 3.12Å; V419-G488 CarbonylContact O-C 3.45Å; V419-G488 WeakPolarHBondContact O-CA 3.26Å; C484-G488 PolarHBondContact O-N 3.12Å
489	L	82.4	Confident	83.8	Confident	15 Å²	15	24.8 Å²	24.8	8%	0.079	15%	0.149	C	C	.	.			trans	-98	143	-175	-56.5	178.3	0	0	0	112.3	L453 C484 L487 L491 P523 V525 M568	L453-L489 HydrophobicContact CD1-CD1 4.27Å; L453-L489 HydrophobicContact CD1-CD2 4.01Å; L453-L489 HydrophobicContact CD1-CG 4.44Å; L453-L489 HydrophobicContact CD2-CD1 4.45Å; L453-L489 HydrophobicContact CD2-CD2 3.69Å; C484-L489 HydrophobicContact CB-CB 4.34Å; C484-L489 PolarHBondContact O-N 3.2Å; L487-L489 VanDerWaalsContact C-N 3.34Å; L487-L489 HydrophobicContact CB-CD1 3.85Å; L487-L489 HydrophobicContact CB-CG 3.74Å; L487-L489 HydrophobicContact CD1-CD1 4.04Å; L487-L489 PolarHBondContact O-N 3.17Å; L489-L491 PolarHBondContact O-N 3.25Å; L489-P523 HydrophobicContact CD2-CB 3.96Å; L489-P523 HydrophobicContact CD2-CG 4.2Å; L489-V525 HydrophobicContact CB-CG2 4.22Å; L489-V525 HydrophobicContact CD1-CG2 3.73Å; L489-M568 HydrophobicContact CD1-SD 4.02Å
490	H	84.3	Confident	83.5	Confident	9 Å²	9	27.4 Å²	27.4	4%	0.042	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	128	173.1	-66.3	-79.1	0	0	0	110.8	P329 S417 V419 C521 P523 A524 V525	P329-H490 HydrophobicContact CG-CB 4.33Å; S417-H490 PolarHBondContact O-NE2 3.02Å; V419-H490 VanDerWaalsContact CG2-CE1 3.5Å; V419-H490 WeakPolarHBondContact CG2-CE1 3.39Å; H490-C521 PolarHBondContact CD2-O 2.67Å; H490-P523 PolarHBondContact CD2-O 3.36Å; H490-P523 PolarHBondContact N-O 3.24Å; H490-A524 HydrophobicContact CB-CB 4.01Å; H490-A524 CarbonylContact O-C 3.58Å; H490-A524 VanDerWaalsContact O-CA 3.23Å; H490-A524 WeakPolarHBondContact O-CA 3.45Å; H490-V525 PolarHBondContact O-N 3.04Å
491	L	85.8	Confident	83.1	Confident	37 Å²	37	29.2 Å²	29.2	19%	0.194	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	111.9	177	178.8	65.8	0	0	0	111.2	V480 A481 C484 L489 L527	V480-L491 HydrophobicContact CG1-CD1 3.98Å; A481-L491 HydrophobicContact CB-CD2 3.84Å; C484-L491 HydrophobicContact CB-CB 4.4Å; L489-L491 PolarHBondContact O-N 3.25Å; L491-L527 HydrophobicContact CD1-CB 3.78Å; L491-L527 HydrophobicContact CD1-CD2 4.1Å
492	L	87.4	Confident	82.8	Confident	12 Å²	12	34.4 Å²	34.4	6%	0.063	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	95	168.7	-178.3	59.1	0	0	0	109.5	P329 V494 R517 A518 V525 L526 L527	P329-L492 HydrophobicContact CB-CB 4.39Å; P329-L492 HydrophobicContact CB-CD1 3.91Å; L492-V494 HydrophobicContact CG-CG2 4.09Å; L492-R517 HydrophobicContact CD2-CG 4.32Å; L492-A518 HydrophobicContact CD2-CB 3.87Å; L492-V525 PolarHBondContact N-O 3.36Å; L492-L526 HydrophobicContact CB-CD1 4.48Å; L492-L526 HydrophobicContact CD2-CD1 4.07Å; L492-L526 HydrophobicContact CG-CD1 4.16Å; L492-L527 PolarHBondContact O-N 2.89Å
493	K	87.8	Confident	82.9	Confident	120 Å²	120	37 Å²	37	52%	0.522	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.7	175.3	-178.3	-176.3	175.9	-173.8	0	110.9	L527 T529	K493-L527 HydrophobicContact CG-CD2 4.32Å; K493-T529 HydrophobicContact CG-CG2 4.26Å
494	V	88.8	Confident	82.9	Confident	10 Å²	10	38.9 Å²	38.9	6%	0.061	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	114.4	179.3	178.3	0	0	0	0	109.4	L492 L499 I514 L526 L527 L528 T529	L492-V494 HydrophobicContact CG-CG2 4.09Å; V494-L499 HydrophobicContact CG1-CD1 4.14Å; V494-L499 HydrophobicContact CG1-CD2 3.75Å; V494-L499 HydrophobicContact CG1-CG 4.1Å; V494-I514 HydrophobicContact CG1-CD1 4.01Å; V494-I514 HydrophobicContact CG1-CG2 4.37Å; V494-I514 HydrophobicContact CG2-CG2 3.84Å; V494-L526 HydrophobicContact CG2-CD1 3.81Å; V494-L527 PolarHBondContact N-O 2.89Å; V494-L528 HydrophobicContact CB-CD2 4.2Å; V494-L528 HydrophobicContact CG1-CD2 4.32Å; V494-T529 PolarHBondContact O-N 3.41Å
495	P	86.3	Confident	83	Confident	52 Å²	52	39.8 Å²	39.8	34%	0.338	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	125.7	171.4	30.5	-30	0	0	0	110.4	S497 S498 T529	P495-S497 PolarHBondContact O-N 2.99Å; P495-S497 VanDerWaalsContact O-N 3.16Å; P495-S498 PolarHBondContact O-N 3.23Å; P495-S498 PolarHBondContact O-OG 3.02Å; P495-T529 WeakPolarHBondContact CA-OG1 3.32Å
496	C	84.3	Confident	83.4	Confident	0 Å²	0	40 Å²	40	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.3	-26.7	179.7	-66.3	0	0	0	0	112.3	S498 L499 C500 T529 A530	C496-S498 PolarHBondContact O-N 2.65Å; C496-L499 HydrophobicContact CB-CD1 4.44Å; C496-L499 WeakPolarHBondContact O-CA 3.25Å; C496-L499 VanDerWaalsContact O-CB 3.25Å; C496-L499 WeakPolarHBondContact O-CB 3.43Å; C496-L499 PolarHBondContact O-N 2.8Å; C496-C500 PolarHBondContact O-N 2.92Å; C496-C500 VanDerWaalsContact O-N 3.17Å; C496-C500 PolarHBondContact O-SG 3.19Å; C496-C500 VanDerWaalsContact O-SG 3.32Å; C496-T529 WeakPolarHBondContact CB-O 3.36Å; C496-T529 PolarHBondContact N-O 3.36Å; C496-T529 PolarHBondContact SG-O 3.02Å; C496-T529 VanDerWaalsContact SG-O 3.41Å; C496-A530 WeakPolarHBondContact CB-O 3.44Å
497	S	84.1	Confident	83.9	Confident	80 Å²	80	39.6 Å²	39.6	56%	0.559	25%	0.249	S	C	*	.	H	α-helix	trans	-60.3	-21.7	171.1	59	0	0	0	0	115.1	P495	P495-S497 PolarHBondContact O-N 2.99Å; P495-S497 VanDerWaalsContact O-N 3.16Å
498	S	85.4	Confident	84.5	Confident	60 Å²	60	40.3 Å²	40.3	42%	0.42	25%	0.251	S	S	.	.	H	α-helix	trans	-85.2	-17.8	170.6	67.5	0	0	0	0	113.8	P495 C496 K510	P495-S498 PolarHBondContact O-N 3.23Å; P495-S498 PolarHBondContact O-OG 3.02Å; C496-S498 PolarHBondContact O-N 2.65Å; S498-K510 PolarHBondContact O-NZ 2.97Å
499	L	82.8	Confident	85.1	Confident	1 Å²	1	44 Å²	44	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-78	-38.9	176.7	-53.2	-177.4	0	0	0	110.4	V494 C496 A501 K510 L511 I514 L534	V494-L499 HydrophobicContact CG1-CD1 4.14Å; V494-L499 HydrophobicContact CG1-CD2 3.75Å; V494-L499 HydrophobicContact CG1-CG 4.1Å; C496-L499 HydrophobicContact CB-CD1 4.44Å; C496-L499 WeakPolarHBondContact O-CA 3.25Å; C496-L499 VanDerWaalsContact O-CB 3.25Å; C496-L499 WeakPolarHBondContact O-CB 3.43Å; C496-L499 PolarHBondContact O-N 2.8Å; L499-A501 PolarHBondContact O-N 3.13Å; L499-K510 WeakPolarHBondContact O-CD 3.26Å; L499-L511 HydrophobicContact CD1-CD1 4.02Å; L499-I514 HydrophobicContact CD2-CD1 3.22Å; L499-L534 HydrophobicContact CB-CD1 4.45Å; L499-L534 HydrophobicContact CD1-CD2 4.46Å
500	C	81.4	Confident	85.4	Confident	57 Å²	57	47.1 Å²	47.1	39%	0.385	29%	0.285	S	S	.	.			trans	-43.8	131.6	170.1	-58.4	0	0	0	0	110.6	C496 K510	C496-C500 PolarHBondContact O-N 2.92Å; C496-C500 VanDerWaalsContact O-N 3.17Å; C496-C500 PolarHBondContact O-SG 3.19Å; C496-C500 VanDerWaalsContact O-SG 3.32Å; C500-K510 PolarHBondContact O-NZ 3.49Å; C500-K510 VanDerWaalsContact O-NZ 3.15Å
501	A	80.6	Confident	85.6	Confident	39 Å²	39	46.7 Å²	46.7	32%	0.322	28%	0.283	S	S	.	.			trans	-150.5	163.5	-177.8	0	0	0	0	0	108.2	L499 S503 A506 V507	L499-A501 PolarHBondContact O-N 3.13Å; A501-S503 PolarHBondContact O-N 3Å; A501-S503 VanDerWaalsContact O-N 3.1Å; A501-A506 HydrophobicContact CB-CB 3.8Å; A501-V507 HydrophobicContact CB-CG2 3.88Å
502	D	77.9	Confident	85.8	Confident	135 Å²	135	49.2 Å²	49.2	72%	0.722	29%	0.294	S	S	*	.	S	Bend	trans	-61.3	-21.4	-176.8	-78.3	-67.9	0	0	0	115	R538	D502-R538 VanDerWaalsContact CA-NH2 3.28Å; D502-R538 VanDerWaalsContact CB-NH2 3.3Å; D502-R538 PolarHBondContact O-NE 2.91Å; D502-R538 PolarHBondContact O-NH2 3.07Å; D502-R538 IonicContact OD1-CZ 3.58Å; D502-R538 IonicContact OD1-NH2 3.94Å; D502-R538 PolarHBondContact OD1-NH2 2.81Å
503	S	85.2	Confident	85.9	Confident	67 Å²	67	51.1 Å²	51.1	47%	0.469	31%	0.312	S	S	.	.	S	Bend	trans	-134.6	144.7	179.3	67.8	0	0	0	0	112.4	A501 G505 A506 V507	A501-S503 PolarHBondContact O-N 3Å; A501-S503 VanDerWaalsContact O-N 3.1Å; S503-G505 VanDerWaalsContact C-N 3.29Å; S503-G505 PolarHBondContact O-N 2.95Å; S503-A506 WeakPolarHBondContact O-CA 3.45Å; S503-A506 WeakPolarHBondContact O-CB 3.43Å; S503-A506 PolarHBondContact O-N 3.36Å; S503-A506 WeakPolarHBondContact OG-CB 3.44Å; S503-A506 PolarHBondContact OG-N 3.46Å; S503-V507 PolarHBondContact O-N 3.33Å; S503-V507 VanDerWaalsContact O-N 3.11Å
504	S	84.6	Confident	85.9	Confident	39 Å²	39	47 Å²	47	27%	0.273	30%	0.295	S	S	.	.	H	α-helix	trans	-58.2	-37.6	-179.3	58.4	0	0	0	0	113.3	A506 V507 E508 D544	S504-A506 VanDerWaalsContact C-N 3.34Å; S504-A506 PolarHBondContact O-N 3.08Å; S504-V507 WeakPolarHBondContact O-CB 3.43Å; S504-V507 PolarHBondContact O-N 3Å; S504-E508 WeakPolarHBondContact O-CB 3.44Å; S504-E508 PolarHBondContact O-N 2.67Å; S504-D544 WeakPolarHBondContact CB-OD2 3.42Å
505	G	85	Confident	85.9	Confident	22 Å²	22	46.7 Å²	46.7	23%	0.227	29%	0.293	C	S	.	.	H	α-helix	trans	-66.2	-29.8	173.1	0	0	0	0	0	114.3	S503 T509	S503-G505 VanDerWaalsContact C-N 3.29Å; S503-G505 PolarHBondContact O-N 2.95Å; G505-T509 WeakPolarHBondContact O-CG2 3.45Å; G505-T509 PolarHBondContact O-N 3.06Å; G505-T509 VanDerWaalsContact O-N 3.08Å; G505-T509 PolarHBondContact O-OG1 2.81Å
506	A	86.8	Confident	85.9	Confident	31 Å²	31	46.8 Å²	46.8	26%	0.256	30%	0.295	S	S	.	.	H	α-helix	trans	-74	-33.8	172.3	0	0	0	0	0	111.8	A501 S503 S504 T509 K510	A501-A506 HydrophobicContact CB-CB 3.8Å; S503-A506 WeakPolarHBondContact O-CA 3.45Å; S503-A506 WeakPolarHBondContact O-CB 3.43Å; S503-A506 PolarHBondContact O-N 3.36Å; S503-A506 WeakPolarHBondContact OG-CB 3.44Å; S503-A506 PolarHBondContact OG-N 3.46Å; S504-A506 VanDerWaalsContact C-N 3.34Å; S504-A506 PolarHBondContact O-N 3.08Å; A506-T509 WeakPolarHBondContact CA-OG1 3.2Å; A506-T509 PolarHBondContact O-OG1 3.41Å; A506-K510 WeakPolarHBondContact O-CB 3.41Å; A506-K510 VanDerWaalsContact O-CG 3.26Å; A506-K510 WeakPolarHBondContact O-CG 3.06Å; A506-K510 PolarHBondContact O-N 2.92Å; A506-K510 VanDerWaalsContact O-N 3.15Å
507	V	87.4	Confident	86	Confident	11 Å²	11	52.5 Å²	52.5	7%	0.067	32%	0.316	C	S	.	.	H	α-helix	trans	-65	-46.7	170.7	-176.6	0	0	0	0	110.5	A501 S503 S504 K510 L511 L534 V547	A501-V507 HydrophobicContact CB-CG2 3.88Å; S503-V507 PolarHBondContact O-N 3.33Å; S503-V507 VanDerWaalsContact O-N 3.11Å; S504-V507 WeakPolarHBondContact O-CB 3.43Å; S504-V507 PolarHBondContact O-N 3Å; V507-K510 PolarHBondContact O-N 3.29Å; V507-L511 WeakPolarHBondContact O-CB 3.28Å; V507-L511 PolarHBondContact O-N 3.22Å; V507-L534 HydrophobicContact CG1-CD1 3.78Å; V507-V547 HydrophobicContact CB-CG2 4.05Å; V507-V547 HydrophobicContact CG1-CG1 3.87Å; V507-V547 HydrophobicContact CG1-CG2 4.07Å
508	E	88.9	Confident	86.1	Confident	42 Å²	42	48.7 Å²	48.7	20%	0.196	29%	0.29	C	S	.	.	H	α-helix	trans	-57.9	-49.7	178.8	-176.8	-175.4	168.7	0	0	112.3	S504 L511 Q512 R546 A550	S504-E508 WeakPolarHBondContact O-CB 3.44Å; S504-E508 PolarHBondContact O-N 2.67Å; E508-L511 WeakPolarHBondContact O-CB 3.22Å; E508-L511 PolarHBondContact O-N 3.21Å; E508-Q512 WeakPolarHBondContact O-CG 3.27Å; E508-Q512 PolarHBondContact O-N 2.92Å; E508-Q512 PolarHBondContact OE1-NE2 3.15Å; E508-R546 IonicContact OE2-CZ 3.71Å; E508-R546 IonicContact OE2-NE 2.72Å; E508-R546 PolarHBondContact OE2-NE 3.37Å; E508-R546 IonicContact OE2-NH2 3.63Å; E508-R546 PolarHBondContact OE2-NH2 3.05Å; E508-A550 HydrophobicContact CG-CB 3.97Å
509	T	89.7	Confident	86	Confident	84 Å²	84	48.5 Å²	48.5	52%	0.515	28%	0.28	S	S	.	.	H	α-helix	trans	-65.9	-38.8	179.1	47.2	0	0	0	0	112.6	G505 A506 L511 A513	G505-T509 WeakPolarHBondContact O-CG2 3.45Å; G505-T509 PolarHBondContact O-N 3.06Å; G505-T509 VanDerWaalsContact O-N 3.08Å; G505-T509 PolarHBondContact O-OG1 2.81Å; A506-T509 WeakPolarHBondContact CA-OG1 3.2Å; A506-T509 PolarHBondContact O-OG1 3.41Å; T509-L511 VanDerWaalsContact C-N 3.35Å; T509-A513 WeakPolarHBondContact O-CB 3.48Å; T509-A513 PolarHBondContact O-N 3.29Å
510	K	89.6	Confident	86	Confident	81 Å²	81	56 Å²	56	35%	0.352	31%	0.308	S	S	.	.	H	α-helix	trans	-60.3	-43.2	170.1	-77.6	175.9	175.3	-170.7	0	111.8	S498 L499 C500 A506 V507 A513 I514	S498-K510 PolarHBondContact O-NZ 2.97Å; L499-K510 WeakPolarHBondContact O-CD 3.26Å; C500-K510 PolarHBondContact O-NZ 3.49Å; C500-K510 VanDerWaalsContact O-NZ 3.15Å; A506-K510 WeakPolarHBondContact O-CB 3.41Å; A506-K510 VanDerWaalsContact O-CG 3.26Å; A506-K510 WeakPolarHBondContact O-CG 3.06Å; A506-K510 PolarHBondContact O-N 2.92Å; A506-K510 VanDerWaalsContact O-N 3.15Å; V507-K510 PolarHBondContact O-N 3.29Å; K510-A513 PolarHBondContact O-N 2.9Å; K510-I514 WeakPolarHBondContact O-CB 3.49Å; K510-I514 WeakPolarHBondContact O-CG1 3.35Å; K510-I514 PolarHBondContact O-N 3.37Å
511	L	89	Confident	85.8	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-61.2	-49.9	179.6	-163.4	75.3	0	0	0	110.5	L499 V507 E508 T509 A513 I514 F515 L534 L551 L554	L499-L511 HydrophobicContact CD1-CD1 4.02Å; V507-L511 WeakPolarHBondContact O-CB 3.28Å; V507-L511 PolarHBondContact O-N 3.22Å; E508-L511 WeakPolarHBondContact O-CB 3.22Å; E508-L511 PolarHBondContact O-N 3.21Å; T509-L511 VanDerWaalsContact C-N 3.35Å; L511-A513 PolarHBondContact O-N 2.96Å; L511-I514 PolarHBondContact O-N 3.06Å; L511-I514 VanDerWaalsContact O-N 3.13Å; L511-F515 HydrophobicContact CD1-CE2 4.14Å; L511-F515 HydrophobicContact CG-CD2 4.26Å; L511-F515 HydrophobicContact CG-CE2 4.16Å; L511-F515 WeakPolarHBondContact O-CD2 3.47Å; L511-F515 PolarHBondContact O-N 2.8Å; L511-L534 HydrophobicContact CD1-CD2 4.3Å; L511-L551 HydrophobicContact CD1-CD1 4.21Å; L511-L551 HydrophobicContact CD2-CB 4.08Å; L511-L551 HydrophobicContact CD2-CD1 4.14Å; L511-L554 HydrophobicContact CB-CD1 4.31Å; L511-L554 HydrophobicContact CD2-CD1 3.77Å; L511-L554 HydrophobicContact CG-CD1 3.76Å
512	Q	89.5	Confident	85.7	Confident	89 Å²	89	53.4 Å²	53.4	42%	0.416	28%	0.283	S	S	.	.	H	α-helix	trans	-59.8	-41.8	175.3	-68.9	170.8	2	0	0	112.4	E508 I514 S516 L554	E508-Q512 WeakPolarHBondContact O-CG 3.27Å; E508-Q512 PolarHBondContact O-N 2.92Å; E508-Q512 PolarHBondContact OE1-NE2 3.15Å; Q512-I514 VanDerWaalsContact C-N 3.26Å; Q512-I514 PolarHBondContact O-N 3.04Å; Q512-S516 WeakPolarHBondContact O-CB 3.45Å; Q512-S516 PolarHBondContact O-N 3.35Å; Q512-S516 PolarHBondContact O-OG 2.86Å; Q512-L554 HydrophobicContact CG-CD1 4.12Å
513	A	89.6	Confident	85.8	Confident	53 Å²	53	47.4 Å²	47.4	44%	0.438	25%	0.252	S	S	.	.	H	α-helix	trans	-62.8	-31.7	175.8	0	0	0	0	0	113	T509 K510 L511 S516 R517	T509-A513 WeakPolarHBondContact O-CB 3.48Å; T509-A513 PolarHBondContact O-N 3.29Å; K510-A513 PolarHBondContact O-N 2.9Å; L511-A513 PolarHBondContact O-N 2.96Å; A513-S516 WeakPolarHBondContact CA-OG 3.36Å; A513-S516 PolarHBondContact O-OG 2.92Å; A513-R517 WeakPolarHBondContact O-CB 3.22Å; A513-R517 PolarHBondContact O-N 3.11Å
514	I	87.4	Confident	85.7	Confident	33 Å²	33	44.4 Å²	44.4	17%	0.169	23%	0.231	C	C	.	.	H	α-helix	trans	-81.5	-42.5	179.5	-77.1	166.5	0	0	0	112	V494 L499 K510 L511 Q512 S516 R517 A518 L526	V494-I514 HydrophobicContact CG1-CD1 4.01Å; V494-I514 HydrophobicContact CG1-CG2 4.37Å; V494-I514 HydrophobicContact CG2-CG2 3.84Å; L499-I514 HydrophobicContact CD2-CD1 3.22Å; K510-I514 WeakPolarHBondContact O-CB 3.49Å; K510-I514 WeakPolarHBondContact O-CG1 3.35Å; K510-I514 PolarHBondContact O-N 3.37Å; L511-I514 PolarHBondContact O-N 3.06Å; L511-I514 VanDerWaalsContact O-N 3.13Å; Q512-I514 VanDerWaalsContact C-N 3.26Å; Q512-I514 PolarHBondContact O-N 3.04Å; I514-S516 VanDerWaalsContact C-N 3.32Å; I514-S516 PolarHBondContact O-N 3.24Å; I514-R517 WeakPolarHBondContact O-CB 3.46Å; I514-R517 PolarHBondContact O-N 3.34Å; I514-R517 VanDerWaalsContact O-N 3.16Å; I514-A518 PolarHBondContact O-N 3.17Å; I514-L526 HydrophobicContact CG2-CD1 4.01Å
515	F	88.3	Confident	85.8	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-61.7	-41.9	172.6	-86.6	-104.5	0	0	0	110.9	L511 R517 A518 R519 L526 L554 L555 L567 V569	L511-F515 HydrophobicContact CD1-CE2 4.14Å; L511-F515 HydrophobicContact CG-CD2 4.26Å; L511-F515 HydrophobicContact CG-CE2 4.16Å; L511-F515 WeakPolarHBondContact O-CD2 3.47Å; L511-F515 PolarHBondContact O-N 2.8Å; F515-R517 VanDerWaalsContact C-N 3.35Å; F515-R517 PolarHBondContact O-N 3.2Å; F515-A518 WeakPolarHBondContact O-CB 3.37Å; F515-A518 PolarHBondContact O-N 3.42Å; F515-A518 VanDerWaalsContact O-N 3.14Å; F515-R519 WeakPolarHBondContact O-CG 3.41Å; F515-R519 PolarHBondContact O-N 2.67Å; F515-L526 HydrophobicContact CD1-CD2 4.16Å; F515-L526 HydrophobicContact CD2-CD2 4.03Å; F515-L526 HydrophobicContact CE1-CD2 3.95Å; F515-L526 HydrophobicContact CE2-CD2 3.82Å; F515-L526 HydrophobicContact CG-CD2 4.21Å; F515-L526 HydrophobicContact CZ-CD2 3.79Å; F515-L554 HydrophobicContact CB-CD1 4.33Å; F515-L554 HydrophobicContact CD1-CB 3.94Å; F515-L554 HydrophobicContact CD2-CB 4.24Å; F515-L554 HydrophobicContact CD2-CD1 3.79Å; F515-L554 HydrophobicContact CE1-CB 3.89Å; F515-L554 WeakPolarHBondContact CE1-O 3.39Å; F515-L554 HydrophobicContact CE2-CB 4.19Å; F515-L554 HydrophobicContact CE2-CD1 4.24Å; F515-L554 HydrophobicContact CG-CB 4.12Å; F515-L554 HydrophobicContact CG-CD1 4.03Å; F515-L554 HydrophobicContact CG-CG 4.49Å; F515-L554 HydrophobicContact CZ-CB 4.01Å; F515-L555 HydrophobicContact CZ-CD2 4.23Å; F515-L567 HydrophobicContact CD1-CD2 4.29Å; F515-V569 HydrophobicContact CE1-CG2 4.21Å
516	S	87.1	Confident	86	Confident	54 Å²	54	41.5 Å²	41.5	38%	0.378	21%	0.207	S	C	.	.	H	α-helix	trans	-68.9	-25.8	173.8	60.3	0	0	0	0	114.1	Q512 A513 I514 R520	Q512-S516 WeakPolarHBondContact O-CB 3.45Å; Q512-S516 PolarHBondContact O-N 3.35Å; Q512-S516 PolarHBondContact O-OG 2.86Å; A513-S516 WeakPolarHBondContact CA-OG 3.36Å; A513-S516 PolarHBondContact O-OG 2.92Å; I514-S516 VanDerWaalsContact C-N 3.32Å; I514-S516 PolarHBondContact O-N 3.24Å; S516-R520 WeakPolarHBondContact O-CG 3.27Å; S516-R520 PolarHBondContact O-NE 3.26Å
517	R	86	Confident	86.3	Confident	119 Å²	119	40 Å²	40	45%	0.449	20%	0.195	S	C	.	.	H	α-helix	trans	-68.4	-44.1	165.3	-177.3	178.4	174.7	-178.6	-2.1	111.2	P329 L492 A513 I514 F515 R520	P329-R517 PolarHBondContact O-NH2 2.66Å; L492-R517 HydrophobicContact CD2-CG 4.32Å; A513-R517 WeakPolarHBondContact O-CB 3.22Å; A513-R517 PolarHBondContact O-N 3.11Å; I514-R517 WeakPolarHBondContact O-CB 3.46Å; I514-R517 PolarHBondContact O-N 3.34Å; I514-R517 VanDerWaalsContact O-N 3.16Å; F515-R517 VanDerWaalsContact C-N 3.35Å; F515-R517 PolarHBondContact O-N 3.2Å; R517-R520 WeakPolarHBondContact O-CB 3.38Å; R517-R520 PolarHBondContact O-N 2.84Å
518	A	85.1	Confident	86.4	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-63.6	-43.4	179.4	0	0	0	0	0	112.4	L492 I514 F515 R520 C521 L526 L567	L492-A518 HydrophobicContact CD2-CB 3.87Å; I514-A518 PolarHBondContact O-N 3.17Å; F515-A518 WeakPolarHBondContact O-CB 3.37Å; F515-A518 PolarHBondContact O-N 3.42Å; F515-A518 VanDerWaalsContact O-N 3.14Å; A518-R520 PolarHBondContact O-N 3.2Å; A518-C521 PolarHBondContact O-N 3.28Å; A518-C521 VanDerWaalsContact O-N 3.07Å; A518-L526 HydrophobicContact CB-CB 4.35Å; A518-L526 HydrophobicContact CB-CD1 4.46Å; A518-L526 HydrophobicContact CB-CD2 4.4Å; A518-L567 HydrophobicContact CB-CD1 3.77Å; A518-L567 HydrophobicContact CB-CD2 3.89Å
519	R	83.6	Confident	86.5	Confident	55 Å²	55	38.5 Å²	38.5	21%	0.208	19%	0.189	C	C	.	.	H	α-helix	trans	-58.4	-26.7	175.4	-69.1	-177.7	-170.3	-172.9	11.2	112.8	F515 D557 D559 L567	F515-R519 WeakPolarHBondContact O-CG 3.41Å; F515-R519 PolarHBondContact O-N 2.67Å; R519-D557 IonicContact CZ-OD2 3.28Å; R519-D557 VanDerWaalsContact CZ-OD2 3.26Å; R519-D557 IonicContact NH1-OD2 3.7Å; R519-D557 PolarHBondContact NH1-OD2 2.9Å; R519-D557 IonicContact NH2-OD2 3.33Å; R519-D557 PolarHBondContact NH2-OD2 2.88Å; R519-D559 WeakPolarHBondContact CD-OD2 3.35Å; R519-D559 IonicContact CZ-OD1 2.84Å; R519-D559 IonicContact CZ-OD2 3.08Å; R519-D559 IonicContact NE-OD1 2.63Å; R519-D559 IonicContact NE-OD2 3.7Å; R519-D559 IonicContact NH1-OD1 3.37Å; R519-D559 PolarHBondContact NH1-OD1 3.31Å; R519-D559 IonicContact NH1-OD2 3.96Å; R519-L567 HydrophobicContact CG-CD2 4.07Å
520	R	82.8	Confident	86.3	Confident	159 Å²	159	36 Å²	36	60%	0.6	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-11.2	176.8	-75.8	179.9	-75.2	173.1	-3.2	115.4	S327 L416 S516 R517 A518	S327-R520 WeakPolarHBondContact CB-O 3.38Å; L416-R520 VanDerWaalsContact CD2-O 3.28Å; L416-R520 WeakPolarHBondContact CD2-O 3.36Å; S516-R520 WeakPolarHBondContact O-CG 3.27Å; S516-R520 PolarHBondContact O-NE 3.26Å; R517-R520 WeakPolarHBondContact O-CB 3.38Å; R517-R520 PolarHBondContact O-N 2.84Å; A518-R520 PolarHBondContact O-N 3.2Å
521	C	78.6	Confident	86.2	Confident	10 Å²	10	32.2 Å²	32.2	7%	0.068	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	20.5	-177	-61.3	0	0	0	0	113.5	S327 H490 A518 A524	S327-C521 WeakPolarHBondContact O-CA 3.48Å; H490-C521 PolarHBondContact CD2-O 2.67Å; A518-C521 PolarHBondContact O-N 3.28Å; A518-C521 VanDerWaalsContact O-N 3.07Å; C521-A524 HydrophobicContact CB-CB 4.45Å; C521-A524 WeakPolarHBondContact O-CB 3.3Å
522	R	78	Confident	85.9	Confident	32 Å²	32	33.1 Å²	33.1	12%	0.121	17%	0.165	C	C	.	.			trans	-62.1	148.9	-175.5	-77.7	173.5	164	141.8	-2.1	113.2	L416 D559 P565	L416-R522 CarbonylContact C-O 3.58Å; L416-R522 WeakPolarHBondContact CA-O 3.39Å; L416-R522 VanDerWaalsContact CB-O 3.28Å; L416-R522 WeakPolarHBondContact CB-O 3.44Å; L416-R522 HydrophobicContact CD1-CB 4.37Å; L416-R522 HydrophobicContact CD2-CB 4.49Å; R522-D559 IonicContact CZ-OD2 3.78Å; R522-D559 IonicContact NH1-OD2 2.66Å; R522-D559 PolarHBondContact NH1-OD2 3.4Å; R522-D559 IonicContact NH2-OD2 2.59Å; R522-D559 PolarHBondContact NH2-OD2 2.93Å; R522-P565 WeakPolarHBondContact CD-O 3.49Å; R522-P565 PolarHBondContact NE-O 3.19Å
523	P	79.1	Confident	85.5	Confident	8 Å²	8	32.8 Å²	32.8	5%	0.052	17%	0.166	C	C	.	.	S	Bend	cis	-72.2	125.8	-9.4	30.3	-33.2	0	0	0	111.4	S417 P418 L489 H490 P565	S417-P523 VanDerWaalsContact C-CD 3.45Å; P418-P523 HydrophobicContact CB-CG 3.9Å; P418-P523 HydrophobicContact CG-CG 4.23Å; L489-P523 HydrophobicContact CD2-CB 3.96Å; L489-P523 HydrophobicContact CD2-CG 4.2Å; H490-P523 PolarHBondContact CD2-O 3.36Å; H490-P523 PolarHBondContact N-O 3.24Å; P523-P565 HydrophobicContact CB-CB 4.09Å; P523-P565 HydrophobicContact CB-CG 3.69Å; P523-P565 HydrophobicContact CG-CG 4.24Å
524	A	82.8	Confident	85	Confident	4 Å²	4	30.6 Å²	30.6	3%	0.033	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	152	-175.7	0	0	0	0	0	111.9	H490 C521 L567 M568	H490-A524 HydrophobicContact CB-CB 4.01Å; H490-A524 CarbonylContact O-C 3.58Å; H490-A524 VanDerWaalsContact O-CA 3.23Å; H490-A524 WeakPolarHBondContact O-CA 3.45Å; C521-A524 HydrophobicContact CB-CB 4.45Å; C521-A524 WeakPolarHBondContact O-CB 3.3Å; A524-L567 HydrophobicContact CB-CD1 4.5Å; A524-M568 PolarHBondContact O-N 3.1Å
525	V	87.5	Confident	84.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	117.2	166.4	-177.9	0	0	0	0	108.5	V480 C484 L489 H490 L492 M568 V570	V480-V525 HydrophobicContact CG1-CG1 4.23Å; C484-V525 WeakPolarHBondContact SG-CG2 3.35Å; L489-V525 HydrophobicContact CB-CG2 4.22Å; L489-V525 HydrophobicContact CD1-CG2 3.73Å; H490-V525 PolarHBondContact O-N 3.04Å; L492-V525 PolarHBondContact N-O 3.36Å; V525-M568 WeakPolarHBondContact CA-O 3.22Å; V525-M568 HydrophobicContact CG2-CB 4.15Å; V525-M568 HydrophobicContact CG2-SD 4.39Å; V525-V570 HydrophobicContact CG1-CB 4.19Å; V525-V570 HydrophobicContact CG1-CG2 3.61Å
526	L	90	Very high	83.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	110.3	169.2	175.2	61.8	0	0	0	108.7	L492 V494 I514 F515 A518 L528 L567 M568 V569 V570	L492-L526 HydrophobicContact CB-CD1 4.48Å; L492-L526 HydrophobicContact CD2-CD1 4.07Å; L492-L526 HydrophobicContact CG-CD1 4.16Å; V494-L526 HydrophobicContact CG2-CD1 3.81Å; I514-L526 HydrophobicContact CG2-CD1 4.01Å; F515-L526 HydrophobicContact CD1-CD2 4.16Å; F515-L526 HydrophobicContact CD2-CD2 4.03Å; F515-L526 HydrophobicContact CE1-CD2 3.95Å; F515-L526 HydrophobicContact CE2-CD2 3.82Å; F515-L526 HydrophobicContact CG-CD2 4.21Å; F515-L526 HydrophobicContact CZ-CD2 3.79Å; A518-L526 HydrophobicContact CB-CB 4.35Å; A518-L526 HydrophobicContact CB-CD1 4.46Å; A518-L526 HydrophobicContact CB-CD2 4.4Å; L526-L528 HydrophobicContact CD1-CD2 4.22Å; L526-L528 HydrophobicContact CD2-CD2 4.33Å; L526-L528 HydrophobicContact CG-CD2 4.15Å; L526-L528 HydrophobicContact CG-CG 4.31Å; L526-L567 HydrophobicContact CB-CD1 4.27Å; L526-M568 PolarHBondContact N-O 3.1Å; L526-V569 HydrophobicContact CB-CG2 4.45Å; L526-V569 HydrophobicContact CD2-CG1 4.48Å; L526-V569 HydrophobicContact CD2-CG2 4.44Å; L526-V570 PolarHBondContact O-N 3.1Å
527	L	91.9	Very high	82.8	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	102.7	178.9	174.3	59.5	0	0	0	110.3	T477 V480 L491 L492 K493 V494 T529 V570 T572	T477-L527 HydrophobicContact CG2-CD2 4.32Å; V480-L527 HydrophobicContact CB-CD1 4.33Å; V480-L527 HydrophobicContact CB-CD2 4.09Å; V480-L527 HydrophobicContact CG1-CB 4.44Å; V480-L527 HydrophobicContact CG1-CD1 4.18Å; V480-L527 HydrophobicContact CG1-CD2 4.01Å; V480-L527 HydrophobicContact CG1-CG 4.43Å; V480-L527 HydrophobicContact CG2-CD1 4.05Å; L491-L527 HydrophobicContact CD1-CB 3.78Å; L491-L527 HydrophobicContact CD1-CD2 4.1Å; L492-L527 PolarHBondContact O-N 2.89Å; K493-L527 HydrophobicContact CG-CD2 4.32Å; V494-L527 PolarHBondContact N-O 2.89Å; L527-T529 HydrophobicContact CD1-CG2 4.28Å; L527-T529 HydrophobicContact CD2-CG2 4.19Å; L527-T529 HydrophobicContact CG-CG2 3.83Å; L527-V570 CarbonylContact C-O 3.53Å; L527-V570 WeakPolarHBondContact CA-O 3.28Å; L527-V570 HydrophobicContact CD1-CB 4.26Å; L527-V570 HydrophobicContact CD1-CG1 4.16Å; L527-V570 WeakPolarHBondContact CD1-O 3.12Å; L527-T572 HydrophobicContact CD1-CG2 3.79Å
528	L	90.7	Very high	81.8	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	110.7	173.5	-60.3	179.2	0	0	0	109.4	V494 L526 V531 L551 V569 V570 A571 T572	V494-L528 HydrophobicContact CB-CD2 4.2Å; V494-L528 HydrophobicContact CG1-CD2 4.32Å; L526-L528 HydrophobicContact CD1-CD2 4.22Å; L526-L528 HydrophobicContact CD2-CD2 4.33Å; L526-L528 HydrophobicContact CG-CD2 4.15Å; L526-L528 HydrophobicContact CG-CG 4.31Å; L528-V531 HydrophobicContact CB-CG2 3.7Å; L528-L551 HydrophobicContact CD1-CD1 4.17Å; L528-V569 HydrophobicContact CD1-CG1 4.19Å; L528-V569 HydrophobicContact CG-CG1 4.47Å; L528-V570 PolarHBondContact N-O 3.42Å; L528-A571 CarbonylContact O-C 3.56Å; L528-A571 WeakPolarHBondContact O-CA 3.28Å; L528-T572 PolarHBondContact O-N 2.99Å
529	T	89.8	Confident	80.6	Confident	20 Å²	20	44.9 Å²	44.9	12%	0.123	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130.1	-178.6	75.2	0	0	0	0	112.4	T477 K493 V494 P495 C496 L527 T572	T477-T529 HydrophobicContact CG2-CG2 3.68Å; K493-T529 HydrophobicContact CG-CG2 4.26Å; V494-T529 PolarHBondContact O-N 3.41Å; P495-T529 WeakPolarHBondContact CA-OG1 3.32Å; C496-T529 WeakPolarHBondContact CB-O 3.36Å; C496-T529 PolarHBondContact N-O 3.36Å; C496-T529 PolarHBondContact SG-O 3.02Å; C496-T529 VanDerWaalsContact SG-O 3.41Å; L527-T529 HydrophobicContact CD1-CG2 4.28Å; L527-T529 HydrophobicContact CD2-CG2 4.19Å; L527-T529 HydrophobicContact CG-CG2 3.83Å; T529-T572 WeakPolarHBondContact CA-OG1 3.15Å
530	A	85.8	Confident	79.6	Confident	32 Å²	32	44.5 Å²	44.5	26%	0.264	22%	0.221	S	C	.	.			trans	65.2	59.8	-176.1	0	0	0	0	0	112.9	C496 D532 L533 T572	C496-A530 WeakPolarHBondContact CB-O 3.44Å; A530-D532 WeakPolarHBondContact CA-OD1 3.31Å; A530-D532 WeakPolarHBondContact CB-OD1 3.02Å; A530-D532 PolarHBondContact O-N 3.2Å; A530-L533 HydrophobicContact CB-CD1 3.89Å; A530-L533 HydrophobicContact CB-CG 4.15Å; A530-L533 WeakPolarHBondContact O-CB 3.21Å; A530-L533 PolarHBondContact O-N 3.11Å; A530-L533 VanDerWaalsContact O-N 3.15Å; A530-T572 WeakPolarHBondContact CA-O 3.28Å; A530-T572 PolarHBondContact N-O 2.89Å; A530-T572 VanDerWaalsContact N-O 3.09Å; A530-T572 PolarHBondContact N-OG1 3.25Å
531	V	87	Confident	78.6	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-68.9	-18.3	178.3	-171.8	0	0	0	0	112	L528 L533 L534 L551 A571 T572 L579 V583	L528-V531 HydrophobicContact CB-CG2 3.7Å; V531-L533 PolarHBondContact O-N 3.07Å; V531-L534 HydrophobicContact CG1-CB 4.42Å; V531-L534 WeakPolarHBondContact O-CB 3.27Å; V531-L534 PolarHBondContact O-N 3.02Å; V531-L551 HydrophobicContact CG1-CD2 4.2Å; V531-A571 HydrophobicContact CG2-CB 3.68Å; V531-T572 PolarHBondContact N-O 3.23Å; V531-T572 VanDerWaalsContact N-O 3.13Å; V531-L579 HydrophobicContact CB-CD1 4.21Å; V531-L579 HydrophobicContact CG1-CD1 3.84Å; V531-V583 HydrophobicContact CG1-CG1 4.41Å
532	D	83.6	Confident	78	Confident	19 Å²	19	45.9 Å²	45.9	10%	0.102	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-55.9	-23.2	166.8	44.4	-6.5	0	0	0	113.9	A530 R536 S574 D578	A530-D532 WeakPolarHBondContact CA-OD1 3.31Å; A530-D532 WeakPolarHBondContact CB-OD1 3.02Å; A530-D532 PolarHBondContact O-N 3.2Å; D532-R536 PolarHBondContact O-NE 3.09Å; D532-S574 VanDerWaalsContact OD2-CB 3.32Å; D532-S574 WeakPolarHBondContact OD2-CB 3.5Å; D532-S574 PolarHBondContact OD2-N 3.49Å; D532-S574 PolarHBondContact OD2-OG 3.3Å; D532-D578 HydrophobicContact CB-CB 4.22Å
533	L	81.1	Confident	77.9	Confident	83 Å²	83	50.5 Å²	50.5	44%	0.435	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-82.6	-14.4	172.5	-59.4	176.7	0	0	0	113.8	A530 V531	A530-L533 HydrophobicContact CB-CD1 3.89Å; A530-L533 HydrophobicContact CB-CG 4.15Å; A530-L533 WeakPolarHBondContact O-CB 3.21Å; A530-L533 PolarHBondContact O-N 3.11Å; A530-L533 VanDerWaalsContact O-N 3.15Å; V531-L533 PolarHBondContact O-N 3.07Å
534	L	79.6	Confident	78	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.037	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	122.1	-173.4	-170.7	65.2	0	0	0	109.8	L499 V507 L511 V531 V547 L551	L499-L534 HydrophobicContact CB-CD1 4.45Å; L499-L534 HydrophobicContact CD1-CD2 4.46Å; V507-L534 HydrophobicContact CG1-CD1 3.78Å; L511-L534 HydrophobicContact CD1-CD2 4.3Å; V531-L534 HydrophobicContact CG1-CB 4.42Å; V531-L534 WeakPolarHBondContact O-CB 3.27Å; V531-L534 PolarHBondContact O-N 3.02Å; L534-V547 HydrophobicContact CD1-CG1 3.66Å; L534-V547 HydrophobicContact CG-CG1 3.92Å; L534-L551 HydrophobicContact CD2-CD1 4.18Å; L534-L551 HydrophobicContact CD2-CD2 3.92Å
535	G	70.6	Confident	78	Confident	7 Å²	7	55.2 Å²	55.2	7%	0.072	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.5	9.4	-177	0	0	0	0	0	114.9	E543 D544	G535-E543 CarbonylContact O-C 3.23Å; G535-E543 VanDerWaalsContact O-CA 3.26Å; G535-E543 WeakPolarHBondContact O-CA 3.34Å; G535-D544 PolarHBondContact O-N 3.37Å
536	R	75.1	Confident	77.8	Confident	109 Å²	109	61.7 Å²	61.7	41%	0.411	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-86.6	138.9	163	-63.4	-174.4	-174	-146.7	-12.3	110.2	D532 D578	D532-R536 PolarHBondContact O-NE 3.09Å; R536-D578 IonicContact CZ-OD1 3.2Å; R536-D578 VanDerWaalsContact NH2-CB 3.27Å; R536-D578 PolarHBondContact NH2-O 2.9Å; R536-D578 IonicContact NH2-OD1 3.29Å; R536-D578 PolarHBondContact NH2-OD1 3.42Å
537	D	69.3	Low	77.7	Confident	86 Å²	86	61.9 Å²	61.9	46%	0.46	33%	0.33	S	S	.	.			trans	-70.7	166.2	172.6	-161.3	1.4	0	0	0	111.5	D539 G540 G542	D537-D539 PolarHBondContact O-N 2.62Å; D537-D539 VanDerWaalsContact O-N 3.15Å; D537-G540 PolarHBondContact O-N 3.34Å; D537-G542 PolarHBondContact N-O 3Å
538	R	65.3	Low	77.4	Confident	176 Å²	176	62 Å²	62	66%	0.664	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-35	-176.7	-77.9	178.9	165.1	-111.2	-3.5	113.8	D502 G540	D502-R538 VanDerWaalsContact CA-NH2 3.28Å; D502-R538 VanDerWaalsContact CB-NH2 3.3Å; D502-R538 PolarHBondContact O-NE 2.91Å; D502-R538 PolarHBondContact O-NH2 3.07Å; D502-R538 IonicContact OD1-CZ 3.58Å; D502-R538 IonicContact OD1-NH2 3.94Å; D502-R538 PolarHBondContact OD1-NH2 2.81Å; R538-G540 VanDerWaalsContact C-N 3.33Å
539	D	60.3	Low	77.2	Confident	133 Å²	133	64.6 Å²	64.6	71%	0.711	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-4.7	-179.8	-62.8	-29.2	0	0	0	113.1	D537 L541	D537-D539 PolarHBondContact O-N 2.62Å; D537-D539 VanDerWaalsContact O-N 3.15Å; D539-L541 HydrophobicContact CB-CD1 4.5Å; D539-L541 PolarHBondContact O-N 3.25Å; D539-L541 VanDerWaalsContact O-N 3.13Å
540	G	63.3	Low	77.1	Confident	46 Å²	46	64.4 Å²	64.4	47%	0.474	35%	0.353	S	S	.	.	S	Bend	trans	69.8	1.1	-179.2	0	0	0	0	0	115.5	D537 R538	D537-G540 PolarHBondContact O-N 3.34Å; R538-G540 VanDerWaalsContact C-N 3.33Å
541	L	60.8	Low	77.2	Confident	165 Å²	165	63 Å²	63	86%	0.864	34%	0.341	S	S	*	.	S	Bend	trans	-97.6	-9.8	-174.9	-69.1	168.4	0	0	0	114.4	D539	D539-L541 HydrophobicContact CB-CD1 4.5Å; D539-L541 PolarHBondContact O-N 3.25Å; D539-L541 VanDerWaalsContact O-N 3.13Å
542	G	67.3	Low	77.2	Confident	34 Å²	34	66.9 Å²	66.9	35%	0.351	36%	0.356	S	S	.	.	S	Bend	trans	-141.3	166.6	-175.9	0	0	0	0	0	113.2	D537	D537-G542 PolarHBondContact N-O 3Å
543	E	75.3	Confident	77.3	Confident	128 Å²	128	71.8 Å²	71.8	60%	0.598	38%	0.377	S	S	*	.	B	Isolated β-bridge	trans	-99.5	131.9	179.3	-62.8	-173.1	159.7	0	0	111.9	G535 A545 P580	G535-E543 CarbonylContact O-C 3.23Å; G535-E543 VanDerWaalsContact O-CA 3.26Å; G535-E543 WeakPolarHBondContact O-CA 3.34Å; E543-A545 PolarHBondContact O-N 2.87Å; E543-A545 VanDerWaalsContact O-N 3.14Å; E543-P580 HydrophobicContact CG-CG 4.42Å; E543-P580 WeakPolarHBondContact OE1-CA 3.43Å; E543-P580 WeakPolarHBondContact OE1-CB 3.37Å
544	D	81.6	Confident	77.5	Confident	37 Å²	37	69 Å²	69	20%	0.198	36%	0.363	C	S	.	.			trans	-82	89.2	170	-175.3	-15.1	0	0	0	110	S504 G535 R546 V547 V548	S504-D544 WeakPolarHBondContact CB-OD2 3.42Å; G535-D544 PolarHBondContact O-N 3.37Å; D544-R546 PolarHBondContact O-N 3.03Å; D544-R546 VanDerWaalsContact O-N 3.09Å; D544-R546 WeakPolarHBondContact OD1-CB 3.38Å; D544-R546 PolarHBondContact OD1-N 3.14Å; D544-V547 HydrophobicContact CB-CB 4.38Å; D544-V547 HydrophobicContact CB-CG2 4.46Å; D544-V547 PolarHBondContact O-N 2.96Å; D544-V547 VanDerWaalsContact O-N 3.15Å; D544-V547 PolarHBondContact OD1-N 3.23Å; D544-V547 VanDerWaalsContact OD2-CG2 3.27Å; D544-V547 WeakPolarHBondContact OD2-CG2 3.01Å; D544-V548 WeakPolarHBondContact O-CG2 3.44Å; D544-V548 PolarHBondContact O-N 3.27Å
545	A	81.7	Confident	77.7	Confident	74 Å²	74	69.4 Å²	69.4	61%	0.612	37%	0.365	S	S	*	.	H	α-helix	trans	-54.3	-27.1	179.1	0	0	0	0	0	113.8	E543 A549	E543-A545 PolarHBondContact O-N 2.87Å; E543-A545 VanDerWaalsContact O-N 3.14Å; A545-A549 WeakPolarHBondContact O-CB 3.44Å; A545-A549 PolarHBondContact O-N 3.5Å
546	R	84.7	Confident	78.1	Confident	136 Å²	136	73 Å²	73	51%	0.513	38%	0.382	S	S	.	.	H	α-helix	trans	-72.7	-45.7	179.1	-178.8	-178.6	174.4	155.8	3.3	111.1	E508 D544 A549 A550	E508-R546 IonicContact OE2-CZ 3.71Å; E508-R546 IonicContact OE2-NE 2.72Å; E508-R546 PolarHBondContact OE2-NE 3.37Å; E508-R546 IonicContact OE2-NH2 3.63Å; E508-R546 PolarHBondContact OE2-NH2 3.05Å; D544-R546 PolarHBondContact O-N 3.03Å; D544-R546 VanDerWaalsContact O-N 3.09Å; D544-R546 WeakPolarHBondContact OD1-CB 3.38Å; D544-R546 PolarHBondContact OD1-N 3.14Å; R546-A549 PolarHBondContact O-N 2.94Å; R546-A550 WeakPolarHBondContact O-CB 3.36Å; R546-A550 PolarHBondContact O-N 3.17Å
547	V	86.4	Confident	78.1	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.024	38%	0.379	C	S	.	.	H	α-helix	trans	-67.6	-39.5	177.7	174.2	0	0	0	0	110.6	V507 L534 D544 A550 L551	V507-V547 HydrophobicContact CB-CG2 4.05Å; V507-V547 HydrophobicContact CG1-CG1 3.87Å; V507-V547 HydrophobicContact CG1-CG2 4.07Å; L534-V547 HydrophobicContact CD1-CG1 3.66Å; L534-V547 HydrophobicContact CG-CG1 3.92Å; D544-V547 HydrophobicContact CB-CB 4.38Å; D544-V547 HydrophobicContact CB-CG2 4.46Å; D544-V547 PolarHBondContact O-N 2.96Å; D544-V547 VanDerWaalsContact O-N 3.15Å; D544-V547 PolarHBondContact OD1-N 3.23Å; D544-V547 VanDerWaalsContact OD2-CG2 3.27Å; D544-V547 WeakPolarHBondContact OD2-CG2 3.01Å; V547-A550 PolarHBondContact O-N 3.23Å; V547-L551 WeakPolarHBondContact O-CB 3.44Å; V547-L551 PolarHBondContact O-N 2.83Å
548	V	86.4	Confident	77.8	Confident	4 Å²	4	71.9 Å²	71.9	2%	0.024	38%	0.381	C	S	.	.	H	α-helix	trans	-61.2	-48	174.4	168.9	0	0	0	0	111.5	D544 A550 L551 R552 P580 D582 V583	D544-V548 WeakPolarHBondContact O-CG2 3.44Å; D544-V548 PolarHBondContact O-N 3.27Å; V548-A550 PolarHBondContact O-N 2.8Å; V548-L551 PolarHBondContact O-N 2.93Å; V548-R552 WeakPolarHBondContact O-CB 3.37Å; V548-R552 PolarHBondContact O-N 2.82Å; V548-P580 HydrophobicContact CG1-CB 4.4Å; V548-P580 HydrophobicContact CG2-CB 4.11Å; V548-P580 HydrophobicContact CG2-CG 3.9Å; V548-D582 HydrophobicContact CG1-CB 3.67Å; V548-V583 HydrophobicContact CG1-CG2 3.89Å; V548-V583 HydrophobicContact CG2-CG2 4.39Å
549	A	86.4	Confident	77.5	Confident	56 Å²	56	66.3 Å²	66.3	46%	0.463	36%	0.364	S	S	.	.	H	α-helix	trans	-63.3	-41.5	177.3	0	0	0	0	0	112.6	A545 R546 R552 H553	A545-A549 WeakPolarHBondContact O-CB 3.44Å; A545-A549 PolarHBondContact O-N 3.5Å; R546-A549 PolarHBondContact O-N 2.94Å; A549-R552 PolarHBondContact O-N 2.87Å; A549-H553 WeakPolarHBondContact O-CB 3.32Å; A549-H553 PolarHBondContact O-N 3.13Å
550	A	86.9	Confident	77.3	Confident	16 Å²	16	65.7 Å²	65.7	13%	0.132	37%	0.367	C	S	.	.	H	α-helix	trans	-64.3	-41.1	176.7	0	0	0	0	0	112.4	E508 R546 V547 V548 H553 L554	E508-A550 HydrophobicContact CG-CB 3.97Å; R546-A550 WeakPolarHBondContact O-CB 3.36Å; R546-A550 PolarHBondContact O-N 3.17Å; V547-A550 PolarHBondContact O-N 3.23Å; V548-A550 PolarHBondContact O-N 2.8Å; A550-H553 PolarHBondContact O-N 2.9Å; A550-L554 WeakPolarHBondContact O-CG 3.44Å; A550-L554 PolarHBondContact O-N 3.26Å
551	L	88.1	Confident	76.8	Confident	2 Å²	2	70 Å²	70	1%	0.01	38%	0.379	C	S	.	.	H	α-helix	trans	-64	-48.1	173.8	-179	69.8	0	0	0	111.3	L511 L528 V531 L534 V547 V548 H553 L554 L555 V583	L511-L551 HydrophobicContact CD1-CD1 4.21Å; L511-L551 HydrophobicContact CD2-CB 4.08Å; L511-L551 HydrophobicContact CD2-CD1 4.14Å; L528-L551 HydrophobicContact CD1-CD1 4.17Å; V531-L551 HydrophobicContact CG1-CD2 4.2Å; L534-L551 HydrophobicContact CD2-CD1 4.18Å; L534-L551 HydrophobicContact CD2-CD2 3.92Å; V547-L551 WeakPolarHBondContact O-CB 3.44Å; V547-L551 PolarHBondContact O-N 2.83Å; V548-L551 PolarHBondContact O-N 2.93Å; L551-H553 VanDerWaalsContact C-N 3.29Å; L551-H553 PolarHBondContact O-N 3.32Å; L551-L554 PolarHBondContact O-N 3.14Å; L551-L555 HydrophobicContact CD1-CD1 4.33Å; L551-L555 HydrophobicContact CD1-CG 4.37Å; L551-L555 HydrophobicContact CG-CD1 3.96Å; L551-L555 HydrophobicContact CG-CG 4.38Å; L551-L555 VanDerWaalsContact O-CG 3.31Å; L551-L555 WeakPolarHBondContact O-CG 3.46Å; L551-L555 PolarHBondContact O-N 3.01Å; L551-V583 HydrophobicContact CD2-CG1 3.85Å; L551-V583 HydrophobicContact CD2-CG2 4.04Å
552	R	86.9	Confident	76.3	Confident	83 Å²	83	69.3 Å²	69.3	31%	0.313	38%	0.376	S	S	.	.	H	α-helix	trans	-56.8	-43.4	176.8	-178.2	176.4	178.6	129.7	20.7	111.2	V548 A549 L555 L556 D582 T585	V548-R552 WeakPolarHBondContact O-CB 3.37Å; V548-R552 PolarHBondContact O-N 2.82Å; A549-R552 PolarHBondContact O-N 2.87Å; R552-L555 PolarHBondContact O-N 2.73Å; R552-L556 HydrophobicContact CG-CD1 3.77Å; R552-L556 WeakPolarHBondContact O-CB 3.12Å; R552-L556 VanDerWaalsContact O-CG 3.27Å; R552-L556 WeakPolarHBondContact O-CG 3.49Å; R552-L556 PolarHBondContact O-N 3.44Å; R552-L556 VanDerWaalsContact O-N 3.1Å; R552-D582 IonicContact CZ-OD1 3.8Å; R552-D582 IonicContact NH1-OD1 3.92Å; R552-D582 PolarHBondContact NH1-OD1 3.39Å; R552-T585 PolarHBondContact NH1-OG1 2.93Å; R552-T585 VanDerWaalsContact NH1-OG1 3.14Å; R552-T585 PolarHBondContact NH2-OG1 3.35Å
553	H	87.2	Confident	75.5	Confident	121 Å²	121	73.6 Å²	73.6	56%	0.56	40%	0.401	S	S	*	.	H	α-helix	trans	-61	-51.1	174.6	-170.5	-61.1	0	0	0	111.4	A549 A550 L551 L555 L556 D557	A549-H553 WeakPolarHBondContact O-CB 3.32Å; A549-H553 PolarHBondContact O-N 3.13Å; A550-H553 PolarHBondContact O-N 2.9Å; L551-H553 VanDerWaalsContact C-N 3.29Å; L551-H553 PolarHBondContact O-N 3.32Å; H553-L555 VanDerWaalsContact C-N 3.26Å; H553-L555 PolarHBondContact O-N 3.46Å; H553-L556 PolarHBondContact O-N 3.15Å; H553-L556 VanDerWaalsContact O-N 3.17Å; H553-D557 WeakPolarHBondContact O-CB 3.41Å; H553-D557 PolarHBondContact O-N 3.28Å
554	L	85.2	Confident	74.6	Confident	26 Å²	26	71 Å²	71	14%	0.136	40%	0.396	C	S	.	.	H	α-helix	trans	-67.4	-22.4	-178.3	-70.1	177.3	0	0	0	114.5	L511 Q512 F515 A550 L551	L511-L554 HydrophobicContact CB-CD1 4.31Å; L511-L554 HydrophobicContact CD2-CD1 3.77Å; L511-L554 HydrophobicContact CG-CD1 3.76Å; Q512-L554 HydrophobicContact CG-CD1 4.12Å; F515-L554 HydrophobicContact CB-CD1 4.33Å; F515-L554 HydrophobicContact CD1-CB 3.94Å; F515-L554 HydrophobicContact CD2-CB 4.24Å; F515-L554 HydrophobicContact CD2-CD1 3.79Å; F515-L554 HydrophobicContact CE1-CB 3.89Å; F515-L554 WeakPolarHBondContact CE1-O 3.39Å; F515-L554 HydrophobicContact CE2-CB 4.19Å; F515-L554 HydrophobicContact CE2-CD1 4.24Å; F515-L554 HydrophobicContact CG-CB 4.12Å; F515-L554 HydrophobicContact CG-CD1 4.03Å; F515-L554 HydrophobicContact CG-CG 4.49Å; F515-L554 HydrophobicContact CZ-CB 4.01Å; A550-L554 WeakPolarHBondContact O-CG 3.44Å; A550-L554 PolarHBondContact O-N 3.26Å; L551-L554 PolarHBondContact O-N 3.14Å
555	L	82.9	Confident	73.7	Confident	14 Å²	14	71.4 Å²	71.4	7%	0.073	40%	0.4	C	S	.	.	H	α-helix	trans	-78.2	-34	172.1	-70.8	173.5	0	0	0	112.8	T463 F515 L551 R552 H553 V569 A586 F587	T463-L555 WeakPolarHBondContact CG2-O 3.41Å; F515-L555 HydrophobicContact CZ-CD2 4.23Å; L551-L555 HydrophobicContact CD1-CD1 4.33Å; L551-L555 HydrophobicContact CD1-CG 4.37Å; L551-L555 HydrophobicContact CG-CD1 3.96Å; L551-L555 HydrophobicContact CG-CG 4.38Å; L551-L555 VanDerWaalsContact O-CG 3.31Å; L551-L555 WeakPolarHBondContact O-CG 3.46Å; L551-L555 PolarHBondContact O-N 3.01Å; R552-L555 PolarHBondContact O-N 2.73Å; H553-L555 VanDerWaalsContact C-N 3.26Å; H553-L555 PolarHBondContact O-N 3.46Å; L555-V569 HydrophobicContact CD2-CB 4.05Å; L555-V569 HydrophobicContact CD2-CG1 3.71Å; L555-V569 HydrophobicContact CD2-CG2 4.19Å; L555-A586 HydrophobicContact CB-CB 4.34Å; L555-A586 HydrophobicContact CD1-CB 3.81Å; L555-F587 HydrophobicContact CD1-CE2 3.9Å; L555-F587 HydrophobicContact CD1-CZ 3.84Å; L555-F587 HydrophobicContact CD2-CZ 4.24Å
556	L	78.9	Confident	73	Confident	83 Å²	83	69.8 Å²	69.8	44%	0.435	38%	0.384	S	S	.	.	H	α-helix	trans	-92.2	-11.9	-179.6	-63.5	171.8	0	0	0	113.8	T463 R552 H553 E558	T463-L556 HydrophobicContact CG2-CD2 3.95Å; R552-L556 HydrophobicContact CG-CD1 3.77Å; R552-L556 WeakPolarHBondContact O-CB 3.12Å; R552-L556 VanDerWaalsContact O-CG 3.27Å; R552-L556 WeakPolarHBondContact O-CG 3.49Å; R552-L556 PolarHBondContact O-N 3.44Å; R552-L556 VanDerWaalsContact O-N 3.1Å; H553-L556 PolarHBondContact O-N 3.15Å; H553-L556 VanDerWaalsContact O-N 3.17Å; L556-E558 PolarHBondContact O-N 3.39Å
557	D	75.1	Confident	72.6	Confident	64 Å²	64	64.3 Å²	64.3	34%	0.342	37%	0.365	S	S	.	.			trans	-73.5	83	179.2	-173.6	54.9	0	0	0	111.1	R519 H553	R519-D557 IonicContact CZ-OD2 3.28Å; R519-D557 VanDerWaalsContact CZ-OD2 3.26Å; R519-D557 IonicContact NH1-OD2 3.7Å; R519-D557 PolarHBondContact NH1-OD2 2.9Å; R519-D557 IonicContact NH2-OD2 3.33Å; R519-D557 PolarHBondContact NH2-OD2 2.88Å; H553-D557 WeakPolarHBondContact O-CB 3.41Å; H553-D557 PolarHBondContact O-N 3.28Å
558	E	63	Low	72.6	Confident	108 Å²	108	64.3 Å²	64.3	51%	0.505	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-69.5	120.9	172.3	-69.6	-70.5	166	0	0	110.6	T463 L556	T463-E558 WeakPolarHBondContact CA-OE1 3.4Å; L556-E558 PolarHBondContact O-N 3.39Å
559	D	60.3	Low	72.7	Confident	59 Å²	59	64.6 Å²	64.6	32%	0.316	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-68	140.1	173	-75.5	-38.2	0	0	0	110	R519 R522 L561	R519-D559 WeakPolarHBondContact CD-OD2 3.35Å; R519-D559 IonicContact CZ-OD1 2.84Å; R519-D559 IonicContact CZ-OD2 3.08Å; R519-D559 IonicContact NE-OD1 2.63Å; R519-D559 IonicContact NE-OD2 3.7Å; R519-D559 IonicContact NH1-OD1 3.37Å; R519-D559 PolarHBondContact NH1-OD1 3.31Å; R519-D559 IonicContact NH1-OD2 3.96Å; R522-D559 IonicContact CZ-OD2 3.78Å; R522-D559 IonicContact NH1-OD2 2.66Å; R522-D559 PolarHBondContact NH1-OD2 3.4Å; R522-D559 IonicContact NH2-OD2 2.59Å; R522-D559 PolarHBondContact NH2-OD2 2.93Å; D559-L561 PolarHBondContact O-N 2.95Å
560	P	55.1	Low	72.9	Confident	119 Å²	119	61.9 Å²	61.9	77%	0.773	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-62	138	-171.4	22.6	-33.5	0	0	0	113.1	N562	P560-N562 PolarHBondContact O-N 3.12Å
561	L	53	Low	73.1	Confident	138 Å²	138	61.1 Å²	61.1	72%	0.723	34%	0.338	S	S	*	.	S	Bend	trans	-50.5	110.9	179.1	-66.7	112	0	0	0	111.9	D559	D559-L561 PolarHBondContact O-N 2.95Å
562	N	49.2	Very low	73.2	Confident	149 Å²	149	61.5 Å²	61.5	80%	0.797	34%	0.34	S	S	*	.	S	Bend	trans	177.6	138.7	133.3	-87.4	-38.6	0	0	0	111.3	P560 C564	P560-N562 PolarHBondContact O-N 3.12Å; N562-C564 PolarHBondContact O-N 2.97Å
563	S	52.2	Low	73.3	Confident	125 Å²	125	57.6 Å²	57.6	87%	0.874	33%	0.326	S	S	*	.	S	Bend	trans	72	-20.7	167.7	75.3	0	0	0	0	121.6
564	C	55.8	Low	73.1	Confident	74 Å²	74	53.6 Å²	53.6	50%	0.5	31%	0.311	S	S	.	.	S	Bend	trans	-111.7	143.1	-176.9	-73.4	0	0	0	0	114.1	N562	N562-C564 PolarHBondContact O-N 2.97Å
565	P	62.6	Low	72.8	Confident	44 Å²	44	58.9 Å²	58.9	29%	0.286	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-67.9	146.2	173.3	28.3	-34	0	0	0	111.6	R522 P523	R522-P565 WeakPolarHBondContact CD-O 3.49Å; R522-P565 PolarHBondContact NE-O 3.19Å; P523-P565 HydrophobicContact CB-CB 4.09Å; P523-P565 HydrophobicContact CB-CG 3.69Å; P523-P565 HydrophobicContact CG-CG 4.24Å
566	P	66.3	Low	72.3	Confident	41 Å²	41	59.7 Å²	59.7	27%	0.266	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-64.6	154.8	-174.6	26.1	-34.5	0	0	0	112.7	R452	R452-P566 HydrophobicContact CB-CG 4.46Å
567	L	77.7	Confident	72	Confident	21 Å²	21	63.2 Å²	63.2	11%	0.11	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-81	117.6	169.5	172.6	63.4	0	0	0	108.5	S464 F515 A518 R519 A524 L526 V569	S464-L567 PolarHBondContact OG-O 3Å; S464-L567 VanDerWaalsContact OG-O 3.12Å; F515-L567 HydrophobicContact CD1-CD2 4.29Å; A518-L567 HydrophobicContact CB-CD1 3.77Å; A518-L567 HydrophobicContact CB-CD2 3.89Å; R519-L567 HydrophobicContact CG-CD2 4.07Å; A524-L567 HydrophobicContact CB-CD1 4.5Å; L526-L567 HydrophobicContact CB-CD1 4.27Å; L567-V569 HydrophobicContact CG-CG2 4.44Å
568	M	85	Confident	71.9	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.015	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	135.9	176.7	-63	170.6	180	0	0	109.6	L449 R452 L453 L489 A524 V525 L526	L449-M568 HydrophobicContact CB-SD 4.25Å; L449-M568 HydrophobicContact CD2-CB 4.44Å; L449-M568 HydrophobicContact CD2-CG 4.35Å; L449-M568 HydrophobicContact CD2-SD 3.76Å; L449-M568 HydrophobicContact CG-SD 4.45Å; R452-M568 HydrophobicContact CB-CE 3.59Å; L453-M568 HydrophobicContact CD2-CE 3.58Å; L453-M568 HydrophobicContact CG-CE 4.06Å; L489-M568 HydrophobicContact CD1-SD 4.02Å; A524-M568 PolarHBondContact O-N 3.1Å; V525-M568 WeakPolarHBondContact CA-O 3.22Å; V525-M568 HydrophobicContact CG2-CB 4.15Å; V525-M568 HydrophobicContact CG2-SD 4.39Å; L526-M568 PolarHBondContact N-O 3.1Å
569	V	88.3	Confident	72.8	Confident	10 Å²	10	57.8 Å²	57.8	6%	0.061	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	124.2	178.7	-172.8	0	0	0	0	109.5	S464 S465 V466 F515 L526 L528 L555 L567	S464-V569 PolarHBondContact O-N 2.94Å; S465-V569 CarbonylContact C-O 3.47Å; S465-V569 VanDerWaalsContact CA-O 3.3Å; S465-V569 WeakPolarHBondContact CA-O 3.3Å; V466-V569 PolarHBondContact N-O 3.34Å; F515-V569 HydrophobicContact CE1-CG2 4.21Å; L526-V569 HydrophobicContact CB-CG2 4.45Å; L526-V569 HydrophobicContact CD2-CG1 4.48Å; L526-V569 HydrophobicContact CD2-CG2 4.44Å; L528-V569 HydrophobicContact CD1-CG1 4.19Å; L528-V569 HydrophobicContact CG-CG1 4.47Å; L555-V569 HydrophobicContact CD2-CB 4.05Å; L555-V569 HydrophobicContact CD2-CG1 3.71Å; L555-V569 HydrophobicContact CD2-CG2 4.19Å; L567-V569 HydrophobicContact CG-CG2 4.44Å
570	V	91.1	Very high	73.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.6	174.5	-176.7	0	0	0	0	108.8	V466 L468 V480 V525 L526 L527 L528	V466-V570 HydrophobicContact CB-CG2 4.34Å; V466-V570 CarbonylContact O-C 3.56Å; V466-V570 WeakPolarHBondContact O-CA 3.13Å; L468-V570 HydrophobicContact CD1-CG1 3.65Å; L468-V570 HydrophobicContact CG-CG1 4.26Å; V480-V570 HydrophobicContact CG2-CB 4.5Å; V480-V570 HydrophobicContact CG2-CG1 3.7Å; V525-V570 HydrophobicContact CG1-CB 4.19Å; V525-V570 HydrophobicContact CG1-CG2 3.61Å; L526-V570 PolarHBondContact O-N 3.1Å; L527-V570 CarbonylContact C-O 3.53Å; L527-V570 WeakPolarHBondContact CA-O 3.28Å; L527-V570 HydrophobicContact CD1-CB 4.26Å; L527-V570 HydrophobicContact CD1-CG1 4.16Å; L527-V570 WeakPolarHBondContact CD1-O 3.12Å; L528-V570 PolarHBondContact N-O 3.42Å
571	A	90.7	Very high	75	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	148.2	174.2	0	0	0	0	0	110.5	V466 L467 L468 L528 V531 F587	V466-A571 PolarHBondContact O-N 3.42Å; L467-A571 HydrophobicContact CD1-CB 3.72Å; L468-A571 PolarHBondContact N-O 3.15Å; L528-A571 CarbonylContact O-C 3.56Å; L528-A571 WeakPolarHBondContact O-CA 3.28Å; V531-A571 HydrophobicContact CG2-CB 3.68Å; A571-F587 HydrophobicContact CB-CD1 4.41Å; A571-F587 HydrophobicContact CB-CE1 3.56Å; A571-F587 HydrophobicContact CB-CE2 4.07Å; A571-F587 HydrophobicContact CB-CZ 3.38Å
572	T	91.1	Very high	76.3	Confident	9 Å²	9	50.3 Å²	50.3	6%	0.055	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132.2	167.1	77.5	0	0	0	0	110.7	L468 K476 L527 L528 T529 A530 V531	L468-T572 HydrophobicContact CB-CG2 4.31Å; L468-T572 WeakPolarHBondContact O-CA 3.48Å; K476-T572 HydrophobicContact CB-CG2 3.88Å; K476-T572 HydrophobicContact CD-CG2 4.35Å; L527-T572 HydrophobicContact CD1-CG2 3.79Å; L528-T572 PolarHBondContact O-N 2.99Å; T529-T572 WeakPolarHBondContact CA-OG1 3.15Å; A530-T572 WeakPolarHBondContact CA-O 3.28Å; A530-T572 PolarHBondContact N-O 2.89Å; A530-T572 VanDerWaalsContact N-O 3.09Å; A530-T572 PolarHBondContact N-OG1 3.25Å; V531-T572 PolarHBondContact N-O 3.23Å; V531-T572 VanDerWaalsContact N-O 3.13Å
573	T	88.7	Confident	77.9	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.012	25%	0.254	C	S	.	.			trans	-121.6	160.5	171.2	-171.7	0	0	0	0	111.4	L467 L468 R469 K476 R575	L467-T573 HydrophobicContact CD1-CG2 4Å; L467-T573 HydrophobicContact CG-CG2 4.37Å; L468-T573 PolarHBondContact O-N 3.05Å; R469-T573 HydrophobicContact CB-CG2 4.43Å; R469-T573 HydrophobicContact CG-CG2 3.73Å; K476-T573 WeakPolarHBondContact CE-O 3.44Å; K476-T573 PolarHBondContact NZ-O 2.84Å; T573-R575 WeakPolarHBondContact CG2-O 3.49Å; T573-R575 PolarHBondContact OG1-O 3.42Å
574	S	83.6	Confident	79.4	Confident	37 Å²	37	40.2 Å²	40.2	26%	0.259	23%	0.225	S	C	.	.	S	Bend	trans	-84.4	-49.3	171.9	63.4	0	0	0	0	112	G470 D532	G470-S574 CarbonylContact C-O 3.34Å; G470-S574 WeakPolarHBondContact O-CA 3.37Å; D532-S574 VanDerWaalsContact OD2-CB 3.32Å; D532-S574 WeakPolarHBondContact OD2-CB 3.5Å; D532-S574 PolarHBondContact OD2-N 3.49Å; D532-S574 PolarHBondContact OD2-OG 3.3Å
575	R	78.6	Confident	80.6	Confident	137 Å²	137	41.2 Å²	41.2	52%	0.517	23%	0.229	S	C	.	.			trans	-124.9	150.3	175.2	-58.8	178.4	170.5	-175.1	-5.3	110.1	T573 D578	T573-R575 WeakPolarHBondContact CG2-O 3.49Å; T573-R575 PolarHBondContact OG1-O 3.42Å; R575-D578 HydrophobicContact CB-CB 4.17Å; R575-D578 WeakPolarHBondContact CB-OD2 3.26Å; R575-D578 VanDerWaalsContact CD-OD2 3.27Å; R575-D578 WeakPolarHBondContact CD-OD2 3.45Å
576	A	71.3	Confident	81.6	Confident	31 Å²	31	39.2 Å²	39.2	26%	0.256	22%	0.216	S	C	.	.	S	Bend	trans	-70.6	-41.1	175.1	0	0	0	0	0	112	R469 D578 L579 Q584	R469-A576 VanDerWaalsContact CZ-CB 3.42Å; A576-D578 PolarHBondContact O-N 3.3Å; A576-L579 PolarHBondContact O-N 3.33Å; A576-Q584 PolarHBondContact O-NE2 2.96Å
577	Q	72.7	Confident	82.5	Confident	157 Å²	157	37.6 Å²	37.6	73%	0.734	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-24.1	-177.2	-62.1	168.8	-10.5	0	0	113.6	L579	Q577-L579 VanDerWaalsContact C-N 3.27Å; Q577-L579 PolarHBondContact O-N 2.94Å
578	D	74	Confident	82.7	Confident	53 Å²	53	40.3 Å²	40.3	28%	0.283	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-2.8	-177.2	-87.7	-40.6	0	0	0	114.3	D532 R536 R575 A576	D532-D578 HydrophobicContact CB-CB 4.22Å; R536-D578 IonicContact CZ-OD1 3.2Å; R536-D578 VanDerWaalsContact NH2-CB 3.27Å; R536-D578 PolarHBondContact NH2-O 2.9Å; R536-D578 IonicContact NH2-OD1 3.29Å; R536-D578 PolarHBondContact NH2-OD1 3.42Å; R575-D578 HydrophobicContact CB-CB 4.17Å; R575-D578 WeakPolarHBondContact CB-OD2 3.26Å; R575-D578 VanDerWaalsContact CD-OD2 3.27Å; R575-D578 WeakPolarHBondContact CD-OD2 3.45Å; A576-D578 PolarHBondContact O-N 3.3Å
579	L	80.8	Confident	82.7	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.021	24%	0.243	C	C	.	.	S	Bend	trans	-107	131.9	-175.1	-168.3	69.3	0	0	0	110.6	L467 V531 A576 Q577 V583 Q584	L467-L579 HydrophobicContact CD1-CD2 4.2Å; L467-L579 HydrophobicContact CD2-CD2 3.84Å; V531-L579 HydrophobicContact CB-CD1 4.21Å; V531-L579 HydrophobicContact CG1-CD1 3.84Å; A576-L579 PolarHBondContact O-N 3.33Å; Q577-L579 VanDerWaalsContact C-N 3.27Å; Q577-L579 PolarHBondContact O-N 2.94Å; L579-V583 HydrophobicContact CD1-CB 4.34Å; L579-V583 HydrophobicContact CD1-CG1 3.98Å; L579-V583 HydrophobicContact CD2-CB 4.43Å; L579-V583 HydrophobicContact CD2-CG1 4.06Å; L579-V583 HydrophobicContact CG-CB 4.14Å; L579-V583 HydrophobicContact CG-CG1 4.1Å; L579-Q584 HydrophobicContact CB-CG 4.14Å; L579-Q584 HydrophobicContact CD2-CG 3.87Å; L579-Q584 HydrophobicContact CG-CG 4.16Å; L579-Q584 PolarHBondContact O-NE2 3.28Å
580	P	82.2	Confident	82.6	Confident	8 Å²	8	48 Å²	48	5%	0.052	26%	0.259	C	S	.	.			trans	-55.9	140.6	178.7	-27.1	35.3	0	0	0	112.7	E543 V548 D582 V583 Q584	E543-P580 HydrophobicContact CG-CG 4.42Å; E543-P580 WeakPolarHBondContact OE1-CA 3.43Å; E543-P580 WeakPolarHBondContact OE1-CB 3.37Å; V548-P580 HydrophobicContact CG1-CB 4.4Å; V548-P580 HydrophobicContact CG2-CB 4.11Å; V548-P580 HydrophobicContact CG2-CG 3.9Å; P580-D582 VanDerWaalsContact C-N 3.27Å; P580-D582 PolarHBondContact O-N 3.07Å; P580-V583 HydrophobicContact CB-CG2 4.18Å; P580-V583 HydrophobicContact CG-CG2 4.48Å; P580-V583 WeakPolarHBondContact O-CB 3.16Å; P580-V583 PolarHBondContact O-N 2.83Å; P580-Q584 PolarHBondContact O-N 2.94Å
581	A	80.6	Confident	82.5	Confident	70 Å²	70	48.8 Å²	48.8	58%	0.579	26%	0.263	S	S	*	.	H	α-helix	trans	-58	-38.5	-174.3	0	0	0	0	0	112.7	V583 Q584 T585	A581-V583 VanDerWaalsContact C-N 3.28Å; A581-V583 PolarHBondContact O-N 3.49Å; A581-Q584 PolarHBondContact O-N 2.75Å; A581-T585 WeakPolarHBondContact O-CG2 3.44Å; A581-T585 PolarHBondContact O-N 2.83Å
582	D	80.7	Confident	82.2	Confident	82 Å²	82	55.4 Å²	55.4	44%	0.439	29%	0.294	S	S	.	.	H	α-helix	trans	-56.8	-40.7	174.5	-85.2	-41.1	0	0	0	112.8	V548 R552 P580 T585	V548-D582 HydrophobicContact CG1-CB 3.67Å; R552-D582 IonicContact CZ-OD1 3.8Å; R552-D582 IonicContact NH1-OD1 3.92Å; R552-D582 PolarHBondContact NH1-OD1 3.39Å; P580-D582 VanDerWaalsContact C-N 3.27Å; P580-D582 PolarHBondContact O-N 3.07Å; D582-T585 PolarHBondContact O-OG1 3.17Å
583	V	81.9	Confident	81.9	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-73.2	-40.9	179.1	-175.8	0	0	0	0	110.3	V531 V548 L551 L579 P580 A581 T585 A586 F587	V531-V583 HydrophobicContact CG1-CG1 4.41Å; V548-V583 HydrophobicContact CG1-CG2 3.89Å; V548-V583 HydrophobicContact CG2-CG2 4.39Å; L551-V583 HydrophobicContact CD2-CG1 3.85Å; L551-V583 HydrophobicContact CD2-CG2 4.04Å; L579-V583 HydrophobicContact CD1-CB 4.34Å; L579-V583 HydrophobicContact CD1-CG1 3.98Å; L579-V583 HydrophobicContact CD2-CB 4.43Å; L579-V583 HydrophobicContact CD2-CG1 4.06Å; L579-V583 HydrophobicContact CG-CB 4.14Å; L579-V583 HydrophobicContact CG-CG1 4.1Å; P580-V583 HydrophobicContact CB-CG2 4.18Å; P580-V583 HydrophobicContact CG-CG2 4.48Å; P580-V583 WeakPolarHBondContact O-CB 3.16Å; P580-V583 PolarHBondContact O-N 2.83Å; A581-V583 VanDerWaalsContact C-N 3.28Å; A581-V583 PolarHBondContact O-N 3.49Å; V583-T585 VanDerWaalsContact C-N 3.31Å; V583-T585 PolarHBondContact O-N 3.1Å; V583-A586 WeakPolarHBondContact O-CB 3.33Å; V583-A586 PolarHBondContact O-N 2.8Å; V583-F587 HydrophobicContact CG1-CD2 4.29Å; V583-F587 HydrophobicContact CG1-CE2 3.75Å; V583-F587 VanDerWaalsContact O-CD2 3.22Å; V583-F587 WeakPolarHBondContact O-CD2 3.49Å
584	Q	83.7	Confident	81.4	Confident	59 Å²	59	58.7 Å²	58.7	28%	0.276	32%	0.316	S	S	.	.	H	α-helix	trans	-55	-46	173.7	-67.5	-176.3	46.9	0	0	111.3	A576 L579 P580 A581 A586 F587	A576-Q584 PolarHBondContact O-NE2 2.96Å; L579-Q584 HydrophobicContact CB-CG 4.14Å; L579-Q584 HydrophobicContact CD2-CG 3.87Å; L579-Q584 HydrophobicContact CG-CG 4.16Å; L579-Q584 PolarHBondContact O-NE2 3.28Å; P580-Q584 PolarHBondContact O-N 2.94Å; A581-Q584 PolarHBondContact O-N 2.75Å; Q584-A586 PolarHBondContact O-N 3.42Å; Q584-A586 VanDerWaalsContact O-N 3.09Å; Q584-F587 PolarHBondContact O-N 2.84Å
585	T	82	Confident	81.2	Confident	95 Å²	95	61.4 Å²	61.4	58%	0.583	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.9	178.4	65.2	0	0	0	0	114.8	R552 A581 D582 V583	R552-T585 PolarHBondContact NH1-OG1 2.93Å; R552-T585 VanDerWaalsContact NH1-OG1 3.14Å; R552-T585 PolarHBondContact NH2-OG1 3.35Å; A581-T585 WeakPolarHBondContact O-CG2 3.44Å; A581-T585 PolarHBondContact O-N 2.83Å; D582-T585 PolarHBondContact O-OG1 3.17Å; V583-T585 VanDerWaalsContact C-N 3.31Å; V583-T585 PolarHBondContact O-N 3.1Å
586	A	81.9	Confident	81.4	Confident	2 Å²	2	55.9 Å²	55.9	2%	0.017	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-2.2	176.1	0	0	0	0	0	113.8	S465 L555 V583 Q584	S465-A586 WeakPolarHBondContact CB-O 3.43Å; S465-A586 PolarHBondContact OG-O 2.85Å; L555-A586 HydrophobicContact CB-CB 4.34Å; L555-A586 HydrophobicContact CD1-CB 3.81Å; V583-A586 WeakPolarHBondContact O-CB 3.33Å; V583-A586 PolarHBondContact O-N 2.8Å; Q584-A586 PolarHBondContact O-N 3.42Å; Q584-A586 VanDerWaalsContact O-N 3.09Å
587	F	85.2	Confident	81.9	Confident	7 Å²	7	57.1 Å²	57.1	3%	0.031	33%	0.328	C	S	.	.			trans	-115.2	96.3	176.6	-70.4	-78.9	0	0	0	110.9	L467 L555 A571 V583 Q584 H589	L467-F587 HydrophobicContact CB-CB 3.77Å; L467-F587 HydrophobicContact CB-CD1 4Å; L467-F587 HydrophobicContact CB-CD2 4.36Å; L467-F587 HydrophobicContact CB-CG 3.78Å; L555-F587 HydrophobicContact CD1-CE2 3.9Å; L555-F587 HydrophobicContact CD1-CZ 3.84Å; L555-F587 HydrophobicContact CD2-CZ 4.24Å; A571-F587 HydrophobicContact CB-CD1 4.41Å; A571-F587 HydrophobicContact CB-CE1 3.56Å; A571-F587 HydrophobicContact CB-CE2 4.07Å; A571-F587 HydrophobicContact CB-CZ 3.38Å; V583-F587 HydrophobicContact CG1-CD2 4.29Å; V583-F587 HydrophobicContact CG1-CE2 3.75Å; V583-F587 VanDerWaalsContact O-CD2 3.22Å; V583-F587 WeakPolarHBondContact O-CD2 3.49Å; Q584-F587 PolarHBondContact O-N 2.84Å; F587-H589 VanDerWaalsContact C-N 3.27Å; F587-H589 PolarHBondContact O-N 2.83Å
588	P	82.4	Confident	82.4	Confident	78 Å²	78	53.7 Å²	53.7	51%	0.506	31%	0.312	S	S	.	.	S	Bend	trans	-70.9	-18.6	-179.5	29.1	-36.1	0	0	0	114.1	S465	S465-P588 WeakPolarHBondContact O-CD 3.29Å; S465-P588 WeakPolarHBondContact OG-CD 3.4Å
589	H	84.9	Confident	82.8	Confident	89 Å²	89	53.3 Å²	53.3	41%	0.412	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	117.6	178.4	-64.6	-55.3	0	0	0	110.7	V466 L467 F587	V466-H589 WeakPolarHBondContact CA-O 3.41Å; V466-H589 HydrophobicContact CG1-CB 4.34Å; V466-H589 HydrophobicContact CG2-CB 4.26Å; L467-H589 PolarHBondContact N-O 2.95Å; F587-H589 VanDerWaalsContact C-N 3.27Å; F587-H589 PolarHBondContact O-N 2.83Å
590	E	86.9	Confident	83.1	Confident	87 Å²	87	55.9 Å²	55.9	41%	0.407	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.1	177.6	-51.3	-165.9	136	0	0	109.1	L467 R469	L467-E590 WeakPolarHBondContact O-CA 3.47Å; R469-E590 IonicContact CZ-OE1 3.2Å; R469-E590 IonicContact CZ-OE2 3.49Å; R469-E590 IonicContact NE-OE1 2.86Å; R469-E590 IonicContact NE-OE2 3.63Å; R469-E590 IonicContact NH1-OE1 3.21Å; R469-E590 IonicContact NH1-OE2 3.88Å; R469-E590 PolarHBondContact NH1-OE2 2.86Å; R469-E590 IonicContact NH2-OE1 2.72Å; R469-E590 PolarHBondContact NH2-OE1 3.46Å; R469-E590 IonicContact NH2-OE2 2.75Å; R469-E590 PolarHBondContact NH2-OE2 2.65Å
591	L	88.5	Confident	83.4	Confident	15 Å²	15	56.7 Å²	56.7	8%	0.079	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.7	-179.3	-68.1	178.8	0	0	0	109	E444 L445 V466 L467 L468 R469	E444-L591 HydrophobicContact CG-CD2 3.95Å; E444-L591 WeakPolarHBondContact OE1-CD2 3.42Å; L445-L591 HydrophobicContact CB-CD1 4.43Å; L445-L591 HydrophobicContact CD1-CD1 4.15Å; V466-L591 HydrophobicContact CG1-CD1 3.94Å; V466-L591 HydrophobicContact CG1-CG 4.27Å; L467-L591 PolarHBondContact O-N 3.28Å; L468-L591 CarbonylContact C-O 3.57Å; L468-L591 WeakPolarHBondContact CA-O 3.44Å; L468-L591 HydrophobicContact CD2-CB 3.74Å; L468-L591 HydrophobicContact CD2-CD1 4.36Å; R469-L591 PolarHBondContact N-O 2.96Å
592	E	85.2	Confident	83.8	Confident	140 Å²	140	54.6 Å²	54.6	65%	0.654	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	135.4	176.2	-173.8	168.9	-175.2	0	0	110.8	P594	E592-P594 WeakPolarHBondContact O-CD 3.49Å
593	V	84.6	Confident	84.1	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.024	31%	0.307	C	S	.	.			trans	-86.9	105	170.7	-178.6	0	0	0	0	108.7	L441 R469 C474 K476	L441-V593 HydrophobicContact CD1-CB 4.3Å; L441-V593 HydrophobicContact CD1-CG1 3.87Å; L441-V593 HydrophobicContact CD1-CG2 4.21Å; R469-V593 PolarHBondContact O-N 3.32Å; C474-V593 HydrophobicContact CB-CG1 3.93Å; K476-V593 HydrophobicContact CG-CG2 3.81Å
594	P	78.6	Confident	84.4	Confident	76 Å²	76	52.8 Å²	52.8	49%	0.494	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-63.9	162.2	178.7	26.8	-37.4	0	0	0	112.8	E592	E592-P594 WeakPolarHBondContact O-CD 3.49Å
595	A	78	Confident	84.6	Confident	94 Å²	94	50.1 Å²	50.1	78%	0.777	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-62.2	145.4	170.5	0	0	0	0	0	111.5	S597	A595-S597 PolarHBondContact O-N 2.91Å
596	L	83.1	Confident	84.9	Confident	20 Å²	20	52.7 Å²	52.7	11%	0.105	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-75.2	119.1	-177.2	-62.5	174.2	0	0	0	111.6	L438 Q600 R601 I604 V632 L635	L438-L596 HydrophobicContact CD2-CD2 3.92Å; L596-Q600 HydrophobicContact CD2-CB 4.37Å; L596-R601 HydrophobicContact CB-CG 3.57Å; L596-R601 HydrophobicContact CD1-CG 4.19Å; L596-R601 PolarHBondContact O-NH1 3.13Å; L596-I604 HydrophobicContact CD1-CD1 3.67Å; L596-I604 HydrophobicContact CD2-CD1 3.78Å; L596-I604 HydrophobicContact CG-CD1 4.35Å; L596-V632 HydrophobicContact CD1-CG2 3.86Å; L596-V632 HydrophobicContact CD2-CG2 4.49Å; L596-L635 HydrophobicContact CD1-CD1 4.16Å
597	S	82.4	Confident	84.9	Confident	58 Å²	58	54.1 Å²	54.1	41%	0.406	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-62.5	160.2	167.5	65.4	0	0	0	0	112.4	A595 G599 Q600 R601	A595-S597 PolarHBondContact O-N 2.91Å; S597-G599 VanDerWaalsContact C-N 3.33Å; S597-G599 PolarHBondContact O-N 2.9Å; S597-Q600 PolarHBondContact O-N 2.91Å; S597-Q600 VanDerWaalsContact O-N 3.15Å; S597-Q600 VanDerWaalsContact OG-CG 3.25Å; S597-Q600 WeakPolarHBondContact OG-CG 3.16Å; S597-Q600 PolarHBondContact OG-N 2.91Å; S597-Q600 PolarHBondContact OG-OE1 2.96Å; S597-R601 WeakPolarHBondContact O-CG 3.2Å; S597-R601 PolarHBondContact O-N 3.04Å
598	E	82.1	Confident	84.8	Confident	85 Å²	85	54.7 Å²	54.7	40%	0.397	31%	0.308	S	S	.	.	H	α-helix	trans	-55.2	-45.5	179.7	-173	-174.6	148.2	0	0	112.6	Q600 R601 L602 A624 R625	E598-Q600 PolarHBondContact O-N 2.67Å; E598-R601 PolarHBondContact O-N 2.85Å; E598-L602 VanDerWaalsContact O-CB 3.32Å; E598-L602 WeakPolarHBondContact O-CB 3.27Å; E598-L602 PolarHBondContact O-N 3.06Å; E598-A624 HydrophobicContact CG-CB 4.32Å; E598-R625 HydrophobicContact CG-CG 4.1Å; E598-R625 WeakPolarHBondContact OE1-CG 3.34Å; E598-R625 IonicContact OE1-NE 2.89Å; E598-R625 VanDerWaalsContact OE2-CG 3.3Å; E598-R625 WeakPolarHBondContact OE2-CG 3.32Å
599	G	84.1	Confident	84.8	Confident	44 Å²	44	51.4 Å²	51.4	45%	0.454	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-38.3	178.1	0	0	0	0	0	113.4	S597 S603	S597-G599 VanDerWaalsContact C-N 3.33Å; S597-G599 PolarHBondContact O-N 2.9Å; G599-S603 WeakPolarHBondContact O-CB 3.48Å; G599-S603 PolarHBondContact O-N 3.47Å; G599-S603 PolarHBondContact O-OG 3.1Å
600	Q	86.5	Confident	84.4	Confident	58 Å²	58	49.9 Å²	49.9	27%	0.271	29%	0.29	S	S	.	.	H	α-helix	trans	-67.5	-46.7	173.4	-69	164	-39	0	0	111.2	G437 L596 S597 E598 L602 S603 I604	G437-Q600 WeakPolarHBondContact O-CG 3.33Å; G437-Q600 PolarHBondContact O-NE2 3.44Å; L596-Q600 HydrophobicContact CD2-CB 4.37Å; S597-Q600 PolarHBondContact O-N 2.91Å; S597-Q600 VanDerWaalsContact O-N 3.15Å; S597-Q600 VanDerWaalsContact OG-CG 3.25Å; S597-Q600 WeakPolarHBondContact OG-CG 3.16Å; S597-Q600 PolarHBondContact OG-N 2.91Å; S597-Q600 PolarHBondContact OG-OE1 2.96Å; E598-Q600 PolarHBondContact O-N 2.67Å; Q600-L602 VanDerWaalsContact C-N 3.31Å; Q600-L602 PolarHBondContact O-N 2.58Å; Q600-S603 PolarHBondContact O-N 3.17Å; Q600-S603 VanDerWaalsContact O-N 3.1Å; Q600-I604 WeakPolarHBondContact O-CB 3.4Å; Q600-I604 WeakPolarHBondContact O-CD1 3.34Å; Q600-I604 VanDerWaalsContact O-CG1 3.28Å; Q600-I604 WeakPolarHBondContact O-CG1 3.4Å; Q600-I604 PolarHBondContact O-N 3.19Å
601	R	88.1	Confident	83.6	Confident	26 Å²	26	52.3 Å²	52.3	10%	0.098	30%	0.301	C	S	.	.	H	α-helix	trans	-57.5	-43.4	176.1	-66.8	-166	-58.9	-108.4	12.4	111.9	L596 S597 E598 S603 I604 L605 A624 C627 L635	L596-R601 HydrophobicContact CB-CG 3.57Å; L596-R601 HydrophobicContact CD1-CG 4.19Å; L596-R601 PolarHBondContact O-NH1 3.13Å; S597-R601 WeakPolarHBondContact O-CG 3.2Å; S597-R601 PolarHBondContact O-N 3.04Å; E598-R601 PolarHBondContact O-N 2.85Å; R601-S603 VanDerWaalsContact C-N 3.35Å; R601-I604 PolarHBondContact O-N 3.15Å; R601-L605 WeakPolarHBondContact O-CB 3.43Å; R601-L605 WeakPolarHBondContact O-CG 3.41Å; R601-L605 PolarHBondContact O-N 2.92Å; R601-A624 HydrophobicContact CB-CB 4.38Å; R601-A624 PolarHBondContact NE-O 3.48Å; R601-A624 PolarHBondContact NH2-O 3.1Å; R601-C627 WeakPolarHBondContact CD-O 3.43Å; R601-C627 PolarHBondContact NE-O 3.09Å; R601-C627 VanDerWaalsContact NE-O 3.12Å; R601-L635 HydrophobicContact CB-CD1 4.28Å; R601-L635 HydrophobicContact CG-CD1 4.25Å
602	L	88.9	Confident	82.9	Confident	26 Å²	26	54.8 Å²	54.8	14%	0.136	31%	0.314	C	S	.	.	H	α-helix	trans	-62.4	-40.1	175.7	172.4	157.6	0	0	0	112.1	E598 Q600 L605 R606 A621 A624	E598-L602 VanDerWaalsContact O-CB 3.32Å; E598-L602 WeakPolarHBondContact O-CB 3.27Å; E598-L602 PolarHBondContact O-N 3.06Å; Q600-L602 VanDerWaalsContact C-N 3.31Å; Q600-L602 PolarHBondContact O-N 2.58Å; L602-L605 PolarHBondContact O-N 3.26Å; L602-R606 VanDerWaalsContact CD2-CZ 3.44Å; L602-R606 WeakPolarHBondContact O-CG 3.47Å; L602-R606 PolarHBondContact O-N 2.96Å; L602-A621 HydrophobicContact CD1-CB 3.8Å; L602-A624 HydrophobicContact CB-CB 3.82Å
603	S	87.3	Confident	82.4	Confident	44 Å²	44	49.6 Å²	49.6	31%	0.308	29%	0.292	S	S	.	.	H	α-helix	trans	-68.8	-42.2	178.9	-57.4	0	0	0	0	111.9	G599 Q600 R601 R606 A607	G599-S603 WeakPolarHBondContact O-CB 3.48Å; G599-S603 PolarHBondContact O-N 3.47Å; G599-S603 PolarHBondContact O-OG 3.1Å; Q600-S603 PolarHBondContact O-N 3.17Å; Q600-S603 VanDerWaalsContact O-N 3.1Å; R601-S603 VanDerWaalsContact C-N 3.35Å; S603-R606 PolarHBondContact O-N 3.37Å; S603-A607 PolarHBondContact O-N 3.18Å; S603-A607 VanDerWaalsContact O-N 3.11Å
604	I	87.6	Confident	82.3	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-58.6	-50.1	171.8	-70.7	165	0	0	0	110.3	W430 P436 L596 Q600 R601 R606 A607 L608 V632 L635	W430-I604 HydrophobicContact CH2-CB 4.38Å; W430-I604 HydrophobicContact CH2-CG2 3.88Å; P436-I604 WeakPolarHBondContact O-CG1 3.38Å; L596-I604 HydrophobicContact CD1-CD1 3.67Å; L596-I604 HydrophobicContact CD2-CD1 3.78Å; L596-I604 HydrophobicContact CG-CD1 4.35Å; Q600-I604 WeakPolarHBondContact O-CB 3.4Å; Q600-I604 WeakPolarHBondContact O-CD1 3.34Å; Q600-I604 VanDerWaalsContact O-CG1 3.28Å; Q600-I604 WeakPolarHBondContact O-CG1 3.4Å; Q600-I604 PolarHBondContact O-N 3.19Å; R601-I604 PolarHBondContact O-N 3.15Å; I604-R606 PolarHBondContact O-N 2.89Å; I604-A607 PolarHBondContact O-N 3.36Å; I604-L608 HydrophobicContact CG2-CD1 3.95Å; I604-L608 WeakPolarHBondContact O-CG 3.5Å; I604-L608 PolarHBondContact O-N 3.35Å; I604-V632 HydrophobicContact CD1-CG2 4.24Å; I604-V632 HydrophobicContact CG2-CG1 4.45Å; I604-L635 HydrophobicContact CB-CD1 4.38Å; I604-L635 HydrophobicContact CG2-CB 4.42Å; I604-L635 HydrophobicContact CG2-CD1 3.74Å
605	L	88.1	Confident	82.3	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-61.4	-42.9	178.6	-77.8	172.3	0	0	0	112.5	R601 L602 L608 T609 L623 A624 L635	R601-L605 WeakPolarHBondContact O-CB 3.43Å; R601-L605 WeakPolarHBondContact O-CG 3.41Å; R601-L605 PolarHBondContact O-N 2.92Å; L602-L605 PolarHBondContact O-N 3.26Å; L605-L608 PolarHBondContact O-N 2.92Å; L605-T609 WeakPolarHBondContact O-CB 3.4Å; L605-T609 WeakPolarHBondContact O-CG2 3.45Å; L605-T609 PolarHBondContact O-N 2.88Å; L605-T609 PolarHBondContact O-OG1 3.48Å; L605-L623 HydrophobicContact CD1-CB 4.39Å; L605-A624 HydrophobicContact CD1-CB 4.2Å; L605-L635 HydrophobicContact CD1-CD2 4.38Å; L605-L635 HydrophobicContact CD2-CB 4.44Å; L605-L635 HydrophobicContact CD2-CD2 4.15Å; L605-L635 HydrophobicContact CG-CD2 4.28Å
606	R	87.5	Confident	82.2	Confident	150 Å²	150	54.8 Å²	54.8	57%	0.566	30%	0.299	S	S	*	.	H	α-helix	trans	-57.8	-48.6	175.1	-78.8	177.9	178.7	170.7	0.4	111.9	L602 S603 I604 T609 A610 L620	L602-R606 VanDerWaalsContact CD2-CZ 3.44Å; L602-R606 WeakPolarHBondContact O-CG 3.47Å; L602-R606 PolarHBondContact O-N 2.96Å; S603-R606 PolarHBondContact O-N 3.37Å; I604-R606 PolarHBondContact O-N 2.89Å; R606-T609 PolarHBondContact O-N 2.95Å; R606-T609 PolarHBondContact O-OG1 3.39Å; R606-A610 PolarHBondContact O-N 3.47Å; R606-L620 HydrophobicContact CG-CD1 3.79Å
607	A	82.3	Confident	82.2	Confident	32 Å²	32	60.3 Å²	60.3	26%	0.264	32%	0.324	S	S	.	.	H	α-helix	trans	-70.7	-36.4	-178.5	0	0	0	0	0	113.2	W430 P436 S603 I604 T609	W430-A607 HydrophobicContact CE3-CB 3.89Å; W430-A607 HydrophobicContact CZ3-CB 3.57Å; P436-A607 HydrophobicContact CG-CB 3.54Å; S603-A607 PolarHBondContact O-N 3.18Å; S603-A607 VanDerWaalsContact O-N 3.11Å; I604-A607 PolarHBondContact O-N 3.36Å; A607-T609 VanDerWaalsContact C-N 3.33Å; A607-T609 PolarHBondContact O-N 3.5Å
608	L	83.1	Confident	82.3	Confident	19 Å²	19	58.5 Å²	58.5	10%	0.099	31%	0.31	C	S	.	.	H	α-helix	trans	-68.6	-30.2	173.3	-66.9	174.8	0	0	0	113	W430 I604 L605 Y636 L639	W430-L608 HydrophobicContact CE3-CD2 4.27Å; W430-L608 HydrophobicContact CH2-CD1 4.06Å; W430-L608 HydrophobicContact CH2-CD2 3.48Å; W430-L608 VanDerWaalsContact CH2-CD2 3.48Å; W430-L608 HydrophobicContact CH2-CG 3.47Å; W430-L608 VanDerWaalsContact CH2-CG 3.47Å; W430-L608 HydrophobicContact CZ2-CD2 4.05Å; W430-L608 HydrophobicContact CZ2-CG 4.41Å; W430-L608 HydrophobicContact CZ3-CD2 3.58Å; W430-L608 HydrophobicContact CZ3-CG 3.64Å; I604-L608 HydrophobicContact CG2-CD1 3.95Å; I604-L608 WeakPolarHBondContact O-CG 3.5Å; I604-L608 PolarHBondContact O-N 3.35Å; L605-L608 PolarHBondContact O-N 2.92Å; L608-Y636 HydrophobicContact CD2-CD2 4.38Å; L608-L639 HydrophobicContact CB-CD1 3.37Å; L608-L639 HydrophobicContact CD1-CD1 3.83Å; L608-L639 HydrophobicContact CG-CD1 4.2Å
609	T	82.2	Confident	82.5	Confident	9 Å²	9	57.9 Å²	57.9	6%	0.055	31%	0.31	C	S	.	.	H	α-helix	trans	-89.9	-8.3	179.8	54.5	0	0	0	0	114.5	L605 R606 A607 H611 L612 L614 L620 L639	L605-T609 WeakPolarHBondContact O-CB 3.4Å; L605-T609 WeakPolarHBondContact O-CG2 3.45Å; L605-T609 PolarHBondContact O-N 2.88Å; L605-T609 PolarHBondContact O-OG1 3.48Å; R606-T609 PolarHBondContact O-N 2.95Å; R606-T609 PolarHBondContact O-OG1 3.39Å; A607-T609 VanDerWaalsContact C-N 3.33Å; A607-T609 PolarHBondContact O-N 3.5Å; T609-H611 PolarHBondContact O-N 3.43Å; T609-H611 VanDerWaalsContact O-N 3.09Å; T609-L612 PolarHBondContact O-N 2.97Å; T609-L614 HydrophobicContact CG2-CD1 4.38Å; T609-L614 HydrophobicContact CG2-CD2 4.17Å; T609-L620 HydrophobicContact CG2-CD2 4.32Å; T609-L639 HydrophobicContact CG2-CD1 4.34Å; T609-L639 HydrophobicContact CG2-CD2 3.59Å
610	A	77.3	Confident	82.7	Confident	57 Å²	57	57.1 Å²	57.1	47%	0.471	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-34.7	-179.9	0	0	0	0	0	113.6	R606	R606-A610 PolarHBondContact O-N 3.47Å
611	H	69.3	Low	82.8	Confident	137 Å²	137	55.7 Å²	55.7	63%	0.634	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-2.5	179.3	-54.9	-38.3	0	0	0	114.2	T609	T609-H611 PolarHBondContact O-N 3.43Å; T609-H611 VanDerWaalsContact O-N 3.09Å
612	L	74.5	Confident	82.6	Confident	68 Å²	68	59.4 Å²	59.4	36%	0.356	31%	0.312	S	S	.	.	S	Bend	trans	-105.7	135	-175.5	-66.4	172.9	0	0	0	111.2	T609 L614 L639 L674	T609-L612 PolarHBondContact O-N 2.97Å; L612-L614 PolarHBondContact O-N 3.05Å; L612-L639 HydrophobicContact CD1-CD2 4.07Å; L612-L674 HydrophobicContact CD1-CD1 4.25Å
613	P	74.2	Confident	82.4	Confident	30 Å²	30	59 Å²	59	20%	0.195	31%	0.309	C	S	.	.			trans	-69.7	114.6	170	29.4	-33.5	0	0	0	110.2	F672 P673 L674	P613-F672 WeakPolarHBondContact CG-O 3.36Å; P613-P673 VanDerWaalsContact O-CA 3.31Å; P613-P673 WeakPolarHBondContact O-CA 3.36Å; P613-L674 PolarHBondContact O-N 3.32Å
614	L	82.3	Confident	82.4	Confident	59 Å²	59	56.9 Å²	56.9	31%	0.309	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-95.8	145.7	172.6	-60.9	179.4	0	0	0	111.1	T609 L612 V618 L620 L674 F679	T609-L614 HydrophobicContact CG2-CD1 4.38Å; T609-L614 HydrophobicContact CG2-CD2 4.17Å; L612-L614 PolarHBondContact O-N 3.05Å; L614-V618 HydrophobicContact CD2-CG1 4.45Å; L614-L620 HydrophobicContact CD1-CD1 4.33Å; L614-L620 HydrophobicContact CD1-CD2 4.07Å; L614-L620 HydrophobicContact CD1-CG 4.38Å; L614-L674 HydrophobicContact CD2-CB 4.33Å; L614-L674 HydrophobicContact CD2-CD1 4.36Å; L614-F679 HydrophobicContact CD2-CE2 4.14Å; L614-F679 HydrophobicContact CD2-CZ 4.09Å
615	G	78.7	Confident	82.1	Confident	14 Å²	14	63.4 Å²	63.4	14%	0.144	32%	0.319	C	S	.	.			trans	-71.6	153.3	166	0	0	0	0	0	112	E617 V618 L674	G615-E617 PolarHBondContact O-N 3.3Å; G615-E617 VanDerWaalsContact O-N 3.16Å; G615-V618 PolarHBondContact O-N 3.09Å; G615-V618 VanDerWaalsContact O-N 3.11Å; G615-L674 PolarHBondContact N-O 3.15Å
616	Q	77.4	Confident	81.7	Confident	210 Å²	210	69.3 Å²	69.3	98%	0.981	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.2	-178.1	-68.7	179.7	-14.2	0	0	113.7	V618	Q616-V618 VanDerWaalsContact C-N 3.3Å
617	E	81.9	Confident	81.3	Confident	137 Å²	137	62.1 Å²	62.1	64%	0.64	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-14.5	178.5	-62.9	165	-174.2	0	0	113.4	G615 N619 A676	G615-E617 PolarHBondContact O-N 3.3Å; G615-E617 VanDerWaalsContact O-N 3.16Å; E617-N619 PolarHBondContact O-N 3.15Å; E617-A676 HydrophobicContact CB-CB 4.28Å
618	V	84.4	Confident	80.9	Confident	19 Å²	19	62.2 Å²	62.2	12%	0.115	32%	0.315	C	S	.	.			trans	-83	102	-171.1	-177.6	0	0	0	0	111.2	L614 G615 Q616 L620 L623 L674 F679	L614-V618 HydrophobicContact CD2-CG1 4.45Å; G615-V618 PolarHBondContact O-N 3.09Å; G615-V618 VanDerWaalsContact O-N 3.11Å; Q616-V618 VanDerWaalsContact C-N 3.3Å; V618-L620 HydrophobicContact CG1-CD2 4.32Å; V618-L623 HydrophobicContact CG1-CD1 3.84Å; V618-L674 WeakPolarHBondContact CG2-O 3.36Å; V618-F679 HydrophobicContact CG1-CD2 3.93Å; V618-F679 HydrophobicContact CG1-CE2 3.68Å; V618-F679 HydrophobicContact CG1-CZ 4.41Å; V618-F679 HydrophobicContact CG2-CD2 4.1Å; V618-F679 HydrophobicContact CG2-CE2 4.04Å
619	N	87.6	Confident	80.4	Confident	72 Å²	72	62.4 Å²	62.4	39%	0.385	32%	0.322	S	S	.	.			trans	-91.6	102.7	173.8	-172.6	-24.7	0	0	0	111.8	E617 A621 Q622 L623	E617-N619 PolarHBondContact O-N 3.15Å; N619-A621 PolarHBondContact O-N 2.95Å; N619-A621 WeakPolarHBondContact OD1-CB 3.38Å; N619-A621 PolarHBondContact OD1-N 3Å; N619-Q622 HydrophobicContact CB-CB 4.16Å; N619-Q622 HydrophobicContact CB-CG 4.13Å; N619-Q622 PolarHBondContact O-N 3.04Å; N619-Q622 VanDerWaalsContact O-N 3.12Å; N619-Q622 PolarHBondContact OD1-N 3.33Å; N619-L623 PolarHBondContact O-N 3.2Å; N619-L623 VanDerWaalsContact O-N 3.1Å
620	L	88.6	Confident	80.4	Confident	28 Å²	28	62.3 Å²	62.3	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-58.8	-28.8	179.3	-62.8	179.7	0	0	0	114	R606 T609 L614 V618 L623 A624	R606-L620 HydrophobicContact CG-CD1 3.79Å; T609-L620 HydrophobicContact CG2-CD2 4.32Å; L614-L620 HydrophobicContact CD1-CD1 4.33Å; L614-L620 HydrophobicContact CD1-CD2 4.07Å; L614-L620 HydrophobicContact CD1-CG 4.38Å; V618-L620 HydrophobicContact CG1-CD2 4.32Å; L620-L623 HydrophobicContact CD2-CD1 4.36Å; L620-L623 PolarHBondContact O-N 2.99Å; L620-A624 WeakPolarHBondContact O-CB 3.37Å; L620-A624 PolarHBondContact O-N 2.75Å
621	A	86.6	Confident	80.8	Confident	28 Å²	28	60.6 Å²	60.6	23%	0.231	30%	0.304	C	S	.	.	H	α-helix	trans	-75.7	-32.5	177.9	0	0	0	0	0	112.4	L602 N619 R625	L602-A621 HydrophobicContact CD1-CB 3.8Å; N619-A621 PolarHBondContact O-N 2.95Å; N619-A621 WeakPolarHBondContact OD1-CB 3.38Å; N619-A621 PolarHBondContact OD1-N 3Å; A621-R625 PolarHBondContact O-N 3.47Å
622	Q	84.1	Confident	81.7	Confident	104 Å²	104	54.7 Å²	54.7	49%	0.486	28%	0.278	S	S	.	.	H	α-helix	trans	-69.7	-38.8	170.6	-71.3	175.1	-16.8	0	0	111	N619 R625 R626	N619-Q622 HydrophobicContact CB-CB 4.16Å; N619-Q622 HydrophobicContact CB-CG 4.13Å; N619-Q622 PolarHBondContact O-N 3.04Å; N619-Q622 VanDerWaalsContact O-N 3.12Å; N619-Q622 PolarHBondContact OD1-N 3.33Å; Q622-R625 PolarHBondContact O-N 3.12Å; Q622-R626 WeakPolarHBondContact O-CG 3.31Å; Q622-R626 PolarHBondContact O-N 3.15Å; Q622-R626 VanDerWaalsContact O-N 3.1Å
623	L	86.6	Confident	82.2	Confident	17 Å²	17	52.9 Å²	52.9	9%	0.089	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-44	173.3	-66.8	177	0	0	0	111.9	L605 V618 N619 L620 R625 R626 C627 F679	L605-L623 HydrophobicContact CD1-CB 4.39Å; V618-L623 HydrophobicContact CG1-CD1 3.84Å; N619-L623 PolarHBondContact O-N 3.2Å; N619-L623 VanDerWaalsContact O-N 3.1Å; L620-L623 HydrophobicContact CD2-CD1 4.36Å; L620-L623 PolarHBondContact O-N 2.99Å; L623-R625 VanDerWaalsContact C-N 3.28Å; L623-R625 PolarHBondContact O-N 3.32Å; L623-R626 PolarHBondContact O-N 3.38Å; L623-C627 WeakPolarHBondContact O-CB 3.39Å; L623-C627 PolarHBondContact O-N 3.45Å; L623-C627 PolarHBondContact O-SG 2.91Å; L623-F679 HydrophobicContact CD1-CB 4.3Å; L623-F679 HydrophobicContact CD1-CD1 3.83Å; L623-F679 HydrophobicContact CD1-CD2 4.2Å; L623-F679 HydrophobicContact CD1-CE1 4.16Å; L623-F679 HydrophobicContact CD1-CG 3.86Å; L623-F679 HydrophobicContact CD1-CZ 4.49Å; L623-F679 HydrophobicContact CD2-CB 3.94Å; L623-F679 HydrophobicContact CD2-CG 4.38Å
624	A	86	Confident	82.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.5	-33.3	177.8	0	0	0	0	0	113.6	E598 R601 L602 L605 L620	E598-A624 HydrophobicContact CG-CB 4.32Å; R601-A624 HydrophobicContact CB-CB 4.38Å; R601-A624 PolarHBondContact NE-O 3.48Å; R601-A624 PolarHBondContact NH2-O 3.1Å; L602-A624 HydrophobicContact CB-CB 3.82Å; L605-A624 HydrophobicContact CD1-CB 4.2Å; L620-A624 WeakPolarHBondContact O-CB 3.37Å; L620-A624 PolarHBondContact O-N 2.75Å
625	R	81.1	Confident	83.1	Confident	140 Å²	140	50.6 Å²	50.6	53%	0.528	26%	0.262	S	S	.	.	H	α-helix	trans	-69.2	-48.7	171.5	-77.2	-174.7	-77.8	168.8	-7.4	112.6	E598 A621 Q622 L623 C627 A628	E598-R625 HydrophobicContact CG-CG 4.1Å; E598-R625 WeakPolarHBondContact OE1-CG 3.34Å; E598-R625 IonicContact OE1-NE 2.89Å; E598-R625 VanDerWaalsContact OE2-CG 3.3Å; E598-R625 WeakPolarHBondContact OE2-CG 3.32Å; A621-R625 PolarHBondContact O-N 3.47Å; Q622-R625 PolarHBondContact O-N 3.12Å; L623-R625 VanDerWaalsContact C-N 3.28Å; L623-R625 PolarHBondContact O-N 3.32Å; R625-C627 PolarHBondContact O-N 2.9Å; R625-A628 PolarHBondContact O-N 3.31Å
626	R	79.4	Confident	83.5	Confident	125 Å²	125	55.2 Å²	55.2	47%	0.472	28%	0.276	S	S	.	.	H	α-helix	trans	-66.8	-18.6	179.3	-66.8	-177.9	71.9	-165.9	2.5	114.1	Q622 L623 A628 L683 Q687	Q622-R626 WeakPolarHBondContact O-CG 3.31Å; Q622-R626 PolarHBondContact O-N 3.15Å; Q622-R626 VanDerWaalsContact O-N 3.1Å; L623-R626 PolarHBondContact O-N 3.38Å; R626-A628 VanDerWaalsContact C-N 3.3Å; R626-A628 PolarHBondContact O-N 3.46Å; R626-L683 HydrophobicContact CB-CD2 3.74Å; R626-L683 VanDerWaalsContact CZ-CD2 3.46Å; R626-Q687 PolarHBondContact O-NE2 2.91Å
627	C	79.6	Confident	84	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	39.2	174.1	-60.6	0	0	0	0	112.7	R601 L623 R625 F630 L635	R601-C627 WeakPolarHBondContact CD-O 3.43Å; R601-C627 PolarHBondContact NE-O 3.09Å; R601-C627 VanDerWaalsContact NE-O 3.12Å; L623-C627 WeakPolarHBondContact O-CB 3.39Å; L623-C627 PolarHBondContact O-N 3.45Å; L623-C627 PolarHBondContact O-SG 2.91Å; R625-C627 PolarHBondContact O-N 2.9Å; C627-F630 HydrophobicContact CB-CB 4.04Å; C627-F630 HydrophobicContact CB-CD2 3.56Å; C627-F630 HydrophobicContact CB-CE2 4.24Å; C627-F630 HydrophobicContact CB-CG 3.93Å; C627-F630 WeakPolarHBondContact O-CB 3.34Å; C627-F630 PolarHBondContact O-N 3.1Å; C627-L635 HydrophobicContact CB-CD2 3.89Å
628	A	73.9	Confident	84.5	Confident	34 Å²	34	40.1 Å²	40.1	28%	0.281	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	143.7	170.9	0	0	0	0	0	111	R625 R626 F630	R625-A628 PolarHBondContact O-N 3.31Å; R626-A628 VanDerWaalsContact C-N 3.3Å; R626-A628 PolarHBondContact O-N 3.46Å; A628-F630 PolarHBondContact O-N 2.92Å
629	G	72.6	Confident	84.6	Confident	23 Å²	23	39.8 Å²	39.8	24%	0.237	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	-9.9	-174.8	0	0	0	0	0	116.3
630	F	82.5	Confident	84.7	Confident	7 Å²	7	38.9 Å²	38.9	3%	0.031	21%	0.205	C	C	.	.			trans	-73.1	137.2	-175.2	-77.4	13.5	0	0	0	112.8	C627 A628 D634 L635 L683 Q686 Q687 H690	C627-F630 HydrophobicContact CB-CB 4.04Å; C627-F630 HydrophobicContact CB-CD2 3.56Å; C627-F630 HydrophobicContact CB-CE2 4.24Å; C627-F630 HydrophobicContact CB-CG 3.93Å; C627-F630 WeakPolarHBondContact O-CB 3.34Å; C627-F630 PolarHBondContact O-N 3.1Å; A628-F630 PolarHBondContact O-N 2.92Å; F630-D634 HydrophobicContact CB-CB 4.09Å; F630-D634 HydrophobicContact CD2-CB 4.31Å; F630-D634 HydrophobicContact CG-CB 4.18Å; F630-L635 HydrophobicContact CB-CD2 4.17Å; F630-L635 HydrophobicContact CB-CG 4.4Å; F630-L635 HydrophobicContact CD2-CD2 4.3Å; F630-L683 HydrophobicContact CE2-CD1 3.56Å; F630-L683 HydrophobicContact CZ-CD1 3.8Å; F630-Q686 HydrophobicContact CE2-CB 4.31Å; F630-Q686 HydrophobicContact CE2-CG 3.93Å; F630-Q686 HydrophobicContact CZ-CB 4.16Å; F630-Q686 HydrophobicContact CZ-CG 3.87Å; F630-Q687 HydrophobicContact CE1-CG 4.23Å; F630-Q687 HydrophobicContact CZ-CG 3.83Å; F630-H690 HydrophobicContact CE1-CB 4.3Å
631	V	85.6	Confident	84.7	Confident	21 Å²	21	40.8 Å²	40.8	13%	0.127	21%	0.213	C	C	.	.			trans	-91.5	162.6	-178.6	-171	0	0	0	0	110.2	P471 C474 G633 D634 L635	P471-V631 HydrophobicContact CG-CG2 4.46Å; C474-V631 HydrophobicContact CB-CG1 3.55Å; V631-G633 VanDerWaalsContact C-N 3.26Å; V631-G633 PolarHBondContact O-N 2.85Å; V631-D634 WeakPolarHBondContact CB-OD2 3.36Å; V631-D634 WeakPolarHBondContact CG2-OD2 3.48Å; V631-D634 PolarHBondContact N-OD2 3.38Å; V631-D634 WeakPolarHBondContact O-CA 3.2Å; V631-D634 WeakPolarHBondContact O-CB 3.48Å; V631-D634 PolarHBondContact O-N 2.9Å; V631-L635 PolarHBondContact O-N 2.84Å
632	V	87.3	Confident	84.9	Confident	13 Å²	13	39.5 Å²	39.5	8%	0.079	20%	0.202	C	C	.	.	H	α-helix	trans	-52.3	-43.8	179	-171	0	0	0	0	112.3	W430 L438 L596 I604 D634 L635 Y636	W430-V632 HydrophobicContact CZ2-CG1 4.29Å; L438-V632 HydrophobicContact CD1-CG2 4.15Å; L596-V632 HydrophobicContact CD1-CG2 3.86Å; L596-V632 HydrophobicContact CD2-CG2 4.49Å; I604-V632 HydrophobicContact CD1-CG2 4.24Å; I604-V632 HydrophobicContact CG2-CG1 4.45Å; V632-D634 VanDerWaalsContact C-N 3.31Å; V632-D634 PolarHBondContact O-N 3.35Å; V632-L635 PolarHBondContact O-N 2.82Å; V632-Y636 PolarHBondContact O-N 3.49Å; V632-Y636 VanDerWaalsContact O-N 3.07Å
633	G	85.9	Confident	85	Confident	29 Å²	29	36.3 Å²	36.3	30%	0.299	19%	0.191	S	C	.	.	H	α-helix	trans	-60.7	-38.1	175.1	0	0	0	0	0	113.2	G473 V631 Y636 A637	G473-G633 PolarHBondContact O-N 3.32Å; V631-G633 VanDerWaalsContact C-N 3.26Å; V631-G633 PolarHBondContact O-N 2.85Å; G633-Y636 PolarHBondContact O-N 2.9Å; G633-A637 WeakPolarHBondContact O-CB 3.37Å; G633-A637 PolarHBondContact O-N 3.46Å
634	D	87.4	Confident	84.9	Confident	42 Å²	42	43.4 Å²	43.4	23%	0.225	22%	0.217	C	C	.	.	H	α-helix	trans	-67.7	-43.6	175.8	-53.9	-28.3	0	0	0	110.3	F630 V631 V632 Y636 A637 L638 Q686 H690	F630-D634 HydrophobicContact CB-CB 4.09Å; F630-D634 HydrophobicContact CD2-CB 4.31Å; F630-D634 HydrophobicContact CG-CB 4.18Å; V631-D634 WeakPolarHBondContact CB-OD2 3.36Å; V631-D634 WeakPolarHBondContact CG2-OD2 3.48Å; V631-D634 PolarHBondContact N-OD2 3.38Å; V631-D634 WeakPolarHBondContact O-CA 3.2Å; V631-D634 WeakPolarHBondContact O-CB 3.48Å; V631-D634 PolarHBondContact O-N 2.9Å; V632-D634 VanDerWaalsContact C-N 3.31Å; V632-D634 PolarHBondContact O-N 3.35Å; D634-Y636 PolarHBondContact O-N 3.47Å; D634-A637 CarbonylContact O-C 3.59Å; D634-A637 WeakPolarHBondContact O-CA 3.48Å; D634-A637 WeakPolarHBondContact O-CB 3.5Å; D634-A637 PolarHBondContact O-N 2.93Å; D634-A637 VanDerWaalsContact O-N 3.09Å; D634-L638 PolarHBondContact O-N 3.28Å; D634-Q686 VanDerWaalsContact O-CD 3.32Å; D634-Q686 PolarHBondContact O-NE2 2.89Å; D634-Q686 PolarHBondContact O-OE1 3.2Å; D634-H690 IonicContact OD2-ND1 3.3Å
635	L	88.3	Confident	85	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-33.2	177	-63.9	172	0	0	0	112.1	L596 R601 I604 L605 C627 F630 V631 V632 L639	L596-L635 HydrophobicContact CD1-CD1 4.16Å; R601-L635 HydrophobicContact CB-CD1 4.28Å; R601-L635 HydrophobicContact CG-CD1 4.25Å; I604-L635 HydrophobicContact CB-CD1 4.38Å; I604-L635 HydrophobicContact CG2-CB 4.42Å; I604-L635 HydrophobicContact CG2-CD1 3.74Å; L605-L635 HydrophobicContact CD1-CD2 4.38Å; L605-L635 HydrophobicContact CD2-CB 4.44Å; L605-L635 HydrophobicContact CD2-CD2 4.15Å; L605-L635 HydrophobicContact CG-CD2 4.28Å; C627-L635 HydrophobicContact CB-CD2 3.89Å; F630-L635 HydrophobicContact CB-CD2 4.17Å; F630-L635 HydrophobicContact CB-CG 4.4Å; F630-L635 HydrophobicContact CD2-CD2 4.3Å; V631-L635 PolarHBondContact O-N 2.84Å; V632-L635 PolarHBondContact O-N 2.82Å; L635-L639 PolarHBondContact O-N 3.26Å
636	Y	87.1	Confident	85.2	Confident	111 Å²	111	37.1 Å²	37.1	44%	0.435	20%	0.195	S	C	.	.	H	α-helix	trans	-72.7	-39.2	171.5	-176	-94.4	0	0	0	112.7	L429 L608 V632 G633 D634 L638 L639 T640	L429-Y636 HydrophobicContact CD1-CD2 4.28Å; L429-Y636 HydrophobicContact CD1-CE2 4.47Å; L429-Y636 HydrophobicContact CD2-CD2 4.03Å; L429-Y636 HydrophobicContact CD2-CE2 3.47Å; L429-Y636 VanDerWaalsContact CD2-CE2 3.47Å; L608-Y636 HydrophobicContact CD2-CD2 4.38Å; V632-Y636 PolarHBondContact O-N 3.49Å; V632-Y636 VanDerWaalsContact O-N 3.07Å; G633-Y636 PolarHBondContact O-N 2.9Å; D634-Y636 PolarHBondContact O-N 3.47Å; Y636-L638 VanDerWaalsContact C-N 3.28Å; Y636-L638 PolarHBondContact O-N 3.12Å; Y636-L639 PolarHBondContact O-N 3.03Å; Y636-T640 PolarHBondContact O-N 3.46Å; Y636-T640 PolarHBondContact O-OG1 3.01Å
637	A	88.3	Confident	85.3	Confident	29 Å²	29	33.5 Å²	33.5	24%	0.24	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-39.8	172.1	0	0	0	0	0	111.1	G633 D634 L639 T640 H641	G633-A637 WeakPolarHBondContact O-CB 3.37Å; G633-A637 PolarHBondContact O-N 3.46Å; D634-A637 CarbonylContact O-C 3.59Å; D634-A637 WeakPolarHBondContact O-CA 3.48Å; D634-A637 WeakPolarHBondContact O-CB 3.5Å; D634-A637 PolarHBondContact O-N 2.93Å; D634-A637 VanDerWaalsContact O-N 3.09Å; A637-L639 VanDerWaalsContact C-N 3.33Å; A637-L639 PolarHBondContact O-N 3.2Å; A637-T640 CarbonylContact O-C 3.53Å; A637-T640 WeakPolarHBondContact O-CA 3.41Å; A637-T640 WeakPolarHBondContact O-CB 3.5Å; A637-T640 PolarHBondContact O-N 3.06Å; A637-H641 WeakPolarHBondContact O-CB 3.37Å; A637-H641 PolarHBondContact O-CD2 2.89Å; A637-H641 PolarHBondContact O-N 3.12Å
638	L	90.8	Very high	85.5	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-60.7	-41.9	179.3	-174.8	69.5	0	0	0	111.6	D634 Y636 T640 H641 S642 A682 L683	D634-L638 PolarHBondContact O-N 3.28Å; Y636-L638 VanDerWaalsContact C-N 3.28Å; Y636-L638 PolarHBondContact O-N 3.12Å; L638-T640 VanDerWaalsContact C-N 3.35Å; L638-H641 PolarHBondContact O-N 2.94Å; L638-S642 WeakPolarHBondContact O-CB 3.34Å; L638-S642 PolarHBondContact O-N 3.17Å; L638-S642 PolarHBondContact O-OG 2.92Å; L638-A682 HydrophobicContact CD1-CB 3.85Å; L638-L683 HydrophobicContact CD1-CB 4.12Å; L638-L683 HydrophobicContact CD1-CD1 4.29Å
639	L	88.5	Confident	85.9	Confident	11 Å²	11	37.8 Å²	37.8	6%	0.058	21%	0.205	C	C	.	.	H	α-helix	trans	-68.2	-35.3	174.8	-69	167.6	0	0	0	112.1	L608 T609 L612 L635 Y636 A637 S642 S643 F679	L608-L639 HydrophobicContact CB-CD1 3.37Å; L608-L639 HydrophobicContact CD1-CD1 3.83Å; L608-L639 HydrophobicContact CG-CD1 4.2Å; T609-L639 HydrophobicContact CG2-CD1 4.34Å; T609-L639 HydrophobicContact CG2-CD2 3.59Å; L612-L639 HydrophobicContact CD1-CD2 4.07Å; L635-L639 PolarHBondContact O-N 3.26Å; Y636-L639 PolarHBondContact O-N 3.03Å; A637-L639 VanDerWaalsContact C-N 3.33Å; A637-L639 PolarHBondContact O-N 3.2Å; L639-S642 WeakPolarHBondContact CA-OG 3.37Å; L639-S642 PolarHBondContact O-OG 3.23Å; L639-S642 VanDerWaalsContact O-OG 3.12Å; L639-S643 WeakPolarHBondContact O-CB 3.41Å; L639-S643 PolarHBondContact O-N 3Å; L639-S643 PolarHBondContact O-OG 3.19Å; L639-F679 HydrophobicContact CD2-CE1 3.83Å; L639-F679 HydrophobicContact CD2-CZ 4.08Å
640	T	87.9	Confident	86.2	Confident	54 Å²	54	38.3 Å²	38.3	33%	0.331	20%	0.202	S	C	.	.	H	α-helix	trans	-69.4	-36.7	173.6	-51.1	0	0	0	0	112	Y636 A637 L638 S643 R644	Y636-T640 PolarHBondContact O-N 3.46Å; Y636-T640 PolarHBondContact O-OG1 3.01Å; A637-T640 CarbonylContact O-C 3.53Å; A637-T640 WeakPolarHBondContact O-CA 3.41Å; A637-T640 WeakPolarHBondContact O-CB 3.5Å; A637-T640 PolarHBondContact O-N 3.06Å; L638-T640 VanDerWaalsContact C-N 3.35Å; T640-S643 WeakPolarHBondContact CA-OG 3.35Å; T640-S643 PolarHBondContact O-OG 3.29Å; T640-S643 VanDerWaalsContact O-OG 3.06Å; T640-R644 WeakPolarHBondContact O-CB 3.41Å; T640-R644 WeakPolarHBondContact O-CG 3.36Å; T640-R644 PolarHBondContact O-N 3.26Å; T640-R644 VanDerWaalsContact O-N 3.15Å
641	H	89.8	Confident	85.9	Confident	68 Å²	68	43.3 Å²	43.3	32%	0.315	22%	0.224	S	C	.	.	H	α-helix	trans	-74.9	-41	176.7	-76.4	-68.2	0	0	0	112.1	A637 L638 R644 A645 A682	A637-H641 WeakPolarHBondContact O-CB 3.37Å; A637-H641 PolarHBondContact O-CD2 2.89Å; A637-H641 PolarHBondContact O-N 3.12Å; L638-H641 PolarHBondContact O-N 2.94Å; H641-R644 PolarHBondContact O-N 3.07Å; H641-A645 WeakPolarHBondContact O-CB 3.25Å; H641-A645 PolarHBondContact O-N 2.85Å; H641-A682 HydrophobicContact CB-CB 3.69Å
642	S	89.8	Confident	85.4	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.1	-39	176.2	56.2	0	0	0	0	112.3	L638 L639 A645 A646	L638-S642 WeakPolarHBondContact O-CB 3.34Å; L638-S642 PolarHBondContact O-N 3.17Å; L638-S642 PolarHBondContact O-OG 2.92Å; L639-S642 WeakPolarHBondContact CA-OG 3.37Å; L639-S642 PolarHBondContact O-OG 3.23Å; L639-S642 VanDerWaalsContact O-OG 3.12Å; S642-A645 PolarHBondContact O-N 2.73Å; S642-A646 WeakPolarHBondContact O-CB 3.4Å; S642-A646 PolarHBondContact O-N 3.09Å
643	S	85.8	Confident	84.6	Confident	37 Å²	37	54.3 Å²	54.3	26%	0.259	28%	0.281	S	S	.	.	H	α-helix	trans	-64.4	-37.7	171.3	51.1	0	0	0	0	112.7	L639 T640 C647	L639-S643 WeakPolarHBondContact O-CB 3.41Å; L639-S643 PolarHBondContact O-N 3Å; L639-S643 PolarHBondContact O-OG 3.19Å; T640-S643 WeakPolarHBondContact CA-OG 3.35Å; T640-S643 PolarHBondContact O-OG 3.29Å; T640-S643 VanDerWaalsContact O-OG 3.06Å; S643-C647 WeakPolarHBondContact O-CB 3.35Å; S643-C647 PolarHBondContact O-N 2.96Å; S643-C647 PolarHBondContact O-SG 3.07Å
644	R	86.3	Confident	83.3	Confident	166 Å²	166	54.1 Å²	54.1	63%	0.626	28%	0.279	S	S	*	.	H	α-helix	trans	-65.8	-41.1	171.1	-73	173.7	73.4	167.8	4.5	112.5	T640 H641 C647 T648	T640-R644 WeakPolarHBondContact O-CB 3.41Å; T640-R644 WeakPolarHBondContact O-CG 3.36Å; T640-R644 PolarHBondContact O-N 3.26Å; T640-R644 VanDerWaalsContact O-N 3.15Å; H641-R644 PolarHBondContact O-N 3.07Å; R644-C647 WeakPolarHBondContact O-CB 3.42Å; R644-C647 PolarHBondContact O-N 3.12Å; R644-T648 PolarHBondContact O-N 3.46Å; R644-T648 PolarHBondContact O-OG1 2.94Å
645	A	87.3	Confident	81.6	Confident	9 Å²	9	59.5 Å²	59.5	7%	0.074	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-46.7	176.5	0	0	0	0	0	111.4	H641 S642 C647 T648 R649 D678	H641-A645 WeakPolarHBondContact O-CB 3.25Å; H641-A645 PolarHBondContact O-N 2.85Å; S642-A645 PolarHBondContact O-N 2.73Å; A645-C647 PolarHBondContact O-N 2.94Å; A645-T648 WeakPolarHBondContact CA-OG1 3.5Å; A645-T648 PolarHBondContact O-N 2.75Å; A645-T648 VanDerWaalsContact O-N 3.11Å; A645-T648 PolarHBondContact O-OG1 2.81Å; A645-R649 PolarHBondContact O-N 2.89Å; A645-D678 HydrophobicContact CB-CB 4.19Å
646	A	85.1	Confident	79.8	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-60.2	-44.4	174.2	0	0	0	0	0	111.9	S642 T648 R649 I650 F672 L674 D678	S642-A646 WeakPolarHBondContact O-CB 3.4Å; S642-A646 PolarHBondContact O-N 3.09Å; A646-T648 PolarHBondContact O-N 3.17Å; A646-R649 PolarHBondContact O-N 3.12Å; A646-I650 WeakPolarHBondContact O-CD1 3.42Å; A646-I650 VanDerWaalsContact O-CG1 3.24Å; A646-I650 WeakPolarHBondContact O-CG1 3.4Å; A646-I650 PolarHBondContact O-N 2.89Å; A646-F672 HydrophobicContact CB-CD2 3.64Å; A646-F672 HydrophobicContact CB-CE2 3.58Å; A646-L674 HydrophobicContact CB-CD2 3.8Å; A646-D678 WeakPolarHBondContact CA-OD1 3.44Å; A646-D678 HydrophobicContact CB-CB 4.45Å; A646-D678 PolarHBondContact N-OD1 3.29Å
647	C	81.4	Confident	78.2	Confident	49 Å²	49	63 Å²	63	33%	0.331	37%	0.365	S	S	.	.	H	α-helix	trans	-57.5	-44.5	171.7	-76.6	0	0	0	0	112.2	S643 R644 A645 I650 K651 F672	S643-C647 WeakPolarHBondContact O-CB 3.35Å; S643-C647 PolarHBondContact O-N 2.96Å; S643-C647 PolarHBondContact O-SG 3.07Å; R644-C647 WeakPolarHBondContact O-CB 3.42Å; R644-C647 PolarHBondContact O-N 3.12Å; A645-C647 PolarHBondContact O-N 2.94Å; C647-I650 PolarHBondContact O-N 3.26Å; C647-K651 WeakPolarHBondContact O-CG 3.26Å; C647-K651 PolarHBondContact O-N 2.93Å; C647-F672 WeakPolarHBondContact SG-CZ 3.33Å
648	T	83.9	Confident	76.6	Confident	71 Å²	71	65 Å²	65	44%	0.436	39%	0.389	S	S	.	.	H	α-helix	trans	-66.3	-38.9	177.4	47.8	0	0	0	0	112.6	R644 A645 A646 I650 K651 N652	R644-T648 PolarHBondContact O-N 3.46Å; R644-T648 PolarHBondContact O-OG1 2.94Å; A645-T648 WeakPolarHBondContact CA-OG1 3.5Å; A645-T648 PolarHBondContact O-N 2.75Å; A645-T648 VanDerWaalsContact O-N 3.11Å; A645-T648 PolarHBondContact O-OG1 2.81Å; A646-T648 PolarHBondContact O-N 3.17Å; T648-I650 VanDerWaalsContact C-N 3.34Å; T648-I650 PolarHBondContact O-N 2.96Å; T648-K651 PolarHBondContact O-N 3.41Å; T648-N652 WeakPolarHBondContact O-CB 3.35Å; T648-N652 PolarHBondContact O-N 3.41Å; T648-N652 PolarHBondContact O-ND2 2.96Å; T648-N652 PolarHBondContact O-OD1 3.27Å
649	R	83.5	Confident	75.1	Confident	52 Å²	52	67.6 Å²	67.6	20%	0.196	40%	0.402	C	S	.	.	H	α-helix	trans	-60.6	-43.8	173.5	-176.4	-177.1	61	-135.2	-18.2	111.2	A645 A646 N652 L653 E677 D678	A645-R649 PolarHBondContact O-N 2.89Å; A646-R649 PolarHBondContact O-N 3.12Å; R649-N652 PolarHBondContact O-N 2.98Å; R649-L653 HydrophobicContact CG-CD1 3.92Å; R649-L653 WeakPolarHBondContact O-CB 3.43Å; R649-L653 VanDerWaalsContact O-CG 3.31Å; R649-L653 WeakPolarHBondContact O-CG 3.47Å; R649-L653 PolarHBondContact O-N 2.68Å; R649-E677 IonicContact NH1-OE2 2.73Å; R649-D678 IonicContact CZ-OD1 3.97Å; R649-D678 IonicContact CZ-OD2 3.5Å; R649-D678 IonicContact NH1-OD1 3.27Å; R649-D678 PolarHBondContact NH1-OD1 2.86Å; R649-D678 IonicContact NH1-OD2 2.7Å; R649-D678 PolarHBondContact NH1-OD2 2.94Å; R649-D678 IonicContact NH2-OD1 3.64Å; R649-D678 PolarHBondContact NH2-OD1 2.94Å; R649-D678 IonicContact NH2-OD2 3.73Å; R649-D678 PolarHBondContact NH2-OD2 3.49Å
650	I	77.4	Confident	74.1	Confident	35 Å²	35	70.5 Å²	70.5	18%	0.179	42%	0.42	C	S	.	.	H	α-helix	trans	-65.9	-42.4	178.8	-66.3	159.9	0	0	0	111	A646 C647 T648 N652 L653 G654 L667 F672	A646-I650 WeakPolarHBondContact O-CD1 3.42Å; A646-I650 VanDerWaalsContact O-CG1 3.24Å; A646-I650 WeakPolarHBondContact O-CG1 3.4Å; A646-I650 PolarHBondContact O-N 2.89Å; C647-I650 PolarHBondContact O-N 3.26Å; T648-I650 VanDerWaalsContact C-N 3.34Å; T648-I650 PolarHBondContact O-N 2.96Å; I650-N652 VanDerWaalsContact C-N 3.27Å; I650-N652 PolarHBondContact O-N 3.29Å; I650-L653 PolarHBondContact O-N 2.89Å; I650-L653 VanDerWaalsContact O-N 3.14Å; I650-G654 PolarHBondContact O-N 3.45Å; I650-L667 HydrophobicContact CG2-CD1 3.89Å; I650-L667 HydrophobicContact CG2-CD2 4.17Å; I650-F672 HydrophobicContact CD1-CB 3.35Å; I650-F672 HydrophobicContact CD1-CD1 3.91Å; I650-F672 HydrophobicContact CD1-CD2 4.06Å; I650-F672 HydrophobicContact CD1-CG 3.51Å
651	K	76	Confident	72.9	Confident	112 Å²	112	76.4 Å²	76.4	49%	0.487	44%	0.444	S	S	.	.	H	α-helix	trans	-61.3	-34.8	174.2	-73.2	-172.6	177	-140.4	0	112.6	C647 T648 L659 E664	C647-K651 WeakPolarHBondContact O-CG 3.26Å; C647-K651 PolarHBondContact O-N 2.93Å; T648-K651 PolarHBondContact O-N 3.41Å; K651-L659 HydrophobicContact CG-CD1 3.99Å; K651-E664 WeakPolarHBondContact CE-OE1 3.13Å; K651-E664 IonicContact NZ-OE1 3.28Å; K651-E664 PolarHBondContact NZ-OE1 3.45Å
652	N	76.3	Confident	71.4	Confident	138 Å²	138	81 Å²	81	74%	0.738	47%	0.466	S	S	*	.	H	α-helix	trans	-79.7	-18.3	176	-64	-10.1	0	0	0	113.8	T648 R649 I650	T648-N652 WeakPolarHBondContact O-CB 3.35Å; T648-N652 PolarHBondContact O-N 3.41Å; T648-N652 PolarHBondContact O-ND2 2.96Å; T648-N652 PolarHBondContact O-OD1 3.27Å; R649-N652 PolarHBondContact O-N 2.98Å; I650-N652 VanDerWaalsContact C-N 3.27Å; I650-N652 PolarHBondContact O-N 3.29Å
653	L	70.1	Confident	70.1	Confident	126 Å²	126	84.4 Å²	84.4	66%	0.66	48%	0.484	S	S	*	.	H	α-helix	trans	-86.9	-21.7	173.3	-76.3	165.2	0	0	0	112.7	R649 I650	R649-L653 HydrophobicContact CG-CD1 3.92Å; R649-L653 WeakPolarHBondContact O-CB 3.43Å; R649-L653 VanDerWaalsContact O-CG 3.31Å; R649-L653 WeakPolarHBondContact O-CG 3.47Å; R649-L653 PolarHBondContact O-N 2.68Å; I650-L653 PolarHBondContact O-N 2.89Å; I650-L653 VanDerWaalsContact O-N 3.14Å
654	G	58.9	Low	68.9	Low	26 Å²	26	86.2 Å²	86.2	27%	0.268	49%	0.489	S	S	.	.	S	Bend	trans	-59.7	134.5	162.6	0	0	0	0	0	109.7	I650	I650-G654 PolarHBondContact O-N 3.45Å
655	L	51.9	Low	67.6	Low	155 Å²	155	80.3 Å²	80.3	81%	0.812	48%	0.479	S	S	*	.			trans	-59.8	169.2	-176.9	-84.6	81	0	0	0	112.3	G657	L655-G657 CarbonylContact O-C 3.58Å; L655-G657 PolarHBondContact O-N 2.85Å
656	A	48.9	Very low	66.1	Low	120 Å²	120	84.7 Å²	84.7	99%	0.992	50%	0.498	S	S	*	.	S	Bend	trans	-59.3	10	-174.4	0	0	0	0	0	117.7
657	G	54	Low	64.9	Low	63 Å²	63	87.9 Å²	87.9	65%	0.649	51%	0.514	S	S	*	.	S	Bend	trans	-122.3	120	158.7	0	0	0	0	0	107.8	L655	L655-G657 CarbonylContact O-C 3.58Å; L655-G657 PolarHBondContact O-N 2.85Å
658	G	55.5	Low	63.7	Low	72 Å²	72	90.4 Å²	90.4	74%	0.742	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-59.5	162.1	-165.9	0	0	0	0	0	115.7
659	L	59.5	Low	62.3	Low	55 Å²	55	91.2 Å²	91.2	29%	0.288	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-56.1	138.1	-179.8	-60	173.5	0	0	0	111.9	K651 D663 E664 L667	K651-L659 HydrophobicContact CG-CD1 3.99Å; L659-D663 HydrophobicContact CB-CB 4.35Å; L659-D663 HydrophobicContact CD2-CB 4.24Å; L659-E664 HydrophobicContact CB-CG 3.97Å; L659-E664 HydrophobicContact CD1-CG 4.17Å; L659-L667 HydrophobicContact CD1-CD1 3.87Å; L659-L667 HydrophobicContact CD2-CD1 4.19Å
660	T	66.6	Low	61	Low	72 Å²	72	92.8 Å²	92.8	44%	0.442	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-78.8	160.9	169	68.9	0	0	0	0	110.9	E662 D663 E664	T660-E662 PolarHBondContact O-N 3.01Å; T660-D663 WeakPolarHBondContact CB-OD2 3.38Å; T660-D663 PolarHBondContact N-OD2 2.79Å; T660-D663 VanDerWaalsContact N-OD2 3.09Å; T660-D663 PolarHBondContact O-N 3.32Å; T660-D663 VanDerWaalsContact O-N 3.1Å; T660-D663 VanDerWaalsContact OG1-CG 3.23Å; T660-D663 PolarHBondContact OG1-N 2.89Å; T660-D663 PolarHBondContact OG1-OD2 3.3Å; T660-E664 PolarHBondContact O-N 3.22Å
661	E	63.4	Low	60.1	Low	179 Å²	179	93 Å²	93	84%	0.836	58%	0.58	S	S	*	*	H	α-helix	trans	-59.9	-28.4	176.1	-63.4	-171.3	157.7	0	0	112.3	G665	E661-G665 PolarHBondContact O-N 3.11Å
662	E	58.2	Low	59.9	Low	163 Å²	163	90.3 Å²	90.3	76%	0.762	57%	0.569	S	S	*	*	H	α-helix	trans	-70.4	-43.5	174.4	-60	-173.6	168.9	0	0	111.4	T660 G665 E666	T660-E662 PolarHBondContact O-N 3.01Å; E662-G665 PolarHBondContact O-N 2.97Å; E662-E666 PolarHBondContact O-N 3.1Å
663	D	61.3	Low	60.1	Low	73 Å²	73	86.8 Å²	86.8	39%	0.39	55%	0.553	S	S	.	*	H	α-helix	trans	-62.9	-41.5	174.2	-62.2	-60.3	0	0	0	111.8	L659 T660 G665 E666 L667	L659-D663 HydrophobicContact CB-CB 4.35Å; L659-D663 HydrophobicContact CD2-CB 4.24Å; T660-D663 WeakPolarHBondContact CB-OD2 3.38Å; T660-D663 PolarHBondContact N-OD2 2.79Å; T660-D663 VanDerWaalsContact N-OD2 3.09Å; T660-D663 PolarHBondContact O-N 3.32Å; T660-D663 VanDerWaalsContact O-N 3.1Å; T660-D663 VanDerWaalsContact OG1-CG 3.23Å; T660-D663 PolarHBondContact OG1-N 2.89Å; T660-D663 PolarHBondContact OG1-OD2 3.3Å; D663-G665 VanDerWaalsContact C-N 3.31Å; D663-G665 PolarHBondContact O-N 2.71Å; D663-E666 PolarHBondContact O-N 2.77Å; D663-L667 WeakPolarHBondContact O-CB 3.09Å; D663-L667 WeakPolarHBondContact O-CD1 3.15Å; D663-L667 VanDerWaalsContact O-CG 3.24Å; D663-L667 WeakPolarHBondContact O-CG 3.42Å; D663-L667 PolarHBondContact O-N 3.39Å
664	E	62.2	Low	60.9	Low	75 Å²	75	80.9 Å²	80.9	35%	0.35	52%	0.523	S	S	.	.	H	α-helix	trans	-63	-38.8	175.2	-67	-154.1	146.5	0	0	111.6	K651 L659 T660 L667 C668	K651-E664 WeakPolarHBondContact CE-OE1 3.13Å; K651-E664 IonicContact NZ-OE1 3.28Å; K651-E664 PolarHBondContact NZ-OE1 3.45Å; L659-E664 HydrophobicContact CB-CG 3.97Å; L659-E664 HydrophobicContact CD1-CG 4.17Å; T660-E664 PolarHBondContact O-N 3.22Å; E664-L667 PolarHBondContact O-N 2.77Å; E664-C668 WeakPolarHBondContact O-CB 3.5Å; E664-C668 PolarHBondContact O-N 3.05Å; E664-C668 PolarHBondContact O-SG 3.16Å
665	G	58.3	Low	62.3	Low	41 Å²	41	82 Å²	82	42%	0.423	52%	0.522	S	S	.	.	H	α-helix	trans	-62.3	-46.3	173.1	0	0	0	0	0	113.3	E661 E662 D663 C668 A669	E661-G665 PolarHBondContact O-N 3.11Å; E662-G665 PolarHBondContact O-N 2.97Å; D663-G665 VanDerWaalsContact C-N 3.31Å; D663-G665 PolarHBondContact O-N 2.71Å; G665-C668 PolarHBondContact O-N 2.84Å; G665-A669 WeakPolarHBondContact O-CB 3.23Å; G665-A669 PolarHBondContact O-N 3.22Å
666	E	55.2	Low	64	Low	101 Å²	101	76.7 Å²	76.7	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-63.3	-42.1	175.8	-73.8	-159.5	-179.5	0	0	112.1	E662 D663 A669 A670	E662-E666 PolarHBondContact O-N 3.1Å; D663-E666 PolarHBondContact O-N 2.77Å; E666-A669 PolarHBondContact O-N 3.11Å; E666-A670 WeakPolarHBondContact O-CB 3.45Å; E666-A670 PolarHBondContact O-N 2.8Å
667	L	59.4	Low	65.9	Low	67 Å²	67	76.6 Å²	76.6	35%	0.351	48%	0.48	S	S	.	.	H	α-helix	trans	-64.7	-41.4	177.8	-73.8	166.9	0	0	0	112.1	I650 L659 D663 E664 A669 A670 G671	I650-L667 HydrophobicContact CG2-CD1 3.89Å; I650-L667 HydrophobicContact CG2-CD2 4.17Å; L659-L667 HydrophobicContact CD1-CD1 3.87Å; L659-L667 HydrophobicContact CD2-CD1 4.19Å; D663-L667 WeakPolarHBondContact O-CB 3.09Å; D663-L667 WeakPolarHBondContact O-CD1 3.15Å; D663-L667 VanDerWaalsContact O-CG 3.24Å; D663-L667 WeakPolarHBondContact O-CG 3.42Å; D663-L667 PolarHBondContact O-N 3.39Å; E664-L667 PolarHBondContact O-N 2.77Å; L667-A669 VanDerWaalsContact C-N 3.35Å; L667-A670 PolarHBondContact O-N 2.73Å; L667-G671 PolarHBondContact O-N 3.27Å
668	C	57.4	Low	67.6	Low	102 Å²	102	73.6 Å²	73.6	69%	0.689	45%	0.449	S	S	*	.	H	α-helix	trans	-65.4	-37.7	174.8	-69.3	0	0	0	0	112.1	E664 G665	E664-C668 WeakPolarHBondContact O-CB 3.5Å; E664-C668 PolarHBondContact O-N 3.05Å; E664-C668 PolarHBondContact O-SG 3.16Å; G665-C668 PolarHBondContact O-N 2.84Å
669	A	55.3	Low	69.3	Low	89 Å²	89	70.3 Å²	70.3	74%	0.736	41%	0.414	S	S	*	.	H	α-helix	trans	-72.2	-32.2	177.2	0	0	0	0	0	113.2	G665 E666 L667	G665-A669 WeakPolarHBondContact O-CB 3.23Å; G665-A669 PolarHBondContact O-N 3.22Å; E666-A669 PolarHBondContact O-N 3.11Å; L667-A669 VanDerWaalsContact C-N 3.35Å
670	A	55.3	Low	70.6	Confident	85 Å²	85	68.4 Å²	68.4	70%	0.702	41%	0.407	S	S	*	.	H	α-helix	trans	-71.7	-34	177.9	0	0	0	0	0	113	E666 L667	E666-A670 WeakPolarHBondContact O-CB 3.45Å; E666-A670 PolarHBondContact O-N 2.8Å; L667-A670 PolarHBondContact O-N 2.73Å
671	G	59.3	Low	71.6	Confident	38 Å²	38	70 Å²	70	39%	0.392	41%	0.41	S	S	.	.			trans	73.3	108.7	-176.4	0	0	0	0	0	112.2	L667	L667-G671 PolarHBondContact O-N 3.27Å
672	F	70.8	Confident	72.9	Confident	56 Å²	56	61.5 Å²	61.5	25%	0.246	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-81.8	134.5	-179.4	54.1	-93.8	0	0	0	112.1	P613 A646 C647 I650 L674	P613-F672 WeakPolarHBondContact CG-O 3.36Å; A646-F672 HydrophobicContact CB-CD2 3.64Å; A646-F672 HydrophobicContact CB-CE2 3.58Å; C647-F672 WeakPolarHBondContact SG-CZ 3.33Å; I650-F672 HydrophobicContact CD1-CB 3.35Å; I650-F672 HydrophobicContact CD1-CD1 3.91Å; I650-F672 HydrophobicContact CD1-CD2 4.06Å; I650-F672 HydrophobicContact CD1-CG 3.51Å; F672-L674 HydrophobicContact CD2-CD2 4.3Å; F672-L674 HydrophobicContact CE2-CD2 3.94Å
673	P	80.6	Confident	74.3	Confident	64 Å²	64	53.8 Å²	53.8	42%	0.416	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-71.9	135.3	175.1	30	-33.6	0	0	0	111.2	P613	P613-P673 VanDerWaalsContact O-CA 3.31Å; P613-P673 WeakPolarHBondContact O-CA 3.36Å
674	L	86.1	Confident	75.3	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.016	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-75.3	125.9	168.8	-58.6	177.6	0	0	0	109.3	L612 P613 L614 G615 V618 A646 F672 F679	L612-L674 HydrophobicContact CD1-CD1 4.25Å; P613-L674 PolarHBondContact O-N 3.32Å; L614-L674 HydrophobicContact CD2-CB 4.33Å; L614-L674 HydrophobicContact CD2-CD1 4.36Å; G615-L674 PolarHBondContact N-O 3.15Å; V618-L674 WeakPolarHBondContact CG2-O 3.36Å; A646-L674 HydrophobicContact CB-CD2 3.8Å; F672-L674 HydrophobicContact CD2-CD2 4.3Å; F672-L674 HydrophobicContact CE2-CD2 3.94Å; L674-F679 HydrophobicContact CB-CE2 3.69Å; L674-F679 HydrophobicContact CB-CZ 4.19Å; L674-F679 HydrophobicContact CD1-CE2 4.24Å; L674-F679 HydrophobicContact CD1-CZ 3.85Å
675	L	88.5	Confident	76.3	Confident	49 Å²	49	57.8 Å²	57.8	26%	0.257	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-101.3	165.7	178.2	-53.6	-172.6	0	0	0	111.1	E677 D678 F679	L675-E677 PolarHBondContact O-N 3.11Å; L675-D678 PolarHBondContact N-OD2 3.11Å; L675-D678 PolarHBondContact O-N 3.48Å; L675-D678 VanDerWaalsContact O-N 3.11Å; L675-F679 WeakPolarHBondContact O-CD2 3.24Å; L675-F679 PolarHBondContact O-N 3.47Å
676	A	88.6	Confident	77.4	Confident	43 Å²	43	56.4 Å²	56.4	36%	0.355	34%	0.336	S	S	.	.	H	α-helix	trans	-59.7	-32.5	-179.6	0	0	0	0	0	112.9	E617 D678 F679 G680	E617-A676 HydrophobicContact CB-CB 4.28Å; A676-D678 PolarHBondContact O-N 2.66Å; A676-F679 PolarHBondContact O-N 3.43Å; A676-G680 PolarHBondContact O-N 2.96Å
677	E	88	Confident	78.4	Confident	119 Å²	119	54.2 Å²	54.2	56%	0.556	33%	0.326	S	S	*	.	H	α-helix	trans	-60.2	-41.6	174.6	-60.2	-179.7	154.7	0	0	113	R649 L675 F679 G680 Q681	R649-E677 IonicContact NH1-OE2 2.73Å; L675-E677 PolarHBondContact O-N 3.11Å; E677-F679 VanDerWaalsContact C-N 3.32Å; E677-F679 PolarHBondContact O-N 3.39Å; E677-G680 WeakPolarHBondContact O-CA 3.17Å; E677-G680 PolarHBondContact O-N 2.94Å; E677-G680 VanDerWaalsContact O-N 3.12Å; E677-Q681 PolarHBondContact O-N 2.97Å
678	D	90.4	Very high	79	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-66.2	-39.5	-178.7	-55.5	-55.6	0	0	0	110.6	A645 A646 R649 L675 A676 A682	A645-D678 HydrophobicContact CB-CB 4.19Å; A646-D678 WeakPolarHBondContact CA-OD1 3.44Å; A646-D678 HydrophobicContact CB-CB 4.45Å; A646-D678 PolarHBondContact N-OD1 3.29Å; R649-D678 IonicContact CZ-OD1 3.97Å; R649-D678 IonicContact CZ-OD2 3.5Å; R649-D678 IonicContact NH1-OD1 3.27Å; R649-D678 PolarHBondContact NH1-OD1 2.86Å; R649-D678 IonicContact NH1-OD2 2.7Å; R649-D678 PolarHBondContact NH1-OD2 2.94Å; R649-D678 IonicContact NH2-OD1 3.64Å; R649-D678 PolarHBondContact NH2-OD1 2.94Å; R649-D678 IonicContact NH2-OD2 3.73Å; R649-D678 PolarHBondContact NH2-OD2 3.49Å; L675-D678 PolarHBondContact N-OD2 3.11Å; L675-D678 PolarHBondContact O-N 3.48Å; L675-D678 VanDerWaalsContact O-N 3.11Å; A676-D678 PolarHBondContact O-N 2.66Å; D678-A682 WeakPolarHBondContact O-CB 3.07Å; D678-A682 PolarHBondContact O-N 2.87Å
679	F	90.3	Very high	79.6	Confident	3 Å²	3	50.9 Å²	50.9	1%	0.013	31%	0.31	C	S	.	.	H	α-helix	trans	-67.9	-34.4	172.4	-74.8	-74.1	0	0	0	112.3	L614 V618 L623 L639 L674 L675 A676 E677 L683	L614-F679 HydrophobicContact CD2-CE2 4.14Å; L614-F679 HydrophobicContact CD2-CZ 4.09Å; V618-F679 HydrophobicContact CG1-CD2 3.93Å; V618-F679 HydrophobicContact CG1-CE2 3.68Å; V618-F679 HydrophobicContact CG1-CZ 4.41Å; V618-F679 HydrophobicContact CG2-CD2 4.1Å; V618-F679 HydrophobicContact CG2-CE2 4.04Å; L623-F679 HydrophobicContact CD1-CB 4.3Å; L623-F679 HydrophobicContact CD1-CD1 3.83Å; L623-F679 HydrophobicContact CD1-CD2 4.2Å; L623-F679 HydrophobicContact CD1-CE1 4.16Å; L623-F679 HydrophobicContact CD1-CG 3.86Å; L623-F679 HydrophobicContact CD1-CZ 4.49Å; L623-F679 HydrophobicContact CD2-CB 3.94Å; L623-F679 HydrophobicContact CD2-CG 4.38Å; L639-F679 HydrophobicContact CD2-CE1 3.83Å; L639-F679 HydrophobicContact CD2-CZ 4.08Å; L674-F679 HydrophobicContact CB-CE2 3.69Å; L674-F679 HydrophobicContact CB-CZ 4.19Å; L674-F679 HydrophobicContact CD1-CE2 4.24Å; L674-F679 HydrophobicContact CD1-CZ 3.85Å; L675-F679 WeakPolarHBondContact O-CD2 3.24Å; L675-F679 PolarHBondContact O-N 3.47Å; A676-F679 PolarHBondContact O-N 3.43Å; E677-F679 VanDerWaalsContact C-N 3.32Å; E677-F679 PolarHBondContact O-N 3.39Å; F679-L683 WeakPolarHBondContact O-CB 3.48Å; F679-L683 PolarHBondContact O-N 3.17Å
680	G	88	Confident	80.2	Confident	14 Å²	14	48.8 Å²	48.8	14%	0.144	29%	0.285	C	S	.	.	H	α-helix	trans	-59.9	-55.2	173.7	0	0	0	0	0	112.1	A676 E677 A682 L683 E684	A676-G680 PolarHBondContact O-N 2.96Å; E677-G680 WeakPolarHBondContact O-CA 3.17Å; E677-G680 PolarHBondContact O-N 2.94Å; E677-G680 VanDerWaalsContact O-N 3.12Å; G680-A682 PolarHBondContact O-N 3.44Å; G680-L683 PolarHBondContact O-N 3.4Å; G680-E684 PolarHBondContact O-N 3.24Å
681	Q	88.2	Confident	80.6	Confident	106 Å²	106	46.1 Å²	46.1	50%	0.495	26%	0.261	S	S	.	.	H	α-helix	trans	-61.2	-44	178.1	-65.3	178.5	18.8	0	0	112.1	E677 L683 E684 L685	E677-Q681 PolarHBondContact O-N 2.97Å; Q681-L683 VanDerWaalsContact C-N 3.33Å; Q681-L683 PolarHBondContact O-N 2.9Å; Q681-E684 PolarHBondContact O-N 2.84Å; Q681-L685 WeakPolarHBondContact O-CG 3.31Å; Q681-L685 PolarHBondContact O-N 3.38Å; Q681-L685 VanDerWaalsContact O-N 3.12Å
682	A	89.7	Confident	80.9	Confident	1 Å²	1	52 Å²	52	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-62.7	-39.8	177.8	0	0	0	0	0	112.3	L638 H641 D678 G680 Q686	L638-A682 HydrophobicContact CD1-CB 3.85Å; H641-A682 HydrophobicContact CB-CB 3.69Å; D678-A682 WeakPolarHBondContact O-CB 3.07Å; D678-A682 PolarHBondContact O-N 2.87Å; G680-A682 PolarHBondContact O-N 3.44Å; A682-Q686 VanDerWaalsContact O-CB 3.29Å; A682-Q686 WeakPolarHBondContact O-CB 3.46Å; A682-Q686 PolarHBondContact O-N 3.01Å
683	L	86.8	Confident	80.2	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-68	-40.9	178.6	-175.7	70.6	0	0	0	111.7	R626 F630 L638 F679 G680 Q681 Q686 Q687	R626-L683 HydrophobicContact CB-CD2 3.74Å; R626-L683 VanDerWaalsContact CZ-CD2 3.46Å; F630-L683 HydrophobicContact CE2-CD1 3.56Å; F630-L683 HydrophobicContact CZ-CD1 3.8Å; L638-L683 HydrophobicContact CD1-CB 4.12Å; L638-L683 HydrophobicContact CD1-CD1 4.29Å; F679-L683 WeakPolarHBondContact O-CB 3.48Å; F679-L683 PolarHBondContact O-N 3.17Å; G680-L683 PolarHBondContact O-N 3.4Å; Q681-L683 VanDerWaalsContact C-N 3.33Å; Q681-L683 PolarHBondContact O-N 2.9Å; L683-Q686 PolarHBondContact O-N 3.12Å; L683-Q687 HydrophobicContact CD1-CG 4.1Å; L683-Q687 HydrophobicContact CG-CG 4.11Å; L683-Q687 VanDerWaalsContact O-CB 3.27Å; L683-Q687 WeakPolarHBondContact O-CB 3.4Å; L683-Q687 VanDerWaalsContact O-CG 3.26Å; L683-Q687 WeakPolarHBondContact O-CG 3.42Å; L683-Q687 PolarHBondContact O-N 3.41Å
684	E	83.1	Confident	79.1	Confident	127 Å²	127	52.3 Å²	52.3	59%	0.593	29%	0.293	S	S	*	.	H	α-helix	trans	-63.1	-44.9	176.1	-73.4	178.1	-161.2	0	0	112.2	G680 Q681 Q686 Q687 T688	G680-E684 PolarHBondContact O-N 3.24Å; Q681-E684 PolarHBondContact O-N 2.84Å; E684-Q686 VanDerWaalsContact C-N 3.29Å; E684-Q686 PolarHBondContact O-N 3.36Å; E684-Q687 PolarHBondContact O-N 3.3Å; E684-T688 WeakPolarHBondContact O-CG2 3.39Å; E684-T688 PolarHBondContact O-N 3.46Å; E684-T688 PolarHBondContact O-OG1 3.35Å
685	L	83.6	Confident	77.5	Confident	105 Å²	105	54.3 Å²	54.3	55%	0.55	31%	0.314	S	S	.	.	H	α-helix	trans	-59.4	-41.8	173.8	-70.9	173.2	0	0	0	111.6	Q681 T688 A689	Q681-L685 WeakPolarHBondContact O-CG 3.31Å; Q681-L685 PolarHBondContact O-N 3.38Å; Q681-L685 VanDerWaalsContact O-N 3.12Å; L685-T688 PolarHBondContact O-OG1 3.05Å; L685-A689 WeakPolarHBondContact O-CB 3.12Å; L685-A689 PolarHBondContact O-N 3.49Å
686	Q	80.6	Confident	75.7	Confident	11 Å²	11	52.5 Å²	52.5	5%	0.051	31%	0.306	C	S	.	.	H	α-helix	trans	-76.8	-36.7	-178.3	-165.6	162.7	-63	0	0	113.4	F630 D634 A682 L683 E684 A689 H690	F630-Q686 HydrophobicContact CE2-CB 4.31Å; F630-Q686 HydrophobicContact CE2-CG 3.93Å; F630-Q686 HydrophobicContact CZ-CB 4.16Å; F630-Q686 HydrophobicContact CZ-CG 3.87Å; D634-Q686 VanDerWaalsContact O-CD 3.32Å; D634-Q686 PolarHBondContact O-NE2 2.89Å; D634-Q686 PolarHBondContact O-OE1 3.2Å; A682-Q686 VanDerWaalsContact O-CB 3.29Å; A682-Q686 WeakPolarHBondContact O-CB 3.46Å; A682-Q686 PolarHBondContact O-N 3.01Å; L683-Q686 PolarHBondContact O-N 3.12Å; E684-Q686 VanDerWaalsContact C-N 3.29Å; E684-Q686 PolarHBondContact O-N 3.36Å; Q686-A689 PolarHBondContact O-N 3.47Å; Q686-H690 WeakPolarHBondContact O-CB 3.37Å; Q686-H690 PolarHBondContact O-N 2.79Å
687	Q	75.8	Confident	73.9	Confident	56 Å²	56	53.1 Å²	53.1	26%	0.262	31%	0.306	S	S	.	.	H	α-helix	trans	-64.6	-40.7	172.8	-75.9	179.6	-18.5	0	0	110.7	R626 F630 L683 E684 H690 S691	R626-Q687 PolarHBondContact O-NE2 2.91Å; F630-Q687 HydrophobicContact CE1-CG 4.23Å; F630-Q687 HydrophobicContact CZ-CG 3.83Å; L683-Q687 HydrophobicContact CD1-CG 4.1Å; L683-Q687 HydrophobicContact CG-CG 4.11Å; L683-Q687 VanDerWaalsContact O-CB 3.27Å; L683-Q687 WeakPolarHBondContact O-CB 3.4Å; L683-Q687 VanDerWaalsContact O-CG 3.26Å; L683-Q687 WeakPolarHBondContact O-CG 3.42Å; L683-Q687 PolarHBondContact O-N 3.41Å; E684-Q687 PolarHBondContact O-N 3.3Å; Q687-H690 PolarHBondContact O-N 2.9Å; Q687-S691 VanDerWaalsContact O-CB 3.28Å; Q687-S691 WeakPolarHBondContact O-CB 3.32Å; Q687-S691 PolarHBondContact O-N 3.41Å; Q687-S691 PolarHBondContact O-OG 3.26Å; Q687-S691 VanDerWaalsContact O-OG 3.07Å
688	T	72.1	Confident	72.3	Confident	47 Å²	47	54.5 Å²	54.5	29%	0.288	31%	0.311	S	S	.	.	H	α-helix	trans	-65	-41.9	174.2	52.6	0	0	0	0	112.6	E684 L685 Q692	E684-T688 WeakPolarHBondContact O-CG2 3.39Å; E684-T688 PolarHBondContact O-N 3.46Å; E684-T688 PolarHBondContact O-OG1 3.35Å; L685-T688 PolarHBondContact O-OG1 3.05Å; T688-Q692 WeakPolarHBondContact O-CB 3.16Å; T688-Q692 VanDerWaalsContact O-CG 3.27Å; T688-Q692 WeakPolarHBondContact O-CG 3.31Å; T688-Q692 PolarHBondContact O-N 3.47Å
689	A	70.9	Confident	71	Confident	51 Å²	51	57.4 Å²	57.4	42%	0.421	33%	0.326	S	S	.	.	H	α-helix	trans	-64.2	-42.2	174.2	0	0	0	0	0	112.7	L685 Q686 Q692 A693	L685-A689 WeakPolarHBondContact O-CB 3.12Å; L685-A689 PolarHBondContact O-N 3.49Å; Q686-A689 PolarHBondContact O-N 3.47Å; A689-Q692 PolarHBondContact O-N 3.44Å; A689-A693 WeakPolarHBondContact O-CB 3.3Å; A689-A693 PolarHBondContact O-N 3.2Å
690	H	67	Low	69.7	Low	45 Å²	45	58 Å²	58	21%	0.208	33%	0.33	C	S	.	.	H	α-helix	trans	-67	-44.1	177.7	-173.8	96.9	0	0	0	111.6	F630 D634 Q686 Q687 Q692 A693 V694	F630-H690 HydrophobicContact CE1-CB 4.3Å; D634-H690 IonicContact OD2-ND1 3.3Å; Q686-H690 WeakPolarHBondContact O-CB 3.37Å; Q686-H690 PolarHBondContact O-N 2.79Å; Q687-H690 PolarHBondContact O-N 2.9Å; H690-Q692 VanDerWaalsContact C-N 3.32Å; H690-Q692 PolarHBondContact O-N 2.88Å; H690-A693 PolarHBondContact O-N 3.13Å; H690-V694 WeakPolarHBondContact O-CB 3.21Å; H690-V694 WeakPolarHBondContact O-CG2 3.47Å; H690-V694 PolarHBondContact O-N 2.92Å
691	S	65.1	Low	68.8	Low	30 Å²	30	63.2 Å²	63.2	21%	0.21	36%	0.364	C	S	.	.	H	α-helix	trans	-55.5	-45.2	171.3	-74.1	0	0	0	0	112	Q687 G695 A696	Q687-S691 VanDerWaalsContact O-CB 3.28Å; Q687-S691 WeakPolarHBondContact O-CB 3.32Å; Q687-S691 PolarHBondContact O-N 3.41Å; Q687-S691 PolarHBondContact O-OG 3.26Å; Q687-S691 VanDerWaalsContact O-OG 3.07Å; S691-G695 CarbonylContact O-C 3.58Å; S691-G695 WeakPolarHBondContact O-CA 3.43Å; S691-G695 PolarHBondContact O-N 3.41Å; S691-A696 CarbonylContact C-O 3.52Å; S691-A696 WeakPolarHBondContact CA-O 3.34Å; S691-A696 WeakPolarHBondContact CB-O 3.44Å; S691-A696 PolarHBondContact O-N 3.38Å; S691-A696 VanDerWaalsContact O-O 3.14Å
692	Q	64	Low	68.5	Low	160 Å²	160	59.4 Å²	59.4	75%	0.748	35%	0.348	S	S	*	.	H	α-helix	trans	-64	-42.6	175.9	-73.8	171.5	-2	0	0	112.3	T688 A689 H690 G695	T688-Q692 WeakPolarHBondContact O-CB 3.16Å; T688-Q692 VanDerWaalsContact O-CG 3.27Å; T688-Q692 WeakPolarHBondContact O-CG 3.31Å; T688-Q692 PolarHBondContact O-N 3.47Å; A689-Q692 PolarHBondContact O-N 3.44Å; H690-Q692 VanDerWaalsContact C-N 3.32Å; H690-Q692 PolarHBondContact O-N 2.88Å; Q692-G695 PolarHBondContact O-N 3.06Å
693	A	57.9	Low	68.2	Low	89 Å²	89	61 Å²	61	74%	0.736	36%	0.359	S	S	*	.	H	α-helix	trans	-71.6	-35.8	-178.1	0	0	0	0	0	113.8	A689 H690 G695	A689-A693 WeakPolarHBondContact O-CB 3.3Å; A689-A693 PolarHBondContact O-N 3.2Å; H690-A693 PolarHBondContact O-N 3.13Å; A693-G695 VanDerWaalsContact C-N 3.3Å
694	V	57.2	Low	68.1	Low	39 Å²	39	62.1 Å²	62.1	24%	0.236	36%	0.363	C	S	.	.	H	α-helix	trans	-81.2	-13.8	175.1	179.9	0	0	0	0	111.4	H690 A696 R791	H690-V694 WeakPolarHBondContact O-CB 3.21Å; H690-V694 WeakPolarHBondContact O-CG2 3.47Å; H690-V694 PolarHBondContact O-N 2.92Å; V694-A696 HydrophobicContact CB-CB 4.25Å; V694-A696 HydrophobicContact CG1-CB 3.91Å; V694-A696 PolarHBondContact O-N 3.08Å; V694-R791 HydrophobicContact CG1-CB 4.48Å
695	G	51.2	Low	68.2	Low	44 Å²	44	62.8 Å²	62.8	45%	0.454	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	16.4	-170	0	0	0	0	0	113	S691 Q692 A693	S691-G695 CarbonylContact O-C 3.58Å; S691-G695 WeakPolarHBondContact O-CA 3.43Å; S691-G695 PolarHBondContact O-N 3.41Å; Q692-G695 PolarHBondContact O-N 3.06Å; A693-G695 VanDerWaalsContact C-N 3.3Å
696	A	51	Low	68.3	Low	12 Å²	12	60.4 Å²	60.4	10%	0.099	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-87.3	122	177.7	0	0	0	0	0	109.2	S691 V694 L766	S691-A696 CarbonylContact C-O 3.52Å; S691-A696 WeakPolarHBondContact CA-O 3.34Å; S691-A696 WeakPolarHBondContact CB-O 3.44Å; S691-A696 PolarHBondContact O-N 3.38Å; S691-A696 VanDerWaalsContact O-O 3.14Å; V694-A696 HydrophobicContact CB-CB 4.25Å; V694-A696 HydrophobicContact CG1-CB 3.91Å; V694-A696 PolarHBondContact O-N 3.08Å; A696-L766 HydrophobicContact CB-CD1 4.49Å; A696-L766 HydrophobicContact CB-CG 4.5Å
697	P	51.3	Low	68.5	Low	55 Å²	55	60.8 Å²	60.8	36%	0.357	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-61.9	152.4	-178	16.4	-23.5	0	0	0	113.1	F765	P697-F765 WeakPolarHBondContact CG-O 3.42Å
698	K	53.9	Low	68.9	Low	148 Å²	148	58.7 Å²	58.7	64%	0.643	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-58.5	149.3	-176.8	-165	178.5	-177.8	177.9	0	111.4	P700	K698-P700 WeakPolarHBondContact O-CD 3.46Å; K698-P700 VanDerWaalsContact O-N 3.11Å
699	I	63.1	Low	69.4	Low	62 Å²	62	56.6 Å²	56.6	32%	0.318	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-50.5	121.6	164.1	-56.9	174.3	0	0	0	107.4
700	P	64.3	Low	70	Confident	16 Å²	16	55.5 Å²	55.5	10%	0.104	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-65.4	140.2	-176.5	25.6	-33.7	0	0	0	110.2	K698 V702 K755 A758 T759 F765	K698-P700 WeakPolarHBondContact O-CD 3.46Å; K698-P700 VanDerWaalsContact O-N 3.11Å; P700-V702 HydrophobicContact CB-CG2 4.4Å; P700-V702 PolarHBondContact O-N 2.74Å; P700-K755 HydrophobicContact CB-CB 3.77Å; P700-K755 HydrophobicContact CB-CD 4.19Å; P700-K755 HydrophobicContact CB-CG 3.85Å; P700-K755 HydrophobicContact CG-CB 3.68Å; P700-K755 HydrophobicContact CG-CG 3.91Å; P700-K755 VanDerWaalsContact CG-O 3.28Å; P700-K755 WeakPolarHBondContact CG-O 3.37Å; P700-A758 HydrophobicContact CG-CB 4.47Å; P700-T759 PolarHBondContact O-OG1 3.11Å; P700-F765 HydrophobicContact CG-CB 4.49Å; P700-F765 HydrophobicContact CG-CD1 4.27Å; P700-F765 HydrophobicContact CG-CG 4.33Å
701	S	68.8	Low	70.8	Confident	122 Å²	122	59 Å²	59	85%	0.853	34%	0.342	S	S	*	.	S	Bend	trans	-81.1	35.6	177.6	67.2	0	0	0	0	112.6
702	V	81.3	Confident	71.8	Confident	27 Å²	27	65.8 Å²	65.8	16%	0.164	37%	0.37	C	S	.	.			trans	-110.5	122.8	-175.1	-176.3	0	0	0	0	108	P700 D706 K755 A756 T759	P700-V702 HydrophobicContact CB-CG2 4.4Å; P700-V702 PolarHBondContact O-N 2.74Å; V702-D706 HydrophobicContact CG1-CB 4.02Å; V702-K755 HydrophobicContact CB-CB 4.34Å; V702-K755 HydrophobicContact CG2-CB 4.41Å; V702-A756 HydrophobicContact CG1-CB 4.27Å; V702-A756 WeakPolarHBondContact O-CA 3.49Å; V702-T759 WeakPolarHBondContact O-CB 3.38Å; V702-T759 PolarHBondContact O-OG1 2.73Å
703	S	84.3	Confident	72.9	Confident	35 Å²	35	59 Å²	59	25%	0.245	34%	0.34	C	S	.	.			trans	-98.7	166.2	-179.6	69.3	0	0	0	0	111.9	H705 D706	S703-H705 PolarHBondContact O-N 2.84Å; S703-H705 VanDerWaalsContact O-N 3.14Å; S703-H705 WeakPolarHBondContact OG-CB 3.49Å; S703-H705 PolarHBondContact OG-N 3.04Å; S703-D706 WeakPolarHBondContact CB-OD2 3.23Å; S703-D706 PolarHBondContact N-OD2 3.03Å; S703-D706 WeakPolarHBondContact O-CB 3.41Å; S703-D706 PolarHBondContact O-N 3.27Å; S703-D706 PolarHBondContact OG-N 2.87Å; S703-D706 PolarHBondContact OG-OD2 2.81Å
704	W	84.7	Confident	74.3	Confident	24 Å²	24	55.8 Å²	55.8	9%	0.091	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-58.7	-23.7	169.4	-84.3	132.6	0	0	0	114.3	D706 V707 K714 L718 L753 A756 V757 E760	W704-D706 VanDerWaalsContact C-N 3.27Å; W704-V707 HydrophobicContact CE3-CB 4.43Å; W704-V707 PolarHBondContact O-N 3.27Å; W704-K714 HydrophobicContact CD2-CD 4.4Å; W704-K714 HydrophobicContact CE3-CD 3.63Å; W704-K714 HydrophobicContact CE3-CG 4.08Å; W704-K714 HydrophobicContact CH2-CB 4.04Å; W704-K714 HydrophobicContact CH2-CD 4.28Å; W704-K714 HydrophobicContact CH2-CG 3.85Å; W704-K714 HydrophobicContact CZ3-CB 4.13Å; W704-K714 HydrophobicContact CZ3-CD 3.56Å; W704-K714 HydrophobicContact CZ3-CG 3.46Å; W704-K714 VanDerWaalsContact CZ3-CG 3.46Å; W704-K714 PolarHBondContact O-NZ 2.75Å; W704-L718 HydrophobicContact CZ2-CD1 4.06Å; W704-L718 HydrophobicContact CZ2-CD2 3.93Å; W704-L718 HydrophobicContact CZ2-CG 3.86Å; W704-L753 HydrophobicContact CH2-CD1 3.68Å; W704-L753 HydrophobicContact CZ3-CD1 3.47Å; W704-L753 VanDerWaalsContact CZ3-CD1 3.47Å; W704-A756 HydrophobicContact CD2-CB 4.31Å; W704-A756 HydrophobicContact CE3-CB 3.97Å; W704-A756 HydrophobicContact CZ3-CB 4.27Å; W704-V757 HydrophobicContact CH2-CG2 3.41Å; W704-V757 VanDerWaalsContact CH2-CG2 3.41Å; W704-V757 HydrophobicContact CZ2-CB 4.43Å; W704-V757 HydrophobicContact CZ2-CG2 3.54Å; W704-V757 HydrophobicContact CZ3-CG2 4.42Å; W704-E760 VanDerWaalsContact CD1-CG 3.45Å
705	H	84.9	Confident	75.7	Confident	141 Å²	141	59.8 Å²	59.8	65%	0.653	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-73.7	-17.7	177.9	-59.6	-40.3	0	0	0	113.1	S703 R888	S703-H705 PolarHBondContact O-N 2.84Å; S703-H705 VanDerWaalsContact O-N 3.14Å; S703-H705 WeakPolarHBondContact OG-CB 3.49Å; S703-H705 PolarHBondContact OG-N 3.04Å; H705-R888 PolarHBondContact O-NH1 3.49Å
706	D	84.4	Confident	77.4	Confident	55 Å²	55	60.5 Å²	60.5	29%	0.294	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-87.2	-13.6	175.4	-58.4	-60.3	0	0	0	112.7	V702 S703 W704	V702-D706 HydrophobicContact CG1-CB 4.02Å; S703-D706 WeakPolarHBondContact CB-OD2 3.23Å; S703-D706 PolarHBondContact N-OD2 3.03Å; S703-D706 WeakPolarHBondContact O-CB 3.41Å; S703-D706 PolarHBondContact O-N 3.27Å; S703-D706 PolarHBondContact OG-N 2.87Å; S703-D706 PolarHBondContact OG-OD2 2.81Å; W704-D706 VanDerWaalsContact C-N 3.27Å
707	V	85.8	Confident	79.1	Confident	19 Å²	19	60 Å²	60	12%	0.115	31%	0.311	C	S	.	.	S	Bend	trans	-102.4	106.1	177.7	-177.2	0	0	0	0	109.2	W704 K714 A756	W704-V707 HydrophobicContact CE3-CB 4.43Å; W704-V707 PolarHBondContact O-N 3.27Å; V707-K714 PolarHBondContact O-NZ 2.69Å; V707-A756 HydrophobicContact CG2-CB 3.76Å
708	G	82.8	Confident	80.6	Confident	12 Å²	12	59.3 Å²	59.3	12%	0.124	30%	0.303	C	S	.	.			trans	-80.5	153.9	173.4	0	0	0	0	0	113.5	V882	G708-V882 WeakPolarHBondContact O-CG2 3.46Å
709	G	83.4	Confident	82	Confident	3 Å²	3	57 Å²	57	3%	0.031	30%	0.295	C	S	.	.	S	Bend	trans	70.4	-157.3	174.1	0	0	0	0	0	115.1	Q711 K714	G709-Q711 VanDerWaalsContact C-N 3.34Å; G709-Q711 PolarHBondContact O-N 2.97Å; G709-K714 WeakPolarHBondContact O-CE 3.38Å
710	L	83.5	Confident	82.8	Confident	28 Å²	28	54.4 Å²	54.4	15%	0.147	28%	0.282	C	S	.	.			trans	54.8	34.6	170	-63	167.9	0	0	0	116.2	E712 V713 K714 V870	L710-E712 VanDerWaalsContact C-N 3.32Å; L710-E712 PolarHBondContact O-N 2.85Å; L710-V713 HydrophobicContact CB-CB 4.3Å; L710-V713 WeakPolarHBondContact O-CB 3.44Å; L710-V713 PolarHBondContact O-N 3.49Å; L710-K714 WeakPolarHBondContact O-CG 3.47Å; L710-K714 PolarHBondContact O-N 2.66Å; L710-V870 HydrophobicContact CD1-CG1 3.82Å; L710-V870 HydrophobicContact CD2-CG1 4.4Å
711	Q	84.5	Confident	83.6	Confident	119 Å²	119	53.8 Å²	53.8	56%	0.556	28%	0.278	S	S	*	.	H	α-helix	trans	-59.2	-36.3	-168.5	-164.7	64.9	28.5	0	0	114.6	G709 K715	G709-Q711 VanDerWaalsContact C-N 3.34Å; G709-Q711 PolarHBondContact O-N 2.97Å; Q711-K715 PolarHBondContact O-N 2.93Å; Q711-K715 VanDerWaalsContact O-N 3.1Å
712	E	85.4	Confident	84.1	Confident	171 Å²	171	51.6 Å²	51.6	80%	0.799	25%	0.254	S	S	*	.	H	α-helix	trans	-67.1	-48.7	178.3	-60.6	179.3	163.1	0	0	111.4	L710 K714 K715 E716	L710-E712 VanDerWaalsContact C-N 3.32Å; L710-E712 PolarHBondContact O-N 2.85Å; E712-K714 VanDerWaalsContact C-N 3.32Å; E712-K714 PolarHBondContact O-N 2.89Å; E712-K715 WeakPolarHBondContact O-CB 3.38Å; E712-K715 PolarHBondContact O-N 3.16Å; E712-K715 VanDerWaalsContact O-N 3.11Å; E712-E716 PolarHBondContact O-N 3.43Å
713	V	87	Confident	83.9	Confident	19 Å²	19	54 Å²	54	12%	0.115	27%	0.266	C	S	.	.	H	α-helix	trans	-56.9	-43.6	174.4	164.5	0	0	0	0	111.4	L710 K715 E716 I717 L753 V868 F869 V870	L710-V713 HydrophobicContact CB-CB 4.3Å; L710-V713 WeakPolarHBondContact O-CB 3.44Å; L710-V713 PolarHBondContact O-N 3.49Å; V713-K715 VanDerWaalsContact C-N 3.34Å; V713-K715 PolarHBondContact O-N 2.95Å; V713-E716 PolarHBondContact O-N 3.02Å; V713-I717 HydrophobicContact CG1-CD1 3.76Å; V713-I717 WeakPolarHBondContact O-CD1 3.42Å; V713-I717 VanDerWaalsContact O-CG1 3.27Å; V713-I717 WeakPolarHBondContact O-CG1 3.46Å; V713-I717 PolarHBondContact O-N 2.91Å; V713-I717 VanDerWaalsContact O-N 3.12Å; V713-L753 HydrophobicContact CG1-CD2 3.63Å; V713-V868 HydrophobicContact CB-CG1 4.25Å; V713-V868 HydrophobicContact CG1-CG1 3.76Å; V713-V868 HydrophobicContact CG2-CG1 3.94Å; V713-F869 WeakPolarHBondContact CG2-O 3.11Å; V713-V870 HydrophobicContact CG1-CG2 4.36Å
714	K	87.8	Confident	83.5	Confident	20 Å²	20	53.3 Å²	53.3	9%	0.087	26%	0.26	C	S	.	.	H	α-helix	trans	-59.5	-45.7	175.2	-66.3	-169.2	178.1	-173	0	111.8	W704 V707 G709 L710 E712 I717 L718	W704-K714 HydrophobicContact CD2-CD 4.4Å; W704-K714 HydrophobicContact CE3-CD 3.63Å; W704-K714 HydrophobicContact CE3-CG 4.08Å; W704-K714 HydrophobicContact CH2-CB 4.04Å; W704-K714 HydrophobicContact CH2-CD 4.28Å; W704-K714 HydrophobicContact CH2-CG 3.85Å; W704-K714 HydrophobicContact CZ3-CB 4.13Å; W704-K714 HydrophobicContact CZ3-CD 3.56Å; W704-K714 HydrophobicContact CZ3-CG 3.46Å; W704-K714 VanDerWaalsContact CZ3-CG 3.46Å; W704-K714 PolarHBondContact O-NZ 2.75Å; V707-K714 PolarHBondContact O-NZ 2.69Å; G709-K714 WeakPolarHBondContact O-CE 3.38Å; L710-K714 WeakPolarHBondContact O-CG 3.47Å; L710-K714 PolarHBondContact O-N 2.66Å; E712-K714 VanDerWaalsContact C-N 3.32Å; E712-K714 PolarHBondContact O-N 2.89Å; K714-I717 PolarHBondContact O-N 2.69Å; K714-L718 WeakPolarHBondContact O-CB 3.48Å; K714-L718 WeakPolarHBondContact O-CG 3.42Å; K714-L718 PolarHBondContact O-N 2.94Å
715	K	87.5	Confident	83	Confident	124 Å²	124	55.2 Å²	55.2	54%	0.539	27%	0.272	S	S	.	.	H	α-helix	trans	-62.8	-46.8	-179.6	-178.1	179.3	169	-177.8	0	111.4	Q711 E712 V713 I717 L718 E719	Q711-K715 PolarHBondContact O-N 2.93Å; Q711-K715 VanDerWaalsContact O-N 3.1Å; E712-K715 WeakPolarHBondContact O-CB 3.38Å; E712-K715 PolarHBondContact O-N 3.16Å; E712-K715 VanDerWaalsContact O-N 3.11Å; V713-K715 VanDerWaalsContact C-N 3.34Å; V713-K715 PolarHBondContact O-N 2.95Å; K715-I717 PolarHBondContact O-N 3.13Å; K715-L718 PolarHBondContact O-N 3.19Å; K715-E719 WeakPolarHBondContact CE-OE1 3.32Å; K715-E719 HydrophobicContact CG-CG 4.42Å; K715-E719 IonicContact NZ-OE1 3.75Å; K715-E719 WeakPolarHBondContact O-CB 3.38Å; K715-E719 WeakPolarHBondContact O-CG 3.34Å; K715-E719 PolarHBondContact O-N 3.38Å
716	E	85.9	Confident	82.5	Confident	59 Å²	59	53.7 Å²	53.7	28%	0.276	27%	0.265	S	S	.	.	H	α-helix	trans	-64.8	-37.8	180	-178.1	168.4	-150.9	0	0	112.9	E712 V713 T720 K866	E712-E716 PolarHBondContact O-N 3.43Å; V713-E716 PolarHBondContact O-N 3.02Å; E716-T720 VanDerWaalsContact O-CB 3.29Å; E716-T720 WeakPolarHBondContact O-CB 3.27Å; E716-T720 PolarHBondContact O-N 3.34Å; E716-T720 PolarHBondContact O-OG1 3.08Å; E716-K866 WeakPolarHBondContact OE1-CE 3.32Å; E716-K866 IonicContact OE1-NZ 3.71Å; E716-K866 PolarHBondContact OE1-NZ 3.3Å
717	I	86.1	Confident	81.9	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-68.8	-43.6	176.7	-62.9	163.4	0	0	0	110.8	V713 K714 K715 T720 I721 L740 L742 L753 V757	V713-I717 HydrophobicContact CG1-CD1 3.76Å; V713-I717 WeakPolarHBondContact O-CD1 3.42Å; V713-I717 VanDerWaalsContact O-CG1 3.27Å; V713-I717 WeakPolarHBondContact O-CG1 3.46Å; V713-I717 PolarHBondContact O-N 2.91Å; V713-I717 VanDerWaalsContact O-N 3.12Å; K714-I717 PolarHBondContact O-N 2.69Å; K715-I717 PolarHBondContact O-N 3.13Å; I717-T720 PolarHBondContact O-N 2.95Å; I717-T720 VanDerWaalsContact O-N 3.16Å; I717-I721 HydrophobicContact CG2-CD1 3.79Å; I717-I721 PolarHBondContact O-N 3.18Å; I717-I721 VanDerWaalsContact O-N 3.07Å; I717-L740 HydrophobicContact CB-CD1 4.45Å; I717-L740 HydrophobicContact CG1-CD1 3.88Å; I717-L740 HydrophobicContact CG1-CD2 4.19Å; I717-L742 HydrophobicContact CD1-CD2 3.87Å; I717-L753 HydrophobicContact CD1-CD1 4.14Å; I717-L753 HydrophobicContact CD1-CD2 3.68Å; I717-L753 HydrophobicContact CD1-CG 3.93Å; I717-V757 HydrophobicContact CB-CG2 4.5Å; I717-V757 HydrophobicContact CG2-CB 4.37Å; I717-V757 HydrophobicContact CG2-CG1 3.85Å; I717-V757 HydrophobicContact CG2-CG2 3.58Å
718	L	83.9	Confident	81.2	Confident	39 Å²	39	58.3 Å²	58.3	20%	0.204	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-49.6	175	-74.4	169.6	0	0	0	111.3	W704 K714 K715 T720 I721 Q722	W704-L718 HydrophobicContact CZ2-CD1 4.06Å; W704-L718 HydrophobicContact CZ2-CD2 3.93Å; W704-L718 HydrophobicContact CZ2-CG 3.86Å; K714-L718 WeakPolarHBondContact O-CB 3.48Å; K714-L718 WeakPolarHBondContact O-CG 3.42Å; K714-L718 PolarHBondContact O-N 2.94Å; K715-L718 PolarHBondContact O-N 3.19Å; L718-T720 PolarHBondContact O-N 2.96Å; L718-T720 VanDerWaalsContact O-N 3.11Å; L718-I721 PolarHBondContact O-N 2.89Å; L718-Q722 WeakPolarHBondContact O-CA 3.46Å; L718-Q722 WeakPolarHBondContact O-CB 3.45Å; L718-Q722 PolarHBondContact O-N 3.17Å
719	E	82	Confident	80.5	Confident	99 Å²	99	65.6 Å²	65.6	46%	0.463	32%	0.32	S	S	.	.	H	α-helix	trans	-60.7	-22.1	175.4	-73.5	178.3	177.4	0	0	113.5	K715 L723	K715-E719 WeakPolarHBondContact CE-OE1 3.32Å; K715-E719 HydrophobicContact CG-CG 4.42Å; K715-E719 IonicContact NZ-OE1 3.75Å; K715-E719 WeakPolarHBondContact O-CB 3.38Å; K715-E719 WeakPolarHBondContact O-CG 3.34Å; K715-E719 PolarHBondContact O-N 3.38Å; E719-L723 WeakPolarHBondContact O-CB 3.41Å
720	T	80.6	Confident	79.6	Confident	8 Å²	8	68.9 Å²	68.9	5%	0.049	34%	0.337	C	S	.	.	H	α-helix	trans	-84.4	-31.9	177.9	-63.8	0	0	0	0	113.2	E716 I717 L718 P724 R737 L740	E716-T720 VanDerWaalsContact O-CB 3.29Å; E716-T720 WeakPolarHBondContact O-CB 3.27Å; E716-T720 PolarHBondContact O-N 3.34Å; E716-T720 PolarHBondContact O-OG1 3.08Å; I717-T720 PolarHBondContact O-N 2.95Å; I717-T720 VanDerWaalsContact O-N 3.16Å; L718-T720 PolarHBondContact O-N 2.96Å; L718-T720 VanDerWaalsContact O-N 3.11Å; T720-P724 WeakPolarHBondContact O-CD 3.31Å; T720-P724 WeakPolarHBondContact O-CG 3.36Å; T720-R737 PolarHBondContact OG1-NH1 3.19Å; T720-L740 HydrophobicContact CG2-CD1 4.07Å
721	I	80.4	Confident	78.6	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.015	34%	0.335	C	S	.	.	H	α-helix	trans	-106.1	-39	-174.2	-64.9	166.5	0	0	0	112	I717 L718 P724 L725 V757 C761 L763 I799 I845	I717-I721 HydrophobicContact CG2-CD1 3.79Å; I717-I721 PolarHBondContact O-N 3.18Å; I717-I721 VanDerWaalsContact O-N 3.07Å; L718-I721 PolarHBondContact O-N 2.89Å; I721-P724 WeakPolarHBondContact O-CD 3.49Å; I721-P724 WeakPolarHBondContact O-CG 3.24Å; I721-L725 HydrophobicContact CG2-CD1 4.1Å; I721-L725 VanDerWaalsContact O-CD1 3.25Å; I721-L725 WeakPolarHBondContact O-CD1 3.31Å; I721-L725 VanDerWaalsContact O-CG 3.25Å; I721-L725 WeakPolarHBondContact O-CG 3.32Å; I721-V757 HydrophobicContact CD1-CG1 3.51Å; I721-C761 HydrophobicContact CG2-CB 4.47Å; I721-L763 HydrophobicContact CG2-CD1 4.19Å; I721-I799 HydrophobicContact CD1-CD1 4.43Å; I721-I845 HydrophobicContact CD1-CD1 3.96Å
722	Q	80	Confident	77.5	Confident	77 Å²	77	67.2 Å²	67.2	36%	0.36	34%	0.339	S	S	.	.	H	α-helix	trans	-74.4	-43.2	-178.4	-172.1	174.3	-7	0	0	112.2	L718 L725 E726	L718-Q722 WeakPolarHBondContact O-CA 3.46Å; L718-Q722 WeakPolarHBondContact O-CB 3.45Å; L718-Q722 PolarHBondContact O-N 3.17Å; Q722-L725 WeakPolarHBondContact O-CB 3.5Å; Q722-L725 PolarHBondContact O-N 3.2Å; Q722-L725 VanDerWaalsContact O-N 3.1Å; Q722-E726 HydrophobicContact CG-CG 4.11Å; Q722-E726 WeakPolarHBondContact CG-OE1 3.38Å; Q722-E726 PolarHBondContact NE2-OE1 3.35Å; Q722-E726 PolarHBondContact O-N 3.15Å
723	L	77.3	Confident	76.2	Confident	77 Å²	77	65.5 Å²	65.5	40%	0.403	34%	0.335	S	S	.	.	H	α-helix	trans	-54.6	-47.6	179.5	-171.3	75.2	0	0	0	113.9	E719 L725 E726 H727	E719-L723 WeakPolarHBondContact O-CB 3.41Å; L723-L725 VanDerWaalsContact C-N 3.34Å; L723-L725 PolarHBondContact O-N 3.36Å; L723-E726 PolarHBondContact O-N 3.15Å; L723-H727 PolarHBondContact O-N 2.88Å
724	P	75.6	Confident	74.8	Confident	20 Å²	20	67.3 Å²	67.3	13%	0.13	36%	0.357	C	S	.	.	H	α-helix	trans	-70.4	-25.6	176.9	28	-36.5	0	0	0	114	T720 I721 L731 F843	T720-P724 WeakPolarHBondContact O-CD 3.31Å; T720-P724 WeakPolarHBondContact O-CG 3.36Å; I721-P724 WeakPolarHBondContact O-CD 3.49Å; I721-P724 WeakPolarHBondContact O-CG 3.24Å; P724-L731 HydrophobicContact CB-CD1 4.03Å; P724-L731 HydrophobicContact CB-CD2 3.7Å; P724-L731 HydrophobicContact CB-CG 4.07Å; P724-F843 HydrophobicContact CB-CE1 4.4Å; P724-F843 HydrophobicContact CB-CZ 4.31Å; P724-F843 HydrophobicContact CG-CE1 3.68Å; P724-F843 HydrophobicContact CG-CZ 3.79Å
725	L	73.6	Confident	73.2	Confident	65 Å²	65	71.9 Å²	71.9	34%	0.34	38%	0.382	S	S	.	.	H	α-helix	trans	-74.1	-38.2	174.4	-67.9	167.7	0	0	0	112.3	I721 Q722 L723 C761 L763 F843	I721-L725 HydrophobicContact CG2-CD1 4.1Å; I721-L725 VanDerWaalsContact O-CD1 3.25Å; I721-L725 WeakPolarHBondContact O-CD1 3.31Å; I721-L725 VanDerWaalsContact O-CG 3.25Å; I721-L725 WeakPolarHBondContact O-CG 3.32Å; Q722-L725 WeakPolarHBondContact O-CB 3.5Å; Q722-L725 PolarHBondContact O-N 3.2Å; Q722-L725 VanDerWaalsContact O-N 3.1Å; L723-L725 VanDerWaalsContact C-N 3.34Å; L723-L725 PolarHBondContact O-N 3.36Å; L725-C761 HydrophobicContact CD1-CB 4.39Å; L725-L763 HydrophobicContact CD1-CD1 4.07Å; L725-L763 HydrophobicContact CD1-CD2 4.42Å; L725-L763 HydrophobicContact CD1-CG 4.48Å; L725-L763 HydrophobicContact CD2-CD2 4.45Å; L725-F843 HydrophobicContact CD2-CE2 3.97Å; L725-F843 HydrophobicContact CD2-CZ 4.37Å; L725-F843 HydrophobicContact CG-CE2 4.25Å; L725-F843 HydrophobicContact CG-CZ 4.32Å
726	E	74.3	Confident	71.8	Confident	109 Å²	109	71.5 Å²	71.5	51%	0.509	38%	0.377	S	S	.	.	H	α-helix	trans	-78.5	-31.9	179	-70.5	-179.6	166.8	0	0	112.6	Q722 L723	Q722-E726 HydrophobicContact CG-CG 4.11Å; Q722-E726 WeakPolarHBondContact CG-OE1 3.38Å; Q722-E726 PolarHBondContact NE2-OE1 3.35Å; Q722-E726 PolarHBondContact O-N 3.15Å; L723-E726 PolarHBondContact O-N 3.15Å
727	H	73.3	Confident	70.6	Confident	98 Å²	98	73.4 Å²	73.4	45%	0.454	38%	0.382	S	S	.	.			trans	-130.1	68.6	-175.9	-63.6	-47.6	0	0	0	112.7	L723 E729 L730	L723-H727 PolarHBondContact O-N 2.88Å; H727-E729 PolarHBondContact O-N 3.49Å; H727-E729 VanDerWaalsContact O-N 3.14Å; H727-L730 HydrophobicContact CB-CB 4.44Å; H727-L730 HydrophobicContact CB-CD1 3.68Å; H727-L730 HydrophobicContact CB-CG 3.92Å; H727-L730 WeakPolarHBondContact O-CB 3.28Å; H727-L730 PolarHBondContact O-N 2.72Å
728	P	69.5	Low	69.5	Low	72 Å²	72	74.2 Å²	74.2	47%	0.468	39%	0.387	S	S	.	.	H	α-helix	trans	-61	-23.8	178.3	25.4	-35.1	0	0	0	113	L730 L731	P728-L730 VanDerWaalsContact C-N 3.25Å; P728-L730 PolarHBondContact O-N 2.84Å; P728-L731 WeakPolarHBondContact O-CB 3.44Å; P728-L731 PolarHBondContact O-N 2.96Å; P728-L731 VanDerWaalsContact O-N 3.16Å
729	E	69	Low	69.3	Low	165 Å²	165	72.8 Å²	72.8	77%	0.771	38%	0.382	S	S	*	.	H	α-helix	trans	-60	-33.6	173.3	-63.7	-178.2	-173	0	0	112.5	H727 L731 S732	H727-E729 PolarHBondContact O-N 3.49Å; H727-E729 VanDerWaalsContact O-N 3.14Å; E729-L731 VanDerWaalsContact C-N 3.29Å; E729-L731 PolarHBondContact O-N 2.82Å; E729-S732 WeakPolarHBondContact O-CB 3.36Å; E729-S732 PolarHBondContact O-N 2.84Å; E729-S732 PolarHBondContact O-OG 3.42Å
730	L	64.4	Low	69.7	Low	72 Å²	72	68.2 Å²	68.2	38%	0.377	36%	0.361	S	S	.	.	H	α-helix	trans	-71.6	-23.1	178.6	-62	177.9	0	0	0	112.7	H727 P728 S732 L733	H727-L730 HydrophobicContact CB-CB 4.44Å; H727-L730 HydrophobicContact CB-CD1 3.68Å; H727-L730 HydrophobicContact CB-CG 3.92Å; H727-L730 WeakPolarHBondContact O-CB 3.28Å; H727-L730 PolarHBondContact O-N 2.72Å; P728-L730 VanDerWaalsContact C-N 3.25Å; P728-L730 PolarHBondContact O-N 2.84Å; L730-S732 PolarHBondContact O-N 3.27Å; L730-L733 HydrophobicContact CD2-CD1 4.05Å; L730-L733 PolarHBondContact O-N 2.77Å
731	L	62.9	Low	70.1	Confident	21 Å²	21	67.9 Å²	67.9	11%	0.11	36%	0.359	C	S	.	.	H	α-helix	trans	-67.6	-24.2	172.4	-64.3	172.1	0	0	0	112.5	P724 P728 E729 L733 G734 L735 R736	P724-L731 HydrophobicContact CB-CD1 4.03Å; P724-L731 HydrophobicContact CB-CD2 3.7Å; P724-L731 HydrophobicContact CB-CG 4.07Å; P728-L731 WeakPolarHBondContact O-CB 3.44Å; P728-L731 PolarHBondContact O-N 2.96Å; P728-L731 VanDerWaalsContact O-N 3.16Å; E729-L731 VanDerWaalsContact C-N 3.29Å; E729-L731 PolarHBondContact O-N 2.82Å; L731-L733 VanDerWaalsContact C-N 3.29Å; L731-G734 PolarHBondContact O-N 3.19Å; L731-L735 WeakPolarHBondContact CD2-O 3.28Å; L731-R736 PolarHBondContact O-NE 3.37Å
732	S	60.3	Low	70.7	Confident	92 Å²	92	67.8 Å²	67.8	64%	0.643	36%	0.359	S	S	*	.	H	α-helix	trans	-71.2	-25.7	176.3	78.6	0	0	0	0	112.6	E729 L730 G734	E729-S732 WeakPolarHBondContact O-CB 3.36Å; E729-S732 PolarHBondContact O-N 2.84Å; E729-S732 PolarHBondContact O-OG 3.42Å; L730-S732 PolarHBondContact O-N 3.27Å; S732-G734 PolarHBondContact O-N 3.39Å
733	L	59.4	Low	71.2	Confident	135 Å²	135	64.4 Å²	64.4	71%	0.707	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	7.8	176.9	-62.5	172	0	0	0	113.6	L730 L731	L730-L733 HydrophobicContact CD2-CD1 4.05Å; L730-L733 PolarHBondContact O-N 2.77Å; L731-L733 VanDerWaalsContact C-N 3.29Å
734	G	56.2	Low	71.9	Confident	57 Å²	57	60.7 Å²	60.7	59%	0.588	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	1.9	176	0	0	0	0	0	115.4	L731 S732 R736	L731-G734 PolarHBondContact O-N 3.19Å; S732-G734 PolarHBondContact O-N 3.39Å; G734-R736 PolarHBondContact O-N 3.27Å
735	L	55.9	Low	72.6	Confident	115 Å²	115	59.8 Å²	59.8	60%	0.602	32%	0.317	S	S	*	.			trans	-76.6	51.2	173.2	-73.4	167.7	0	0	0	112.3	L731	L731-L735 WeakPolarHBondContact CD2-O 3.28Å
736	R	57.4	Low	73.2	Confident	116 Å²	116	59.6 Å²	59.6	44%	0.438	32%	0.32	S	S	.	.			trans	-84.6	119.4	174.9	-59.3	-174	-171.5	179.1	6.9	108.8	L731 G734 H837	L731-R736 PolarHBondContact O-NE 3.37Å; G734-R736 PolarHBondContact O-N 3.27Å; R736-H837 PolarHBondContact NH1-O 3.36Å
737	R	59.5	Low	73.8	Confident	99 Å²	99	55.7 Å²	55.7	37%	0.374	31%	0.309	S	S	.	.			trans	-103.8	113.3	174.7	-62.8	-174.8	-175.3	178.9	9.7	108	T720 D865	T720-R737 PolarHBondContact OG1-NH1 3.19Å; R737-D865 WeakPolarHBondContact CA-OD2 3.19Å
738	S	62.9	Low	74.5	Confident	19 Å²	19	51.8 Å²	51.8	13%	0.133	29%	0.292	C	S	.	.			trans	-86.8	-20.5	-168	-61.9	0	0	0	0	114	H837 G862 R863 D865	S738-H837 PolarHBondContact OG-CE1 2.88Å; S738-H837 PolarHBondContact OG-NE2 2.94Å; S738-G862 WeakPolarHBondContact CB-O 3.34Å; S738-G862 PolarHBondContact OG-O 3.43Å; S738-R863 CarbonylContact C-O 3.6Å; S738-R863 WeakPolarHBondContact CB-O 3.33Å; S738-D865 PolarHBondContact N-OD2 3.42Å
739	G	80.9	Confident	75.3	Confident	9 Å²	9	49.5 Å²	49.5	9%	0.093	28%	0.282	C	S	.	.			trans	-179.5	159	-179.6	0	0	0	0	0	115.7	V844 R863 F864 D865 K866	G739-V844 CarbonylContact C-O 3.58Å; G739-V844 WeakPolarHBondContact CA-O 3.46Å; G739-R863 WeakPolarHBondContact CA-O 3.42Å; G739-R863 PolarHBondContact N-O 3.26Å; G739-F864 CarbonylContact O-C 3.56Å; G739-D865 PolarHBondContact O-N 2.86Å; G739-D865 VanDerWaalsContact O-N 3.12Å; G739-K866 PolarHBondContact O-N 3.22Å
740	L	89.1	Confident	76.3	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.021	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.2	-177.8	-173.7	144	0	0	0	110.7	I717 T720 L742 V844 I845 G846 K866 V868	I717-L740 HydrophobicContact CB-CD1 4.45Å; I717-L740 HydrophobicContact CG1-CD1 3.88Å; I717-L740 HydrophobicContact CG1-CD2 4.19Å; T720-L740 HydrophobicContact CG2-CD1 4.07Å; L740-L742 HydrophobicContact CD2-CD2 3.51Å; L740-L742 HydrophobicContact CD2-CG 3.85Å; L740-V844 PolarHBondContact N-O 3.26Å; L740-I845 HydrophobicContact CD2-CG2 4.28Å; L740-I845 CarbonylContact O-C 3.56Å; L740-I845 VanDerWaalsContact O-CA 3.28Å; L740-I845 WeakPolarHBondContact O-CA 3.41Å; L740-G846 PolarHBondContact O-N 2.84Å; L740-K866 CarbonylContact C-O 3.45Å; L740-K866 WeakPolarHBondContact CA-O 3.19Å; L740-K866 HydrophobicContact CD1-CB 4.31Å; L740-K866 HydrophobicContact CG-CB 4.31Å; L740-V868 HydrophobicContact CD1-CG2 3.95Å; L740-V868 HydrophobicContact CD2-CB 4.42Å; L740-V868 HydrophobicContact CD2-CG2 4.17Å; L740-V868 HydrophobicContact CG-CG2 4.01Å
741	L	90.9	Very high	77.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	110.1	-179.2	-175.6	60.6	0	0	0	111	L805 T848 L854 L859 F864 K866 L867 V868	L741-L805 HydrophobicContact CD1-CD2 3.86Å; L741-T848 HydrophobicContact CD1-CG2 4.05Å; L741-T848 HydrophobicContact CD2-CG2 4.47Å; L741-T848 HydrophobicContact CG-CG2 4.37Å; L741-L854 HydrophobicContact CD2-CD2 4.1Å; L741-L859 HydrophobicContact CD2-CD2 3.59Å; L741-F864 HydrophobicContact CB-CB 4Å; L741-F864 HydrophobicContact CB-CD1 3.92Å; L741-F864 HydrophobicContact CB-CG 4.03Å; L741-K866 PolarHBondContact N-O 3.24Å; L741-L867 HydrophobicContact CB-CD2 4.26Å; L741-L867 HydrophobicContact CD2-CD2 3.86Å; L741-L867 HydrophobicContact CG-CD2 4.33Å; L741-V868 PolarHBondContact O-N 3.01Å
742	L	92.4	Very high	78.7	Confident	2 Å²	2	44 Å²	44	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	116.5	172.3	-59.3	176.6	0	0	0	109.7	I717 L740 K750 L753 A754 I845 G846 A847 T848 V868 V870	I717-L742 HydrophobicContact CD1-CD2 3.87Å; L740-L742 HydrophobicContact CD2-CD2 3.51Å; L740-L742 HydrophobicContact CD2-CG 3.85Å; L742-K750 HydrophobicContact CB-CB 4.41Å; L742-K750 HydrophobicContact CB-CD 4.19Å; L742-K750 HydrophobicContact CB-CG 4.34Å; L742-K750 HydrophobicContact CD1-CB 4.41Å; L742-L753 HydrophobicContact CD1-CD2 4.36Å; L742-L753 HydrophobicContact CD2-CD2 4.08Å; L742-A754 HydrophobicContact CD1-CB 4.33Å; L742-I845 HydrophobicContact CD1-CG2 3.88Å; L742-I845 HydrophobicContact CG-CG2 4.06Å; L742-G846 PolarHBondContact N-O 2.83Å; L742-A847 HydrophobicContact CB-CB 4.45Å; L742-A847 WeakPolarHBondContact O-CA 3.37Å; L742-T848 PolarHBondContact O-N 3.04Å; L742-V868 HydrophobicContact CD2-CB 4.16Å; L742-V868 HydrophobicContact CD2-CG1 4.24Å; L742-V870 HydrophobicContact CB-CG2 4.33Å; L742-V870 HydrophobicContact CD2-CG2 3.95Å
743	H	91.3	Very high	80.1	Confident	5 Å²	5	39.8 Å²	39.8	2%	0.023	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	149.3	176.8	74.3	99.6	0	0	0	112.4	T848 P851 V868 F869 V870	H743-T848 WeakPolarHBondContact CA-O 3.41Å; H743-T848 HydrophobicContact CB-CG2 3.86Å; H743-P851 HydrophobicContact CB-CB 4.2Å; H743-P851 HydrophobicContact CB-CG 4.06Å; H743-V868 PolarHBondContact CD2-O 3.22Å; H743-V868 PolarHBondContact N-O 3.45Å; H743-F869 AromaticContact CE1-CD2 3.61Å; H743-F869 AromaticContact ND1-CD2 3.79Å; H743-F869 CarbonylContact O-C 3.59Å; H743-F869 WeakPolarHBondContact O-CA 3.27Å; H743-F869 WeakPolarHBondContact O-CD2 3.45Å; H743-V870 PolarHBondContact O-N 2.97Å
744	G	90.8	Very high	81.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	156.9	179.4	179.5	0	0	0	0	0	112.4	K750	G744-K750 PolarHBondContact O-NZ 3.49Å
745	P	89.6	Confident	82.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.			trans	-58.2	156.5	179.1	18.5	-26.1	0	0	0	113.2	T748 K750 V962 L967 Y970	P745-T748 HydrophobicContact CB-CG2 4.47Å; P745-T748 HydrophobicContact CG-CG2 3.78Å; P745-T748 PolarHBondContact O-OG1 2.8Å; P745-T748 VanDerWaalsContact O-OG1 3.14Å; P745-K750 PolarHBondContact O-NZ 3.35Å; P745-V962 HydrophobicContact CB-CG1 4.29Å; P745-V962 HydrophobicContact CB-CG2 4.16Å; P745-L967 HydrophobicContact CG-CD2 4.36Å; P745-Y970 HydrophobicContact CB-CD2 3.94Å; P745-Y970 HydrophobicContact CB-CE2 3.64Å; P745-Y970 HydrophobicContact CG-CD2 4.19Å; P745-Y970 HydrophobicContact CG-CE2 4.37Å
746	P	88.3	Confident	84.4	Confident	61 Å²	61	28.1 Å²	28.1	40%	0.396	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	158.7	171.4	28.5	-35.2	0	0	0	110.7	T748	P746-T748 VanDerWaalsContact C-N 3.27Å; P746-T748 PolarHBondContact O-N 2.6Å
747	G	85.7	Confident	85.8	Confident	28 Å²	28	22.6 Å²	22.6	29%	0.289	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	76	-2.1	176.6	0	0	0	0	0	116.8	G749 G911 A912	G747-G749 VanDerWaalsContact C-N 3.28Å; G747-G749 PolarHBondContact O-N 3.28Å; G747-G911 PolarHBondContact O-N 2.71Å; G747-G911 VanDerWaalsContact O-N 3.16Å; G747-A912 PolarHBondContact O-N 2.85Å
748	T	87.2	Confident	87	Confident	15 Å²	15	17.9 Å²	17.9	9%	0.092	11%	0.113	C	C	.	.	S	Bend	trans	-81.3	1.8	176.9	61.3	0	0	0	0	115.1	P745 P746 V870	P745-T748 HydrophobicContact CB-CG2 4.47Å; P745-T748 HydrophobicContact CG-CG2 3.78Å; P745-T748 PolarHBondContact O-OG1 2.8Å; P745-T748 VanDerWaalsContact O-OG1 3.14Å; P746-T748 VanDerWaalsContact C-N 3.27Å; P746-T748 PolarHBondContact O-N 2.6Å; T748-V870 WeakPolarHBondContact CB-O 3.45Å; T748-V870 PolarHBondContact OG1-O 3.48Å
749	G	86.4	Confident	87.9	Confident	24 Å²	24	18.9 Å²	18.9	25%	0.247	12%	0.118	C	C	.	.			trans	84	20.8	172.3	0	0	0	0	0	116.1	G747 T751 L752 L753	G747-G749 VanDerWaalsContact C-N 3.28Å; G747-G749 PolarHBondContact O-N 3.28Å; G749-T751 VanDerWaalsContact C-N 3.3Å; G749-T751 PolarHBondContact O-N 2.9Å; G749-L752 WeakPolarHBondContact O-CA 3.07Å; G749-L752 WeakPolarHBondContact O-CB 3.41Å; G749-L752 PolarHBondContact O-N 3.09Å; G749-L753 PolarHBondContact O-N 2.83Å
750	K	90.4	Very high	88	Confident	12 Å²	12	23.7 Å²	23.7	5%	0.052	14%	0.138	C	C	.	.	H	α-helix	trans	-46.5	-48	177	-63.7	-174.6	-71	-86.1	0	113.5	L742 G744 P745 L752 L753 A754 A847 T848 N849 V870	L742-K750 HydrophobicContact CB-CB 4.41Å; L742-K750 HydrophobicContact CB-CD 4.19Å; L742-K750 HydrophobicContact CB-CG 4.34Å; L742-K750 HydrophobicContact CD1-CB 4.41Å; G744-K750 PolarHBondContact O-NZ 3.49Å; P745-K750 PolarHBondContact O-NZ 3.35Å; K750-L752 VanDerWaalsContact C-N 3.35Å; K750-L752 PolarHBondContact O-N 3.03Å; K750-L753 WeakPolarHBondContact O-CB 3.46Å; K750-L753 PolarHBondContact O-N 2.72Å; K750-A754 PolarHBondContact O-N 2.89Å; K750-A754 VanDerWaalsContact O-N 3.1Å; K750-A847 HydrophobicContact CB-CB 4.35Å; K750-T848 VanDerWaalsContact CE-O 3.31Å; K750-T848 WeakPolarHBondContact CE-O 3.32Å; K750-N849 WeakPolarHBondContact CE-OD1 3.45Å; K750-N849 PolarHBondContact NZ-OD1 3.27Å; K750-V870 HydrophobicContact CD-CB 4.48Å; K750-V870 HydrophobicContact CG-CB 3.94Å; K750-V870 HydrophobicContact CG-CG1 4.17Å; K750-V870 HydrophobicContact CG-CG2 4.13Å
751	T	88.8	Confident	87.4	Confident	42 Å²	42	24.8 Å²	24.8	26%	0.258	15%	0.146	S	C	.	.	H	α-helix	trans	-67	-29.6	176.8	-41.8	0	0	0	0	113.6	G749 K755 F801 D803	G749-T751 VanDerWaalsContact C-N 3.3Å; G749-T751 PolarHBondContact O-N 2.9Å; T751-K755 WeakPolarHBondContact O-CD 3.08Å; T751-K755 VanDerWaalsContact O-CG 3.24Å; T751-K755 WeakPolarHBondContact O-CG 3.24Å; T751-K755 PolarHBondContact O-N 3.38Å; T751-F801 HydrophobicContact CG2-CE1 3.84Å; T751-F801 HydrophobicContact CG2-CZ 4.28Å; T751-D803 VanDerWaalsContact CG2-OD2 3.26Å; T751-D803 WeakPolarHBondContact CG2-OD2 3.5Å; T751-D803 PolarHBondContact OG1-OD2 3.37Å
752	L	88.5	Confident	86.7	Confident	90 Å²	90	29.4 Å²	29.4	47%	0.471	18%	0.178	S	C	.	.	H	α-helix	trans	-76.7	-37.5	175.1	-67	174.2	0	0	0	111.4	G749 K750 K755 A756	G749-L752 WeakPolarHBondContact O-CA 3.07Å; G749-L752 WeakPolarHBondContact O-CB 3.41Å; G749-L752 PolarHBondContact O-N 3.09Å; K750-L752 VanDerWaalsContact C-N 3.35Å; K750-L752 PolarHBondContact O-N 3.03Å; L752-K755 PolarHBondContact O-N 3.02Å; L752-A756 PolarHBondContact O-N 3.14Å
753	L	89.6	Confident	86	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-61.3	-51.6	176.5	176.9	60.7	0	0	0	111.1	W704 V713 I717 L742 G749 K750 K755 A756 V757 V870	W704-L753 HydrophobicContact CH2-CD1 3.68Å; W704-L753 HydrophobicContact CZ3-CD1 3.47Å; W704-L753 VanDerWaalsContact CZ3-CD1 3.47Å; V713-L753 HydrophobicContact CG1-CD2 3.63Å; I717-L753 HydrophobicContact CD1-CD1 4.14Å; I717-L753 HydrophobicContact CD1-CD2 3.68Å; I717-L753 HydrophobicContact CD1-CG 3.93Å; L742-L753 HydrophobicContact CD1-CD2 4.36Å; L742-L753 HydrophobicContact CD2-CD2 4.08Å; G749-L753 PolarHBondContact O-N 2.83Å; K750-L753 WeakPolarHBondContact O-CB 3.46Å; K750-L753 PolarHBondContact O-N 2.72Å; L753-K755 VanDerWaalsContact C-N 3.26Å; L753-K755 PolarHBondContact O-N 2.86Å; L753-A756 PolarHBondContact O-N 2.99Å; L753-V757 WeakPolarHBondContact O-CG2 3.35Å; L753-V757 PolarHBondContact O-N 3.29Å; L753-V870 HydrophobicContact CD2-CG2 4.06Å
754	A	87.7	Confident	85.4	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-60.2	-35.6	176.7	0	0	0	0	0	112.8	L742 K750 A758 F765 F801 I845	L742-A754 HydrophobicContact CD1-CB 4.33Å; K750-A754 PolarHBondContact O-N 2.89Å; K750-A754 VanDerWaalsContact O-N 3.1Å; A754-A758 PolarHBondContact O-N 2.85Å; A754-F765 HydrophobicContact CB-CE2 4.29Å; A754-F801 HydrophobicContact CB-CD2 3.33Å; A754-F801 HydrophobicContact CB-CE2 3.37Å; A754-F801 HydrophobicContact CB-CG 4.07Å; A754-F801 HydrophobicContact CB-CZ 4.13Å; A754-I845 HydrophobicContact CB-CG2 4.29Å
755	K	87.4	Confident	85.1	Confident	62 Å²	62	32.1 Å²	32.1	27%	0.27	19%	0.194	S	C	.	.	H	α-helix	trans	-66	-48.1	174.5	-76.5	173.4	-177.2	176.6	0	112.1	P700 V702 T751 L752 L753 V757 A758 T759 F765	P700-K755 HydrophobicContact CB-CB 3.77Å; P700-K755 HydrophobicContact CB-CD 4.19Å; P700-K755 HydrophobicContact CB-CG 3.85Å; P700-K755 HydrophobicContact CG-CB 3.68Å; P700-K755 HydrophobicContact CG-CG 3.91Å; P700-K755 VanDerWaalsContact CG-O 3.28Å; P700-K755 WeakPolarHBondContact CG-O 3.37Å; V702-K755 HydrophobicContact CB-CB 4.34Å; V702-K755 HydrophobicContact CG2-CB 4.41Å; T751-K755 WeakPolarHBondContact O-CD 3.08Å; T751-K755 VanDerWaalsContact O-CG 3.24Å; T751-K755 WeakPolarHBondContact O-CG 3.24Å; T751-K755 PolarHBondContact O-N 3.38Å; L752-K755 PolarHBondContact O-N 3.02Å; L753-K755 VanDerWaalsContact C-N 3.26Å; L753-K755 PolarHBondContact O-N 2.86Å; K755-V757 VanDerWaalsContact C-N 3.3Å; K755-V757 PolarHBondContact O-N 2.88Å; K755-A758 PolarHBondContact O-N 3.29Å; K755-T759 PolarHBondContact O-N 3.26Å; K755-T759 PolarHBondContact O-OG1 2.82Å; K755-F765 HydrophobicContact CD-CE1 4.38Å; K755-F765 HydrophobicContact CG-CD1 4.35Å; K755-F765 HydrophobicContact CG-CE1 3.6Å; K755-F765 HydrophobicContact CG-CE2 4.38Å; K755-F765 HydrophobicContact CG-CZ 3.62Å
756	A	87.7	Confident	84.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.5	-39.7	178.1	0	0	0	0	0	112.9	V702 W704 V707 L752 L753 T759 E760	V702-A756 HydrophobicContact CG1-CB 4.27Å; V702-A756 WeakPolarHBondContact O-CA 3.49Å; W704-A756 HydrophobicContact CD2-CB 4.31Å; W704-A756 HydrophobicContact CE3-CB 3.97Å; W704-A756 HydrophobicContact CZ3-CB 4.27Å; V707-A756 HydrophobicContact CG2-CB 3.76Å; L752-A756 PolarHBondContact O-N 3.14Å; L753-A756 PolarHBondContact O-N 2.99Å; A756-T759 PolarHBondContact O-N 3.04Å; A756-E760 PolarHBondContact O-N 2.72Å
757	V	87.1	Confident	84.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.7	-45.3	176.2	170.3	0	0	0	0	111.6	W704 I717 I721 L753 K755 E760 C761 I799	W704-V757 HydrophobicContact CH2-CG2 3.41Å; W704-V757 VanDerWaalsContact CH2-CG2 3.41Å; W704-V757 HydrophobicContact CZ2-CB 4.43Å; W704-V757 HydrophobicContact CZ2-CG2 3.54Å; W704-V757 HydrophobicContact CZ3-CG2 4.42Å; I717-V757 HydrophobicContact CB-CG2 4.5Å; I717-V757 HydrophobicContact CG2-CB 4.37Å; I717-V757 HydrophobicContact CG2-CG1 3.85Å; I717-V757 HydrophobicContact CG2-CG2 3.58Å; I721-V757 HydrophobicContact CD1-CG1 3.51Å; L753-V757 WeakPolarHBondContact O-CG2 3.35Å; L753-V757 PolarHBondContact O-N 3.29Å; K755-V757 VanDerWaalsContact C-N 3.3Å; K755-V757 PolarHBondContact O-N 2.88Å; V757-E760 PolarHBondContact O-N 3.31Å; V757-C761 WeakPolarHBondContact O-CB 3.45Å; V757-C761 PolarHBondContact O-N 3.28Å; V757-C761 PolarHBondContact O-SG 2.89Å; V757-I799 HydrophobicContact CG1-CD1 4.2Å
758	A	84.3	Confident	84.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.1	-40.1	179.9	0	0	0	0	0	112.6	P700 A754 K755 S762 L763 F765 I799	P700-A758 HydrophobicContact CG-CB 4.47Å; A754-A758 PolarHBondContact O-N 2.85Å; K755-A758 PolarHBondContact O-N 3.29Å; A758-S762 PolarHBondContact O-N 3.47Å; A758-S762 VanDerWaalsContact O-N 3.12Å; A758-L763 PolarHBondContact O-N 3.01Å; A758-F765 HydrophobicContact CB-CB 3.85Å; A758-F765 HydrophobicContact CB-CD2 3.54Å; A758-F765 HydrophobicContact CB-CE2 4.41Å; A758-F765 HydrophobicContact CB-CG 3.99Å; A758-I799 HydrophobicContact CB-CD1 4Å
759	T	82.8	Confident	84.7	Confident	39 Å²	39	34.4 Å²	34.4	24%	0.239	20%	0.195	C	C	.	.	H	α-helix	trans	-61.6	-47.8	175.3	-41.7	0	0	0	0	111.7	P700 V702 K755 A756 S762	P700-T759 PolarHBondContact O-OG1 3.11Å; V702-T759 WeakPolarHBondContact O-CB 3.38Å; V702-T759 PolarHBondContact O-OG1 2.73Å; K755-T759 PolarHBondContact O-N 3.26Å; K755-T759 PolarHBondContact O-OG1 2.82Å; A756-T759 PolarHBondContact O-N 3.04Å; T759-S762 PolarHBondContact O-N 2.92Å; T759-S762 VanDerWaalsContact O-N 3.12Å
760	E	82.9	Confident	84.4	Confident	110 Å²	110	33.3 Å²	33.3	51%	0.514	18%	0.183	S	C	.	.	H	α-helix	trans	-65.4	-44.9	-177.3	-163	79.3	164	0	0	111.5	W704 A756 V757 S762	W704-E760 VanDerWaalsContact CD1-CG 3.45Å; A756-E760 PolarHBondContact O-N 2.72Å; V757-E760 PolarHBondContact O-N 3.31Å; E760-S762 PolarHBondContact O-N 2.98Å
761	C	76.5	Confident	83.8	Confident	27 Å²	27	36.2 Å²	36.2	18%	0.182	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-3.1	177.5	-54.7	0	0	0	0	112.7	I721 L725 V757 L763	I721-C761 HydrophobicContact CG2-CB 4.47Å; L725-C761 HydrophobicContact CD1-CB 4.39Å; V757-C761 WeakPolarHBondContact O-CB 3.45Å; V757-C761 PolarHBondContact O-N 3.28Å; V757-C761 PolarHBondContact O-SG 2.89Å; C761-L763 HydrophobicContact CB-CD1 4.08Å; C761-L763 HydrophobicContact CB-CG 3.8Å; C761-L763 PolarHBondContact O-N 3.46Å
762	S	76.3	Confident	83.3	Confident	97 Å²	97	39.4 Å²	39.4	68%	0.678	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	32.5	-174.9	-61.1	0	0	0	0	114	A758 T759 E760	A758-S762 PolarHBondContact O-N 3.47Å; A758-S762 VanDerWaalsContact O-N 3.12Å; T759-S762 PolarHBondContact O-N 2.92Å; T759-S762 VanDerWaalsContact O-N 3.12Å; E760-S762 PolarHBondContact O-N 2.98Å
763	L	77.8	Confident	82.8	Confident	7 Å²	7	35.4 Å²	35.4	4%	0.037	19%	0.194	C	C	.	.			trans	-92.3	153.2	-178.2	-66	-173.5	0	0	0	111.9	I721 L725 A758 C761 P797 I799 F843	I721-L763 HydrophobicContact CG2-CD1 4.19Å; L725-L763 HydrophobicContact CD1-CD1 4.07Å; L725-L763 HydrophobicContact CD1-CD2 4.42Å; L725-L763 HydrophobicContact CD1-CG 4.48Å; L725-L763 HydrophobicContact CD2-CD2 4.45Å; A758-L763 PolarHBondContact O-N 3.01Å; C761-L763 HydrophobicContact CB-CD1 4.08Å; C761-L763 HydrophobicContact CB-CG 3.8Å; C761-L763 PolarHBondContact O-N 3.46Å; L763-P797 HydrophobicContact CD2-CB 3.74Å; L763-P797 HydrophobicContact CD2-CG 3.77Å; L763-I799 HydrophobicContact CB-CD1 4.34Å; L763-I799 HydrophobicContact CB-CG1 4.12Å; L763-I799 HydrophobicContact CD1-CD1 3.93Å; L763-I799 HydrophobicContact CD1-CG1 3.64Å; L763-F843 HydrophobicContact CD1-CD2 4.16Å; L763-F843 HydrophobicContact CD1-CE2 4.44Å
764	T	77.1	Confident	82.2	Confident	51 Å²	51	38.5 Å²	38.5	31%	0.313	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	135.6	171.4	60.5	0	0	0	0	109.6	A795 P797 C798 I799	T764-A795 PolarHBondContact OG1-O 2.83Å; T764-P797 PolarHBondContact OG1-O 3.32Å; T764-C798 WeakPolarHBondContact O-CA 3.11Å; T764-C798 WeakPolarHBondContact OG1-CA 3.17Å; T764-C798 WeakPolarHBondContact OG1-CB 3.36Å; T764-I799 PolarHBondContact O-N 2.96Å
765	F	84.3	Confident	81.4	Confident	6 Å²	6	41.3 Å²	41.3	3%	0.026	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	106	-171.5	-177.9	-105.6	0	0	0	111.1	P697 P700 A754 K755 A758 I799 F801	P697-F765 WeakPolarHBondContact CG-O 3.42Å; P700-F765 HydrophobicContact CG-CB 4.49Å; P700-F765 HydrophobicContact CG-CD1 4.27Å; P700-F765 HydrophobicContact CG-CG 4.33Å; A754-F765 HydrophobicContact CB-CE2 4.29Å; K755-F765 HydrophobicContact CD-CE1 4.38Å; K755-F765 HydrophobicContact CG-CD1 4.35Å; K755-F765 HydrophobicContact CG-CE1 3.6Å; K755-F765 HydrophobicContact CG-CE2 4.38Å; K755-F765 HydrophobicContact CG-CZ 3.62Å; A758-F765 HydrophobicContact CB-CB 3.85Å; A758-F765 HydrophobicContact CB-CD2 3.54Å; A758-F765 HydrophobicContact CB-CE2 4.41Å; A758-F765 HydrophobicContact CB-CG 3.99Å; F765-I799 HydrophobicContact CD2-CG2 4.41Å; F765-F801 HydrophobicContact CD2-CB 4.38Å; F765-F801 HydrophobicContact CE2-CB 3.46Å; F765-F801 VanDerWaalsContact CE2-CB 3.46Å; F765-F801 HydrophobicContact CE2-CD1 4.49Å; F765-F801 AromaticContact CE2-CG 3.96Å; F765-F801 HydrophobicContact CE2-CG 3.96Å; F765-F801 HydrophobicContact CZ-CB 3.53Å; F765-F801 AromaticContact CZ-CD1 3.8Å; F765-F801 HydrophobicContact CZ-CD1 3.8Å; F765-F801 AromaticContact CZ-CG 3.72Å; F765-F801 HydrophobicContact CZ-CG 3.72Å
766	L	85.9	Confident	80.3	Confident	11 Å²	11	47.1 Å²	47.1	6%	0.058	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	87.2	-177.2	-147.4	165.4	0	0	0	109.7	A696 V768 V788 R791 A792 I799 F801	A696-L766 HydrophobicContact CB-CD1 4.49Å; A696-L766 HydrophobicContact CB-CG 4.5Å; L766-V768 HydrophobicContact CD2-CG2 3.57Å; L766-V788 HydrophobicContact CD2-CG1 4.32Å; L766-R791 HydrophobicContact CD1-CB 4.25Å; L766-A792 HydrophobicContact CD1-CB 4.1Å; L766-I799 PolarHBondContact N-O 3.46Å; L766-F801 PolarHBondContact O-N 3.34Å
767	S	85.9	Confident	79	Confident	34 Å²	34	55.5 Å²	55.5	24%	0.238	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	128.9	176.9	-162	0	0	0	0	111
768	V	86.3	Confident	77.8	Confident	10 Å²	10	60.8 Å²	60.8	6%	0.061	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129.1	175.7	-174.2	0	0	0	0	108.7	L766 L773 V788 F801 F802 D803	L766-V768 HydrophobicContact CD2-CG2 3.57Å; V768-L773 HydrophobicContact CG1-CD1 3.6Å; V768-L773 HydrophobicContact CG1-CD2 3.86Å; V768-L773 HydrophobicContact CG1-CG 3.55Å; V768-V788 HydrophobicContact CG2-CG1 3.92Å; V768-V788 HydrophobicContact CG2-CG2 4.14Å; V768-F801 PolarHBondContact N-O 3.45Å; V768-F802 HydrophobicContact CB-CD1 4.21Å; V768-F802 HydrophobicContact CB-CE1 4.37Å; V768-F802 WeakPolarHBondContact O-CA 3.13Å; V768-D803 PolarHBondContact O-N 2.96Å
769	K	85	Confident	77.2	Confident	98 Å²	98	62.3 Å²	62.3	43%	0.426	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	141.3	173.1	-49.6	-168.7	-160.6	100.5	0	110.1	P771 E772	K769-P771 VanDerWaalsContact C-N 3.34Å; K769-E772 HydrophobicContact CB-CG 4.05Å; K769-E772 PolarHBondContact N-OE2 2.67Å; K769-E772 VanDerWaalsContact N-OE2 3.16Å; K769-E772 IonicContact NZ-OE1 3.89Å; K769-E772 PolarHBondContact NZ-OE1 3.22Å; K769-E772 WeakPolarHBondContact O-CB 3.3Å; K769-E772 PolarHBondContact O-N 3.06Å
770	G	79.3	Confident	77.1	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-48.2	-46.9	177.6	0	0	0	0	0	114.6	E772 L773 I774 D803 S807	G770-E772 VanDerWaalsContact C-N 3.28Å; G770-E772 PolarHBondContact O-N 3.15Å; G770-L773 PolarHBondContact O-N 2.89Å; G770-I774 WeakPolarHBondContact O-CG1 3.24Å; G770-D803 PolarHBondContact N-O 3.02Å; G770-S807 WeakPolarHBondContact CA-OG 3.11Å
771	P	78.6	Confident	77	Confident	72 Å²	72	59.7 Å²	59.7	47%	0.468	32%	0.321	S	S	.	.	H	α-helix	trans	-64.8	-23.1	177.9	-24.7	35.9	0	0	0	115.3	K769 L773	K769-P771 VanDerWaalsContact C-N 3.34Å; P771-L773 VanDerWaalsContact C-N 3.29Å; P771-L773 PolarHBondContact O-N 3.31Å
772	E	78.3	Confident	77.4	Confident	109 Å²	109	60.2 Å²	60.2	51%	0.509	32%	0.321	S	S	.	.	H	α-helix	trans	-75.7	-18.5	-179	-67	167.7	171.7	0	0	112.4	K769 G770	K769-E772 HydrophobicContact CB-CG 4.05Å; K769-E772 PolarHBondContact N-OE2 2.67Å; K769-E772 VanDerWaalsContact N-OE2 3.16Å; K769-E772 IonicContact NZ-OE1 3.89Å; K769-E772 PolarHBondContact NZ-OE1 3.22Å; K769-E772 WeakPolarHBondContact O-CB 3.3Å; K769-E772 PolarHBondContact O-N 3.06Å; G770-E772 VanDerWaalsContact C-N 3.28Å; G770-E772 PolarHBondContact O-N 3.15Å
773	L	77.6	Confident	77.7	Confident	7 Å²	7	59.6 Å²	59.6	4%	0.037	31%	0.307	C	S	.	.	H	α-helix	trans	-90.5	-20.1	177.7	-69.6	174.6	0	0	0	113.8	V768 G770 P771 N775 S781 N784 V785 V788 F802 L808	V768-L773 HydrophobicContact CG1-CD1 3.6Å; V768-L773 HydrophobicContact CG1-CD2 3.86Å; V768-L773 HydrophobicContact CG1-CG 3.55Å; G770-L773 PolarHBondContact O-N 2.89Å; P771-L773 VanDerWaalsContact C-N 3.29Å; P771-L773 PolarHBondContact O-N 3.31Å; L773-N775 PolarHBondContact O-N 3.42Å; L773-S781 WeakPolarHBondContact O-CB 3.29Å; L773-N784 HydrophobicContact CD2-CB 4.18Å; L773-V785 HydrophobicContact CD1-CG2 4.22Å; L773-V788 HydrophobicContact CD2-CG2 4.01Å; L773-F802 HydrophobicContact CD1-CE1 4.19Å; L773-L808 HydrophobicContact CB-CD1 3.97Å; L773-L808 HydrophobicContact CD1-CD1 3.96Å; L773-L808 HydrophobicContact CD1-CD2 3.75Å
774	I	76.6	Confident	78	Confident	67 Å²	67	61.1 Å²	61.1	34%	0.344	32%	0.316	S	S	.	.			trans	-94	96.3	-169.1	-57.4	166.5	0	0	0	109.9	G770 S807 L808 M822	G770-I774 WeakPolarHBondContact O-CG1 3.24Å; I774-S807 WeakPolarHBondContact CD1-O 3.46Å; I774-L808 HydrophobicContact CD1-CD1 4.42Å; I774-L808 HydrophobicContact CG1-CD1 4.07Å; I774-M822 HydrophobicContact CD1-CE 4.4Å
775	N	72.1	Confident	78.5	Confident	60 Å²	60	58.8 Å²	58.8	32%	0.321	30%	0.301	S	S	.	.			trans	-92.7	147.3	166.4	-76.6	-51.5	0	0	0	111.2	L773 Y777 S781 N784	L773-N775 PolarHBondContact O-N 3.42Å; N775-Y777 PolarHBondContact O-N 3.39Å; N775-S781 PolarHBondContact N-OG 3.21Å; N775-S781 PolarHBondContact O-OG 2.87Å; N775-N784 PolarHBondContact ND2-ND2 2.97Å; N775-N784 VanDerWaalsContact ND2-ND2 3.14Å
776	M	63.2	Low	78.6	Confident	184 Å²	184	63.3 Å²	63.3	91%	0.906	32%	0.318	S	S	*	.	S	Bend	trans	-72.7	-16.2	175.4	-63.6	-175.9	74	0	0	113.2
777	Y	62.2	Low	78.4	Confident	176 Å²	176	65.4 Å²	65.4	69%	0.69	33%	0.328	S	S	*	.	S	Bend	trans	-77.7	128.1	178.5	-66.8	-78.5	0	0	0	111.2	N775 G779 Q780	N775-Y777 PolarHBondContact O-N 3.39Å; Y777-G779 PolarHBondContact O-N 3.2Å; Y777-Q780 PolarHBondContact O-N 3.24Å
778	V	61.3	Low	78.4	Confident	111 Å²	111	64.5 Å²	64.5	67%	0.673	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	131.4	-175.2	-178	0	0	0	0	110.9	Q780	V778-Q780 VanDerWaalsContact C-N 3.25Å; V778-Q780 PolarHBondContact O-N 3.43Å
779	G	72.4	Confident	78.4	Confident	32 Å²	32	64 Å²	64	33%	0.33	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	-28.9	177.5	0	0	0	0	0	115.2	Y777 S781 E782 E783	Y777-G779 PolarHBondContact O-N 3.2Å; G779-S781 VanDerWaalsContact C-N 3.31Å; G779-S781 PolarHBondContact O-N 3.07Å; G779-E782 PolarHBondContact O-N 3.44Å; G779-E782 VanDerWaalsContact O-N 3.11Å; G779-E783 PolarHBondContact O-N 3.16Å
780	Q	78.9	Confident	78.2	Confident	92 Å²	92	61.6 Å²	61.6	43%	0.43	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-37.1	-177.4	-166	173.2	15.7	0	0	112.6	Y777 V778 E782 E783 N784	Y777-Q780 PolarHBondContact O-N 3.24Å; V778-Q780 VanDerWaalsContact C-N 3.25Å; V778-Q780 PolarHBondContact O-N 3.43Å; Q780-E782 VanDerWaalsContact C-N 3.31Å; Q780-E782 PolarHBondContact O-N 3.14Å; Q780-E783 PolarHBondContact O-N 3.47Å; Q780-N784 WeakPolarHBondContact O-CB 3.35Å; Q780-N784 PolarHBondContact O-N 3.04Å; Q780-N784 PolarHBondContact O-OD1 3.18Å
781	S	82.5	Confident	78	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.007	33%	0.331	C	S	.	.	H	α-helix	trans	-67.2	-28.6	176.8	-50.7	0	0	0	0	113.4	L773 N775 G779 V785	L773-S781 WeakPolarHBondContact O-CB 3.29Å; N775-S781 PolarHBondContact N-OG 3.21Å; N775-S781 PolarHBondContact O-OG 2.87Å; G779-S781 VanDerWaalsContact C-N 3.31Å; G779-S781 PolarHBondContact O-N 3.07Å; S781-V785 WeakPolarHBondContact O-CG2 2.99Å; S781-V785 PolarHBondContact O-N 2.98Å
782	E	84.8	Confident	78.1	Confident	39 Å²	39	62.2 Å²	62.2	18%	0.182	31%	0.309	C	S	.	.	H	α-helix	trans	-74.6	-42.3	176.5	-64.3	170	-139.2	0	0	110.7	G779 Q780 V785 R786 R824 V825	G779-E782 PolarHBondContact O-N 3.44Å; G779-E782 VanDerWaalsContact O-N 3.11Å; Q780-E782 VanDerWaalsContact C-N 3.31Å; Q780-E782 PolarHBondContact O-N 3.14Å; E782-V785 PolarHBondContact O-N 2.85Å; E782-R786 PolarHBondContact O-N 2.98Å; E782-R824 HydrophobicContact CG-CB 4.26Å; E782-R824 VanDerWaalsContact OE1-CB 3.22Å; E782-R824 WeakPolarHBondContact OE1-CB 3.47Å; E782-R824 WeakPolarHBondContact OE1-CD 3.48Å; E782-V825 HydrophobicContact CG-CG2 4.17Å
783	E	82.9	Confident	78	Confident	83 Å²	83	61.1 Å²	61.1	39%	0.388	30%	0.3	S	S	.	.	H	α-helix	trans	-68.3	-37.9	176.6	-167.5	57.8	-151.5	0	0	111.8	G779 Q780 V785 R786 E787	G779-E783 PolarHBondContact O-N 3.16Å; Q780-E783 PolarHBondContact O-N 3.47Å; E783-V785 VanDerWaalsContact C-N 3.27Å; E783-V785 PolarHBondContact O-N 3.35Å; E783-R786 WeakPolarHBondContact O-CB 3.38Å; E783-R786 PolarHBondContact O-N 2.89Å; E783-R786 VanDerWaalsContact O-N 3.14Å; E783-R786 WeakPolarHBondContact OE2-CD 3.39Å; E783-R786 IonicContact OE2-NH1 3.77Å; E783-R786 PolarHBondContact OE2-NH1 2.77Å; E783-E787 PolarHBondContact O-N 2.86Å
784	N	83.3	Confident	77.6	Confident	40 Å²	40	64.2 Å²	64.2	21%	0.214	33%	0.327	C	S	.	.	H	α-helix	trans	-56	-40.7	172.4	-75.4	-3.8	0	0	0	112.4	L773 N775 Q780 E787 V788	L773-N784 HydrophobicContact CD2-CB 4.18Å; N775-N784 PolarHBondContact ND2-ND2 2.97Å; N775-N784 VanDerWaalsContact ND2-ND2 3.14Å; Q780-N784 WeakPolarHBondContact O-CB 3.35Å; Q780-N784 PolarHBondContact O-N 3.04Å; Q780-N784 PolarHBondContact O-OD1 3.18Å; N784-E787 PolarHBondContact O-N 3.03Å; N784-V788 WeakPolarHBondContact O-CG2 3.32Å; N784-V788 PolarHBondContact O-N 2.83Å
785	V	86.9	Confident	77.3	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.012	32%	0.315	C	S	.	.	H	α-helix	trans	-64.4	-48.2	175.3	169.6	0	0	0	0	110.6	L773 S781 E782 E783 E787 V788 F789 V825 Q828 L829 E832	L773-V785 HydrophobicContact CD1-CG2 4.22Å; S781-V785 WeakPolarHBondContact O-CG2 2.99Å; S781-V785 PolarHBondContact O-N 2.98Å; E782-V785 PolarHBondContact O-N 2.85Å; E783-V785 VanDerWaalsContact C-N 3.27Å; E783-V785 PolarHBondContact O-N 3.35Å; V785-E787 VanDerWaalsContact C-N 3.27Å; V785-E787 PolarHBondContact O-N 3.03Å; V785-V788 PolarHBondContact O-N 3.13Å; V785-F789 HydrophobicContact CG1-CD2 3.96Å; V785-F789 HydrophobicContact CG1-CE2 3.94Å; V785-F789 WeakPolarHBondContact O-CD2 3.36Å; V785-F789 PolarHBondContact O-N 2.96Å; V785-F789 VanDerWaalsContact O-N 3.16Å; V785-V825 HydrophobicContact CG2-CG1 4.21Å; V785-Q828 HydrophobicContact CB-CG 4.5Å; V785-Q828 HydrophobicContact CG1-CG 4.23Å; V785-L829 HydrophobicContact CG1-CB 3.75Å; V785-E832 HydrophobicContact CG1-CG 4.35Å
786	R	86.6	Confident	77.2	Confident	100 Å²	100	60 Å²	60	38%	0.377	31%	0.31	S	S	.	.	H	α-helix	trans	-56.8	-42.6	175.7	-70.1	-178.6	-179.8	155.8	5.5	112.1	E782 E783 F789 A790 Q828	E782-R786 PolarHBondContact O-N 2.98Å; E783-R786 WeakPolarHBondContact O-CB 3.38Å; E783-R786 PolarHBondContact O-N 2.89Å; E783-R786 VanDerWaalsContact O-N 3.14Å; E783-R786 WeakPolarHBondContact OE2-CD 3.39Å; E783-R786 IonicContact OE2-NH1 3.77Å; E783-R786 PolarHBondContact OE2-NH1 2.77Å; R786-F789 PolarHBondContact O-N 2.77Å; R786-A790 VanDerWaalsContact O-CB 3.3Å; R786-A790 WeakPolarHBondContact O-CB 3.47Å; R786-A790 PolarHBondContact O-N 2.79Å; R786-Q828 HydrophobicContact CG-CG 4.1Å; R786-Q828 VanDerWaalsContact NE-CD 3.27Å; R786-Q828 VanDerWaalsContact NE-NE2 3.14Å
787	E	82.9	Confident	77.9	Confident	56 Å²	56	53.3 Å²	53.3	26%	0.262	28%	0.28	S	S	.	.	H	α-helix	trans	-65.7	-40.7	-179.3	-150.9	-159.1	162.6	0	0	111.6	E783 N784 V785 F789 A790 R791	E783-E787 PolarHBondContact O-N 2.86Å; N784-E787 PolarHBondContact O-N 3.03Å; V785-E787 VanDerWaalsContact C-N 3.27Å; V785-E787 PolarHBondContact O-N 3.03Å; E787-F789 PolarHBondContact O-N 3.32Å; E787-A790 PolarHBondContact O-N 3.33Å; E787-R791 VanDerWaalsContact CD-NE 3.31Å; E787-R791 WeakPolarHBondContact O-CB 3.5Å; E787-R791 VanDerWaalsContact O-CG 3.23Å; E787-R791 WeakPolarHBondContact O-CG 3.24Å; E787-R791 PolarHBondContact O-N 2.89Å; E787-R791 IonicContact OE1-CZ 2.76Å; E787-R791 VanDerWaalsContact OE1-CZ 3.27Å; E787-R791 IonicContact OE1-NE 2.73Å; E787-R791 PolarHBondContact OE1-NE 2.95Å; E787-R791 IonicContact OE1-NH2 3.68Å; E787-R791 PolarHBondContact OE1-NH2 3.25Å; E787-R791 IonicContact OE2-CZ 3.65Å; E787-R791 IonicContact OE2-NE 3.98Å; E787-R791 IonicContact OE2-NH2 2.69Å; E787-R791 PolarHBondContact OE2-NH2 3.31Å
788	V	85.1	Confident	78.8	Confident	15 Å²	15	44.9 Å²	44.9	9%	0.091	25%	0.247	C	C	.	.	H	α-helix	trans	-57.9	-49	173.7	162.5	0	0	0	0	111.5	L766 V768 L773 N784 V785 R791 A792 I800 F802	L766-V788 HydrophobicContact CD2-CG1 4.32Å; V768-V788 HydrophobicContact CG2-CG1 3.92Å; V768-V788 HydrophobicContact CG2-CG2 4.14Å; L773-V788 HydrophobicContact CD2-CG2 4.01Å; N784-V788 WeakPolarHBondContact O-CG2 3.32Å; N784-V788 PolarHBondContact O-N 2.83Å; V785-V788 PolarHBondContact O-N 3.13Å; V788-R791 PolarHBondContact O-N 2.82Å; V788-A792 WeakPolarHBondContact O-CB 3.17Å; V788-A792 PolarHBondContact O-N 2.94Å; V788-I800 HydrophobicContact CG1-CG2 4.29Å; V788-F802 HydrophobicContact CG1-CZ 4.48Å
789	F	86.1	Confident	80	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-68.8	-33.2	178.4	-77.6	-80.6	0	0	0	112.5	V785 R786 E787 A792 R793 I800 F802 L829 E832 L833 L836 V844	V785-F789 HydrophobicContact CG1-CD2 3.96Å; V785-F789 HydrophobicContact CG1-CE2 3.94Å; V785-F789 WeakPolarHBondContact O-CD2 3.36Å; V785-F789 PolarHBondContact O-N 2.96Å; V785-F789 VanDerWaalsContact O-N 3.16Å; R786-F789 PolarHBondContact O-N 2.77Å; E787-F789 PolarHBondContact O-N 3.32Å; F789-A792 PolarHBondContact O-N 3.36Å; F789-R793 WeakPolarHBondContact O-CB 3.08Å; F789-R793 VanDerWaalsContact O-CG 3.32Å; F789-R793 WeakPolarHBondContact O-CG 3.38Å; F789-R793 PolarHBondContact O-N 3.32Å; F789-R793 PolarHBondContact O-NE 2.99Å; F789-I800 HydrophobicContact CD1-CD1 3.45Å; F789-I800 VanDerWaalsContact CD1-CD1 3.45Å; F789-I800 HydrophobicContact CE1-CD1 3.54Å; F789-I800 HydrophobicContact CG-CD1 4.31Å; F789-I800 HydrophobicContact CZ-CD1 4.44Å; F789-F802 HydrophobicContact CE1-CE2 4.45Å; F789-F802 HydrophobicContact CE1-CZ 4.46Å; F789-F802 HydrophobicContact CE2-CE2 4.4Å; F789-F802 AromaticContact CE2-CZ 3.78Å; F789-F802 HydrophobicContact CE2-CZ 3.78Å; F789-F802 AromaticContact CZ-CE2 3.78Å; F789-F802 HydrophobicContact CZ-CE2 3.78Å; F789-F802 AromaticContact CZ-CZ 3.61Å; F789-F802 HydrophobicContact CZ-CZ 3.61Å; F789-L829 HydrophobicContact CE2-CB 4.38Å; F789-L829 HydrophobicContact CE2-CD1 3.77Å; F789-L829 HydrophobicContact CZ-CD1 3.8Å; F789-E832 HydrophobicContact CB-CB 4.26Å; F789-E832 HydrophobicContact CB-CG 4.19Å; F789-E832 VanDerWaalsContact CB-OE2 3.31Å; F789-E832 WeakPolarHBondContact CB-OE2 3.18Å; F789-E832 HydrophobicContact CD1-CB 4.08Å; F789-E832 HydrophobicContact CD2-CB 3.41Å; F789-E832 VanDerWaalsContact CD2-CB 3.41Å; F789-E832 HydrophobicContact CD2-CG 3.59Å; F789-E832 HydrophobicContact CE1-CB 4.26Å; F789-E832 HydrophobicContact CE2-CB 3.63Å; F789-E832 HydrophobicContact CE2-CG 4.17Å; F789-E832 HydrophobicContact CG-CB 3.66Å; F789-E832 HydrophobicContact CG-CG 3.99Å; F789-E832 HydrophobicContact CZ-CB 4.05Å; F789-L833 HydrophobicContact CE1-CD2 4.2Å; F789-L833 HydrophobicContact CZ-CD2 4.04Å; F789-L833 HydrophobicContact CZ-CG 4.4Å; F789-L836 HydrophobicContact CD1-CD1 3.87Å; F789-L836 HydrophobicContact CD1-CD2 4.26Å; F789-L836 HydrophobicContact CD1-CG 4.14Å; F789-L836 HydrophobicContact CE1-CD1 3.64Å; F789-L836 HydrophobicContact CE1-CG 4.28Å; F789-V844 HydrophobicContact CE1-CG2 4.27Å
790	A	80.3	Confident	80.8	Confident	47 Å²	47	38.1 Å²	38.1	39%	0.388	20%	0.2	S	C	.	.	H	α-helix	trans	-66.8	-43.8	173.6	0	0	0	0	0	112.4	R786 E787 A792 R793 A794	R786-A790 VanDerWaalsContact O-CB 3.3Å; R786-A790 WeakPolarHBondContact O-CB 3.47Å; R786-A790 PolarHBondContact O-N 2.79Å; E787-A790 PolarHBondContact O-N 3.33Å; A790-A792 VanDerWaalsContact C-N 3.33Å; A790-R793 PolarHBondContact O-N 3.37Å; A790-A794 PolarHBondContact O-N 3.39Å
791	R	76.3	Confident	81.4	Confident	86 Å²	86	33.7 Å²	33.7	33%	0.325	18%	0.179	S	C	.	.	H	α-helix	trans	-61.4	-41.8	173.2	-70.6	174.2	-170.3	-173.6	11.9	111	V694 L766 E787 V788 A794 A795	V694-R791 HydrophobicContact CG1-CB 4.48Å; L766-R791 HydrophobicContact CD1-CB 4.25Å; E787-R791 VanDerWaalsContact CD-NE 3.31Å; E787-R791 WeakPolarHBondContact O-CB 3.5Å; E787-R791 VanDerWaalsContact O-CG 3.23Å; E787-R791 WeakPolarHBondContact O-CG 3.24Å; E787-R791 PolarHBondContact O-N 2.89Å; E787-R791 IonicContact OE1-CZ 2.76Å; E787-R791 VanDerWaalsContact OE1-CZ 3.27Å; E787-R791 IonicContact OE1-NE 2.73Å; E787-R791 PolarHBondContact OE1-NE 2.95Å; E787-R791 IonicContact OE1-NH2 3.68Å; E787-R791 PolarHBondContact OE1-NH2 3.25Å; E787-R791 IonicContact OE2-CZ 3.65Å; E787-R791 IonicContact OE2-NE 3.98Å; E787-R791 IonicContact OE2-NH2 2.69Å; E787-R791 PolarHBondContact OE2-NH2 3.31Å; V788-R791 PolarHBondContact O-N 2.82Å; R791-A794 PolarHBondContact O-N 3.01Å; R791-A795 WeakPolarHBondContact O-CB 3.38Å; R791-A795 PolarHBondContact O-N 3.39Å
792	A	79.3	Confident	81.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.8	-48.1	175.3	0	0	0	0	0	112.3	L766 V788 F789 A790 A794 A795 A796 C798 I800 V842	L766-A792 HydrophobicContact CD1-CB 4.1Å; V788-A792 WeakPolarHBondContact O-CB 3.17Å; V788-A792 PolarHBondContact O-N 2.94Å; F789-A792 PolarHBondContact O-N 3.36Å; A790-A792 VanDerWaalsContact C-N 3.33Å; A792-A794 VanDerWaalsContact C-N 3.29Å; A792-A794 PolarHBondContact O-N 3.47Å; A792-A795 CarbonylContact O-C 3.08Å; A792-A795 PolarHBondContact O-N 3.03Å; A792-A795 VanDerWaalsContact O-N 3.08Å; A792-A796 PolarHBondContact O-N 3.39Å; A792-C798 PolarHBondContact O-SG 2.97Å; A792-I800 HydrophobicContact CB-CD1 3.39Å; A792-I800 HydrophobicContact CB-CG1 3.56Å; A792-V842 HydrophobicContact CB-CG1 4.41Å
793	R	77.4	Confident	82.1	Confident	86 Å²	86	33.2 Å²	33.2	33%	0.325	18%	0.177	S	C	.	.	H	α-helix	trans	-58.4	-38.3	174.9	-74.9	-178.9	-71.7	-104.6	3.1	112.4	F789 A790 A796 E832 L836 T839 V842	F789-R793 WeakPolarHBondContact O-CB 3.08Å; F789-R793 VanDerWaalsContact O-CG 3.32Å; F789-R793 WeakPolarHBondContact O-CG 3.38Å; F789-R793 PolarHBondContact O-N 3.32Å; F789-R793 PolarHBondContact O-NE 2.99Å; A790-R793 PolarHBondContact O-N 3.37Å; R793-A796 WeakPolarHBondContact O-CB 3.05Å; R793-E832 IonicContact CZ-OE2 3.4Å; R793-E832 VanDerWaalsContact CZ-OE2 3.3Å; R793-E832 IonicContact NH1-OE2 2.68Å; R793-E832 PolarHBondContact NH1-OE2 3.44Å; R793-E832 IonicContact NH2-OE2 2.77Å; R793-E832 PolarHBondContact NH2-OE2 3.18Å; R793-L836 HydrophobicContact CG-CD2 4.25Å; R793-T839 HydrophobicContact CG-CG2 4.45Å; R793-V842 HydrophobicContact CG-CG2 4.45Å
794	A	69.1	Low	82.3	Confident	72 Å²	72	33.1 Å²	33.1	60%	0.595	18%	0.177	S	C	*	.	H	α-helix	trans	-70.9	-28.5	175.6	0	0	0	0	0	113.6	A790 R791 A792	A790-A794 PolarHBondContact O-N 3.39Å; R791-A794 PolarHBondContact O-N 3.01Å; A792-A794 VanDerWaalsContact C-N 3.29Å; A792-A794 PolarHBondContact O-N 3.47Å
795	A	69.2	Low	82.6	Confident	11 Å²	11	31.3 Å²	31.3	9%	0.091	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	12.6	-179.2	0	0	0	0	0	114.2	T764 R791 A792	T764-A795 PolarHBondContact OG1-O 2.83Å; R791-A795 WeakPolarHBondContact O-CB 3.38Å; R791-A795 PolarHBondContact O-N 3.39Å; A792-A795 CarbonylContact O-C 3.08Å; A792-A795 PolarHBondContact O-N 3.03Å; A792-A795 VanDerWaalsContact O-N 3.08Å
796	A	71.6	Confident	82.6	Confident	28 Å²	28	32.7 Å²	32.7	23%	0.231	17%	0.174	C	C	.	.			trans	-62.5	141.2	-176.8	0	0	0	0	0	113	A792 R793 D841 V842	A792-A796 PolarHBondContact O-N 3.39Å; R793-A796 WeakPolarHBondContact O-CB 3.05Å; A796-D841 HydrophobicContact CB-CB 3.92Å; A796-V842 HydrophobicContact CB-CG2 4.32Å
797	P	76.3	Confident	82.5	Confident	42 Å²	42	29.7 Å²	29.7	27%	0.273	17%	0.169	S	C	.	.	S	Bend	cis	-78.8	135.7	2	33.4	-36.3	0	0	0	112.9	L763 T764 D841	L763-P797 HydrophobicContact CD2-CB 3.74Å; L763-P797 HydrophobicContact CD2-CG 3.77Å; T764-P797 PolarHBondContact OG1-O 3.32Å; P797-D841 VanDerWaalsContact CA-O 3.23Å; P797-D841 WeakPolarHBondContact CA-O 3.33Å; P797-D841 HydrophobicContact CB-CB 4.08Å
798	C	80.9	Confident	82.6	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	158	-170.7	75.5	0	0	0	0	114.3	T764 A792 D841 F843	T764-C798 WeakPolarHBondContact O-CA 3.11Å; T764-C798 WeakPolarHBondContact OG1-CA 3.17Å; T764-C798 WeakPolarHBondContact OG1-CB 3.36Å; A792-C798 PolarHBondContact O-SG 2.97Å; C798-D841 PolarHBondContact N-O 3.41Å; C798-F843 PolarHBondContact O-N 2.78Å
799	I	87.1	Confident	82.5	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.4	168.4	-59.8	-178.6	0	0	0	108.7	I721 V757 A758 L763 T764 F765 L766 F843 I845	I721-I799 HydrophobicContact CD1-CD1 4.43Å; V757-I799 HydrophobicContact CG1-CD1 4.2Å; A758-I799 HydrophobicContact CB-CD1 4Å; L763-I799 HydrophobicContact CB-CD1 4.34Å; L763-I799 HydrophobicContact CB-CG1 4.12Å; L763-I799 HydrophobicContact CD1-CD1 3.93Å; L763-I799 HydrophobicContact CD1-CG1 3.64Å; T764-I799 PolarHBondContact O-N 2.96Å; F765-I799 HydrophobicContact CD2-CG2 4.41Å; L766-I799 PolarHBondContact N-O 3.46Å; I799-F843 CarbonylContact C-O 3.58Å; I799-F843 WeakPolarHBondContact CA-O 3.29Å; I799-F843 HydrophobicContact CG1-CB 4.37Å; I799-I845 HydrophobicContact CD1-CD1 4.45Å; I799-I845 HydrophobicContact CG2-CB 4.45Å; I799-I845 HydrophobicContact CG2-CD1 3.69Å; I799-I845 HydrophobicContact CG2-CG1 3.89Å
800	I	89.4	Confident	82.3	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.5	165.7	-48.2	177.2	0	0	0	108	V788 F789 A792 F802 V842 F843 V844 I845	V788-I800 HydrophobicContact CG1-CG2 4.29Å; F789-I800 HydrophobicContact CD1-CD1 3.45Å; F789-I800 VanDerWaalsContact CD1-CD1 3.45Å; F789-I800 HydrophobicContact CE1-CD1 3.54Å; F789-I800 HydrophobicContact CG-CD1 4.31Å; F789-I800 HydrophobicContact CZ-CD1 4.44Å; A792-I800 HydrophobicContact CB-CD1 3.39Å; A792-I800 HydrophobicContact CB-CG1 3.56Å; I800-F802 HydrophobicContact CB-CE2 4.36Å; I800-F802 HydrophobicContact CG2-CD2 4.07Å; I800-F802 HydrophobicContact CG2-CE1 4.23Å; I800-F802 HydrophobicContact CG2-CE2 3.53Å; I800-F802 HydrophobicContact CG2-CZ 3.61Å; I800-V842 HydrophobicContact CD1-CG1 3.91Å; I800-V842 HydrophobicContact CG1-CG1 4.15Å; I800-F843 PolarHBondContact N-O 3.18Å; I800-V844 HydrophobicContact CD1-CG2 4.38Å; I800-I845 PolarHBondContact O-N 2.94Å
801	F	91.3	Very high	82.3	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	109.7	176.7	177.9	-104	0	0	0	110.9	T751 A754 F765 L766 V768 D803 I845 A847	T751-F801 HydrophobicContact CG2-CE1 3.84Å; T751-F801 HydrophobicContact CG2-CZ 4.28Å; A754-F801 HydrophobicContact CB-CD2 3.33Å; A754-F801 HydrophobicContact CB-CE2 3.37Å; A754-F801 HydrophobicContact CB-CG 4.07Å; A754-F801 HydrophobicContact CB-CZ 4.13Å; F765-F801 HydrophobicContact CD2-CB 4.38Å; F765-F801 HydrophobicContact CE2-CB 3.46Å; F765-F801 VanDerWaalsContact CE2-CB 3.46Å; F765-F801 HydrophobicContact CE2-CD1 4.49Å; F765-F801 AromaticContact CE2-CG 3.96Å; F765-F801 HydrophobicContact CE2-CG 3.96Å; F765-F801 HydrophobicContact CZ-CB 3.53Å; F765-F801 AromaticContact CZ-CD1 3.8Å; F765-F801 HydrophobicContact CZ-CD1 3.8Å; F765-F801 AromaticContact CZ-CG 3.72Å; F765-F801 HydrophobicContact CZ-CG 3.72Å; L766-F801 PolarHBondContact O-N 3.34Å; V768-F801 PolarHBondContact N-O 3.45Å; F801-D803 HydrophobicContact CD1-CB 4.36Å; F801-D803 HydrophobicContact CE1-CB 3.61Å; F801-D803 WeakPolarHBondContact CE1-OD2 3.13Å; F801-D803 HydrophobicContact CZ-CB 4.17Å; F801-I845 CarbonylContact C-O 3.34Å; F801-I845 VanDerWaalsContact CA-O 3.3Å; F801-I845 WeakPolarHBondContact CA-O 3.38Å; F801-I845 HydrophobicContact CD2-CB 4.01Å; F801-I845 HydrophobicContact CD2-CG2 3.78Å; F801-I845 HydrophobicContact CE2-CG2 4.07Å; F801-A847 HydrophobicContact CE2-CB 3.72Å; F801-A847 HydrophobicContact CZ-CB 3.59Å
802	F	91.3	Very high	82.3	Confident	3 Å²	3	27.2 Å²	27.2	1%	0.013	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	105.8	174.4	-67.4	-73	0	0	0	110.1	V768 L773 V788 F789 I800 L805 L808 L829 V844 I845 G846 A847	V768-F802 HydrophobicContact CB-CD1 4.21Å; V768-F802 HydrophobicContact CB-CE1 4.37Å; V768-F802 WeakPolarHBondContact O-CA 3.13Å; L773-F802 HydrophobicContact CD1-CE1 4.19Å; V788-F802 HydrophobicContact CG1-CZ 4.48Å; F789-F802 HydrophobicContact CE1-CE2 4.45Å; F789-F802 HydrophobicContact CE1-CZ 4.46Å; F789-F802 HydrophobicContact CE2-CE2 4.4Å; F789-F802 AromaticContact CE2-CZ 3.78Å; F789-F802 HydrophobicContact CE2-CZ 3.78Å; F789-F802 AromaticContact CZ-CE2 3.78Å; F789-F802 HydrophobicContact CZ-CE2 3.78Å; F789-F802 AromaticContact CZ-CZ 3.61Å; F789-F802 HydrophobicContact CZ-CZ 3.61Å; I800-F802 HydrophobicContact CB-CE2 4.36Å; I800-F802 HydrophobicContact CG2-CD2 4.07Å; I800-F802 HydrophobicContact CG2-CE1 4.23Å; I800-F802 HydrophobicContact CG2-CE2 3.53Å; I800-F802 HydrophobicContact CG2-CZ 3.61Å; F802-L805 HydrophobicContact CB-CD1 4.13Å; F802-L808 HydrophobicContact CD1-CD2 4.34Å; F802-L829 HydrophobicContact CE1-CD1 4.29Å; F802-L829 HydrophobicContact CE2-CD1 3.95Å; F802-L829 HydrophobicContact CZ-CD1 3.79Å; F802-V844 HydrophobicContact CD2-CG1 3.67Å; F802-V844 HydrophobicContact CE2-CG1 3.69Å; F802-I845 PolarHBondContact N-O 3.14Å; F802-G846 CarbonylContact O-C 3.6Å; F802-A847 PolarHBondContact O-N 3.41Å
803	D	90.1	Very high	81.6	Confident	26 Å²	26	30.8 Å²	30.8	14%	0.139	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	148.2	171.3	-140.8	-22.8	0	0	0	110.9	T751 V768 G770 F801 L805	T751-D803 VanDerWaalsContact CG2-OD2 3.26Å; T751-D803 WeakPolarHBondContact CG2-OD2 3.5Å; T751-D803 PolarHBondContact OG1-OD2 3.37Å; V768-D803 PolarHBondContact O-N 2.96Å; G770-D803 PolarHBondContact N-O 3.02Å; F801-D803 HydrophobicContact CD1-CB 4.36Å; F801-D803 HydrophobicContact CE1-CB 3.61Å; F801-D803 WeakPolarHBondContact CE1-OD2 3.13Å; F801-D803 HydrophobicContact CZ-CB 4.17Å; D803-L805 VanDerWaalsContact C-N 3.34Å; D803-L805 PolarHBondContact O-N 3.27Å
804	E	89	Confident	80.8	Confident	82 Å²	82	34.8 Å²	34.8	38%	0.383	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	45.6	-177.2	-55.5	-176.6	150	0	0	113.5	D806 S807 A847	E804-D806 PolarHBondContact O-N 2.96Å; E804-S807 WeakPolarHBondContact O-CB 3.22Å; E804-S807 PolarHBondContact O-N 2.93Å; E804-S807 PolarHBondContact O-OG 3.41Å; E804-A847 PolarHBondContact N-O 2.7Å
805	L	88.4	Confident	80.2	Confident	1 Å²	1	34 Å²	34	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-57	-26	-176.7	-174.2	64.6	0	0	0	113.3	L741 F802 D803 S807 L808 A809 A847 L854 F864	L741-L805 HydrophobicContact CD1-CD2 3.86Å; F802-L805 HydrophobicContact CB-CD1 4.13Å; D803-L805 VanDerWaalsContact C-N 3.34Å; D803-L805 PolarHBondContact O-N 3.27Å; L805-S807 PolarHBondContact O-N 3.34Å; L805-L808 HydrophobicContact CD1-CB 4.49Å; L805-L808 HydrophobicContact CD1-CD2 4.27Å; L805-L808 PolarHBondContact O-N 2.93Å; L805-L808 VanDerWaalsContact O-N 3.17Å; L805-A809 PolarHBondContact O-N 3.39Å; L805-A847 PolarHBondContact N-O 3.48Å; L805-L854 HydrophobicContact CB-CD1 4.41Å; L805-L854 HydrophobicContact CD2-CD1 3.88Å; L805-L854 HydrophobicContact CG-CD1 3.88Å; L805-F864 HydrophobicContact CD2-CD2 4.49Å; L805-F864 HydrophobicContact CD2-CE2 3.66Å; L805-F864 HydrophobicContact CD2-CZ 3.81Å
806	D	87.9	Confident	79.6	Confident	31 Å²	31	37.2 Å²	37.2	17%	0.166	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-19.4	173.3	45.8	-60.4	0	0	0	114.3	E804 T848 R850	E804-D806 PolarHBondContact O-N 2.96Å; D806-T848 WeakPolarHBondContact CB-OG1 3.23Å; D806-T848 WeakPolarHBondContact OD1-CA 3.5Å; D806-T848 WeakPolarHBondContact OD1-CB 3.41Å; D806-T848 PolarHBondContact OD1-OG1 3.21Å; D806-R850 HydrophobicContact CB-CB 4.5Å
807	S	84.4	Confident	79	Confident	38 Å²	38	40.8 Å²	40.8	27%	0.266	24%	0.243	S	C	.	.	H	α-helix	trans	-82	-31.6	171.1	68.7	0	0	0	0	113.1	G770 I774 E804 L805 M822	G770-S807 WeakPolarHBondContact CA-OG 3.11Å; I774-S807 WeakPolarHBondContact CD1-O 3.46Å; E804-S807 WeakPolarHBondContact O-CB 3.22Å; E804-S807 PolarHBondContact O-N 2.93Å; E804-S807 PolarHBondContact O-OG 3.41Å; L805-S807 PolarHBondContact O-N 3.34Å; S807-M822 WeakPolarHBondContact O-CE 3.48Å
808	L	83.4	Confident	77.9	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-82.8	-35.2	-179.7	-172.4	66.3	0	0	0	112.2	L773 I774 F802 L805 V825 L829	L773-L808 HydrophobicContact CB-CD1 3.97Å; L773-L808 HydrophobicContact CD1-CD1 3.96Å; L773-L808 HydrophobicContact CD1-CD2 3.75Å; I774-L808 HydrophobicContact CD1-CD1 4.42Å; I774-L808 HydrophobicContact CG1-CD1 4.07Å; F802-L808 HydrophobicContact CD1-CD2 4.34Å; L805-L808 HydrophobicContact CD1-CB 4.49Å; L805-L808 HydrophobicContact CD1-CD2 4.27Å; L805-L808 PolarHBondContact O-N 2.93Å; L805-L808 VanDerWaalsContact O-N 3.17Å; L808-V825 HydrophobicContact CD1-CG1 3.73Å; L808-V825 HydrophobicContact CG-CG1 4.44Å; L808-L829 HydrophobicContact CD2-CD2 3.98Å; L808-L829 HydrophobicContact CG-CD2 4.46Å
809	A	83.1	Confident	77.2	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	30%	0.298	C	S	.	.	S	Bend	trans	-132.6	64.3	-174.2	0	0	0	0	0	114.4	L805 V826 L854 D855 L858	L805-A809 PolarHBondContact O-N 3.39Å; A809-V826 HydrophobicContact CB-CG1 4.42Å; A809-V826 HydrophobicContact CB-CG2 3.74Å; A809-L854 WeakPolarHBondContact O-CA 3.36Å; A809-D855 PolarHBondContact O-N 3.32Å; A809-D855 VanDerWaalsContact O-N 3.1Å; A809-L858 HydrophobicContact CB-CD1 3.39Å
810	P	83.5	Confident	76.7	Confident	20 Å²	20	48.8 Å²	48.8	13%	0.13	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-65.7	156	170.8	31.5	-36.7	0	0	0	111.6	R812 M822 L853	P810-R812 PolarHBondContact O-N 3.42Å; P810-M822 HydrophobicContact CG-CE 3.57Å; P810-M822 HydrophobicContact CG-SD 3.88Å; P810-L853 CarbonylContact C-O 3.56Å; P810-L853 WeakPolarHBondContact CA-O 3.39Å
811	S	80.1	Confident	76.1	Confident	20 Å²	20	50.4 Å²	50.4	14%	0.14	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-58.5	120.8	175.8	62.8	0	0	0	0	111.3	G813 R814 L853	S811-G813 PolarHBondContact O-N 3.36Å; S811-R814 PolarHBondContact O-N 3.16Å; S811-R814 WeakPolarHBondContact OG-CD 2.89Å; S811-L853 PolarHBondContact N-O 2.83Å
812	R	74.8	Confident	75.6	Confident	110 Å²	110	52.3 Å²	52.3	42%	0.415	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47	134.2	-178.7	-58	-178.6	-178.6	-115.6	-2.2	112.2	P810 R814 D823 S827 D855	P810-R812 PolarHBondContact O-N 3.42Å; R812-R814 VanDerWaalsContact C-N 3.35Å; R812-R814 PolarHBondContact O-N 3Å; R812-D823 WeakPolarHBondContact CG-OD1 3.45Å; R812-S827 PolarHBondContact NH1-OG 2.53Å; R812-S827 VanDerWaalsContact NH1-OG 3.1Å; R812-S827 PolarHBondContact NH2-OG 3.32Å; R812-D855 IonicContact CZ-OD2 2.68Å; R812-D855 IonicContact NE-OD2 2.89Å; R812-D855 PolarHBondContact NE-OD2 3.21Å; R812-D855 IonicContact NH2-OD2 3.72Å
813	G	64.9	Low	75.3	Confident	75 Å²	75	55.3 Å²	55.3	77%	0.773	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	1.6	178	0	0	0	0	0	116.9	S811	S811-G813 PolarHBondContact O-N 3.36Å
814	R	61.1	Low	75	Confident	170 Å²	170	60.1 Å²	60.1	64%	0.642	36%	0.363	S	S	*	.	S	Bend	trans	-84.2	-31.5	167.5	-90.2	-164.4	178.2	143.3	-10.8	113.8	S811 R812 D852	S811-R814 PolarHBondContact O-N 3.16Å; S811-R814 WeakPolarHBondContact OG-CD 2.89Å; R812-R814 VanDerWaalsContact C-N 3.35Å; R812-R814 PolarHBondContact O-N 3Å; R814-D852 PolarHBondContact NH1-O 2.82Å
815	S	56.8	Low	74.9	Confident	56 Å²	56	56.4 Å²	56.4	39%	0.392	35%	0.346	S	S	.	.	S	Bend	trans	-88.8	117.4	178.1	-52.9	0	0	0	0	109.5	D817	S815-D817 PolarHBondContact O-N 3.13Å
816	G	56.2	Low	74.8	Confident	79 Å²	79	56.4 Å²	56.4	81%	0.814	35%	0.346	S	S	*	.			trans	-76.8	39.3	-179.5	0	0	0	0	0	114.3	S818	G816-S818 PolarHBondContact O-N 3.01Å
817	D	58.7	Low	74.8	Confident	102 Å²	102	57.3 Å²	57.3	55%	0.545	36%	0.355	S	S	.	.			trans	-84.4	112.9	-170.9	-72.3	-29.6	0	0	0	112.1	S815 G819 G820	S815-D817 PolarHBondContact O-N 3.13Å; D817-G819 PolarHBondContact O-N 2.97Å; D817-G820 PolarHBondContact O-N 3.2Å
818	S	54.6	Low	75.1	Confident	139 Å²	139	56.7 Å²	56.7	97%	0.972	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	12.4	-171.1	-48.5	0	0	0	0	117.5	G816	G816-S818 PolarHBondContact O-N 3.01Å
819	G	65	Low	75.4	Confident	44 Å²	44	56.6 Å²	56.6	45%	0.454	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-8.3	-179.7	0	0	0	0	0	115.8	D817 V821	D817-G819 PolarHBondContact O-N 2.97Å; G819-V821 PolarHBondContact O-N 2.98Å; G819-V821 VanDerWaalsContact O-N 3.1Å
820	G	76.5	Confident	75.6	Confident	28 Å²	28	57.3 Å²	57.3	29%	0.289	35%	0.351	S	S	.	.			trans	61.2	15.9	-178.3	0	0	0	0	0	115	D817 M822 D823 R824	D817-G820 PolarHBondContact O-N 3.2Å; G820-M822 PolarHBondContact O-N 2.81Å; G820-D823 PolarHBondContact O-N 3.05Å; G820-R824 PolarHBondContact O-N 2.95Å
821	V	78.3	Confident	75.8	Confident	33 Å²	33	58.8 Å²	58.8	20%	0.2	37%	0.365	C	S	.	.	H	α-helix	trans	-62.5	-42.7	-174.8	179.3	0	0	0	0	110.9	G819 D823 R824 V825	G819-V821 PolarHBondContact O-N 2.98Å; G819-V821 VanDerWaalsContact O-N 3.1Å; V821-D823 PolarHBondContact O-N 2.83Å; V821-R824 PolarHBondContact O-N 2.94Å; V821-V825 HydrophobicContact CG1-CG2 4.41Å; V821-V825 WeakPolarHBondContact O-CG2 3.38Å; V821-V825 PolarHBondContact O-N 3.07Å
822	M	79.8	Confident	76.2	Confident	41 Å²	41	59 Å²	59	20%	0.202	36%	0.364	C	S	.	.	H	α-helix	trans	-60.7	-45.7	176.7	-59	-163.7	88.4	0	0	111.8	I774 S807 P810 G820 R824 V825 V826	I774-M822 HydrophobicContact CD1-CE 4.4Å; S807-M822 WeakPolarHBondContact O-CE 3.48Å; P810-M822 HydrophobicContact CG-CE 3.57Å; P810-M822 HydrophobicContact CG-SD 3.88Å; G820-M822 PolarHBondContact O-N 2.81Å; M822-R824 PolarHBondContact O-N 3.49Å; M822-V825 PolarHBondContact O-N 3.27Å; M822-V826 WeakPolarHBondContact O-CG2 3.48Å; M822-V826 PolarHBondContact O-N 3.14Å
823	D	84.1	Confident	76.7	Confident	66 Å²	66	54 Å²	54	35%	0.353	35%	0.345	S	S	.	.	H	α-helix	trans	-60.9	-33.2	179.6	-74.1	-31.3	0	0	0	112.5	R812 G820 V821 S827	R812-D823 WeakPolarHBondContact CG-OD1 3.45Å; G820-D823 PolarHBondContact O-N 3.05Å; V821-D823 PolarHBondContact O-N 2.83Å; D823-S827 WeakPolarHBondContact O-CB 3.41Å; D823-S827 PolarHBondContact O-N 2.86Å; D823-S827 PolarHBondContact O-OG 3.36Å
824	R	84.2	Confident	77.6	Confident	126 Å²	126	53.7 Å²	53.7	48%	0.475	33%	0.326	S	S	.	.	H	α-helix	trans	-73	-46.2	174.3	-61.9	178.6	-165.7	-178.6	4.2	111.9	E782 G820 V821 M822 V826 S827 Q828	E782-R824 HydrophobicContact CG-CB 4.26Å; E782-R824 VanDerWaalsContact OE1-CB 3.22Å; E782-R824 WeakPolarHBondContact OE1-CB 3.47Å; E782-R824 WeakPolarHBondContact OE1-CD 3.48Å; G820-R824 PolarHBondContact O-N 2.95Å; V821-R824 PolarHBondContact O-N 2.94Å; M822-R824 PolarHBondContact O-N 3.49Å; R824-V826 VanDerWaalsContact C-N 3.31Å; R824-V826 PolarHBondContact O-N 2.84Å; R824-S827 CarbonylContact O-C 3.6Å; R824-S827 WeakPolarHBondContact O-CA 3.39Å; R824-S827 PolarHBondContact O-N 2.81Å; R824-Q828 PolarHBondContact O-N 2.75Å
825	V	86.4	Confident	78.4	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.03	31%	0.312	C	S	.	.	H	α-helix	trans	-58.1	-42.8	175.6	170.6	0	0	0	0	111	E782 V785 L808 V821 M822 S827 Q828 L829	E782-V825 HydrophobicContact CG-CG2 4.17Å; V785-V825 HydrophobicContact CG2-CG1 4.21Å; L808-V825 HydrophobicContact CD1-CG1 3.73Å; L808-V825 HydrophobicContact CG-CG1 4.44Å; V821-V825 HydrophobicContact CG1-CG2 4.41Å; V821-V825 WeakPolarHBondContact O-CG2 3.38Å; V821-V825 PolarHBondContact O-N 3.07Å; M822-V825 PolarHBondContact O-N 3.27Å; V825-S827 VanDerWaalsContact C-N 3.34Å; V825-S827 PolarHBondContact O-N 2.9Å; V825-Q828 PolarHBondContact O-N 2.91Å; V825-L829 WeakPolarHBondContact O-CA 3.49Å; V825-L829 PolarHBondContact O-N 3.33Å
826	V	87.3	Confident	79.1	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-63.1	-41	172.6	176.7	0	0	0	0	111.2	A809 M822 R824 L829 L830 D855	A809-V826 HydrophobicContact CB-CG1 4.42Å; A809-V826 HydrophobicContact CB-CG2 3.74Å; M822-V826 WeakPolarHBondContact O-CG2 3.48Å; M822-V826 PolarHBondContact O-N 3.14Å; R824-V826 VanDerWaalsContact C-N 3.31Å; R824-V826 PolarHBondContact O-N 2.84Å; V826-L829 CarbonylContact O-C 3.55Å; V826-L829 WeakPolarHBondContact O-CA 3.44Å; V826-L829 PolarHBondContact O-N 3.24Å; V826-L830 HydrophobicContact CG1-CD1 4.44Å; V826-L830 VanDerWaalsContact O-CG 3.32Å; V826-L830 WeakPolarHBondContact O-CG 3.39Å; V826-L830 PolarHBondContact O-N 2.89Å; V826-D855 HydrophobicContact CG1-CB 4.41Å
827	S	88.7	Confident	79.4	Confident	49 Å²	49	44.2 Å²	44.2	34%	0.343	27%	0.27	S	S	.	.	H	α-helix	trans	-68.7	-35.2	-180	-54.4	0	0	0	0	112.6	R812 D823 R824 V825 L830 A831	R812-S827 PolarHBondContact NH1-OG 2.53Å; R812-S827 VanDerWaalsContact NH1-OG 3.1Å; R812-S827 PolarHBondContact NH2-OG 3.32Å; D823-S827 WeakPolarHBondContact O-CB 3.41Å; D823-S827 PolarHBondContact O-N 2.86Å; D823-S827 PolarHBondContact O-OG 3.36Å; R824-S827 CarbonylContact O-C 3.6Å; R824-S827 WeakPolarHBondContact O-CA 3.39Å; R824-S827 PolarHBondContact O-N 2.81Å; V825-S827 VanDerWaalsContact C-N 3.34Å; V825-S827 PolarHBondContact O-N 2.9Å; S827-L830 PolarHBondContact O-N 3.45Å; S827-A831 PolarHBondContact O-N 3.14Å
828	Q	89.7	Confident	79.4	Confident	25 Å²	25	43.9 Å²	43.9	12%	0.117	28%	0.276	C	S	.	.	H	α-helix	trans	-69.5	-41.4	170	-172.6	61.7	48	0	0	111.5	V785 R786 R824 V825 L830 A831 E832	V785-Q828 HydrophobicContact CB-CG 4.5Å; V785-Q828 HydrophobicContact CG1-CG 4.23Å; R786-Q828 HydrophobicContact CG-CG 4.1Å; R786-Q828 VanDerWaalsContact NE-CD 3.27Å; R786-Q828 VanDerWaalsContact NE-NE2 3.14Å; R824-Q828 PolarHBondContact O-N 2.75Å; V825-Q828 PolarHBondContact O-N 2.91Å; Q828-L830 PolarHBondContact O-N 3.05Å; Q828-A831 PolarHBondContact O-N 3.26Å; Q828-E832 PolarHBondContact NE2-OE1 3.28Å; Q828-E832 PolarHBondContact O-N 2.73Å
829	L	89	Confident	79.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-24.6	-72	154.3	164.6	153.5	0	0	0	113.5	V785 F789 F802 L808 V825 V826 E832 L833 L858	V785-L829 HydrophobicContact CG1-CB 3.75Å; F789-L829 HydrophobicContact CE2-CB 4.38Å; F789-L829 HydrophobicContact CE2-CD1 3.77Å; F789-L829 HydrophobicContact CZ-CD1 3.8Å; F802-L829 HydrophobicContact CE1-CD1 4.29Å; F802-L829 HydrophobicContact CE2-CD1 3.95Å; F802-L829 HydrophobicContact CZ-CD1 3.79Å; L808-L829 HydrophobicContact CD2-CD2 3.98Å; L808-L829 HydrophobicContact CG-CD2 4.46Å; V825-L829 WeakPolarHBondContact O-CA 3.49Å; V825-L829 PolarHBondContact O-N 3.33Å; V826-L829 CarbonylContact O-C 3.55Å; V826-L829 WeakPolarHBondContact O-CA 3.44Å; V826-L829 PolarHBondContact O-N 3.24Å; L829-E832 PolarHBondContact O-N 3.22Å; L829-L833 HydrophobicContact CD1-CD1 4.4Å; L829-L833 HydrophobicContact CD1-CG 4.47Å; L829-L833 HydrophobicContact CG-CD1 4.26Å; L829-L833 WeakPolarHBondContact O-CG 3.03Å; L829-L833 PolarHBondContact O-N 3.15Å; L829-L858 HydrophobicContact CD2-CD2 4.46Å
830	L	88.6	Confident	79.2	Confident	15 Å²	15	43.1 Å²	43.1	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-64.6	-39.9	-176.3	-61.8	176.9	0	0	0	111.9	V826 S827 Q828 L833 D834 A857 L858	V826-L830 HydrophobicContact CG1-CD1 4.44Å; V826-L830 VanDerWaalsContact O-CG 3.32Å; V826-L830 WeakPolarHBondContact O-CG 3.39Å; V826-L830 PolarHBondContact O-N 2.89Å; S827-L830 PolarHBondContact O-N 3.45Å; Q828-L830 PolarHBondContact O-N 3.05Å; L830-L833 PolarHBondContact O-N 3.25Å; L830-D834 WeakPolarHBondContact O-CB 3.37Å; L830-D834 PolarHBondContact O-N 3.17Å; L830-A857 HydrophobicContact CD1-CB 3.83Å; L830-A857 HydrophobicContact CD2-CB 4.47Å; L830-L858 HydrophobicContact CD2-CD2 3.39Å; L830-L858 HydrophobicContact CD2-CG 3.87Å
831	A	88.1	Confident	79.1	Confident	51 Å²	51	45.6 Å²	45.6	42%	0.421	26%	0.256	S	S	.	.	H	α-helix	trans	-64.6	-39.2	179.6	0	0	0	0	0	113.2	S827 Q828 G835	S827-A831 PolarHBondContact O-N 3.14Å; Q828-A831 PolarHBondContact O-N 3.26Å; A831-G835 PolarHBondContact O-N 3.12Å
832	E	87.4	Confident	79.2	Confident	24 Å²	24	44.8 Å²	44.8	11%	0.112	25%	0.25	C	S	.	.	H	α-helix	trans	-69.9	-41.7	175.3	-68.1	-63.9	143.5	0	0	111.9	V785 F789 R793 Q828 L829 G835 L836	V785-E832 HydrophobicContact CG1-CG 4.35Å; F789-E832 HydrophobicContact CB-CB 4.26Å; F789-E832 HydrophobicContact CB-CG 4.19Å; F789-E832 VanDerWaalsContact CB-OE2 3.31Å; F789-E832 WeakPolarHBondContact CB-OE2 3.18Å; F789-E832 HydrophobicContact CD1-CB 4.08Å; F789-E832 HydrophobicContact CD2-CB 3.41Å; F789-E832 VanDerWaalsContact CD2-CB 3.41Å; F789-E832 HydrophobicContact CD2-CG 3.59Å; F789-E832 HydrophobicContact CE1-CB 4.26Å; F789-E832 HydrophobicContact CE2-CB 3.63Å; F789-E832 HydrophobicContact CE2-CG 4.17Å; F789-E832 HydrophobicContact CG-CB 3.66Å; F789-E832 HydrophobicContact CG-CG 3.99Å; F789-E832 HydrophobicContact CZ-CB 4.05Å; R793-E832 IonicContact CZ-OE2 3.4Å; R793-E832 VanDerWaalsContact CZ-OE2 3.3Å; R793-E832 IonicContact NH1-OE2 2.68Å; R793-E832 PolarHBondContact NH1-OE2 3.44Å; R793-E832 IonicContact NH2-OE2 2.77Å; R793-E832 PolarHBondContact NH2-OE2 3.18Å; Q828-E832 PolarHBondContact NE2-OE1 3.28Å; Q828-E832 PolarHBondContact O-N 2.73Å; L829-E832 PolarHBondContact O-N 3.22Å; E832-G835 PolarHBondContact O-N 3.14Å; E832-G835 VanDerWaalsContact O-N 3.14Å; E832-L836 WeakPolarHBondContact O-CG 3.33Å; E832-L836 PolarHBondContact O-N 2.98Å
833	L	86.3	Confident	79.5	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-45.6	174.9	-69	173.5	0	0	0	111.5	F789 L829 L830 G835 L836 H837 V844 L858 R863 F864	F789-L833 HydrophobicContact CE1-CD2 4.2Å; F789-L833 HydrophobicContact CZ-CD2 4.04Å; F789-L833 HydrophobicContact CZ-CG 4.4Å; L829-L833 HydrophobicContact CD1-CD1 4.4Å; L829-L833 HydrophobicContact CD1-CG 4.47Å; L829-L833 HydrophobicContact CG-CD1 4.26Å; L829-L833 WeakPolarHBondContact O-CG 3.03Å; L829-L833 PolarHBondContact O-N 3.15Å; L830-L833 PolarHBondContact O-N 3.25Å; L833-G835 VanDerWaalsContact C-N 3.27Å; L833-G835 PolarHBondContact O-N 2.59Å; L833-L836 PolarHBondContact O-N 2.99Å; L833-H837 PolarHBondContact O-CE1 2.85Å; L833-H837 VanDerWaalsContact O-CE1 3.31Å; L833-H837 PolarHBondContact O-ND1 3.01Å; L833-V844 HydrophobicContact CD2-CB 4.29Å; L833-V844 HydrophobicContact CD2-CG1 4.11Å; L833-V844 HydrophobicContact CD2-CG2 3.89Å; L833-L858 HydrophobicContact CD1-CD2 3.74Å; L833-R863 HydrophobicContact CB-CG 4.46Å; L833-F864 HydrophobicContact CD1-CE2 4.25Å
834	D	83.2	Confident	79.8	Confident	70 Å²	70	40.8 Å²	40.8	37%	0.374	23%	0.229	S	C	.	.	H	α-helix	trans	-63	-35.2	174.7	-64.8	-11	0	0	0	111.2	L830 H837 R863	L830-D834 WeakPolarHBondContact O-CB 3.37Å; L830-D834 PolarHBondContact O-N 3.17Å; D834-H837 PolarHBondContact O-ND1 3.3Å; D834-R863 IonicContact OD1-CZ 2.83Å; D834-R863 IonicContact OD1-NE 3.64Å; D834-R863 PolarHBondContact OD1-NE 2.83Å; D834-R863 IonicContact OD1-NH2 2.68Å; D834-R863 PolarHBondContact OD1-NH2 3.44Å; D834-R863 IonicContact OD2-CZ 3.17Å; D834-R863 IonicContact OD2-NE 2.79Å; D834-R863 IonicContact OD2-NH2 2.71Å; D834-R863 PolarHBondContact OD2-NH2 2.69Å
835	G	78	Confident	80.1	Confident	34 Å²	34	35 Å²	35	35%	0.351	21%	0.207	S	C	.	.	H	α-helix	trans	-67.9	-33.6	175.7	0	0	0	0	0	114.9	A831 E832 L833 H837 S838	A831-G835 PolarHBondContact O-N 3.12Å; E832-G835 PolarHBondContact O-N 3.14Å; E832-G835 VanDerWaalsContact O-N 3.14Å; L833-G835 VanDerWaalsContact C-N 3.27Å; L833-G835 PolarHBondContact O-N 2.59Å; G835-H837 PolarHBondContact O-N 2.75Å; G835-H837 VanDerWaalsContact O-N 3.11Å; G835-S838 PolarHBondContact O-N 3.5Å; G835-S838 PolarHBondContact O-OG 3.24Å
836	L	71.8	Confident	80.4	Confident	11 Å²	11	34.7 Å²	34.7	6%	0.058	21%	0.206	C	C	.	.	H	α-helix	trans	-61.5	-19.1	-179.5	-76.5	-174.3	0	0	0	114.1	F789 R793 E832 L833 S838 T839 V842 V844	F789-L836 HydrophobicContact CD1-CD1 3.87Å; F789-L836 HydrophobicContact CD1-CD2 4.26Å; F789-L836 HydrophobicContact CD1-CG 4.14Å; F789-L836 HydrophobicContact CE1-CD1 3.64Å; F789-L836 HydrophobicContact CE1-CG 4.28Å; R793-L836 HydrophobicContact CG-CD2 4.25Å; E832-L836 WeakPolarHBondContact O-CG 3.33Å; E832-L836 PolarHBondContact O-N 2.98Å; L833-L836 PolarHBondContact O-N 2.99Å; L836-S838 PolarHBondContact O-N 3.48Å; L836-T839 PolarHBondContact O-N 2.75Å; L836-T839 VanDerWaalsContact O-O 3.06Å; L836-T839 PolarHBondContact O-OG1 3.19Å; L836-V842 HydrophobicContact CD1-CG1 3.86Å; L836-V842 HydrophobicContact CD2-CB 4.01Å; L836-V842 HydrophobicContact CD2-CG1 3.83Å; L836-V842 HydrophobicContact CD2-CG2 4.45Å; L836-V844 HydrophobicContact CD1-CG2 3.52Å
837	H	61.3	Low	80.7	Confident	60 Å²	60	34.7 Å²	34.7	28%	0.278	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-17	179.5	-66	61.5	0	0	0	113.9	R736 S738 L833 D834 G835 G862	R736-H837 PolarHBondContact NH1-O 3.36Å; S738-H837 PolarHBondContact OG-CE1 2.88Å; S738-H837 PolarHBondContact OG-NE2 2.94Å; L833-H837 PolarHBondContact O-CE1 2.85Å; L833-H837 VanDerWaalsContact O-CE1 3.31Å; L833-H837 PolarHBondContact O-ND1 3.01Å; D834-H837 PolarHBondContact O-ND1 3.3Å; G835-H837 PolarHBondContact O-N 2.75Å; G835-H837 VanDerWaalsContact O-N 3.11Å; H837-G862 PolarHBondContact CE1-O 3.39Å; H837-G862 WeakPolarHBondContact NE2-CA 3.33Å; H837-G862 PolarHBondContact NE2-O 2.78Å
838	S	58.3	Low	80.8	Confident	95 Å²	95	32.4 Å²	32.4	66%	0.664	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-25.1	176	63.6	0	0	0	0	113.6	G835 L836	G835-S838 PolarHBondContact O-N 3.5Å; G835-S838 PolarHBondContact O-OG 3.24Å; L836-S838 PolarHBondContact O-N 3.48Å
839	T	57.6	Low	80.8	Confident	49 Å²	49	33.2 Å²	33.2	30%	0.301	20%	0.195	S	C	.	.			trans	-103.2	117.6	-176	45.8	0	0	0	0	110.6	R793 L836 D841	R793-T839 HydrophobicContact CG-CG2 4.45Å; L836-T839 PolarHBondContact O-N 2.75Å; L836-T839 VanDerWaalsContact O-O 3.06Å; L836-T839 PolarHBondContact O-OG1 3.19Å; T839-D841 VanDerWaalsContact C-N 3.28Å; T839-D841 PolarHBondContact O-N 3.14Å
840	Q	59.8	Low	80.8	Confident	118 Å²	118	39.8 Å²	39.8	55%	0.551	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-10.7	-165.1	-63.5	179.5	1.1	0	0	115.1
841	D	72.4	Confident	80.7	Confident	81 Å²	81	39.3 Å²	39.3	43%	0.433	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.6	8.3	-159.1	-59.6	-36.7	0	0	0	114.9	A796 P797 C798 T839	A796-D841 HydrophobicContact CB-CB 3.92Å; P797-D841 VanDerWaalsContact CA-O 3.23Å; P797-D841 WeakPolarHBondContact CA-O 3.33Å; P797-D841 HydrophobicContact CB-CB 4.08Å; C798-D841 PolarHBondContact N-O 3.41Å; T839-D841 VanDerWaalsContact C-N 3.28Å; T839-D841 PolarHBondContact O-N 3.14Å
842	V	81.4	Confident	80.6	Confident	15 Å²	15	39.5 Å²	39.5	9%	0.091	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.3	-176.8	179.3	0	0	0	0	110.5	A792 R793 A796 I800 L836	A792-V842 HydrophobicContact CB-CG1 4.41Å; R793-V842 HydrophobicContact CG-CG2 4.45Å; A796-V842 HydrophobicContact CB-CG2 4.32Å; I800-V842 HydrophobicContact CD1-CG1 3.91Å; I800-V842 HydrophobicContact CG1-CG1 4.15Å; L836-V842 HydrophobicContact CD1-CG1 3.86Å; L836-V842 HydrophobicContact CD2-CB 4.01Å; L836-V842 HydrophobicContact CD2-CG1 3.83Å; L836-V842 HydrophobicContact CD2-CG2 4.45Å
843	F	86.4	Confident	80.5	Confident	22 Å²	22	41 Å²	41	10%	0.096	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	142.7	178.3	-60.6	-84.8	0	0	0	111.2	P724 L725 L763 C798 I799 I800	P724-F843 HydrophobicContact CB-CE1 4.4Å; P724-F843 HydrophobicContact CB-CZ 4.31Å; P724-F843 HydrophobicContact CG-CE1 3.68Å; P724-F843 HydrophobicContact CG-CZ 3.79Å; L725-F843 HydrophobicContact CD2-CE2 3.97Å; L725-F843 HydrophobicContact CD2-CZ 4.37Å; L725-F843 HydrophobicContact CG-CE2 4.25Å; L725-F843 HydrophobicContact CG-CZ 4.32Å; L763-F843 HydrophobicContact CD1-CD2 4.16Å; L763-F843 HydrophobicContact CD1-CE2 4.44Å; C798-F843 PolarHBondContact O-N 2.78Å; I799-F843 CarbonylContact C-O 3.58Å; I799-F843 WeakPolarHBondContact CA-O 3.29Å; I799-F843 HydrophobicContact CG1-CB 4.37Å; I800-F843 PolarHBondContact N-O 3.18Å
844	V	89.7	Confident	80.5	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.9	176.8	-173.2	0	0	0	0	110.8	G739 L740 F789 I800 F802 L833 L836 F864	G739-V844 CarbonylContact C-O 3.58Å; G739-V844 WeakPolarHBondContact CA-O 3.46Å; L740-V844 PolarHBondContact N-O 3.26Å; F789-V844 HydrophobicContact CE1-CG2 4.27Å; I800-V844 HydrophobicContact CD1-CG2 4.38Å; F802-V844 HydrophobicContact CD2-CG1 3.67Å; F802-V844 HydrophobicContact CE2-CG1 3.69Å; L833-V844 HydrophobicContact CD2-CB 4.29Å; L833-V844 HydrophobicContact CD2-CG1 4.11Å; L833-V844 HydrophobicContact CD2-CG2 3.89Å; L836-V844 HydrophobicContact CD1-CG2 3.52Å; V844-F864 HydrophobicContact CG1-CE1 3.96Å; V844-F864 HydrophobicContact CG1-CZ 4.01Å
845	I	91.4	Very high	80.8	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.015	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	117.1	171.5	-57.1	179	0	0	0	108.5	I721 L740 L742 A754 I799 I800 F801 F802	I721-I845 HydrophobicContact CD1-CD1 3.96Å; L740-I845 HydrophobicContact CD2-CG2 4.28Å; L740-I845 CarbonylContact O-C 3.56Å; L740-I845 VanDerWaalsContact O-CA 3.28Å; L740-I845 WeakPolarHBondContact O-CA 3.41Å; L742-I845 HydrophobicContact CD1-CG2 3.88Å; L742-I845 HydrophobicContact CG-CG2 4.06Å; A754-I845 HydrophobicContact CB-CG2 4.29Å; I799-I845 HydrophobicContact CD1-CD1 4.45Å; I799-I845 HydrophobicContact CG2-CB 4.45Å; I799-I845 HydrophobicContact CG2-CD1 3.69Å; I799-I845 HydrophobicContact CG2-CG1 3.89Å; I800-I845 PolarHBondContact O-N 2.94Å; F801-I845 CarbonylContact C-O 3.34Å; F801-I845 VanDerWaalsContact CA-O 3.3Å; F801-I845 WeakPolarHBondContact CA-O 3.38Å; F801-I845 HydrophobicContact CD2-CB 4.01Å; F801-I845 HydrophobicContact CD2-CG2 3.78Å; F801-I845 HydrophobicContact CE2-CG2 4.07Å; F802-I845 PolarHBondContact N-O 3.14Å
846	G	92.3	Very high	81.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	146.9	169	0	0	0	0	0	110.9	L740 L742 F802	L740-G846 PolarHBondContact O-N 2.84Å; L742-G846 PolarHBondContact N-O 2.83Å; F802-G846 CarbonylContact O-C 3.6Å
847	A	93.1	Very high	81.9	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	136.1	165	0	0	0	0	0	110.6	L742 K750 F801 F802 E804 L805	L742-A847 HydrophobicContact CB-CB 4.45Å; L742-A847 WeakPolarHBondContact O-CA 3.37Å; K750-A847 HydrophobicContact CB-CB 4.35Å; F801-A847 HydrophobicContact CE2-CB 3.72Å; F801-A847 HydrophobicContact CZ-CB 3.59Å; F802-A847 PolarHBondContact O-N 3.41Å; E804-A847 PolarHBondContact N-O 2.7Å; L805-A847 PolarHBondContact N-O 3.48Å
848	T	91.3	Very high	83	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	147	174.7	-179	0	0	0	0	111.7	L741 L742 H743 K750 D806 R850 P851	L741-T848 HydrophobicContact CD1-CG2 4.05Å; L741-T848 HydrophobicContact CD2-CG2 4.47Å; L741-T848 HydrophobicContact CG-CG2 4.37Å; L742-T848 PolarHBondContact O-N 3.04Å; H743-T848 WeakPolarHBondContact CA-O 3.41Å; H743-T848 HydrophobicContact CB-CG2 3.86Å; K750-T848 VanDerWaalsContact CE-O 3.31Å; K750-T848 WeakPolarHBondContact CE-O 3.32Å; D806-T848 WeakPolarHBondContact CB-OG1 3.23Å; D806-T848 WeakPolarHBondContact OD1-CA 3.5Å; D806-T848 WeakPolarHBondContact OD1-CB 3.41Å; D806-T848 PolarHBondContact OD1-OG1 3.21Å; T848-R850 PolarHBondContact OG1-N 3.11Å; T848-P851 HydrophobicContact CG2-CB 4.08Å
849	N	90.3	Very high	84.3	Confident	42 Å²	42	35.5 Å²	35.5	23%	0.225	18%	0.183	C	C	.	.	S	Bend	trans	-91.7	-18.9	167.8	-63.2	-54.1	0	0	0	111.8	K750 Y970	K750-N849 WeakPolarHBondContact CE-OD1 3.45Å; K750-N849 PolarHBondContact NZ-OD1 3.27Å; N849-Y970 WeakPolarHBondContact O-CE1 3.38Å; N849-Y970 PolarHBondContact O-OH 3.46Å
850	R	87.3	Confident	85.6	Confident	138 Å²	138	40.8 Å²	40.8	52%	0.521	20%	0.198	S	C	.	.			trans	-135	73.5	-172.1	-65.5	-175.6	176	177.2	-0.1	111.9	D806 T848 D852 L853	D806-R850 HydrophobicContact CB-CB 4.5Å; T848-R850 PolarHBondContact OG1-N 3.11Å; R850-D852 WeakPolarHBondContact CA-OD1 3.39Å; R850-D852 PolarHBondContact O-N 3.28Å; R850-D852 VanDerWaalsContact O-N 3.07Å; R850-L853 HydrophobicContact CB-CB 4.36Å; R850-L853 HydrophobicContact CB-CD1 3.98Å; R850-L853 HydrophobicContact CB-CG 4.06Å; R850-L853 HydrophobicContact CG-CD1 4.43Å; R850-L853 PolarHBondContact O-N 3.12Å
851	P	87.1	Confident	86.5	Confident	5 Å²	5	41 Å²	41	3%	0.032	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-11.8	178.2	30.9	-38.3	0	0	0	113.3	H743 T848 L853 I973 F977	H743-P851 HydrophobicContact CB-CB 4.2Å; H743-P851 HydrophobicContact CB-CG 4.06Å; T848-P851 HydrophobicContact CG2-CB 4.08Å; P851-L853 VanDerWaalsContact C-N 3.32Å; P851-I973 HydrophobicContact CG-CG2 3.9Å; P851-F977 HydrophobicContact CB-CE2 3.82Å; P851-F977 HydrophobicContact CB-CZ 4.2Å; P851-F977 HydrophobicContact CG-CE2 4.05Å
852	D	85.6	Confident	86.6	Confident	56 Å²	56	38 Å²	38	30%	0.299	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-6.7	173.2	59.6	-35.6	0	0	0	114.6	R814 R850 R969	R814-D852 PolarHBondContact NH1-O 2.82Å; R850-D852 WeakPolarHBondContact CA-OD1 3.39Å; R850-D852 PolarHBondContact O-N 3.28Å; R850-D852 VanDerWaalsContact O-N 3.07Å; D852-R969 IonicContact OD2-CZ 3.75Å; D852-R969 IonicContact OD2-NH2 2.71Å; D852-R969 PolarHBondContact OD2-NH2 2.69Å
853	L	85.4	Confident	86.8	Confident	54 Å²	54	39 Å²	39	28%	0.283	20%	0.2	S	C	.	.	S	Bend	trans	-103.2	-11.5	172.7	-62.9	-176.2	0	0	0	113.6	P810 S811 R850 P851	P810-L853 CarbonylContact C-O 3.56Å; P810-L853 WeakPolarHBondContact CA-O 3.39Å; S811-L853 PolarHBondContact N-O 2.83Å; R850-L853 HydrophobicContact CB-CB 4.36Å; R850-L853 HydrophobicContact CB-CD1 3.98Å; R850-L853 HydrophobicContact CB-CG 4.06Å; R850-L853 HydrophobicContact CG-CD1 4.43Å; R850-L853 PolarHBondContact O-N 3.12Å; P851-L853 VanDerWaalsContact C-N 3.32Å
854	L	87.6	Confident	86.8	Confident	10 Å²	10	38 Å²	38	5%	0.052	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-71.2	148.2	-175.6	-161.3	100.3	0	0	0	112.4	L741 L805 A809 P856 L858 L859	L741-L854 HydrophobicContact CD2-CD2 4.1Å; L805-L854 HydrophobicContact CB-CD1 4.41Å; L805-L854 HydrophobicContact CD2-CD1 3.88Å; L805-L854 HydrophobicContact CG-CD1 3.88Å; A809-L854 WeakPolarHBondContact O-CA 3.36Å; L854-P856 WeakPolarHBondContact O-CD 3.2Å; L854-L858 HydrophobicContact CD1-CD1 4.1Å; L854-L858 HydrophobicContact CD2-CB 3.85Å; L854-L858 HydrophobicContact CD2-CD1 4.04Å; L854-L858 HydrophobicContact CG-CD1 3.93Å; L854-L859 HydrophobicContact CD2-CD1 4.4Å; L854-L859 HydrophobicContact CD2-CD2 3.7Å; L854-L859 HydrophobicContact CD2-CG 3.89Å
855	D	87.9	Confident	86.2	Confident	11 Å²	11	40.5 Å²	40.5	6%	0.059	21%	0.209	C	C	.	.			trans	-63.5	118.8	167.9	-175.1	-10.3	0	0	0	110.6	A809 R812 V826 A857 L858	A809-D855 PolarHBondContact O-N 3.32Å; A809-D855 VanDerWaalsContact O-N 3.1Å; R812-D855 IonicContact CZ-OD2 2.68Å; R812-D855 IonicContact NE-OD2 2.89Å; R812-D855 PolarHBondContact NE-OD2 3.21Å; R812-D855 IonicContact NH2-OD2 3.72Å; V826-D855 HydrophobicContact CG1-CB 4.41Å; D855-A857 PolarHBondContact O-N 3.3Å; D855-A857 VanDerWaalsContact OD1-CB 3.24Å; D855-A857 WeakPolarHBondContact OD1-CB 3.29Å; D855-A857 PolarHBondContact OD1-N 3.24Å; D855-L858 WeakPolarHBondContact O-CB 3.47Å; D855-L858 PolarHBondContact O-N 2.92Å
856	P	86.1	Confident	85.8	Confident	86 Å²	86	43.8 Å²	43.8	56%	0.558	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-61.7	-13.1	177.7	27	-36.5	0	0	0	113.7	L854 L858 L859	L854-P856 WeakPolarHBondContact O-CD 3.2Å; P856-L858 PolarHBondContact O-N 3.37Å; P856-L859 PolarHBondContact O-N 3.35Å
857	A	87.1	Confident	85.6	Confident	12 Å²	12	46.4 Å²	46.4	10%	0.099	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-61.5	-28.1	170.1	0	0	0	0	0	113.2	L830 D855 L859 R863	L830-A857 HydrophobicContact CD1-CB 3.83Å; L830-A857 HydrophobicContact CD2-CB 4.47Å; D855-A857 PolarHBondContact O-N 3.3Å; D855-A857 VanDerWaalsContact OD1-CB 3.24Å; D855-A857 WeakPolarHBondContact OD1-CB 3.29Å; D855-A857 PolarHBondContact OD1-N 3.24Å; A857-L859 VanDerWaalsContact C-N 3.32Å; A857-R863 VanDerWaalsContact O-CD 3.29Å; A857-R863 WeakPolarHBondContact O-CD 3.42Å; A857-R863 PolarHBondContact O-NH1 3.46Å
858	L	86	Confident	85.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-73.1	-24	177	-75.2	168.4	0	0	0	113.2	A809 L829 L830 L833 L854 D855 P856 R860 R863 F864	A809-L858 HydrophobicContact CB-CD1 3.39Å; L829-L858 HydrophobicContact CD2-CD2 4.46Å; L830-L858 HydrophobicContact CD2-CD2 3.39Å; L830-L858 HydrophobicContact CD2-CG 3.87Å; L833-L858 HydrophobicContact CD1-CD2 3.74Å; L854-L858 HydrophobicContact CD1-CD1 4.1Å; L854-L858 HydrophobicContact CD2-CB 3.85Å; L854-L858 HydrophobicContact CD2-CD1 4.04Å; L854-L858 HydrophobicContact CG-CD1 3.93Å; D855-L858 WeakPolarHBondContact O-CB 3.47Å; D855-L858 PolarHBondContact O-N 2.92Å; P856-L858 PolarHBondContact O-N 3.37Å; L858-R860 VanDerWaalsContact C-N 3.31Å; L858-R863 VanDerWaalsContact O-CB 3.26Å; L858-R863 WeakPolarHBondContact O-CB 3.47Å; L858-F864 HydrophobicContact CB-CD2 4.11Å; L858-F864 HydrophobicContact CD2-CD2 4.38Å; L858-F864 HydrophobicContact CD2-CE2 4.08Å; L858-F864 PolarHBondContact O-N 2.84Å; L858-F864 VanDerWaalsContact O-N 3.16Å
859	L	85	Confident	85.3	Confident	40 Å²	40	48.4 Å²	48.4	21%	0.209	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-89.7	7.4	-177.4	-56.2	-177.9	0	0	0	113.4	L741 L854 P856 A857 L867 F977	L741-L859 HydrophobicContact CD2-CD2 3.59Å; L854-L859 HydrophobicContact CD2-CD1 4.4Å; L854-L859 HydrophobicContact CD2-CD2 3.7Å; L854-L859 HydrophobicContact CD2-CG 3.89Å; P856-L859 PolarHBondContact O-N 3.35Å; A857-L859 VanDerWaalsContact C-N 3.32Å; L859-L867 HydrophobicContact CD2-CD2 3.99Å; L859-F977 HydrophobicContact CD1-CD1 4.19Å; L859-F977 HydrophobicContact CD1-CE1 3.45Å; L859-F977 VanDerWaalsContact CD1-CE1 3.45Å; L859-F977 HydrophobicContact CD1-CZ 4.13Å
860	R	85.4	Confident	85.2	Confident	160 Å²	160	46.4 Å²	46.4	60%	0.604	24%	0.235	S	C	*	.	S	Bend	trans	-77.4	146.7	178.4	-66.2	-176.2	179.6	-172.9	0.1	110.5	L858 G862 R863	L858-R860 VanDerWaalsContact C-N 3.31Å; R860-G862 PolarHBondContact O-N 3.39Å; R860-R863 WeakPolarHBondContact O-CB 3.44Å; R860-R863 PolarHBondContact O-N 2.94Å
861	P	77.4	Confident	85	Confident	124 Å²	124	40.4 Å²	40.4	81%	0.805	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.9	138.4	171.7	-25.7	34.6	0	0	0	111.7	D865	P861-D865 WeakPolarHBondContact CA-OD1 3.44Å
862	G	74.3	Confident	84.7	Confident	18 Å²	18	41.1 Å²	41.1	19%	0.186	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.6	-8.4	-166	0	0	0	0	0	113.8	S738 H837 R860 D865	S738-G862 WeakPolarHBondContact CB-O 3.34Å; S738-G862 PolarHBondContact OG-O 3.43Å; H837-G862 PolarHBondContact CE1-O 3.39Å; H837-G862 WeakPolarHBondContact NE2-CA 3.33Å; H837-G862 PolarHBondContact NE2-O 2.78Å; R860-G862 PolarHBondContact O-N 3.39Å; G862-D865 WeakPolarHBondContact CA-OD1 3.38Å; G862-D865 PolarHBondContact N-OD1 3.49Å
863	R	85.8	Confident	84.3	Confident	34 Å²	34	39.5 Å²	39.5	13%	0.128	21%	0.213	C	C	.	.	S	Bend	trans	-120.6	-103.9	-176.7	-64.8	169.4	180	167.6	-2.2	110.6	S738 G739 L833 D834 A857 L858 R860 D865	S738-R863 CarbonylContact C-O 3.6Å; S738-R863 WeakPolarHBondContact CB-O 3.33Å; G739-R863 WeakPolarHBondContact CA-O 3.42Å; G739-R863 PolarHBondContact N-O 3.26Å; L833-R863 HydrophobicContact CB-CG 4.46Å; D834-R863 IonicContact OD1-CZ 2.83Å; D834-R863 IonicContact OD1-NE 3.64Å; D834-R863 PolarHBondContact OD1-NE 2.83Å; D834-R863 IonicContact OD1-NH2 2.68Å; D834-R863 PolarHBondContact OD1-NH2 3.44Å; D834-R863 IonicContact OD2-CZ 3.17Å; D834-R863 IonicContact OD2-NE 2.79Å; D834-R863 IonicContact OD2-NH2 2.71Å; D834-R863 PolarHBondContact OD2-NH2 2.69Å; A857-R863 VanDerWaalsContact O-CD 3.29Å; A857-R863 WeakPolarHBondContact O-CD 3.42Å; A857-R863 PolarHBondContact O-NH1 3.46Å; L858-R863 VanDerWaalsContact O-CB 3.26Å; L858-R863 WeakPolarHBondContact O-CB 3.47Å; R860-R863 WeakPolarHBondContact O-CB 3.44Å; R860-R863 PolarHBondContact O-N 2.94Å; R863-D865 VanDerWaalsContact C-N 3.32Å; R863-D865 PolarHBondContact N-OD1 2.9Å; R863-D865 PolarHBondContact O-N 2.94Å
864	F	86.1	Confident	83.6	Confident	3 Å²	3	42.8 Å²	42.8	1%	0.013	23%	0.227	C	C	.	.	S	Bend	trans	-87.4	76	169.1	-70	-70.5	0	0	0	110	G739 L741 L805 L833 V844 L858 K866	G739-F864 CarbonylContact O-C 3.56Å; L741-F864 HydrophobicContact CB-CB 4Å; L741-F864 HydrophobicContact CB-CD1 3.92Å; L741-F864 HydrophobicContact CB-CG 4.03Å; L805-F864 HydrophobicContact CD2-CD2 4.49Å; L805-F864 HydrophobicContact CD2-CE2 3.66Å; L805-F864 HydrophobicContact CD2-CZ 3.81Å; L833-F864 HydrophobicContact CD1-CE2 4.25Å; V844-F864 HydrophobicContact CG1-CE1 3.96Å; V844-F864 HydrophobicContact CG1-CZ 4.01Å; L858-F864 HydrophobicContact CB-CD2 4.11Å; L858-F864 HydrophobicContact CD2-CD2 4.38Å; L858-F864 HydrophobicContact CD2-CE2 4.08Å; L858-F864 PolarHBondContact O-N 2.84Å; L858-F864 VanDerWaalsContact O-N 3.16Å; F864-K866 PolarHBondContact O-N 3.26Å
865	D	78.3	Confident	83.4	Confident	54 Å²	54	47 Å²	47	29%	0.289	25%	0.25	S	C	.	.			trans	-62.7	-27.3	-177.2	-60.4	-37.5	0	0	0	113.5	R737 S738 G739 P861 G862 R863	R737-D865 WeakPolarHBondContact CA-OD2 3.19Å; S738-D865 PolarHBondContact N-OD2 3.42Å; G739-D865 PolarHBondContact O-N 2.86Å; G739-D865 VanDerWaalsContact O-N 3.12Å; P861-D865 WeakPolarHBondContact CA-OD1 3.44Å; G862-D865 WeakPolarHBondContact CA-OD1 3.38Å; G862-D865 PolarHBondContact N-OD1 3.49Å; R863-D865 VanDerWaalsContact C-N 3.32Å; R863-D865 PolarHBondContact N-OD1 2.9Å; R863-D865 PolarHBondContact O-N 2.94Å
866	K	82.9	Confident	83.2	Confident	71 Å²	71	50.6 Å²	50.6	31%	0.309	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	110.7	-176.4	-80.8	-64	-162.5	161.6	0	112.1	E716 G739 L740 L741 F864	E716-K866 WeakPolarHBondContact OE1-CE 3.32Å; E716-K866 IonicContact OE1-NZ 3.71Å; E716-K866 PolarHBondContact OE1-NZ 3.3Å; G739-K866 PolarHBondContact O-N 3.22Å; L740-K866 CarbonylContact C-O 3.45Å; L740-K866 WeakPolarHBondContact CA-O 3.19Å; L740-K866 HydrophobicContact CD1-CB 4.31Å; L740-K866 HydrophobicContact CG-CB 4.31Å; L741-K866 PolarHBondContact N-O 3.24Å; F864-K866 PolarHBondContact O-N 3.26Å
867	L	87.1	Confident	83.2	Confident	55 Å²	55	49.6 Å²	49.6	29%	0.288	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	114.8	171.1	-78.2	152.9	0	0	0	109.5	L741 L859 F977	L741-L867 HydrophobicContact CB-CD2 4.26Å; L741-L867 HydrophobicContact CD2-CD2 3.86Å; L741-L867 HydrophobicContact CG-CD2 4.33Å; L859-L867 HydrophobicContact CD2-CD2 3.99Å; L867-F977 HydrophobicContact CD1-CB 4.42Å; L867-F977 HydrophobicContact CD1-CD1 4.31Å
868	V	88.8	Confident	83.1	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	117.2	-177.7	179.6	0	0	0	0	109.8	V713 L740 L741 L742 H743	V713-V868 HydrophobicContact CB-CG1 4.25Å; V713-V868 HydrophobicContact CG1-CG1 3.76Å; V713-V868 HydrophobicContact CG2-CG1 3.94Å; L740-V868 HydrophobicContact CD1-CG2 3.95Å; L740-V868 HydrophobicContact CD2-CB 4.42Å; L740-V868 HydrophobicContact CD2-CG2 4.17Å; L740-V868 HydrophobicContact CG-CG2 4.01Å; L741-V868 PolarHBondContact O-N 3.01Å; L742-V868 HydrophobicContact CD2-CB 4.16Å; L742-V868 HydrophobicContact CD2-CG1 4.24Å; H743-V868 PolarHBondContact CD2-O 3.22Å; H743-V868 PolarHBondContact N-O 3.45Å
869	F	89.3	Confident	83.2	Confident	43 Å²	43	49.3 Å²	49.3	19%	0.189	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	117.7	-178.9	179.8	-115.1	0	0	0	111.7	V713 H743 Q974	V713-F869 WeakPolarHBondContact CG2-O 3.11Å; H743-F869 AromaticContact CE1-CD2 3.61Å; H743-F869 AromaticContact ND1-CD2 3.79Å; H743-F869 CarbonylContact O-C 3.59Å; H743-F869 WeakPolarHBondContact O-CA 3.27Å; H743-F869 WeakPolarHBondContact O-CD2 3.45Å; F869-Q974 HydrophobicContact CB-CG 4.2Å; F869-Q974 VanDerWaalsContact CD1-CD 3.43Å; F869-Q974 HydrophobicContact CD1-CG 4.3Å; F869-Q974 HydrophobicContact CG-CG 4.12Å
870	V	88.8	Confident	83.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.264	C	S	.	.			trans	-104.9	78.6	177.8	-168.2	0	0	0	0	109.2	L710 V713 L742 H743 T748 K750 L753	L710-V870 HydrophobicContact CD1-CG1 3.82Å; L710-V870 HydrophobicContact CD2-CG1 4.4Å; V713-V870 HydrophobicContact CG1-CG2 4.36Å; L742-V870 HydrophobicContact CB-CG2 4.33Å; L742-V870 HydrophobicContact CD2-CG2 3.95Å; H743-V870 PolarHBondContact O-N 2.97Å; T748-V870 WeakPolarHBondContact CB-O 3.45Å; T748-V870 PolarHBondContact OG1-O 3.48Å; K750-V870 HydrophobicContact CD-CB 4.48Å; K750-V870 HydrophobicContact CG-CB 3.94Å; K750-V870 HydrophobicContact CG-CG1 4.17Å; K750-V870 HydrophobicContact CG-CG2 4.13Å; L753-V870 HydrophobicContact CD2-CG2 4.06Å
871	G	83.1	Confident	83.6	Confident	11 Å²	11	47.6 Å²	47.6	11%	0.113	25%	0.254	C	S	.	.			trans	-73.8	173.8	179.6	0	0	0	0	0	114.5
872	A	81.7	Confident	84.2	Confident	21 Å²	21	42.3 Å²	42.3	17%	0.174	22%	0.219	C	C	.	.			trans	-69.8	147.7	165.6	0	0	0	0	0	109.9	E874 L967	A872-E874 PolarHBondContact O-N 2.92Å; A872-L967 HydrophobicContact CB-CD2 4.06Å
873	N	77.1	Confident	84.9	Confident	22 Å²	22	41.5 Å²	41.5	12%	0.118	21%	0.21	C	C	.	.			trans	-77.4	113.5	-179.7	-68.2	-77.1	0	0	0	109.7	Q879	N873-Q879 HydrophobicContact CB-CG 4Å; N873-Q879 WeakPolarHBondContact O-CG 3.28Å; N873-Q879 PolarHBondContact O-NE2 2.81Å
874	E	70.7	Confident	85.1	Confident	122 Å²	122	41.9 Å²	41.9	57%	0.57	22%	0.218	S	C	*	.			trans	-82.5	-29.2	177.9	-57.3	-170	168.9	0	0	111.9	A872 K971	A872-E874 PolarHBondContact O-N 2.92Å; E874-K971 VanDerWaalsContact CD-NZ 3.31Å; E874-K971 WeakPolarHBondContact OE1-CE 3.23Å; E874-K971 IonicContact OE1-NZ 2.64Å; E874-K971 PolarHBondContact OE1-NZ 3.18Å; E874-K971 IonicContact OE2-NZ 3.14Å; E874-K971 PolarHBondContact OE2-NZ 2.88Å; E874-K971 VanDerWaalsContact OE2-NZ 3.14Å
875	D	82.3	Confident	85.3	Confident	98 Å²	98	42 Å²	42	52%	0.524	22%	0.22	S	C	.	.	S	Bend	trans	-75.9	129.7	177.6	-28.9	-64.7	0	0	0	112.2	A877 S878 Q879	D875-A877 PolarHBondContact O-N 2.85Å; D875-S878 WeakPolarHBondContact O-CA 3.22Å; D875-S878 WeakPolarHBondContact O-CB 3.42Å; D875-S878 PolarHBondContact O-N 2.92Å; D875-S878 PolarHBondContact OD2-OG 3.47Å; D875-Q879 WeakPolarHBondContact O-CG 3.35Å; D875-Q879 PolarHBondContact O-N 3.35Å
876	R	83.6	Confident	85.8	Confident	88 Å²	88	40.6 Å²	40.6	33%	0.332	21%	0.212	S	C	.	.	H	α-helix	trans	-54	-37.2	167.9	-68.6	-57.1	-152	179.7	10	112.5	S878 Q879 L880 L902 C905	R876-S878 VanDerWaalsContact C-N 3.3Å; R876-S878 PolarHBondContact O-N 3.43Å; R876-Q879 VanDerWaalsContact CD-OE1 3.31Å; R876-Q879 VanDerWaalsContact NH1-OE1 3.09Å; R876-Q879 PolarHBondContact O-N 2.79Å; R876-L880 WeakPolarHBondContact O-CB 3.45Å; R876-L880 PolarHBondContact O-N 3.18Å; R876-L902 HydrophobicContact CB-CD2 4.49Å; R876-L902 PolarHBondContact NH1-O 2.86Å; R876-L902 VanDerWaalsContact NH1-O 3.16Å; R876-L902 PolarHBondContact NH2-O 2.78Å; R876-L902 WeakPolarHBondContact O-CD2 3.04Å; R876-C905 PolarHBondContact NH1-O 3.45Å; R876-C905 PolarHBondContact NH2-O 3.07Å
877	A	86.3	Confident	86	Confident	65 Å²	65	37.6 Å²	37.6	54%	0.537	20%	0.2	S	C	.	.	H	α-helix	trans	-68.4	-25.8	176.2	0	0	0	0	0	113.7	D875 R881	D875-A877 PolarHBondContact O-N 2.85Å; A877-R881 WeakPolarHBondContact O-CG 3.43Å; A877-R881 PolarHBondContact O-NE 2.98Å
878	S	86.3	Confident	86	Confident	5 Å²	5	42.5 Å²	42.5	4%	0.035	21%	0.214	C	C	.	.	H	α-helix	trans	-81.9	-42	174.5	-63.3	0	0	0	0	110.6	D875 R876 R881 V882	D875-S878 WeakPolarHBondContact O-CA 3.22Å; D875-S878 WeakPolarHBondContact O-CB 3.42Å; D875-S878 PolarHBondContact O-N 2.92Å; D875-S878 PolarHBondContact OD2-OG 3.47Å; R876-S878 VanDerWaalsContact C-N 3.3Å; R876-S878 PolarHBondContact O-N 3.43Å; S878-R881 PolarHBondContact O-N 2.92Å; S878-R881 PolarHBondContact OG-NH2 3.1Å; S878-V882 PolarHBondContact O-N 2.88Å; S878-V882 VanDerWaalsContact O-N 3.11Å
879	Q	87.3	Confident	85.8	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-59.6	-44.3	172.2	-67	176.3	-4.4	0	0	112.6	N873 D875 R876 R881 V882 L883 L902 P907	N873-Q879 HydrophobicContact CB-CG 4Å; N873-Q879 WeakPolarHBondContact O-CG 3.28Å; N873-Q879 PolarHBondContact O-NE2 2.81Å; D875-Q879 WeakPolarHBondContact O-CG 3.35Å; D875-Q879 PolarHBondContact O-N 3.35Å; R876-Q879 VanDerWaalsContact CD-OE1 3.31Å; R876-Q879 VanDerWaalsContact NH1-OE1 3.09Å; R876-Q879 PolarHBondContact O-N 2.79Å; Q879-R881 VanDerWaalsContact C-N 3.31Å; Q879-R881 PolarHBondContact O-N 3.09Å; Q879-V882 WeakPolarHBondContact O-CB 3.4Å; Q879-V882 PolarHBondContact O-N 2.84Å; Q879-V882 VanDerWaalsContact O-N 3.09Å; Q879-L883 PolarHBondContact O-N 2.86Å; Q879-L902 HydrophobicContact CB-CD1 3.87Å; Q879-L902 HydrophobicContact CB-CD2 3.86Å; Q879-L902 HydrophobicContact CB-CG 4.48Å; Q879-P907 PolarHBondContact NE2-O 2.92Å
880	L	89.6	Confident	85.6	Confident	60 Å²	60	49.3 Å²	49.3	31%	0.314	24%	0.244	S	C	.	.	H	α-helix	trans	-59.9	-40.4	176.2	-174.3	156.1	0	0	0	111.7	R876 V882 L883 S884 V899 L902	R876-L880 WeakPolarHBondContact O-CB 3.45Å; R876-L880 PolarHBondContact O-N 3.18Å; L880-V882 VanDerWaalsContact C-N 3.33Å; L880-V882 PolarHBondContact O-N 3.21Å; L880-L883 PolarHBondContact O-N 3.24Å; L880-S884 VanDerWaalsContact O-CB 3.29Å; L880-S884 WeakPolarHBondContact O-CB 3.19Å; L880-S884 PolarHBondContact O-N 3.38Å; L880-V899 HydrophobicContact CD1-CG2 3.71Å; L880-L902 HydrophobicContact CB-CD2 4.04Å
881	R	89.2	Confident	85.6	Confident	104 Å²	104	55.4 Å²	55.4	39%	0.392	27%	0.271	S	S	.	.	H	α-helix	trans	-64.5	-36	174.8	-76	178	-74.2	163.6	-4.8	112.3	A877 S878 Q879 A885	A877-R881 WeakPolarHBondContact O-CG 3.43Å; A877-R881 PolarHBondContact O-NE 2.98Å; S878-R881 PolarHBondContact O-N 2.92Å; S878-R881 PolarHBondContact OG-NH2 3.1Å; Q879-R881 VanDerWaalsContact C-N 3.31Å; Q879-R881 PolarHBondContact O-N 3.09Å; R881-A885 WeakPolarHBondContact O-CB 3.26Å; R881-A885 PolarHBondContact O-N 3.05Å
882	V	89.8	Confident	85.7	Confident	12 Å²	12	57.3 Å²	57.3	7%	0.073	28%	0.278	C	S	.	.	H	α-helix	trans	-66.6	-49.2	173.2	174.6	0	0	0	0	111.1	G708 S878 Q879 L880 S884 A885 I886 L914	G708-V882 WeakPolarHBondContact O-CG2 3.46Å; S878-V882 PolarHBondContact O-N 2.88Å; S878-V882 VanDerWaalsContact O-N 3.11Å; Q879-V882 WeakPolarHBondContact O-CB 3.4Å; Q879-V882 PolarHBondContact O-N 2.84Å; Q879-V882 VanDerWaalsContact O-N 3.09Å; L880-V882 VanDerWaalsContact C-N 3.33Å; L880-V882 PolarHBondContact O-N 3.21Å; V882-S884 VanDerWaalsContact C-N 3.33Å; V882-S884 PolarHBondContact O-N 2.67Å; V882-A885 PolarHBondContact O-N 2.73Å; V882-A885 VanDerWaalsContact O-N 3.16Å; V882-I886 HydrophobicContact CG1-CD1 3.75Å; V882-I886 HydrophobicContact CG1-CG1 4.46Å; V882-I886 WeakPolarHBondContact O-CG1 3.46Å; V882-I886 PolarHBondContact O-N 3.09Å; V882-L914 HydrophobicContact CB-CD1 4.13Å; V882-L914 HydrophobicContact CG1-CD1 3.76Å
883	L	89.4	Confident	86	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-42.2	178	-174.8	61.4	0	0	0	111.6	Q879 L880 A885 I886 T887 L898	Q879-L883 PolarHBondContact O-N 2.86Å; L880-L883 PolarHBondContact O-N 3.24Å; L883-A885 PolarHBondContact O-N 2.66Å; L883-I886 PolarHBondContact O-N 2.62Å; L883-T887 HydrophobicContact CD1-CG2 4.19Å; L883-T887 HydrophobicContact CG-CG2 4.41Å; L883-T887 WeakPolarHBondContact O-CB 3.24Å; L883-T887 VanDerWaalsContact O-CG2 3.24Å; L883-T887 WeakPolarHBondContact O-CG2 3.16Å; L883-T887 PolarHBondContact O-N 2.89Å; L883-T887 PolarHBondContact O-OG1 2.82Å; L883-L898 HydrophobicContact CD2-CB 4.13Å; L883-L898 HydrophobicContact CD2-CD2 4.27Å; L883-L898 HydrophobicContact CG-CD2 4.32Å
884	S	89.9	Confident	86.2	Confident	42 Å²	42	64.7 Å²	64.7	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-60.7	-43.2	173.5	-176.3	0	0	0	0	112.4	L880 V882 T887 R888	L880-S884 VanDerWaalsContact O-CB 3.29Å; L880-S884 WeakPolarHBondContact O-CB 3.19Å; L880-S884 PolarHBondContact O-N 3.38Å; V882-S884 VanDerWaalsContact C-N 3.33Å; V882-S884 PolarHBondContact O-N 2.67Å; S884-T887 WeakPolarHBondContact CA-OG1 3.25Å; S884-T887 PolarHBondContact O-OG1 3.35Å; S884-T887 VanDerWaalsContact O-OG1 3.05Å; S884-R888 WeakPolarHBondContact O-CG 3.47Å; S884-R888 PolarHBondContact O-N 2.6Å
885	A	89.4	Confident	86.8	Confident	6 Å²	6	62.1 Å²	62.1	5%	0.05	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-42.1	177	0	0	0	0	0	112.5	R881 V882 L883	R881-A885 WeakPolarHBondContact O-CB 3.26Å; R881-A885 PolarHBondContact O-N 3.05Å; V882-A885 PolarHBondContact O-N 2.73Å; V882-A885 VanDerWaalsContact O-N 3.16Å; L883-A885 PolarHBondContact O-N 2.66Å
886	I	89.1	Confident	86.9	Confident	23 Å²	23	58.4 Å²	58.4	12%	0.118	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-48.5	176.8	-69	167.5	0	0	0	110.9	V882 L883 R888 K889 F890 L914 Y915 C918	V882-I886 HydrophobicContact CG1-CD1 3.75Å; V882-I886 HydrophobicContact CG1-CG1 4.46Å; V882-I886 WeakPolarHBondContact O-CG1 3.46Å; V882-I886 PolarHBondContact O-N 3.09Å; L883-I886 PolarHBondContact O-N 2.62Å; I886-R888 PolarHBondContact O-N 2.95Å; I886-R888 VanDerWaalsContact O-N 3.15Å; I886-K889 PolarHBondContact O-N 3.37Å; I886-F890 HydrophobicContact CG2-CE2 4.01Å; I886-F890 WeakPolarHBondContact O-CD2 3.27Å; I886-L914 HydrophobicContact CD1-CB 3.86Å; I886-Y915 HydrophobicContact CG2-CD2 4Å; I886-C918 HydrophobicContact CG2-CB 4.1Å
887	T	88.6	Confident	87.1	Confident	9 Å²	9	56.2 Å²	56.2	6%	0.055	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-18.9	-175.4	50.3	0	0	0	0	114.4	L883 S884 K889 F890 L892 L898	L883-T887 HydrophobicContact CD1-CG2 4.19Å; L883-T887 HydrophobicContact CG-CG2 4.41Å; L883-T887 WeakPolarHBondContact O-CB 3.24Å; L883-T887 VanDerWaalsContact O-CG2 3.24Å; L883-T887 WeakPolarHBondContact O-CG2 3.16Å; L883-T887 PolarHBondContact O-N 2.89Å; L883-T887 PolarHBondContact O-OG1 2.82Å; S884-T887 WeakPolarHBondContact CA-OG1 3.25Å; S884-T887 PolarHBondContact O-OG1 3.35Å; S884-T887 VanDerWaalsContact O-OG1 3.05Å; T887-K889 PolarHBondContact O-N 3.39Å; T887-K889 VanDerWaalsContact O-N 3.13Å; T887-F890 CarbonylContact O-C 3.55Å; T887-F890 PolarHBondContact O-N 3.04Å; T887-L892 HydrophobicContact CG2-CD1 4.24Å; T887-L892 HydrophobicContact CG2-CD2 4.35Å; T887-L898 HydrophobicContact CG2-CD2 3.99Å
888	R	86.3	Confident	87.2	Confident	157 Å²	157	54.6 Å²	54.6	59%	0.592	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.6	172.8	-73.3	170.6	179.4	-174.7	-6.7	114.4	H705 S884 I886 F890	H705-R888 PolarHBondContact O-NH1 3.49Å; S884-R888 WeakPolarHBondContact O-CG 3.47Å; S884-R888 PolarHBondContact O-N 2.6Å; I886-R888 PolarHBondContact O-N 2.95Å; I886-R888 VanDerWaalsContact O-N 3.15Å; R888-F890 VanDerWaalsContact C-N 3.28Å
889	K	84.1	Confident	87.3	Confident	149 Å²	149	57.8 Å²	57.8	65%	0.648	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-12	175.4	-64.5	-179.6	179.8	177.6	0	113.1	I886 T887	I886-K889 PolarHBondContact O-N 3.37Å; T887-K889 PolarHBondContact O-N 3.39Å; T887-K889 VanDerWaalsContact O-N 3.13Å
890	F	86.4	Confident	87.3	Confident	38 Å²	38	61.9 Å²	61.9	17%	0.167	32%	0.317	C	S	.	.	S	Bend	trans	-116	158.8	-175.2	-57.1	-94.1	0	0	0	110.4	I886 T887 R888 C918 M922 L946	I886-F890 HydrophobicContact CG2-CE2 4.01Å; I886-F890 WeakPolarHBondContact O-CD2 3.27Å; T887-F890 CarbonylContact O-C 3.55Å; T887-F890 PolarHBondContact O-N 3.04Å; R888-F890 VanDerWaalsContact C-N 3.28Å; F890-C918 HydrophobicContact CD2-CB 4.37Å; F890-C918 HydrophobicContact CE2-CB 3.83Å; F890-C918 HydrophobicContact CZ-CB 3.93Å; F890-M922 HydrophobicContact CD1-CB 4.32Å; F890-M922 HydrophobicContact CD1-CG 4.29Å; F890-M922 HydrophobicContact CD1-SD 3.88Å; F890-M922 HydrophobicContact CE1-CB 4.04Å; F890-M922 HydrophobicContact CE1-CG 4.15Å; F890-M922 HydrophobicContact CE1-SD 4.33Å; F890-L946 HydrophobicContact CB-CD1 3.63Å; F890-L946 HydrophobicContact CD1-CD1 4.13Å; F890-L946 HydrophobicContact CG-CD1 4.07Å
891	K	86.7	Confident	87.1	Confident	129 Å²	129	59 Å²	59	56%	0.561	30%	0.302	S	S	*	.			trans	-97.4	106.9	173.7	-69.5	179	177.3	-177.7	0	108.9	A943 M945 L946	K891-A943 HydrophobicContact CD-CB 3.76Å; K891-M945 HydrophobicContact CB-CG 4.46Å; K891-M945 WeakPolarHBondContact O-CA 3.28Å; K891-L946 PolarHBondContact O-N 3Å
892	L	86.9	Confident	87	Confident	51 Å²	51	54.3 Å²	54.3	27%	0.267	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-85.9	144.6	174.7	-62.7	177	0	0	0	110.5	T887 V896 L898 L946 L951	T887-L892 HydrophobicContact CG2-CD1 4.24Å; T887-L892 HydrophobicContact CG2-CD2 4.35Å; L892-V896 HydrophobicContact CD2-CG1 4.33Å; L892-L898 HydrophobicContact CD1-CD2 4.04Å; L892-L946 HydrophobicContact CD2-CB 4.09Å; L892-L946 HydrophobicContact CD2-CD1 3.91Å; L892-L951 HydrophobicContact CD2-CD1 4.25Å
893	E	86.6	Confident	86.8	Confident	66 Å²	66	58.6 Å²	58.6	31%	0.308	31%	0.307	S	S	.	.			trans	-68	142.5	163.9	-170.4	-167	145.2	0	0	110.5	S895 V896 L946	E893-S895 WeakPolarHBondContact CG-OG 3.37Å; E893-S895 PolarHBondContact O-N 3.18Å; E893-S895 WeakPolarHBondContact OE1-CB 3.36Å; E893-S895 PolarHBondContact OE1-OG 3.26Å; E893-V896 HydrophobicContact CB-CG2 4.14Å; E893-V896 WeakPolarHBondContact O-CB 3.25Å; E893-V896 PolarHBondContact O-N 3.33Å; E893-V896 VanDerWaalsContact O-N 3.07Å; E893-L946 WeakPolarHBondContact CB-O 3.39Å; E893-L946 PolarHBondContact N-O 3.04Å; E893-L946 VanDerWaalsContact N-O 3.07Å
894	P	83	Confident	86.6	Confident	132 Å²	132	62.4 Å²	62.4	86%	0.857	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-16.2	-179.4	-26.5	35.3	0	0	0	116
895	S	82.7	Confident	86.3	Confident	68 Å²	68	60.6 Å²	60.6	48%	0.476	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-12.8	177.7	62.1	0	0	0	0	113.9	E893 S897	E893-S895 WeakPolarHBondContact CG-OG 3.37Å; E893-S895 PolarHBondContact O-N 3.18Å; E893-S895 WeakPolarHBondContact OE1-CB 3.36Å; E893-S895 PolarHBondContact OE1-OG 3.26Å; S895-S897 PolarHBondContact O-N 3.47Å
896	V	84.9	Confident	86	Confident	20 Å²	20	62.5 Å²	62.5	12%	0.121	33%	0.332	C	S	.	.			trans	-76.7	116	-172.8	175.7	0	0	0	0	111.9	L892 E893 L898 M948 L951	L892-V896 HydrophobicContact CD2-CG1 4.33Å; E893-V896 HydrophobicContact CB-CG2 4.14Å; E893-V896 WeakPolarHBondContact O-CB 3.25Å; E893-V896 PolarHBondContact O-N 3.33Å; E893-V896 VanDerWaalsContact O-N 3.07Å; V896-L898 HydrophobicContact CG1-CD2 4.21Å; V896-M948 HydrophobicContact CB-SD 4.47Å; V896-M948 HydrophobicContact CG1-SD 4.02Å; V896-M948 HydrophobicContact CG2-CB 4.38Å; V896-L951 HydrophobicContact CG1-CD1 3.57Å
897	S	87.3	Confident	85.4	Confident	41 Å²	41	65 Å²	65	29%	0.287	35%	0.35	S	S	.	.			trans	-97.1	104.7	173.7	52.6	0	0	0	0	111.8	S895 V899 N900 V901	S895-S897 PolarHBondContact O-N 3.47Å; S897-V899 PolarHBondContact O-N 3.03Å; S897-V899 VanDerWaalsContact O-N 3.13Å; S897-N900 PolarHBondContact O-N 2.78Å; S897-N900 VanDerWaalsContact O-N 3.14Å; S897-N900 WeakPolarHBondContact OG-CB 3.37Å; S897-N900 PolarHBondContact OG-ND2 3.04Å; S897-V901 PolarHBondContact O-N 2.78Å
898	L	88.2	Confident	85	Confident	31 Å²	31	67.1 Å²	67.1	16%	0.162	36%	0.359	C	S	.	.	H	α-helix	trans	-59.9	-24.5	179.5	-60.4	-177.1	0	0	0	114	L883 T887 L892 V896 L902	L883-L898 HydrophobicContact CD2-CB 4.13Å; L883-L898 HydrophobicContact CD2-CD2 4.27Å; L883-L898 HydrophobicContact CG-CD2 4.32Å; T887-L898 HydrophobicContact CG2-CD2 3.99Å; L892-L898 HydrophobicContact CD1-CD2 4.04Å; V896-L898 HydrophobicContact CG1-CD2 4.21Å; L898-L902 WeakPolarHBondContact O-CB 3.42Å; L898-L902 PolarHBondContact O-N 3.17Å
899	V	88.6	Confident	84.9	Confident	73 Å²	73	59.7 Å²	59.7	44%	0.442	33%	0.331	S	S	.	.	H	α-helix	trans	-62.5	-53.6	174.2	-177.4	0	0	0	0	110.3	L880 S897 V901 L902 D903	L880-V899 HydrophobicContact CD1-CG2 3.71Å; S897-V899 PolarHBondContact O-N 3.03Å; S897-V899 VanDerWaalsContact O-N 3.13Å; V899-V901 VanDerWaalsContact C-N 3.3Å; V899-V901 PolarHBondContact O-N 2.63Å; V899-L902 WeakPolarHBondContact O-CA 3.42Å; V899-L902 WeakPolarHBondContact O-CB 3.33Å; V899-L902 PolarHBondContact O-N 2.84Å; V899-D903 PolarHBondContact O-N 2.89Å
900	N	86.7	Confident	85.1	Confident	86 Å²	86	52.8 Å²	52.8	46%	0.46	30%	0.301	S	S	.	.	H	α-helix	trans	-64.3	-36	-175.9	-59.7	16	0	0	0	111.6	S897 L902 D903 C904 M948	S897-N900 PolarHBondContact O-N 2.78Å; S897-N900 VanDerWaalsContact O-N 3.14Å; S897-N900 WeakPolarHBondContact OG-CB 3.37Å; S897-N900 PolarHBondContact OG-ND2 3.04Å; N900-L902 VanDerWaalsContact C-N 3.31Å; N900-L902 PolarHBondContact O-N 2.73Å; N900-D903 PolarHBondContact O-N 3.25Å; N900-C904 PolarHBondContact O-N 3.18Å; N900-C904 PolarHBondContact O-SG 3.28Å; N900-M948 HydrophobicContact CB-CE 3.64Å
901	V	86.3	Confident	85.2	Confident	1 Å²	1	52 Å²	52	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-61.2	-42.1	173	-179.7	0	0	0	0	110.8	S897 V899 C904 C905 L917 M948 L951	S897-V901 PolarHBondContact O-N 2.78Å; V899-V901 VanDerWaalsContact C-N 3.3Å; V899-V901 PolarHBondContact O-N 2.63Å; V901-C904 PolarHBondContact O-N 2.7Å; V901-C905 PolarHBondContact O-N 3.02Å; V901-C905 PolarHBondContact O-SG 3.37Å; V901-L917 HydrophobicContact CG1-CD2 4.16Å; V901-M948 HydrophobicContact CG2-CE 3.74Å; V901-M948 HydrophobicContact CG2-SD 3.81Å; V901-L951 HydrophobicContact CG1-CB 4.32Å; V901-L951 HydrophobicContact CG2-CB 4.07Å; V901-L951 HydrophobicContact CG2-CD1 4.36Å
902	L	86.1	Confident	85.3	Confident	5 Å²	5	48 Å²	48	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-71.6	-32.6	-179.8	-170.8	69.2	0	0	0	112.8	R876 Q879 L880 L898 V899 N900 C904 C905 L914	R876-L902 HydrophobicContact CB-CD2 4.49Å; R876-L902 PolarHBondContact NH1-O 2.86Å; R876-L902 VanDerWaalsContact NH1-O 3.16Å; R876-L902 PolarHBondContact NH2-O 2.78Å; R876-L902 WeakPolarHBondContact O-CD2 3.04Å; Q879-L902 HydrophobicContact CB-CD1 3.87Å; Q879-L902 HydrophobicContact CB-CD2 3.86Å; Q879-L902 HydrophobicContact CB-CG 4.48Å; L880-L902 HydrophobicContact CB-CD2 4.04Å; L898-L902 WeakPolarHBondContact O-CB 3.42Å; L898-L902 PolarHBondContact O-N 3.17Å; V899-L902 WeakPolarHBondContact O-CA 3.42Å; V899-L902 WeakPolarHBondContact O-CB 3.33Å; V899-L902 PolarHBondContact O-N 2.84Å; N900-L902 VanDerWaalsContact C-N 3.31Å; N900-L902 PolarHBondContact O-N 2.73Å; L902-C904 VanDerWaalsContact C-N 3.33Å; L902-C905 WeakPolarHBondContact O-CB 3.4Å; L902-C905 PolarHBondContact O-N 2.82Å; L902-C905 VanDerWaalsContact O-N 3.07Å; L902-L914 HydrophobicContact CD1-CD2 4.47Å
903	D	86.2	Confident	85.5	Confident	101 Å²	101	46.1 Å²	46.1	54%	0.54	29%	0.286	S	S	.	.	H	α-helix	trans	-66.4	-35	175.2	-70.7	-31.8	0	0	0	112.2	V899 N900 C905	V899-D903 PolarHBondContact O-N 2.89Å; N900-D903 PolarHBondContact O-N 3.25Å; D903-C905 PolarHBondContact O-N 3.1Å
904	C	84.2	Confident	85.6	Confident	83 Å²	83	43.1 Å²	43.1	56%	0.561	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-13.3	170.8	-65	0	0	0	0	113.8	N900 V901 L902 L952	N900-C904 PolarHBondContact O-N 3.18Å; N900-C904 PolarHBondContact O-SG 3.28Å; V901-C904 PolarHBondContact O-N 2.7Å; L902-C904 VanDerWaalsContact C-N 3.33Å; C904-L952 HydrophobicContact CB-CD2 4.24Å
905	C	83.8	Confident	86	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.027	25%	0.253	C	S	.	.	S	Bend	trans	-92.1	144.5	-176.7	-76.2	0	0	0	0	112.8	R876 V901 L902 D903 L909	R876-C905 PolarHBondContact NH1-O 3.45Å; R876-C905 PolarHBondContact NH2-O 3.07Å; V901-C905 PolarHBondContact O-N 3.02Å; V901-C905 PolarHBondContact O-SG 3.37Å; L902-C905 WeakPolarHBondContact O-CB 3.4Å; L902-C905 PolarHBondContact O-N 2.82Å; L902-C905 VanDerWaalsContact O-N 3.07Å; D903-C905 PolarHBondContact O-N 3.1Å; C905-L909 HydrophobicContact CB-CD1 3.63Å
906	P	82.8	Confident	86.4	Confident	46 Å²	46	41.5 Å²	41.5	30%	0.299	25%	0.246	S	C	.	.			trans	-52.1	149.6	170.3	-25.9	34.4	0	0	0	112.5	Q908 L909	P906-Q908 PolarHBondContact O-N 2.88Å; P906-L909 WeakPolarHBondContact O-CG 3.49Å
907	P	76.5	Confident	86.7	Confident	75 Å²	75	40.6 Å²	40.6	49%	0.487	24%	0.24	S	C	.	.	S	Bend	trans	-72.9	-13.7	179.8	29.2	-34.8	0	0	0	113.7	Q879	Q879-P907 PolarHBondContact NE2-O 2.92Å
908	Q	80.3	Confident	86.9	Confident	54 Å²	54	38.6 Å²	38.6	25%	0.252	23%	0.227	S	C	.	.			trans	-104.9	59.3	-172	-65.5	155.1	28.1	0	0	111.5	P906 P960 E964 L967	P906-Q908 PolarHBondContact O-N 2.88Å; Q908-P960 WeakPolarHBondContact O-CB 3.41Å; Q908-E964 VanDerWaalsContact CD-CG 3.48Å; Q908-E964 VanDerWaalsContact NE2-CG 3.35Å; Q908-E964 PolarHBondContact NE2-OE1 2.79Å; Q908-L967 HydrophobicContact CB-CD1 4.38Å; Q908-L967 HydrophobicContact CG-CD1 4.18Å
909	L	84.1	Confident	87.1	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	24%	0.235	C	C	.	.			trans	-109.1	134	-179.1	-66.4	177	0	0	0	112.1	C905 P906 D913 L914 L958 P960	C905-L909 HydrophobicContact CB-CD1 3.63Å; P906-L909 WeakPolarHBondContact O-CG 3.49Å; L909-D913 HydrophobicContact CB-CB 4.37Å; L909-D913 HydrophobicContact CD2-CB 3.74Å; L909-L914 HydrophobicContact CB-CD2 4.37Å; L909-L914 HydrophobicContact CB-CG 4.28Å; L909-L914 HydrophobicContact CD1-CD2 3.86Å; L909-L958 HydrophobicContact CD1-CD2 3.77Å; L909-L958 HydrophobicContact CD2-CD2 3.64Å; L909-L958 HydrophobicContact CD2-CG 4.28Å; L909-L958 HydrophobicContact CG-CD2 4.4Å; L909-P960 HydrophobicContact CD2-CB 4.23Å
910	T	88.6	Confident	87.2	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.018	23%	0.233	C	C	.	.			trans	-82.8	168	170	71.6	0	0	0	0	110.9	A912 D913 L914 V962	T910-A912 PolarHBondContact O-N 2.91Å; T910-A912 PolarHBondContact OG1-N 3.15Å; T910-D913 WeakPolarHBondContact CB-OD2 3.47Å; T910-D913 WeakPolarHBondContact CG2-OD2 3.39Å; T910-D913 PolarHBondContact N-OD2 3.07Å; T910-D913 PolarHBondContact O-N 2.88Å; T910-D913 PolarHBondContact OG1-N 2.89Å; T910-D913 PolarHBondContact OG1-OD2 2.88Å; T910-L914 PolarHBondContact O-N 3.39Å; T910-L914 VanDerWaalsContact O-N 3.16Å; T910-V962 HydrophobicContact CG2-CG2 3.71Å
911	G	88.3	Confident	87.5	Confident	21 Å²	21	35.4 Å²	35.4	22%	0.216	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-29.5	173.5	0	0	0	0	0	112.7	G747 Y915	G747-G911 PolarHBondContact O-N 2.71Å; G747-G911 VanDerWaalsContact O-N 3.16Å; G911-Y915 WeakPolarHBondContact O-CB 3.36Å; G911-Y915 PolarHBondContact O-N 3.02Å
912	A	88.9	Confident	87.7	Confident	46 Å²	46	38.6 Å²	38.6	38%	0.38	23%	0.227	S	C	.	.	H	α-helix	trans	-70.1	-38.9	173.7	0	0	0	0	0	112.4	G747 T910 Y915 S916	G747-A912 PolarHBondContact O-N 2.85Å; T910-A912 PolarHBondContact O-N 2.91Å; T910-A912 PolarHBondContact OG1-N 3.15Å; A912-Y915 WeakPolarHBondContact O-CB 3.28Å; A912-Y915 PolarHBondContact O-N 2.92Å; A912-S916 PolarHBondContact O-N 2.87Å
913	D	90.8	Very high	87.9	Confident	12 Å²	12	41.2 Å²	41.2	6%	0.064	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-43.1	177	-51.6	-45.9	0	0	0	111.1	L909 T910 Y915 S916 L917 L958 S961	L909-D913 HydrophobicContact CB-CB 4.37Å; L909-D913 HydrophobicContact CD2-CB 3.74Å; T910-D913 WeakPolarHBondContact CB-OD2 3.47Å; T910-D913 WeakPolarHBondContact CG2-OD2 3.39Å; T910-D913 PolarHBondContact N-OD2 3.07Å; T910-D913 PolarHBondContact O-N 2.88Å; T910-D913 PolarHBondContact OG1-N 2.89Å; T910-D913 PolarHBondContact OG1-OD2 2.88Å; D913-Y915 PolarHBondContact O-N 3.22Å; D913-S916 WeakPolarHBondContact O-CB 3.43Å; D913-S916 PolarHBondContact O-N 3.45Å; D913-L917 WeakPolarHBondContact O-CB 3.19Å; D913-L917 PolarHBondContact O-N 2.97Å; D913-L958 HydrophobicContact CB-CD1 4.45Å; D913-S961 VanDerWaalsContact CG-OG 3.26Å; D913-S961 WeakPolarHBondContact OD1-CB 3.47Å; D913-S961 PolarHBondContact OD1-N 2.96Å; D913-S961 PolarHBondContact OD1-OG 2.78Å; D913-S961 PolarHBondContact OD2-OG 2.78Å
914	L	89.9	Confident	88.1	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-64.6	-29.1	173.8	-66.9	173.7	0	0	0	112.5	V882 I886 L902 L909 T910 L917 C918	V882-L914 HydrophobicContact CB-CD1 4.13Å; V882-L914 HydrophobicContact CG1-CD1 3.76Å; I886-L914 HydrophobicContact CD1-CB 3.86Å; L902-L914 HydrophobicContact CD1-CD2 4.47Å; L909-L914 HydrophobicContact CB-CD2 4.37Å; L909-L914 HydrophobicContact CB-CG 4.28Å; L909-L914 HydrophobicContact CD1-CD2 3.86Å; T910-L914 PolarHBondContact O-N 3.39Å; T910-L914 VanDerWaalsContact O-N 3.16Å; L914-L917 HydrophobicContact CD2-CD2 4.31Å; L914-C918 PolarHBondContact O-N 2.87Å; L914-C918 PolarHBondContact O-SG 3.03Å
915	Y	90.6	Very high	88.4	Confident	118 Å²	118	33.3 Å²	33.3	46%	0.463	20%	0.197	S	C	.	.	H	α-helix	trans	-73.4	-41.4	172.1	-176.3	-91.7	0	0	0	111.8	I886 G911 A912 D913 L917 C918 S919	I886-Y915 HydrophobicContact CG2-CD2 4Å; G911-Y915 WeakPolarHBondContact O-CB 3.36Å; G911-Y915 PolarHBondContact O-N 3.02Å; A912-Y915 WeakPolarHBondContact O-CB 3.28Å; A912-Y915 PolarHBondContact O-N 2.92Å; D913-Y915 PolarHBondContact O-N 3.22Å; Y915-L917 VanDerWaalsContact C-N 3.34Å; Y915-C918 PolarHBondContact O-N 3.14Å; Y915-S919 WeakPolarHBondContact O-CB 3.49Å; Y915-S919 PolarHBondContact O-N 3.18Å
916	S	91.1	Very high	88.7	Confident	49 Å²	49	37.6 Å²	37.6	34%	0.343	22%	0.22	S	C	.	.	H	α-helix	trans	-59.1	-46.8	173.5	-161.7	0	0	0	0	110.6	A912 D913 C918 S919 D920	A912-S916 PolarHBondContact O-N 2.87Å; D913-S916 WeakPolarHBondContact O-CB 3.43Å; D913-S916 PolarHBondContact O-N 3.45Å; S916-C918 VanDerWaalsContact C-N 3.33Å; S916-C918 PolarHBondContact O-N 3.3Å; S916-S919 CarbonylContact O-C 3.52Å; S916-S919 WeakPolarHBondContact O-CA 3.34Å; S916-S919 WeakPolarHBondContact O-CB 3.46Å; S916-S919 PolarHBondContact O-N 3.04Å; S916-D920 WeakPolarHBondContact O-CB 3.42Å; S916-D920 VanDerWaalsContact O-CG 3.29Å; S916-D920 PolarHBondContact O-N 2.96Å; S916-D920 VanDerWaalsContact O-OD2 3.14Å; S916-D920 PolarHBondContact OG-OD2 3.23Å
917	L	92	Very high	89	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-49.5	-50.4	174.7	177	69.6	0	0	0	112.4	V901 D913 L914 Y915 A921 A954 A955 L958	V901-L917 HydrophobicContact CG1-CD2 4.16Å; D913-L917 WeakPolarHBondContact O-CB 3.19Å; D913-L917 PolarHBondContact O-N 2.97Å; L914-L917 HydrophobicContact CD2-CD2 4.31Å; Y915-L917 VanDerWaalsContact C-N 3.34Å; L917-A921 WeakPolarHBondContact O-CB 3.48Å; L917-A921 PolarHBondContact O-N 2.91Å; L917-A954 VanDerWaalsContact CD1-C 3.5Å; L917-A954 HydrophobicContact CD1-CB 3.7Å; L917-A955 VanDerWaalsContact CD1-CA 3.43Å; L917-A955 HydrophobicContact CD1-CB 3.87Å; L917-L958 HydrophobicContact CB-CD1 4.4Å; L917-L958 HydrophobicContact CB-CD2 4.26Å; L917-L958 HydrophobicContact CD1-CD2 4.35Å
918	C	91.8	Very high	89.4	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68	-35.2	177.3	-66.7	0	0	0	0	112.8	I886 F890 L914 Y915 S916 M922	I886-C918 HydrophobicContact CG2-CB 4.1Å; F890-C918 HydrophobicContact CD2-CB 4.37Å; F890-C918 HydrophobicContact CE2-CB 3.83Å; F890-C918 HydrophobicContact CZ-CB 3.93Å; L914-C918 PolarHBondContact O-N 2.87Å; L914-C918 PolarHBondContact O-SG 3.03Å; Y915-C918 PolarHBondContact O-N 3.14Å; S916-C918 VanDerWaalsContact C-N 3.33Å; S916-C918 PolarHBondContact O-N 3.3Å; C918-M922 VanDerWaalsContact O-CB 3.3Å; C918-M922 WeakPolarHBondContact O-CB 3.43Å; C918-M922 PolarHBondContact O-N 3.49Å
919	S	91.6	Very high	89.6	Confident	47 Å²	47	43.4 Å²	43.4	33%	0.329	23%	0.228	S	C	.	.	H	α-helix	trans	-69.2	-37.3	177	-169	0	0	0	0	112.7	Y915 S916 M922 T923	Y915-S919 WeakPolarHBondContact O-CB 3.49Å; Y915-S919 PolarHBondContact O-N 3.18Å; S916-S919 CarbonylContact O-C 3.52Å; S916-S919 WeakPolarHBondContact O-CA 3.34Å; S916-S919 WeakPolarHBondContact O-CB 3.46Å; S916-S919 PolarHBondContact O-N 3.04Å; S919-M922 PolarHBondContact O-N 3.26Å; S919-T923 WeakPolarHBondContact O-CB 3.49Å; S919-T923 PolarHBondContact O-N 2.82Å; S919-T923 PolarHBondContact O-OG1 2.85Å
920	D	91.7	Very high	89.7	Confident	75 Å²	75	46.5 Å²	46.5	40%	0.401	25%	0.247	S	C	.	.	H	α-helix	trans	-72	-41.5	177.3	-69.1	-38.6	0	0	0	110.6	S916 T923 A924 A954	S916-D920 WeakPolarHBondContact O-CB 3.42Å; S916-D920 VanDerWaalsContact O-CG 3.29Å; S916-D920 PolarHBondContact O-N 2.96Å; S916-D920 VanDerWaalsContact O-OD2 3.14Å; S916-D920 PolarHBondContact OG-OD2 3.23Å; D920-T923 WeakPolarHBondContact O-CB 3.49Å; D920-T923 PolarHBondContact O-N 3.11Å; D920-A924 PolarHBondContact O-N 2.86Å; D920-A954 HydrophobicContact CB-CB 4.01Å
921	A	91.8	Very high	89.5	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-41.4	170.8	0	0	0	0	0	112	L917 T923 A924 A925 L946 D950 L951 A954	L917-A921 WeakPolarHBondContact O-CB 3.48Å; L917-A921 PolarHBondContact O-N 2.91Å; A921-T923 VanDerWaalsContact C-N 3.28Å; A921-T923 PolarHBondContact O-N 2.9Å; A921-A924 PolarHBondContact O-N 2.9Å; A921-A925 WeakPolarHBondContact O-CB 3.29Å; A921-A925 PolarHBondContact O-N 2.65Å; A921-L946 VanDerWaalsContact C-CD2 3.47Å; A921-L946 HydrophobicContact CB-CD2 3.92Å; A921-D950 HydrophobicContact CB-CB 4.29Å; A921-L951 HydrophobicContact CB-CD2 3.66Å; A921-L951 HydrophobicContact CB-CG 4.01Å; A921-A954 HydrophobicContact CB-CB 4.04Å
922	M	91	Very high	89.3	Confident	69 Å²	69	52 Å²	52	34%	0.34	27%	0.267	S	S	.	.	H	α-helix	trans	-61.7	-37.6	173.6	-174	74.1	-179.7	0	0	111.6	F890 C918 S919 L926 L944 L946	F890-M922 HydrophobicContact CD1-CB 4.32Å; F890-M922 HydrophobicContact CD1-CG 4.29Å; F890-M922 HydrophobicContact CD1-SD 3.88Å; F890-M922 HydrophobicContact CE1-CB 4.04Å; F890-M922 HydrophobicContact CE1-CG 4.15Å; F890-M922 HydrophobicContact CE1-SD 4.33Å; C918-M922 VanDerWaalsContact O-CB 3.3Å; C918-M922 WeakPolarHBondContact O-CB 3.43Å; C918-M922 PolarHBondContact O-N 3.49Å; S919-M922 PolarHBondContact O-N 3.26Å; M922-L926 VanDerWaalsContact O-CB 3.31Å; M922-L926 WeakPolarHBondContact O-CB 3.33Å; M922-L926 PolarHBondContact O-N 2.89Å; M922-L944 HydrophobicContact CE-CB 4.32Å; M922-L944 HydrophobicContact CE-CD2 3.51Å; M922-L944 HydrophobicContact CG-CD2 4.42Å; M922-L944 HydrophobicContact SD-CD2 3.58Å; M922-L944 VanDerWaalsContact SD-CD2 3.58Å; M922-L946 HydrophobicContact CB-CD2 4.31Å
923	T	90.9	Very high	89	Confident	60 Å²	60	54.3 Å²	54.3	37%	0.368	27%	0.273	S	S	.	.	H	α-helix	trans	-71.1	-35.1	176.6	-56.2	0	0	0	0	111.9	S919 D920 A921 K927	S919-T923 WeakPolarHBondContact O-CB 3.49Å; S919-T923 PolarHBondContact O-N 2.82Å; S919-T923 PolarHBondContact O-OG1 2.85Å; D920-T923 WeakPolarHBondContact O-CB 3.49Å; D920-T923 PolarHBondContact O-N 3.11Å; A921-T923 VanDerWaalsContact C-N 3.28Å; A921-T923 PolarHBondContact O-N 2.9Å; T923-K927 WeakPolarHBondContact O-CG 3.31Å; T923-K927 PolarHBondContact O-N 3.05Å
924	A	89.6	Confident	88.7	Confident	17 Å²	17	61.1 Å²	61.1	14%	0.14	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-49	172.1	0	0	0	0	0	111.5	D920 A921 L926 K927 R928 D950	D920-A924 PolarHBondContact O-N 2.86Å; A921-A924 PolarHBondContact O-N 2.9Å; A924-L926 VanDerWaalsContact C-N 3.28Å; A924-L926 PolarHBondContact O-N 2.87Å; A924-K927 PolarHBondContact O-N 3.27Å; A924-K927 VanDerWaalsContact O-N 3.16Å; A924-R928 PolarHBondContact O-N 3.37Å; A924-D950 HydrophobicContact CB-CB 4.38Å
925	A	89.6	Confident	88.4	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58.2	-38.6	174.8	0	0	0	0	0	112.3	A921 R929 L944 L946 D950	A921-A925 WeakPolarHBondContact O-CB 3.29Å; A921-A925 PolarHBondContact O-N 2.65Å; A925-R929 WeakPolarHBondContact O-CB 3.5Å; A925-R929 PolarHBondContact O-N 3Å; A925-L944 HydrophobicContact CB-CD2 3.82Å; A925-L944 HydrophobicContact CB-CG 4.32Å; A925-L946 HydrophobicContact CB-CD2 4.15Å; A925-D950 WeakPolarHBondContact CB-OD2 3.48Å
926	L	89.8	Confident	87.5	Confident	95 Å²	95	64.5 Å²	64.5	50%	0.497	34%	0.341	S	S	.	.	H	α-helix	trans	-67.4	-43.1	175.9	-176.5	63.2	0	0	0	112	M922 A924 R929 V930 L944	M922-L926 VanDerWaalsContact O-CB 3.31Å; M922-L926 WeakPolarHBondContact O-CB 3.33Å; M922-L926 PolarHBondContact O-N 2.89Å; A924-L926 VanDerWaalsContact C-N 3.28Å; A924-L926 PolarHBondContact O-N 2.87Å; L926-R929 PolarHBondContact O-N 2.93Å; L926-V930 WeakPolarHBondContact O-CG2 3.47Å; L926-V930 PolarHBondContact O-N 3.04Å; L926-L944 HydrophobicContact CB-CD2 4.31Å; L926-L944 HydrophobicContact CD1-CD1 4.31Å
927	K	89.2	Confident	86.7	Confident	149 Å²	149	67 Å²	67	65%	0.648	35%	0.35	S	S	*	.	H	α-helix	trans	-61.6	-44.3	175.8	-76.2	172.2	178.5	178.6	0	111.9	T923 A924 R929 V930 H931	T923-K927 WeakPolarHBondContact O-CG 3.31Å; T923-K927 PolarHBondContact O-N 3.05Å; A924-K927 PolarHBondContact O-N 3.27Å; A924-K927 VanDerWaalsContact O-N 3.16Å; K927-R929 VanDerWaalsContact C-N 3.34Å; K927-R929 PolarHBondContact O-N 2.82Å; K927-V930 PolarHBondContact O-N 3.05Å; K927-H931 PolarHBondContact O-N 2.91Å
928	R	85.8	Confident	85.2	Confident	93 Å²	93	75.5 Å²	75.5	35%	0.351	39%	0.39	S	S	.	.	H	α-helix	trans	-56.2	-48.3	172	178.4	168.6	53.8	74.9	-1	110.8	A924 V930 H931 D932 M945 D950	A924-R928 PolarHBondContact O-N 3.37Å; R928-V930 VanDerWaalsContact C-N 3.35Å; R928-V930 PolarHBondContact O-N 2.99Å; R928-H931 WeakPolarHBondContact O-CB 3.31Å; R928-H931 PolarHBondContact O-N 2.82Å; R928-H931 VanDerWaalsContact O-N 3.15Å; R928-D932 PolarHBondContact O-N 2.95Å; R928-M945 PolarHBondContact NH2-O 3.42Å; R928-D950 IonicContact CZ-OD2 2.73Å; R928-D950 IonicContact NE-OD1 3.12Å; R928-D950 IonicContact NE-OD2 2.8Å; R928-D950 IonicContact NH2-OD1 2.66Å; R928-D950 IonicContact NH2-OD2 3.69Å; R928-D950 PolarHBondContact NH2-OD2 3.01Å
929	R	83.9	Confident	83.6	Confident	55 Å²	55	79.4 Å²	79.4	21%	0.208	42%	0.415	C	S	.	.	H	α-helix	trans	-64.5	-33.3	178.6	-172.9	51.2	157.1	170.3	-10.5	114.4	A925 L926 K927 L933 P939 S941 L944	A925-R929 WeakPolarHBondContact O-CB 3.5Å; A925-R929 PolarHBondContact O-N 3Å; L926-R929 PolarHBondContact O-N 2.93Å; K927-R929 VanDerWaalsContact C-N 3.34Å; K927-R929 PolarHBondContact O-N 2.82Å; R929-L933 HydrophobicContact CG-CD1 4.49Å; R929-L933 VanDerWaalsContact O-CG 3.28Å; R929-L933 WeakPolarHBondContact O-CG 3.44Å; R929-L933 PolarHBondContact O-N 2.87Å; R929-P939 VanDerWaalsContact NH2-CB 3.27Å; R929-S941 PolarHBondContact NH2-O 3.35Å; R929-S941 VanDerWaalsContact NH2-O 3.11Å; R929-L944 HydrophobicContact CB-CD1 3.56Å; R929-L944 HydrophobicContact CG-CD1 3.81Å
930	V	86.8	Confident	81.8	Confident	66 Å²	66	81.2 Å²	81.2	40%	0.4	44%	0.441	S	S	.	.	H	α-helix	trans	-67.1	-43.3	173.3	171.1	0	0	0	0	110.3	L926 K927 R928 L933 E934	L926-V930 WeakPolarHBondContact O-CG2 3.47Å; L926-V930 PolarHBondContact O-N 3.04Å; K927-V930 PolarHBondContact O-N 3.05Å; R928-V930 VanDerWaalsContact C-N 3.35Å; R928-V930 PolarHBondContact O-N 2.99Å; V930-L933 PolarHBondContact O-N 3.02Å; V930-E934 HydrophobicContact CG1-CG 4.44Å; V930-E934 WeakPolarHBondContact O-CG 3.22Å; V930-E934 PolarHBondContact O-N 3.13Å
931	H	85.3	Confident	80.1	Confident	98 Å²	98	81 Å²	81	45%	0.454	45%	0.445	S	S	.	.	H	α-helix	trans	-59.4	-47.1	174.3	-161.8	-82.5	0	0	0	112	K927 R928 L933 E934 E935	K927-H931 PolarHBondContact O-N 2.91Å; R928-H931 WeakPolarHBondContact O-CB 3.31Å; R928-H931 PolarHBondContact O-N 2.82Å; R928-H931 VanDerWaalsContact O-N 3.15Å; H931-L933 PolarHBondContact O-N 3.38Å; H931-L933 VanDerWaalsContact O-N 3.17Å; H931-E934 PolarHBondContact O-N 3.2Å; H931-E934 VanDerWaalsContact O-N 3.11Å; H931-E935 IonicContact CE1-OE1 3.78Å; H931-E935 PolarHBondContact CE1-OE1 2.98Å; H931-E935 VanDerWaalsContact CE1-OE1 3.28Å; H931-E935 IonicContact CE1-OE2 2.72Å; H931-E935 PolarHBondContact CE1-OE2 2.88Å; H931-E935 VanDerWaalsContact ND1-CD 3.25Å; H931-E935 IonicContact ND1-OE1 3.46Å; H931-E935 IonicContact ND1-OE2 2.9Å; H931-E935 PolarHBondContact ND1-OE2 2.73Å; H931-E935 PolarHBondContact O-N 3.25Å
932	D	82.8	Confident	78.5	Confident	40 Å²	40	87.3 Å²	87.3	21%	0.214	49%	0.489	C	S	.	.	H	α-helix	trans	-55.9	-34.7	176.8	-56.2	-28.8	0	0	0	112.3	R928 G936 L937	R928-D932 PolarHBondContact O-N 2.95Å; D932-G936 PolarHBondContact O-N 3.39Å; D932-L937 PolarHBondContact O-N 2.84Å
933	L	82.1	Confident	77.3	Confident	96 Å²	96	85.2 Å²	85.2	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-79.5	-36.5	178.7	-70.9	169.5	0	0	0	112.5	R929 V930 H931 E935 G936	R929-L933 HydrophobicContact CG-CD1 4.49Å; R929-L933 VanDerWaalsContact O-CG 3.28Å; R929-L933 WeakPolarHBondContact O-CG 3.44Å; R929-L933 PolarHBondContact O-N 2.87Å; V930-L933 PolarHBondContact O-N 3.02Å; H931-L933 PolarHBondContact O-N 3.38Å; H931-L933 VanDerWaalsContact O-N 3.17Å; L933-E935 VanDerWaalsContact C-N 3.31Å; L933-G936 PolarHBondContact O-N 3.17Å
934	E	85.9	Confident	76.7	Confident	155 Å²	155	84.2 Å²	84.2	72%	0.724	48%	0.475	S	S	*	.	H	α-helix	trans	-66.8	-32.9	173.7	-72.7	176.9	171.1	0	0	111.7	V930 H931 G936	V930-E934 HydrophobicContact CG1-CG 4.44Å; V930-E934 WeakPolarHBondContact O-CG 3.22Å; V930-E934 PolarHBondContact O-N 3.13Å; H931-E934 PolarHBondContact O-N 3.2Å; H931-E934 VanDerWaalsContact O-N 3.11Å; E934-G936 VanDerWaalsContact C-N 3.3Å
935	E	83.7	Confident	76.6	Confident	128 Å²	128	87.9 Å²	87.9	60%	0.598	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-2.7	173.4	-67.3	-174.5	130	0	0	114	H931 L933 L937	H931-E935 IonicContact CE1-OE1 3.78Å; H931-E935 PolarHBondContact CE1-OE1 2.98Å; H931-E935 VanDerWaalsContact CE1-OE1 3.28Å; H931-E935 IonicContact CE1-OE2 2.72Å; H931-E935 PolarHBondContact CE1-OE2 2.88Å; H931-E935 VanDerWaalsContact ND1-CD 3.25Å; H931-E935 IonicContact ND1-OE1 3.46Å; H931-E935 IonicContact ND1-OE2 2.9Å; H931-E935 PolarHBondContact ND1-OE2 2.73Å; H931-E935 PolarHBondContact O-N 3.25Å; L933-E935 VanDerWaalsContact C-N 3.31Å; E935-L937 HydrophobicContact CB-CD1 4.07Å
936	G	71.9	Confident	76.5	Confident	62 Å²	62	88 Å²	88	64%	0.639	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	21	171.3	0	0	0	0	0	116.1	D932 L933 E934	D932-G936 PolarHBondContact O-N 3.39Å; L933-G936 PolarHBondContact O-N 3.17Å; E934-G936 VanDerWaalsContact C-N 3.3Å
937	L	73.4	Confident	76.5	Confident	102 Å²	102	84.7 Å²	84.7	53%	0.534	48%	0.475	S	S	.	.			trans	-75.4	130.7	173.7	-80.6	77.3	0	0	0	111.1	D932 E935	D932-L937 PolarHBondContact O-N 2.84Å; E935-L937 HydrophobicContact CB-CD1 4.07Å
938	E	60.7	Low	76.5	Confident	179 Å²	179	79.4 Å²	79.4	84%	0.836	45%	0.453	S	S	*	.			trans	-63.5	141.4	-178.5	-73.3	-153.3	165.5	0	0	113.2	G940	E938-G940 PolarHBondContact O-N 2.74Å
939	P	58.2	Low	76.6	Confident	82 Å²	82	82.5 Å²	82.5	53%	0.532	47%	0.471	S	S	.	.			trans	-80.5	81.1	-174.2	32.6	-36.3	0	0	0	112.8	R929 S941	R929-P939 VanDerWaalsContact NH2-CB 3.27Å; P939-S941 PolarHBondContact O-N 3.03Å
940	G	54.2	Low	76.9	Confident	84 Å²	84	80.5 Å²	80.5	87%	0.866	47%	0.465	S	S	*	.	S	Bend	trans	-58.1	-8.9	178.4	0	0	0	0	0	116.7	E938	E938-G940 PolarHBondContact O-N 2.74Å
941	S	55.6	Low	77	Confident	70 Å²	70	77.4 Å²	77.4	49%	0.49	45%	0.446	S	S	.	.			trans	-153.6	146.9	160.7	-158.6	0	0	0	0	111.1	R929 P939 A943	R929-S941 PolarHBondContact NH2-O 3.35Å; R929-S941 VanDerWaalsContact NH2-O 3.11Å; P939-S941 PolarHBondContact O-N 3.03Å; S941-A943 PolarHBondContact O-N 3.45Å
942	S	58.2	Low	77.2	Confident	133 Å²	133	75.9 Å²	75.9	93%	0.93	44%	0.441	S	S	*	.	S	Bend	trans	-81	-0.2	174.6	49.5	0	0	0	0	113.5
943	A	66.3	Low	77.5	Confident	25 Å²	25	78.4 Å²	78.4	21%	0.207	45%	0.452	C	S	.	.	S	Bend	trans	-101.6	123.4	176.7	0	0	0	0	0	111.5	K891 S941 M945	K891-A943 HydrophobicContact CD-CB 3.76Å; S941-A943 PolarHBondContact O-N 3.45Å; A943-M945 PolarHBondContact O-N 3.06Å
944	L	78.4	Confident	77.9	Confident	40 Å²	40	74 Å²	74	21%	0.209	43%	0.429	C	S	.	.			trans	-65.7	129.4	166.4	-157	90.9	0	0	0	109	M922 A925 L926 R929	M922-L944 HydrophobicContact CE-CB 4.32Å; M922-L944 HydrophobicContact CE-CD2 3.51Å; M922-L944 HydrophobicContact CG-CD2 4.42Å; M922-L944 HydrophobicContact SD-CD2 3.58Å; M922-L944 VanDerWaalsContact SD-CD2 3.58Å; A925-L944 HydrophobicContact CB-CD2 3.82Å; A925-L944 HydrophobicContact CB-CG 4.32Å; L926-L944 HydrophobicContact CB-CD2 4.31Å; L926-L944 HydrophobicContact CD1-CD1 4.31Å; R929-L944 HydrophobicContact CB-CD1 3.56Å; R929-L944 HydrophobicContact CG-CD1 3.81Å
945	M	86	Confident	78	Confident	94 Å²	94	67 Å²	67	46%	0.463	40%	0.397	S	S	.	.			trans	-118.2	137.1	174.3	-59.2	-146.4	-54.8	0	0	110.9	K891 R928 A943	K891-M945 HydrophobicContact CB-CG 4.46Å; K891-M945 WeakPolarHBondContact O-CA 3.28Å; R928-M945 PolarHBondContact NH2-O 3.42Å; A943-M945 PolarHBondContact O-N 3.06Å
946	L	88.5	Confident	78.1	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-80.8	125.5	174.9	-71.8	167.9	0	0	0	110.2	F890 K891 L892 E893 A921 M922 A925	F890-L946 HydrophobicContact CB-CD1 3.63Å; F890-L946 HydrophobicContact CD1-CD1 4.13Å; F890-L946 HydrophobicContact CG-CD1 4.07Å; K891-L946 PolarHBondContact O-N 3Å; L892-L946 HydrophobicContact CD2-CB 4.09Å; L892-L946 HydrophobicContact CD2-CD1 3.91Å; E893-L946 WeakPolarHBondContact CB-O 3.39Å; E893-L946 PolarHBondContact N-O 3.04Å; E893-L946 VanDerWaalsContact N-O 3.07Å; A921-L946 VanDerWaalsContact C-CD2 3.47Å; A921-L946 HydrophobicContact CB-CD2 3.92Å; M922-L946 HydrophobicContact CB-CD2 4.31Å; A925-L946 HydrophobicContact CB-CD2 4.15Å
947	T	89.8	Confident	78.8	Confident	26 Å²	26	70.4 Å²	70.4	16%	0.16	41%	0.405	C	S	.	.			trans	-91.2	170.1	171.7	71.1	0	0	0	0	111	E949 D950	T947-E949 VanDerWaalsContact C-N 3.3Å; T947-E949 PolarHBondContact O-N 3.46Å; T947-E949 PolarHBondContact OG1-N 2.85Å; T947-D950 PolarHBondContact N-OD2 3.39Å; T947-D950 PolarHBondContact OG1-N 3.38Å; T947-D950 PolarHBondContact OG1-OD2 3.31Å; T947-D950 VanDerWaalsContact OG1-OD2 3.1Å
948	M	88.6	Confident	79.4	Confident	38 Å²	38	66.6 Å²	66.6	19%	0.187	39%	0.386	C	S	.	.	H	α-helix	trans	-64.6	-34.7	174.8	-167.4	62.5	173.7	0	0	112.5	V896 N900 V901 L951 L952	V896-M948 HydrophobicContact CB-SD 4.47Å; V896-M948 HydrophobicContact CG1-SD 4.02Å; V896-M948 HydrophobicContact CG2-CB 4.38Å; N900-M948 HydrophobicContact CB-CE 3.64Å; V901-M948 HydrophobicContact CG2-CE 3.74Å; V901-M948 HydrophobicContact CG2-SD 3.81Å; M948-L951 PolarHBondContact O-N 3.36Å; M948-L952 HydrophobicContact CG-CD1 4.1Å; M948-L952 WeakPolarHBondContact O-CG 3.27Å; M948-L952 PolarHBondContact O-N 3.36Å
949	E	88.1	Confident	80.6	Confident	158 Å²	158	66.1 Å²	66.1	74%	0.738	38%	0.383	S	S	*	.	H	α-helix	trans	-68.5	-40.6	-178.8	-62	-178.5	170.1	0	0	112.1	T947 L951 L952 Q953	T947-E949 VanDerWaalsContact C-N 3.3Å; T947-E949 PolarHBondContact O-N 3.46Å; T947-E949 PolarHBondContact OG1-N 2.85Å; E949-L951 VanDerWaalsContact C-N 3.29Å; E949-L951 PolarHBondContact O-N 2.93Å; E949-L952 PolarHBondContact O-N 2.98Å; E949-Q953 WeakPolarHBondContact O-CB 3.44Å; E949-Q953 PolarHBondContact O-N 2.86Å
950	D	90.4	Very high	81.9	Confident	13 Å²	13	65 Å²	65	7%	0.07	38%	0.376	C	S	.	.	H	α-helix	trans	-59.2	-41.6	176.7	-63.7	-40.4	0	0	0	110.9	A921 A924 A925 R928 T947 A954	A921-D950 HydrophobicContact CB-CB 4.29Å; A924-D950 HydrophobicContact CB-CB 4.38Å; A925-D950 WeakPolarHBondContact CB-OD2 3.48Å; R928-D950 IonicContact CZ-OD2 2.73Å; R928-D950 IonicContact NE-OD1 3.12Å; R928-D950 IonicContact NE-OD2 2.8Å; R928-D950 IonicContact NH2-OD1 2.66Å; R928-D950 IonicContact NH2-OD2 3.69Å; R928-D950 PolarHBondContact NH2-OD2 3.01Å; T947-D950 PolarHBondContact N-OD2 3.39Å; T947-D950 PolarHBondContact OG1-N 3.38Å; T947-D950 PolarHBondContact OG1-OD2 3.31Å; T947-D950 VanDerWaalsContact OG1-OD2 3.1Å; D950-A954 WeakPolarHBondContact O-CB 3.43Å; D950-A954 PolarHBondContact O-N 2.71Å; D950-A954 VanDerWaalsContact O-N 3.12Å
951	L	89.3	Confident	83.3	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-71.2	-40.8	178.3	-75.1	163.4	0	0	0	112.9	L892 V896 V901 A921 M948 E949 A954 A955	L892-L951 HydrophobicContact CD2-CD1 4.25Å; V896-L951 HydrophobicContact CG1-CD1 3.57Å; V901-L951 HydrophobicContact CG1-CB 4.32Å; V901-L951 HydrophobicContact CG2-CB 4.07Å; V901-L951 HydrophobicContact CG2-CD1 4.36Å; A921-L951 HydrophobicContact CB-CD2 3.66Å; A921-L951 HydrophobicContact CB-CG 4.01Å; M948-L951 PolarHBondContact O-N 3.36Å; E949-L951 VanDerWaalsContact C-N 3.29Å; E949-L951 PolarHBondContact O-N 2.93Å; L951-A954 PolarHBondContact O-N 3.07Å; L951-A955 WeakPolarHBondContact O-CB 3.42Å; L951-A955 PolarHBondContact O-N 3.28Å
952	L	89.6	Confident	84.7	Confident	66 Å²	66	61.4 Å²	61.4	35%	0.346	34%	0.337	S	S	.	.	H	α-helix	trans	-68.4	-38.1	176.5	-70.5	172.1	0	0	0	111.9	C904 M948 E949 A954 A955 A956	C904-L952 HydrophobicContact CB-CD2 4.24Å; M948-L952 HydrophobicContact CG-CD1 4.1Å; M948-L952 WeakPolarHBondContact O-CG 3.27Å; M948-L952 PolarHBondContact O-N 3.36Å; E949-L952 PolarHBondContact O-N 2.98Å; L952-A954 VanDerWaalsContact C-N 3.33Å; L952-A955 PolarHBondContact O-N 2.98Å; L952-A956 PolarHBondContact O-N 2.65Å
953	Q	89	Confident	86	Confident	94 Å²	94	57.4 Å²	57.4	44%	0.439	31%	0.309	S	S	.	.	H	α-helix	trans	-65.7	-36.9	174.9	-168.9	-174.2	89.3	0	0	111.7	E949 R957	E949-Q953 WeakPolarHBondContact O-CB 3.44Å; E949-Q953 PolarHBondContact O-N 2.86Å; Q953-R957 VanDerWaalsContact CD-NH2 3.32Å; Q953-R957 WeakPolarHBondContact O-CG 3.45Å
954	A	90	Very high	86.9	Confident	3 Å²	3	61.8 Å²	61.8	3%	0.025	33%	0.326	C	S	.	.	H	α-helix	trans	-67.2	-43.3	172.4	0	0	0	0	0	111.6	L917 D920 A921 D950 L951 L952 A956 R957 L958	L917-A954 VanDerWaalsContact CD1-C 3.5Å; L917-A954 HydrophobicContact CD1-CB 3.7Å; D920-A954 HydrophobicContact CB-CB 4.01Å; A921-A954 HydrophobicContact CB-CB 4.04Å; D950-A954 WeakPolarHBondContact O-CB 3.43Å; D950-A954 PolarHBondContact O-N 2.71Å; D950-A954 VanDerWaalsContact O-N 3.12Å; L951-A954 PolarHBondContact O-N 3.07Å; L952-A954 VanDerWaalsContact C-N 3.33Å; A954-A956 VanDerWaalsContact C-N 3.33Å; A954-A956 PolarHBondContact O-N 2.63Å; A954-R957 PolarHBondContact O-N 3.37Å; A954-L958 PolarHBondContact O-N 2.91Å; A954-L958 VanDerWaalsContact O-N 3.11Å
955	A	87.9	Confident	87.2	Confident	8 Å²	8	67.5 Å²	67.5	7%	0.066	35%	0.351	C	S	.	.	H	α-helix	trans	-60.2	-40.1	178.8	0	0	0	0	0	112.6	L917 L951 L952 R957 L958	L917-A955 VanDerWaalsContact CD1-CA 3.43Å; L917-A955 HydrophobicContact CD1-CB 3.87Å; L951-A955 WeakPolarHBondContact O-CB 3.42Å; L951-A955 PolarHBondContact O-N 3.28Å; L952-A955 PolarHBondContact O-N 2.98Å; A955-R957 PolarHBondContact O-N 3.1Å; A955-L958 PolarHBondContact O-N 2.96Å
956	A	86.5	Confident	87.2	Confident	93 Å²	93	67.1 Å²	67.1	77%	0.769	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.5	176.5	0	0	0	0	0	114.3	L952 A954	L952-A956 PolarHBondContact O-N 2.65Å; A954-A956 VanDerWaalsContact C-N 3.33Å; A954-A956 PolarHBondContact O-N 2.63Å
957	R	86.5	Confident	87	Confident	169 Å²	169	68.4 Å²	68.4	64%	0.638	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-13.3	177.1	-68.5	177.8	-179.3	143.2	6.4	113.3	Q953 A954 A955 Q959	Q953-R957 VanDerWaalsContact CD-NH2 3.32Å; Q953-R957 WeakPolarHBondContact O-CG 3.45Å; A954-R957 PolarHBondContact O-N 3.37Å; A955-R957 PolarHBondContact O-N 3.1Å; R957-Q959 PolarHBondContact O-N 3.19Å
958	L	86.6	Confident	86.8	Confident	22 Å²	22	71.5 Å²	71.5	12%	0.115	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-70.2	119.3	-172.6	-170.9	69.8	0	0	0	111.3	L909 D913 L917 A954 A955	L909-L958 HydrophobicContact CD1-CD2 3.77Å; L909-L958 HydrophobicContact CD2-CD2 3.64Å; L909-L958 HydrophobicContact CD2-CG 4.28Å; L909-L958 HydrophobicContact CG-CD2 4.4Å; D913-L958 HydrophobicContact CB-CD1 4.45Å; L917-L958 HydrophobicContact CB-CD1 4.4Å; L917-L958 HydrophobicContact CB-CD2 4.26Å; L917-L958 HydrophobicContact CD1-CD2 4.35Å; A954-L958 PolarHBondContact O-N 2.91Å; A954-L958 VanDerWaalsContact O-N 3.11Å; A955-L958 PolarHBondContact O-N 2.96Å
959	Q	85	Confident	86.8	Confident	169 Å²	169	75.7 Å²	75.7	79%	0.79	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-99	133.2	167.1	-67.3	-175.2	-11.4	0	0	109.2	R957	R957-Q959 PolarHBondContact O-N 3.19Å
960	P	85	Confident	86.8	Confident	57 Å²	57	69.5 Å²	69.5	37%	0.37	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-68	133.5	177.8	28.2	-33.8	0	0	0	110.5	Q908 L909 V962	Q908-P960 WeakPolarHBondContact O-CB 3.41Å; L909-P960 HydrophobicContact CD2-CB 4.23Å; P960-V962 VanDerWaalsContact C-N 3.32Å; P960-V962 PolarHBondContact O-N 3.17Å
961	S	83.9	Confident	86.5	Confident	72 Å²	72	72.4 Å²	72.4	50%	0.503	37%	0.366	S	S	.	.	S	Bend	trans	-76.5	-14	-177.5	55.9	0	0	0	0	114.9	D913	D913-S961 VanDerWaalsContact CG-OG 3.26Å; D913-S961 WeakPolarHBondContact OD1-CB 3.47Å; D913-S961 PolarHBondContact OD1-N 2.96Å; D913-S961 PolarHBondContact OD1-OG 2.78Å; D913-S961 PolarHBondContact OD2-OG 2.78Å
962	V	84.5	Confident	86.4	Confident	7 Å²	7	80.8 Å²	80.8	4%	0.042	40%	0.397	C	S	.	.	S	Bend	trans	-124.7	128.4	-178.7	-173.1	0	0	0	0	109.7	P745 T910 P960 E966 L967	P745-V962 HydrophobicContact CB-CG1 4.29Å; P745-V962 HydrophobicContact CB-CG2 4.16Å; T910-V962 HydrophobicContact CG2-CG2 3.71Å; P960-V962 VanDerWaalsContact C-N 3.32Å; P960-V962 PolarHBondContact O-N 3.17Å; V962-E966 HydrophobicContact CG1-CB 3.93Å; V962-L967 HydrophobicContact CG1-CD2 3.96Å; V962-L967 HydrophobicContact CG1-CG 3.95Å
963	S	86.4	Confident	86.2	Confident	50 Å²	50	78.4 Å²	78.4	35%	0.35	39%	0.385	S	S	.	.			trans	-80.7	155.9	179.4	65.6	0	0	0	0	113.2	Q965 E966 L967	S963-Q965 PolarHBondContact O-N 3.17Å; S963-E966 WeakPolarHBondContact CB-OE2 3.37Å; S963-E966 PolarHBondContact N-OE2 3.19Å; S963-E966 PolarHBondContact O-N 3.09Å; S963-E966 VanDerWaalsContact OG-CD 3.32Å; S963-E966 VanDerWaalsContact OG-CG 3.28Å; S963-E966 WeakPolarHBondContact OG-CG 3.29Å; S963-E966 PolarHBondContact OG-N 2.89Å; S963-E966 PolarHBondContact OG-OE2 3.36Å; S963-L967 PolarHBondContact O-N 2.99Å
964	E	83.9	Confident	85.9	Confident	117 Å²	117	77.3 Å²	77.3	55%	0.547	38%	0.38	S	S	.	.	H	α-helix	trans	-52.6	-38.8	171.6	-67.5	-171.7	169	0	0	112.7	Q908 E966 L967 L968	Q908-E964 VanDerWaalsContact CD-CG 3.48Å; Q908-E964 VanDerWaalsContact NE2-CG 3.35Å; Q908-E964 PolarHBondContact NE2-OE1 2.79Å; E964-E966 VanDerWaalsContact C-N 3.32Å; E964-E966 PolarHBondContact O-N 2.78Å; E964-L967 PolarHBondContact O-N 2.8Å; E964-L968 WeakPolarHBondContact O-CB 3.48Å; E964-L968 VanDerWaalsContact O-CG 3.31Å; E964-L968 WeakPolarHBondContact O-CG 3.4Å; E964-L968 PolarHBondContact O-N 3.4Å
965	Q	86.7	Confident	85.7	Confident	160 Å²	160	83.7 Å²	83.7	75%	0.748	41%	0.409	S	S	*	.	H	α-helix	trans	-65.9	-36.7	-179.4	-60.4	-174.3	10.6	0	0	111.7	S963 R969	S963-Q965 PolarHBondContact O-N 3.17Å; Q965-R969 PolarHBondContact O-N 2.97Å
966	E	85.2	Confident	85.4	Confident	86 Å²	86	90.6 Å²	90.6	40%	0.402	44%	0.437	S	S	.	.	H	α-helix	trans	-72.5	-41.3	174.5	-71.6	165.6	126	0	0	111.8	V962 S963 E964 L968 R969 Y970	V962-E966 HydrophobicContact CG1-CB 3.93Å; S963-E966 WeakPolarHBondContact CB-OE2 3.37Å; S963-E966 PolarHBondContact N-OE2 3.19Å; S963-E966 PolarHBondContact O-N 3.09Å; S963-E966 VanDerWaalsContact OG-CD 3.32Å; S963-E966 VanDerWaalsContact OG-CG 3.28Å; S963-E966 WeakPolarHBondContact OG-CG 3.29Å; S963-E966 PolarHBondContact OG-N 2.89Å; S963-E966 PolarHBondContact OG-OE2 3.36Å; E964-E966 VanDerWaalsContact C-N 3.32Å; E964-E966 PolarHBondContact O-N 2.78Å; E966-L968 VanDerWaalsContact C-N 3.3Å; E966-L968 PolarHBondContact O-N 3.42Å; E966-R969 CarbonylContact O-C 3.59Å; E966-R969 WeakPolarHBondContact O-CA 3.33Å; E966-R969 WeakPolarHBondContact O-CB 3.28Å; E966-R969 PolarHBondContact O-N 2.78Å; E966-Y970 HydrophobicContact CB-CE2 4.46Å; E966-Y970 WeakPolarHBondContact O-CD2 3.42Å; E966-Y970 PolarHBondContact O-N 2.82Å
967	L	83.5	Confident	84.9	Confident	27 Å²	27	88.5 Å²	88.5	14%	0.141	41%	0.411	C	S	.	.	H	α-helix	trans	-58.2	-43.4	172.7	-68.7	173.5	0	0	0	111.2	P745 A872 Q908 V962 S963 E964 R969 Y970 K971	P745-L967 HydrophobicContact CG-CD2 4.36Å; A872-L967 HydrophobicContact CB-CD2 4.06Å; Q908-L967 HydrophobicContact CB-CD1 4.38Å; Q908-L967 HydrophobicContact CG-CD1 4.18Å; V962-L967 HydrophobicContact CG1-CD2 3.96Å; V962-L967 HydrophobicContact CG1-CG 3.95Å; S963-L967 PolarHBondContact O-N 2.99Å; E964-L967 PolarHBondContact O-N 2.8Å; L967-R969 VanDerWaalsContact C-N 3.35Å; L967-R969 PolarHBondContact O-N 3.02Å; L967-Y970 PolarHBondContact O-N 2.96Å; L967-K971 WeakPolarHBondContact O-CG 3.35Å; L967-K971 PolarHBondContact O-N 2.68Å
968	L	86.3	Confident	84.2	Confident	91 Å²	91	84.4 Å²	84.4	48%	0.476	41%	0.413	S	S	.	.	H	α-helix	trans	-63.7	-36.4	173	-71.4	171	0	0	0	112.6	E964 E966 R972	E964-L968 WeakPolarHBondContact O-CB 3.48Å; E964-L968 VanDerWaalsContact O-CG 3.31Å; E964-L968 WeakPolarHBondContact O-CG 3.4Å; E964-L968 PolarHBondContact O-N 3.4Å; E966-L968 VanDerWaalsContact C-N 3.3Å; E966-L968 PolarHBondContact O-N 3.42Å; L968-R972 VanDerWaalsContact O-CG 3.28Å; L968-R972 WeakPolarHBondContact O-CG 3.45Å; L968-R972 PolarHBondContact O-N 3.24Å
969	R	88.1	Confident	83	Confident	127 Å²	127	87.5 Å²	87.5	48%	0.479	44%	0.442	S	S	.	.	H	α-helix	trans	-62.3	-46.9	171.5	177.7	-178	172.8	178.6	-1.6	111	D852 Q965 E966 L967 R972 I973	D852-R969 IonicContact OD2-CZ 3.75Å; D852-R969 IonicContact OD2-NH2 2.71Å; D852-R969 PolarHBondContact OD2-NH2 2.69Å; Q965-R969 PolarHBondContact O-N 2.97Å; E966-R969 CarbonylContact O-C 3.59Å; E966-R969 WeakPolarHBondContact O-CA 3.33Å; E966-R969 WeakPolarHBondContact O-CB 3.28Å; E966-R969 PolarHBondContact O-N 2.78Å; L967-R969 VanDerWaalsContact C-N 3.35Å; L967-R969 PolarHBondContact O-N 3.02Å; R969-R972 PolarHBondContact O-N 3.39Å; R969-I973 HydrophobicContact CG-CD1 3.86Å; R969-I973 VanDerWaalsContact O-CG1 3.29Å; R969-I973 WeakPolarHBondContact O-CG1 2.97Å; R969-I973 PolarHBondContact O-N 3.16Å
970	Y	87.5	Confident	81.5	Confident	27 Å²	27	87.1 Å²	87.1	11%	0.106	46%	0.456	C	S	.	.	H	α-helix	trans	-63.1	-42.4	177.4	-75.2	-68.1	0	0	0	112.3	P745 N849 E966 L967 R972 I973 Q974	P745-Y970 HydrophobicContact CB-CD2 3.94Å; P745-Y970 HydrophobicContact CB-CE2 3.64Å; P745-Y970 HydrophobicContact CG-CD2 4.19Å; P745-Y970 HydrophobicContact CG-CE2 4.37Å; N849-Y970 WeakPolarHBondContact O-CE1 3.38Å; N849-Y970 PolarHBondContact O-OH 3.46Å; E966-Y970 HydrophobicContact CB-CE2 4.46Å; E966-Y970 WeakPolarHBondContact O-CD2 3.42Å; E966-Y970 PolarHBondContact O-N 2.82Å; L967-Y970 PolarHBondContact O-N 2.96Å; Y970-R972 PolarHBondContact O-N 3.16Å; Y970-I973 PolarHBondContact O-N 3Å; Y970-I973 VanDerWaalsContact O-N 3.16Å; Y970-Q974 WeakPolarHBondContact O-CB 3.47Å; Y970-Q974 PolarHBondContact O-N 3.38Å
971	K	85.1	Confident	81.3	Confident	74 Å²	74	88.7 Å²	88.7	32%	0.322	46%	0.461	S	S	.	.	H	α-helix	trans	-60	-43.1	173.4	-72.1	-175.5	178.5	-171.9	0	112.1	E874 L967 I973 Q974 H975	E874-K971 VanDerWaalsContact CD-NZ 3.31Å; E874-K971 WeakPolarHBondContact OE1-CE 3.23Å; E874-K971 IonicContact OE1-NZ 2.64Å; E874-K971 PolarHBondContact OE1-NZ 3.18Å; E874-K971 IonicContact OE2-NZ 3.14Å; E874-K971 PolarHBondContact OE2-NZ 2.88Å; E874-K971 VanDerWaalsContact OE2-NZ 3.14Å; L967-K971 WeakPolarHBondContact O-CG 3.35Å; L967-K971 PolarHBondContact O-N 2.68Å; K971-I973 VanDerWaalsContact C-N 3.33Å; K971-I973 PolarHBondContact O-N 3.15Å; K971-Q974 PolarHBondContact O-N 3.4Å; K971-H975 PolarHBondContact O-CD2 3.36Å; K971-H975 PolarHBondContact O-N 3.29Å
972	R	87.6	Confident	81.2	Confident	177 Å²	177	89.5 Å²	89.5	67%	0.668	46%	0.458	S	S	*	.	H	α-helix	trans	-62.8	-36.9	173.9	-72	172.1	-172.5	174.5	4.5	112.7	L968 R969 Y970 K976	L968-R972 VanDerWaalsContact O-CG 3.28Å; L968-R972 WeakPolarHBondContact O-CG 3.45Å; L968-R972 PolarHBondContact O-N 3.24Å; R969-R972 PolarHBondContact O-N 3.39Å; Y970-R972 PolarHBondContact O-N 3.16Å; R972-K976 WeakPolarHBondContact O-CG 3.07Å; R972-K976 PolarHBondContact O-N 2.77Å
973	I	85.2	Confident	81	Confident	16 Å²	16	94.1 Å²	94.1	8%	0.082	48%	0.481	C	S	.	.	H	α-helix	trans	-68.3	-44.3	176.2	-71.6	168.6	0	0	0	110.4	P851 R969 Y970 K971 H975 K976 F977	P851-I973 HydrophobicContact CG-CG2 3.9Å; R969-I973 HydrophobicContact CG-CD1 3.86Å; R969-I973 VanDerWaalsContact O-CG1 3.29Å; R969-I973 WeakPolarHBondContact O-CG1 2.97Å; R969-I973 PolarHBondContact O-N 3.16Å; Y970-I973 PolarHBondContact O-N 3Å; Y970-I973 VanDerWaalsContact O-N 3.16Å; K971-I973 VanDerWaalsContact C-N 3.33Å; K971-I973 PolarHBondContact O-N 3.15Å; I973-H975 PolarHBondContact O-N 3.07Å; I973-K976 WeakPolarHBondContact O-CB 3.43Å; I973-K976 PolarHBondContact O-N 3.42Å; I973-K976 VanDerWaalsContact O-N 3.13Å; I973-F977 HydrophobicContact CG2-CD2 3.63Å; I973-F977 HydrophobicContact CG2-CE2 3.54Å; I973-F977 WeakPolarHBondContact O-CD2 3.4Å; I973-F977 PolarHBondContact O-N 2.95Å
974	Q	83.4	Confident	80.7	Confident	72 Å²	72	96.7 Å²	96.7	34%	0.336	49%	0.489	S	S	.	.	H	α-helix	trans	-57.1	-47.6	174.4	-174.1	-171.4	6.9	0	0	111.5	F869 Y970 K971 K976 F977 A978	F869-Q974 HydrophobicContact CB-CG 4.2Å; F869-Q974 VanDerWaalsContact CD1-CD 3.43Å; F869-Q974 HydrophobicContact CD1-CG 4.3Å; F869-Q974 HydrophobicContact CG-CG 4.12Å; Y970-Q974 WeakPolarHBondContact O-CB 3.47Å; Y970-Q974 PolarHBondContact O-N 3.38Å; K971-Q974 PolarHBondContact O-N 3.4Å; Q974-K976 VanDerWaalsContact C-N 3.27Å; Q974-K976 PolarHBondContact O-N 3.17Å; Q974-F977 PolarHBondContact O-N 3.08Å; Q974-A978 WeakPolarHBondContact O-CB 3.46Å; Q974-A978 PolarHBondContact O-N 3.29Å
975	H	83.9	Confident	80.5	Confident	137 Å²	137	95.4 Å²	95.4	63%	0.634	49%	0.485	S	S	*	.	H	α-helix	trans	-61.7	-31	176.3	-77.4	-62.7	0	0	0	113.8	K971 I973 A979	K971-H975 PolarHBondContact O-CD2 3.36Å; K971-H975 PolarHBondContact O-N 3.29Å; I973-H975 PolarHBondContact O-N 3.07Å; H975-A979 VanDerWaalsContact O-CB 3.3Å; H975-A979 WeakPolarHBondContact O-CB 3.48Å; H975-A979 PolarHBondContact O-N 3.44Å
976	K	83.1	Confident	80.1	Confident	152 Å²	152	91.1 Å²	91.1	66%	0.661	47%	0.468	S	S	*	.	H	α-helix	trans	-69.6	-45	173.3	-73.3	177.3	177.8	-170.5	0	111.7	R972 I973 Q974 A978 A979 C980	R972-K976 WeakPolarHBondContact O-CG 3.07Å; R972-K976 PolarHBondContact O-N 2.77Å; I973-K976 WeakPolarHBondContact O-CB 3.43Å; I973-K976 PolarHBondContact O-N 3.42Å; I973-K976 VanDerWaalsContact O-N 3.13Å; Q974-K976 VanDerWaalsContact C-N 3.27Å; Q974-K976 PolarHBondContact O-N 3.17Å; K976-A978 VanDerWaalsContact C-N 3.34Å; K976-A979 PolarHBondContact O-N 3.43Å; K976-C980 PolarHBondContact O-N 3.12Å; K976-C980 PolarHBondContact O-SG 3.36Å
977	F	76.4	Confident	79.7	Confident	50 Å²	50	91.5 Å²	91.5	22%	0.219	47%	0.473	C	S	.	.	H	α-helix	trans	-73.4	-23.2	179.5	-75	-61.6	0	0	0	113.9	P851 L859 L867 I973 Q974 A979	P851-F977 HydrophobicContact CB-CE2 3.82Å; P851-F977 HydrophobicContact CB-CZ 4.2Å; P851-F977 HydrophobicContact CG-CE2 4.05Å; L859-F977 HydrophobicContact CD1-CD1 4.19Å; L859-F977 HydrophobicContact CD1-CE1 3.45Å; L859-F977 VanDerWaalsContact CD1-CE1 3.45Å; L859-F977 HydrophobicContact CD1-CZ 4.13Å; L867-F977 HydrophobicContact CD1-CB 4.42Å; L867-F977 HydrophobicContact CD1-CD1 4.31Å; I973-F977 HydrophobicContact CG2-CD2 3.63Å; I973-F977 HydrophobicContact CG2-CE2 3.54Å; I973-F977 WeakPolarHBondContact O-CD2 3.4Å; I973-F977 PolarHBondContact O-N 2.95Å; Q974-F977 PolarHBondContact O-N 3.08Å; F977-A979 VanDerWaalsContact C-N 3.35Å
978	A	71	Confident	79.4	Confident	82 Å²	82	96.5 Å²	96.5	68%	0.678	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-6.3	173.1	0	0	0	0	0	114	Q974 K976	Q974-A978 WeakPolarHBondContact O-CB 3.46Å; Q974-A978 PolarHBondContact O-N 3.29Å; K976-A978 VanDerWaalsContact C-N 3.34Å
979	A	62.2	Low	78.8	Confident	88 Å²	88	96.9 Å²	96.9	73%	0.727	50%	0.5	S	S	*	.			trans	-107.5	-2.9	177.7	0	0	0	0	0	113.3	H975 K976 F977	H975-A979 VanDerWaalsContact O-CB 3.3Å; H975-A979 WeakPolarHBondContact O-CB 3.48Å; H975-A979 PolarHBondContact O-N 3.44Å; K976-A979 PolarHBondContact O-N 3.43Å; F977-A979 VanDerWaalsContact C-N 3.35Å
980	C	52.4	Low	78	Confident	161 Å²	161	94.2 Å²	94.2	100%	1.088	50%	0.502	S	S	*	.			trans	-99.6	0	170.9	-69.1	0	0	0	0	110	K976	K976-C980 PolarHBondContact O-N 3.12Å; K976-C980 PolarHBondContact O-SG 3.36Å

Retrieved 980 of 980 residues in 213.6 ms (Link to these results)

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