A0A096NNJ9_PAPAN Loading...

Cas scaffolding protein family member 4

Docking protein that plays a role in tyrosine kinase-based signaling related to cell adhesion and cell spreading. Regulates PTK2/FAK1 activity, focal adhesion integrity, and cell spreading.

AlphaFold DB , UniProt , Accession A0A096NNJ9, Species PAPAN (Papio anubis, Olive baboon), Gene CASS4, Length 812 aa.

						>A0A096NNJ9_PAPAN|A0A096NNJ9|CASS4
MKGTGVVDGAPKALLARALYDNCPDCSDELAFSRGDILTILEQHVPESEGWWKCLLHGRQGLAPANRLQILTEVTADRPCPPFLRGLEEAPASSEETYQVPTLPCPPTPGPVYEHMRSWVEGPQPPSAQVYEFPDPPTSARIICEKTLSFPKQAIITLPRPTRASLPTLPSQVYDVPTQHRGPVVLKEPEKQQLYDIPASPKKAGLHPPAGQASGQGVPLISVTTLRKGGYSTLPSPQKSEWVYDTPVSPGKASVRNTPLPTFEEESRPHALPSSGSTFHNPPSGRARSLTPQLNTNVPMQKKLSLPEIPSYGFLVPRDTFPLDEDVSYKVPSSFLIPRVEQQNTKPNIYDIPKAISSVSQAGKELAKAKEVSENSTGHNSSWFSRRTASRSPELDRLSGSSSDSRASIVSSCSTTSTDSSSSSSSEESAKELSLDLDVAKETVMSLQHKVVSSVAGLMLFVSRKWRFRDYLEANIDAIHRSTEHIEESVREFLDFARGVHGTACNLTDSNLQNRIRDQMQTISNSYRILLETKESLDNRNWPLEVLVTDNVQNSPDDLERFVMVARMLPEDIKRFASIVIANGRLLFKQNCEKEETVQLTPNAEFKCDKCIQPPQRETESHQKSTPSTKQREDEHSSELLKKNRANICQQTLPNLEKKQKPILEQRLDENEDLGTMNPGPLTPQPSSQQTPERKHCLSEHCRLYFGALFKAISAFHGSLSSSQPTEIITQSKLVITVGQKLVDTLCTETQERDVRNEILRGSSHLCSLLKDVALATKNAVLTYPSPAALGHLQAEAEKLERHTRQFRGTLG
					

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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	36.1	Very low	38.4	Very low	235 Å²	235	128.4 Å²	128.4	100%	1.158	82%	0.816	S	S	*	*				0	139	0	-72.4	149	59.4	0	0	108
2	K	37.6	Very low	40.1	Very low	218 Å²	218	131.4 Å²	131.4	95%	0.948	81%	0.808	S	S	*	*			trans	43.3	134.2	165.9	-60.3	-176.5	178	-176.7	0	118.3
3	G	35.3	Very low	42.5	Very low	75 Å²	75	126.2 Å²	126.2	77%	0.773	79%	0.786	S	S	*	*			cis	177.1	161.1	1.2	0	0	0	0	0	109.3
4	T	42.6	Very low	45.7	Very low	141 Å²	141	123.3 Å²	123.3	87%	0.865	76%	0.762	S	S	*	*			trans	-74.6	141.7	-174	44.4	0	0	0	0	113.7
5	G	31.1	Very low	48.8	Very low	76 Å²	76	119.1 Å²	119.1	78%	0.784	73%	0.732	S	S	*	*			trans	-131.5	93.8	162.5	0	0	0	0	0	109.3
6	V	35.3	Very low	51.5	Low	120 Å²	120	111.7 Å²	111.7	73%	0.727	69%	0.687	S	S	*	*			trans	-83.8	125.4	177.8	175.4	0	0	0	0	108.6	D8	V6-D8 HydrophobicContact CG1-CB 4.06Å
7	V	40.3	Very low	53.9	Low	145 Å²	145	111.5 Å²	111.5	88%	0.879	67%	0.67	S	S	*	*			trans	-97.9	82	167.9	-176	0	0	0	0	107.1
8	D	38.6	Very low	56.2	Low	137 Å²	137	105.4 Å²	105.4	73%	0.733	63%	0.634	S	S	*	*			trans	-85.1	121	171	-165.6	-7.8	0	0	0	109	V6 A10	V6-D8 HydrophobicContact CG1-CB 4.06Å; D8-A10 PolarHBondContact OD1-N 3.36Å
9	G	38.3	Very low	57.9	Low	68 Å²	68	102.9 Å²	102.9	70%	0.701	62%	0.617	S	S	*	*			trans	-150.6	44.8	-177.5	0	0	0	0	0	109.4
10	A	40.9	Very low	59.6	Low	73 Å²	73	104.8 Å²	104.8	60%	0.603	61%	0.613	S	S	*	*			trans	-48.4	127.8	-178.8	0	0	0	0	0	111.6	D8 K12	D8-A10 PolarHBondContact OD1-N 3.36Å; A10-K12 PolarHBondContact O-N 3.29Å
11	P	46.1	Very low	61.1	Low	124 Å²	124	104.2 Å²	104.2	81%	0.805	61%	0.608	S	S	*	*			trans	-64.4	128.7	177.3	26.9	-33.4	0	0	0	109.2	A13	P11-A13 PolarHBondContact O-N 3.2Å
12	K	58.8	Low	63.6	Low	165 Å²	165	93.3 Å²	93.3	72%	0.717	55%	0.554	S	S	*	*			trans	-62.6	105.3	178	-69.2	-170.1	176.1	-169	0	109.8	A10 L14	A10-K12 PolarHBondContact O-N 3.29Å; K12-L14 PolarHBondContact O-N 3.07Å
13	A	71.6	Confident	66	Low	64 Å²	64	88 Å²	88	53%	0.529	54%	0.543	S	S	.	.			trans	-66	112.3	178.9	0	0	0	0	0	110	P11 L15 T39	P11-A13 PolarHBondContact O-N 3.2Å; A13-L15 PolarHBondContact O-N 3.4Å; A13-T39 HydrophobicContact CB-CG2 3.9Å
14	L	87.8	Confident	68.3	Low	85 Å²	85	87 Å²	87	45%	0.445	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	114.8	177.1	-72.4	172.2	0	0	0	109.3	K12 I40	K12-L14 PolarHBondContact O-N 3.07Å; L14-I40 HydrophobicContact CB-CB 4.24Å; L14-I40 WeakPolarHBondContact O-CB 3.2Å; L14-I40 PolarHBondContact O-N 3.1Å
15	L	91	Very high	70	Confident	61 Å²	61	87.7 Å²	87.7	32%	0.319	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	148.9	175.9	-60.2	-179.1	0	0	0	110.9	A13 I37 L38 T39 L71	A13-L15 PolarHBondContact O-N 3.4Å; L15-I37 HydrophobicContact CB-CG2 4.19Å; L15-I37 HydrophobicContact CD1-CG2 4.32Å; L15-I37 HydrophobicContact CD2-CG2 4.38Å; L15-L38 CarbonylContact C-O 3.54Å; L15-L38 WeakPolarHBondContact CA-O 3.46Å; L15-T39 WeakPolarHBondContact CD2-OG1 3.48Å; L15-L71 HydrophobicContact CB-CB 4.42Å; L15-L71 PolarHBondContact O-N 3.45Å
16	A	92.1	Very high	72.4	Confident	0 Å²	0	87.2 Å²	87.2	0%	0	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	144.8	168.5	0	0	0	0	0	111.9	I37 L38 I40 L68 Q69	A16-I37 WeakPolarHBondContact O-CA 3.16Å; A16-L38 PolarHBondContact N-O 2.94Å; A16-L38 PolarHBondContact O-N 3.28Å; A16-I40 HydrophobicContact CB-CD1 3.83Å; A16-I40 HydrophobicContact CB-CG1 4.04Å; A16-L68 HydrophobicContact CB-CB 4.23Å; A16-Q69 CarbonylContact C-O 3.57Å; A16-Q69 WeakPolarHBondContact CA-O 3.43Å; A16-Q69 WeakPolarHBondContact CB-O 3.4Å
17	R	93.4	Very high	74.4	Confident	108 Å²	108	86.9 Å²	86.9	41%	0.408	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.9	174.4	-179.6	174.2	62.2	178.5	-1	110.7	L19 D36 I37 Q69 L71	R17-L19 PolarHBondContact O-N 3.36Å; R17-D36 CarbonylContact C-O 3.58Å; R17-D36 WeakPolarHBondContact CA-O 3.26Å; R17-I37 HydrophobicContact CB-CD1 3.73Å; R17-I37 HydrophobicContact CG-CD1 3.87Å; R17-Q69 PolarHBondContact N-O 3.49Å; R17-Q69 PolarHBondContact O-N 2.83Å; R17-L71 HydrophobicContact CB-CD1 4.26Å; R17-L71 HydrophobicContact CB-CD2 4.31Å; R17-L71 HydrophobicContact CB-CG 4.36Å
18	A	93.8	Very high	76.5	Confident	2 Å²	2	85.1 Å²	85.1	2%	0.017	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	123.9	168.9	0	0	0	0	0	111.6	F32 S33 G35 D36 L38 L68	A18-F32 HydrophobicContact CB-CD2 3.44Å; A18-F32 VanDerWaalsContact CB-CD2 3.44Å; A18-F32 HydrophobicContact CB-CE2 3.73Å; A18-F32 HydrophobicContact CB-CG 4.46Å; A18-S33 WeakPolarHBondContact CB-O 3.41Å; A18-G35 PolarHBondContact O-N 3.16Å; A18-D36 HydrophobicContact CB-CB 4.34Å; A18-D36 PolarHBondContact N-O 3.07Å; A18-L38 HydrophobicContact CB-CD1 3.99Å; A18-L68 HydrophobicContact CB-CD2 4.38Å
19	L	89.9	Confident	78.9	Confident	58 Å²	58	80.1 Å²	80.1	30%	0.304	47%	0.467	S	S	.	.	S	Bend	trans	-85.1	-23.9	176.1	-64.9	-179.8	0	0	0	112.9	R17 R34 R67 Q69	R17-L19 PolarHBondContact O-N 3.36Å; L19-R34 VanDerWaalsContact O-CD 3.24Å; L19-R34 WeakPolarHBondContact O-CD 3.39Å; L19-R34 VanDerWaalsContact O-CG 3.31Å; L19-R34 WeakPolarHBondContact O-CG 3.2Å; L19-R34 PolarHBondContact O-NE 2.76Å; L19-R67 WeakPolarHBondContact CB-O 3.29Å; L19-R67 PolarHBondContact N-O 3.34Å; L19-Q69 HydrophobicContact CD1-CB 4.2Å; L19-Q69 HydrophobicContact CD2-CB 3.86Å; L19-Q69 HydrophobicContact CG-CB 4.01Å
20	Y	90.7	Very high	81.4	Confident	140 Å²	140	77.3 Å²	77.3	55%	0.549	44%	0.435	S	S	.	.	S	Bend	trans	-144.4	162	-176.9	-51.4	-78.9	0	0	0	109.6	F32 R67	Y20-F32 WeakPolarHBondContact O-CE2 3.23Å; Y20-R67 HydrophobicContact CD2-CB 4.22Å; Y20-R67 HydrophobicContact CD2-CG 4.18Å
21	D	90.9	Very high	83.7	Confident	94 Å²	94	76.7 Å²	76.7	50%	0.503	43%	0.43	S	S	.	.			trans	-69.5	154.6	171	-45.8	-60.9	0	0	0	110.9	F32 S33 R34 R67	D21-F32 CarbonylContact C-O 3.58Å; D21-F32 WeakPolarHBondContact CA-O 3.42Å; D21-S33 WeakPolarHBondContact OD1-CA 3.08Å; D21-R34 WeakPolarHBondContact OD1-CB 3.26Å; D21-R34 PolarHBondContact OD1-N 3.22Å; D21-R67 PolarHBondContact O-NH1 3.05Å
22	N	90.4	Very high	85.9	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.027	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-136.6	107.3	173.8	-162.4	70.6	0	0	0	110.4	L30 A31 F32 R67	N22-L30 PolarHBondContact ND2-O 2.77Å; N22-A31 WeakPolarHBondContact O-CA 3.48Å; N22-F32 HydrophobicContact CB-CD1 3.71Å; N22-F32 HydrophobicContact CB-CD2 3.87Å; N22-F32 HydrophobicContact CB-CE1 3.42Å; N22-F32 VanDerWaalsContact CB-CE1 3.42Å; N22-F32 HydrophobicContact CB-CE2 3.62Å; N22-F32 HydrophobicContact CB-CG 3.94Å; N22-F32 HydrophobicContact CB-CZ 3.4Å; N22-F32 PolarHBondContact N-O 3.28Å; N22-F32 PolarHBondContact O-N 2.67Å; N22-R67 PolarHBondContact OD1-NE 3.16Å; N22-R67 PolarHBondContact OD1-NH1 3.29Å
23	C	86.7	Confident	87.5	Confident	106 Å²	106	66.4 Å²	66.4	72%	0.716	38%	0.381	S	S	*	.			trans	-83.2	124.5	162.5	-59.1	0	0	0	0	107.4
24	P	85	Confident	88.5	Confident	55 Å²	55	72 Å²	72	36%	0.357	39%	0.388	S	S	.	.			trans	-76.3	131.7	-179.1	30.5	-34.3	0	0	0	111.1	E29 A31	P24-E29 WeakPolarHBondContact CA-OE2 3.01Å; P24-E29 HydrophobicContact CB-CB 3.43Å; P24-E29 VanDerWaalsContact CB-CB 3.43Å; P24-A31 HydrophobicContact CG-CB 4.03Å
25	D	77.2	Confident	88.6	Confident	156 Å²	156	70 Å²	70	83%	0.834	39%	0.387	S	S	*	.	S	Bend	trans	-85.2	-19.8	176.7	-77.2	-37.6	0	0	0	112.4	E29	D25-E29 PolarHBondContact N-OE1 2.93Å; D25-E29 PolarHBondContact N-OE2 2.83Å; D25-E29 VanDerWaalsContact N-OE2 3.08Å
26	C	80.7	Confident	88.7	Confident	65 Å²	65	69 Å²	69	44%	0.439	38%	0.382	S	S	.	.	S	Bend	trans	-132.1	172	173.6	74.9	0	0	0	0	114	D28 E29	C26-D28 PolarHBondContact O-N 3.35Å; C26-E29 PolarHBondContact N-OE1 3.3Å; C26-E29 PolarHBondContact O-N 3.17Å; C26-E29 PolarHBondContact SG-OE1 2.76Å
27	S	79	Confident	88.7	Confident	114 Å²	114	72.8 Å²	72.8	80%	0.797	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-22.2	-178.1	48.2	0	0	0	0	114.9
28	D	83.1	Confident	88.7	Confident	107 Å²	107	67.7 Å²	67.7	57%	0.572	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-7.7	-167.6	-57.9	6.8	0	0	0	110.9	C26 G61 L62	C26-D28 PolarHBondContact O-N 3.35Å; D28-G61 CarbonylContact O-C 3.48Å; D28-G61 WeakPolarHBondContact O-CA 3.23Å; D28-L62 PolarHBondContact O-N 2.71Å
29	E	89.7	Confident	88.6	Confident	33 Å²	33	69.3 Å²	69.3	15%	0.154	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-85	149.5	174.1	-77.4	170.9	-117.5	0	0	112.6	P24 D25 C26 W51 L62	P24-E29 WeakPolarHBondContact CA-OE2 3.01Å; P24-E29 HydrophobicContact CB-CB 3.43Å; P24-E29 VanDerWaalsContact CB-CB 3.43Å; D25-E29 PolarHBondContact N-OE1 2.93Å; D25-E29 PolarHBondContact N-OE2 2.83Å; D25-E29 VanDerWaalsContact N-OE2 3.08Å; C26-E29 PolarHBondContact N-OE1 3.3Å; C26-E29 PolarHBondContact O-N 3.17Å; C26-E29 PolarHBondContact SG-OE1 2.76Å; E29-W51 HydrophobicContact CG-CH2 3.95Å; E29-W51 HydrophobicContact CG-CZ3 3.74Å; E29-L62 CarbonylContact C-O 3.57Å; E29-L62 WeakPolarHBondContact CA-O 3.48Å
30	L	90.1	Very high	88.6	Confident	9 Å²	9	67 Å²	67	5%	0.047	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-96.2	123.6	-178.6	-167.9	58.1	0	0	0	111	N22 F32 L38 C54 L56 R59 L62	N22-L30 PolarHBondContact ND2-O 2.77Å; L30-F32 VanDerWaalsContact O-CD1 3.25Å; L30-F32 WeakPolarHBondContact O-CD1 3.48Å; L30-L38 HydrophobicContact CD2-CD2 3.78Å; L30-C54 HydrophobicContact CD2-CB 3.76Å; L30-L56 HydrophobicContact CD1-CB 4.38Å; L30-L56 HydrophobicContact CD2-CB 3.93Å; L30-L56 HydrophobicContact CG-CB 4.36Å; L30-R59 HydrophobicContact CD1-CB 4.12Å; L30-L62 PolarHBondContact N-O 2.75Å
31	A	89.7	Confident	88.5	Confident	59 Å²	59	64.6 Å²	64.6	49%	0.488	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-74.7	130.3	168.9	0	0	0	0	0	110.6	N22 P24	N22-A31 WeakPolarHBondContact O-CA 3.48Å; P24-A31 HydrophobicContact CG-CB 4.03Å
32	F	92.6	Very high	88.2	Confident	10 Å²	10	63.7 Å²	63.7	4%	0.044	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-154	157.3	175.5	57.8	-97.3	0	0	0	112	A18 Y20 D21 N22 L30 D36 L38 L56 A63 R67 L68	A18-F32 HydrophobicContact CB-CD2 3.44Å; A18-F32 VanDerWaalsContact CB-CD2 3.44Å; A18-F32 HydrophobicContact CB-CE2 3.73Å; A18-F32 HydrophobicContact CB-CG 4.46Å; Y20-F32 WeakPolarHBondContact O-CE2 3.23Å; D21-F32 CarbonylContact C-O 3.58Å; D21-F32 WeakPolarHBondContact CA-O 3.42Å; N22-F32 HydrophobicContact CB-CD1 3.71Å; N22-F32 HydrophobicContact CB-CD2 3.87Å; N22-F32 HydrophobicContact CB-CE1 3.42Å; N22-F32 VanDerWaalsContact CB-CE1 3.42Å; N22-F32 HydrophobicContact CB-CE2 3.62Å; N22-F32 HydrophobicContact CB-CG 3.94Å; N22-F32 HydrophobicContact CB-CZ 3.4Å; N22-F32 PolarHBondContact N-O 3.28Å; N22-F32 PolarHBondContact O-N 2.67Å; L30-F32 VanDerWaalsContact O-CD1 3.25Å; L30-F32 WeakPolarHBondContact O-CD1 3.48Å; F32-D36 HydrophobicContact CB-CB 4.44Å; F32-L38 HydrophobicContact CB-CD1 4.32Å; F32-L38 HydrophobicContact CB-CD2 4.37Å; F32-L38 HydrophobicContact CD1-CD2 3.81Å; F32-L38 HydrophobicContact CD2-CD1 4.49Å; F32-L38 HydrophobicContact CE1-CD2 4.24Å; F32-L38 HydrophobicContact CG-CD1 4.33Å; F32-L38 HydrophobicContact CG-CD2 4.13Å; F32-L56 HydrophobicContact CB-CD2 3.43Å; F32-L56 VanDerWaalsContact CB-CD2 3.43Å; F32-A63 HydrophobicContact CD1-CB 4.38Å; F32-A63 HydrophobicContact CE1-CB 3.59Å; F32-A63 HydrophobicContact CZ-CB 4.29Å; F32-R67 HydrophobicContact CE2-CB 4.22Å; F32-R67 HydrophobicContact CZ-CB 4.12Å; F32-L68 HydrophobicContact CE2-CD2 4.05Å; F32-L68 HydrophobicContact CZ-CD2 3.95Å
33	S	93.2	Very high	87.9	Confident	64 Å²	64	67.5 Å²	67.5	45%	0.448	39%	0.387	S	S	.	.			trans	-106	154.8	179.2	-46.2	0	0	0	0	110.9	A18 D21 G35 D36	A18-S33 WeakPolarHBondContact CB-O 3.41Å; D21-S33 WeakPolarHBondContact OD1-CA 3.08Å; S33-G35 PolarHBondContact O-N 2.89Å; S33-D36 PolarHBondContact N-OD2 3.02Å; S33-D36 VanDerWaalsContact O-CB 3.3Å; S33-D36 WeakPolarHBondContact O-CB 3.21Å; S33-D36 PolarHBondContact O-N 2.78Å
34	R	92.1	Very high	87.3	Confident	182 Å²	182	69.9 Å²	69.9	69%	0.687	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	119.9	174.2	177.9	170.1	-172.3	-129.1	-2.1	110.8	L19 D21	L19-R34 VanDerWaalsContact O-CD 3.24Å; L19-R34 WeakPolarHBondContact O-CD 3.39Å; L19-R34 VanDerWaalsContact O-CG 3.31Å; L19-R34 WeakPolarHBondContact O-CG 3.2Å; L19-R34 PolarHBondContact O-NE 2.76Å; D21-R34 WeakPolarHBondContact OD1-CB 3.26Å; D21-R34 PolarHBondContact OD1-N 3.22Å
35	G	88.6	Confident	86.9	Confident	41 Å²	41	68.4 Å²	68.4	42%	0.423	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	104	-16.1	-176.4	0	0	0	0	0	114.6	A18 S33	A18-G35 PolarHBondContact O-N 3.16Å; S33-G35 PolarHBondContact O-N 2.89Å
36	D	93	Very high	85.8	Confident	40 Å²	40	65.1 Å²	65.1	21%	0.214	36%	0.364	C	S	.	.			trans	-57.9	146.1	175.7	-74.4	-11.5	0	0	0	111.3	R17 A18 F32 S33 L38 L56	R17-D36 CarbonylContact C-O 3.58Å; R17-D36 WeakPolarHBondContact CA-O 3.26Å; A18-D36 HydrophobicContact CB-CB 4.34Å; A18-D36 PolarHBondContact N-O 3.07Å; F32-D36 HydrophobicContact CB-CB 4.44Å; S33-D36 PolarHBondContact N-OD2 3.02Å; S33-D36 VanDerWaalsContact O-CB 3.3Å; S33-D36 WeakPolarHBondContact O-CB 3.21Å; S33-D36 PolarHBondContact O-N 2.78Å; D36-L38 HydrophobicContact CB-CD1 4.11Å; D36-L56 HydrophobicContact CB-CD1 4.31Å; D36-L56 HydrophobicContact CB-CD2 4.12Å
37	I	92.6	Very high	85	Confident	81 Å²	81	71.7 Å²	71.7	42%	0.415	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	113.4	175.4	-52.1	-55.3	0	0	0	109	L15 A16 R17 L56 L71	L15-I37 HydrophobicContact CB-CG2 4.19Å; L15-I37 HydrophobicContact CD1-CG2 4.32Å; L15-I37 HydrophobicContact CD2-CG2 4.38Å; A16-I37 WeakPolarHBondContact O-CA 3.16Å; R17-I37 HydrophobicContact CB-CD1 3.73Å; R17-I37 HydrophobicContact CG-CD1 3.87Å; I37-L56 WeakPolarHBondContact O-CD1 3.3Å; I37-L71 HydrophobicContact CD1-CD1 3.94Å
38	L	93.2	Very high	84.8	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	141.3	-179.6	-65.1	83.9	0	0	0	109.9	L15 A16 A18 L30 F32 D36 C54 L56 A63 L68	L15-L38 CarbonylContact C-O 3.54Å; L15-L38 WeakPolarHBondContact CA-O 3.46Å; A16-L38 PolarHBondContact N-O 2.94Å; A16-L38 PolarHBondContact O-N 3.28Å; A18-L38 HydrophobicContact CB-CD1 3.99Å; L30-L38 HydrophobicContact CD2-CD2 3.78Å; F32-L38 HydrophobicContact CB-CD1 4.32Å; F32-L38 HydrophobicContact CB-CD2 4.37Å; F32-L38 HydrophobicContact CD1-CD2 3.81Å; F32-L38 HydrophobicContact CD2-CD1 4.49Å; F32-L38 HydrophobicContact CE1-CD2 4.24Å; F32-L38 HydrophobicContact CG-CD1 4.33Å; F32-L38 HydrophobicContact CG-CD2 4.13Å; D36-L38 HydrophobicContact CB-CD1 4.11Å; L38-C54 HydrophobicContact CB-CB 4.28Å; L38-C54 HydrophobicContact CD2-CB 3.9Å; L38-L56 HydrophobicContact CD1-CD2 4.48Å; L38-L56 HydrophobicContact CD2-CB 4.47Å; L38-L56 HydrophobicContact CG-CB 4.17Å; L38-L56 HydrophobicContact CG-CD1 4.36Å; L38-L56 HydrophobicContact CG-CD2 4.17Å; L38-L56 HydrophobicContact CG-CG 4.45Å; L38-A63 HydrophobicContact CD2-CB 4.24Å; L38-L68 HydrophobicContact CD1-CD2 3.95Å; L38-L68 HydrophobicContact CD2-CD2 4.18Å
39	T	91.9	Very high	84.3	Confident	36 Å²	36	72.1 Å²	72.1	22%	0.221	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	117.6	167.9	-59.3	0	0	0	0	109.1	A13 L15 L41 C54 L55	A13-T39 HydrophobicContact CB-CG2 3.9Å; L15-T39 WeakPolarHBondContact CD2-OG1 3.48Å; T39-L41 HydrophobicContact CG2-CD2 4.17Å; T39-C54 CarbonylContact O-C 3.59Å; T39-C54 VanDerWaalsContact O-CA 3.3Å; T39-C54 WeakPolarHBondContact O-CA 3.48Å; T39-L55 PolarHBondContact N-O 2.71Å; T39-L55 PolarHBondContact O-N 3.47Å
40	I	91	Very high	83.9	Confident	10 Å²	10	73 Å²	73	5%	0.051	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	126.4	171.5	-54.1	173.3	0	0	0	108.5	L14 A16 Q43 W52 I70	L14-I40 HydrophobicContact CB-CB 4.24Å; L14-I40 WeakPolarHBondContact O-CB 3.2Å; L14-I40 PolarHBondContact O-N 3.1Å; A16-I40 HydrophobicContact CB-CD1 3.83Å; A16-I40 HydrophobicContact CB-CG1 4.04Å; I40-Q43 HydrophobicContact CG2-CG 3.61Å; I40-W52 HydrophobicContact CD1-CD2 4.32Å; I40-W52 HydrophobicContact CD1-CE3 3.5Å; I40-W52 HydrophobicContact CD1-CH2 4.49Å; I40-W52 HydrophobicContact CD1-CZ3 3.61Å; I40-W52 HydrophobicContact CG1-CE3 4.08Å; I40-W52 HydrophobicContact CG2-CB 4.46Å; I40-I70 HydrophobicContact CD1-CG1 3.96Å
41	L	87.4	Confident	83.9	Confident	90 Å²	90	76.2 Å²	76.2	47%	0.471	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-34.7	174.1	-59.9	178	0	0	0	111.6	T39 K53 L55 Q60	T39-L41 HydrophobicContact CG2-CD2 4.17Å; L41-K53 PolarHBondContact N-O 2.9Å; L41-L55 HydrophobicContact CD1-CB 3.98Å; L41-L55 HydrophobicContact CG-CB 4.27Å; L41-Q60 HydrophobicContact CD1-CG 4.02Å; L41-Q60 VanDerWaalsContact CD1-NE2 3.29Å
42	E	84.6	Confident	84.1	Confident	74 Å²	74	75.3 Å²	75.3	35%	0.346	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	119	-175.8	-169.7	168.7	-148.9	0	0	110.3	V45 W52 K53	E42-V45 HydrophobicContact CG-CG2 4.38Å; E42-W52 CarbonylContact O-C 3.48Å; E42-W52 WeakPolarHBondContact O-CA 3.43Å; E42-K53 HydrophobicContact CB-CB 3.74Å; E42-K53 HydrophobicContact CB-CD 4.32Å; E42-K53 PolarHBondContact N-O 2.82Å; E42-K53 PolarHBondContact O-N 3.3Å; E42-K53 WeakPolarHBondContact OE2-CD 3.24Å; E42-K53 IonicContact OE2-NZ 2.67Å; E42-K53 PolarHBondContact OE2-NZ 2.94Å
43	Q	84	Confident	83.9	Confident	86 Å²	86	78.3 Å²	78.3	40%	0.402	41%	0.405	S	S	.	.	S	Bend	trans	-90.1	-13.8	179.6	-70.4	-174.4	-6.3	0	0	114.1	I40 W52	I40-Q43 HydrophobicContact CG2-CG 3.61Å; Q43-W52 HydrophobicContact CG-CD2 4.31Å; Q43-W52 HydrophobicContact CG-CG 4.36Å; Q43-W52 PolarHBondContact O-NE1 2.86Å
44	H	73.8	Confident	83.9	Confident	156 Å²	156	75.2 Å²	75.2	72%	0.722	38%	0.384	S	S	*	.			trans	-126.3	81.4	-177.5	179.5	-68.7	0	0	0	108.3	P46	H44-P46 WeakPolarHBondContact O-CD 3.31Å
45	V	76.8	Confident	83.9	Confident	24 Å²	24	69.5 Å²	69.5	15%	0.145	37%	0.367	C	S	.	.			trans	-80.7	118.4	173.6	-175.8	0	0	0	0	108	E42 S48 K53 L62	E42-V45 HydrophobicContact CG-CG2 4.38Å; V45-S48 PolarHBondContact O-N 3.11Å; V45-K53 HydrophobicContact CG2-CB 4Å; V45-L62 HydrophobicContact CG1-CD2 4.15Å; V45-L62 HydrophobicContact CG2-CD2 3.99Å
46	P	54.1	Low	84	Confident	86 Å²	86	68.1 Å²	68.1	56%	0.558	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	146.5	173.2	-22.7	34.3	0	0	0	110.8	H44 S48	H44-P46 WeakPolarHBondContact O-CD 3.31Å; P46-S48 PolarHBondContact O-N 3.29Å; P46-S48 VanDerWaalsContact O-N 3.12Å
47	E	65.4	Low	83.5	Confident	204 Å²	204	74 Å²	74	95%	0.953	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	5.5	-179.3	-48	-178.8	171.9	0	0	115.3
48	S	73.6	Confident	83.1	Confident	38 Å²	38	73.4 Å²	73.4	27%	0.266	39%	0.39	S	S	.	.			trans	-143.8	66.7	178.6	-71.6	0	0	0	0	113.1	V45 P46 G50 W51	V45-S48 PolarHBondContact O-N 3.11Å; P46-S48 PolarHBondContact O-N 3.29Å; P46-S48 VanDerWaalsContact O-N 3.12Å; S48-G50 PolarHBondContact O-N 3.46Å; S48-W51 PolarHBondContact O-N 3.04Å
49	E	72.8	Confident	82.7	Confident	191 Å²	191	82.7 Å²	82.7	89%	0.893	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	135.6	173.7	-66.6	-176	-171.2	0	0	111.8	W51	E49-W51 VanDerWaalsContact C-N 3.35Å
50	G	82.4	Confident	82.6	Confident	53 Å²	53	86.2 Å²	86.2	55%	0.546	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	0.6	-177.7	0	0	0	0	0	115.5	S48 A65	S48-G50 PolarHBondContact O-N 3.46Å; G50-A65 WeakPolarHBondContact O-CB 3.37Å; G50-A65 PolarHBondContact O-N 2.89Å
51	W	90	Very high	82.6	Confident	76 Å²	76	86.1 Å²	86.1	29%	0.288	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.9	175	-64.2	83.4	0	0	0	111.9	E29 S48 E49 L62 P64	E29-W51 HydrophobicContact CG-CH2 3.95Å; E29-W51 HydrophobicContact CG-CZ3 3.74Å; S48-W51 PolarHBondContact O-N 3.04Å; E49-W51 VanDerWaalsContact C-N 3.35Å; W51-L62 HydrophobicContact CE3-CB 3.82Å; W51-L62 HydrophobicContact CZ3-CB 4.44Å; W51-P64 HydrophobicContact CD2-CB 4.36Å; W51-P64 HydrophobicContact CE3-CB 4Å; W51-P64 HydrophobicContact CH2-CB 4.2Å; W51-P64 HydrophobicContact CH2-CG 4.46Å; W51-P64 HydrophobicContact CZ2-CB 4.5Å; W51-P64 HydrophobicContact CZ3-CB 3.93Å; W51-P64 HydrophobicContact CZ3-CG 4.1Å
52	W	92.1	Very high	82.8	Confident	39 Å²	39	83.6 Å²	83.6	15%	0.148	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.3	175.4	-65	-13.8	0	0	0	110.2	I40 E42 Q43 C54 A63 A65 L68 I70	I40-W52 HydrophobicContact CD1-CD2 4.32Å; I40-W52 HydrophobicContact CD1-CE3 3.5Å; I40-W52 HydrophobicContact CD1-CH2 4.49Å; I40-W52 HydrophobicContact CD1-CZ3 3.61Å; I40-W52 HydrophobicContact CG1-CE3 4.08Å; I40-W52 HydrophobicContact CG2-CB 4.46Å; E42-W52 CarbonylContact O-C 3.48Å; E42-W52 WeakPolarHBondContact O-CA 3.43Å; Q43-W52 HydrophobicContact CG-CD2 4.31Å; Q43-W52 HydrophobicContact CG-CG 4.36Å; Q43-W52 PolarHBondContact O-NE1 2.86Å; W52-C54 PolarHBondContact O-N 3.3Å; W52-C54 PolarHBondContact O-SG 2.94Å; W52-A63 PolarHBondContact N-O 3.23Å; W52-A63 PolarHBondContact O-N 3.17Å; W52-A65 HydrophobicContact CD2-CB 3.76Å; W52-A65 VanDerWaalsContact CE2-CB 3.43Å; W52-A65 HydrophobicContact CE3-CB 4.38Å; W52-A65 HydrophobicContact CG-CB 4.06Å; W52-A65 HydrophobicContact CH2-CB 4.35Å; W52-A65 HydrophobicContact CZ2-CB 3.77Å; W52-L68 HydrophobicContact CE3-CB 4.02Å; W52-L68 HydrophobicContact CE3-CD1 3.66Å; W52-L68 HydrophobicContact CE3-CG 4.47Å; W52-L68 HydrophobicContact CZ3-CB 3.69Å; W52-L68 HydrophobicContact CZ3-CD1 4.21Å; W52-I70 HydrophobicContact CH2-CD1 3.74Å; W52-I70 HydrophobicContact CH2-CG1 3.68Å; W52-I70 HydrophobicContact CZ2-CD1 4.31Å; W52-I70 HydrophobicContact CZ3-CD1 4.31Å; W52-I70 HydrophobicContact CZ3-CG1 3.84Å
53	K	90.4	Very high	83.1	Confident	73 Å²	73	80 Å²	80	32%	0.317	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	113.4	173	-150	174.4	-170.7	170.4	0	108.3	L41 E42 V45 Q60 L62	L41-K53 PolarHBondContact N-O 2.9Å; E42-K53 HydrophobicContact CB-CB 3.74Å; E42-K53 HydrophobicContact CB-CD 4.32Å; E42-K53 PolarHBondContact N-O 2.82Å; E42-K53 PolarHBondContact O-N 3.3Å; E42-K53 WeakPolarHBondContact OE2-CD 3.24Å; E42-K53 IonicContact OE2-NZ 2.67Å; E42-K53 PolarHBondContact OE2-NZ 2.94Å; V45-K53 HydrophobicContact CG2-CB 4Å; K53-Q60 HydrophobicContact CG-CG 4.27Å; K53-L62 HydrophobicContact CG-CD2 4.44Å
54	C	92.5	Very high	83.4	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	159.8	-173.7	-63.9	0	0	0	0	111.1	L30 L38 T39 W52 Q60 G61 A63	L30-C54 HydrophobicContact CD2-CB 3.76Å; L38-C54 HydrophobicContact CB-CB 4.28Å; L38-C54 HydrophobicContact CD2-CB 3.9Å; T39-C54 CarbonylContact O-C 3.59Å; T39-C54 VanDerWaalsContact O-CA 3.3Å; T39-C54 WeakPolarHBondContact O-CA 3.48Å; W52-C54 PolarHBondContact O-N 3.3Å; W52-C54 PolarHBondContact O-SG 2.94Å; C54-Q60 WeakPolarHBondContact O-CA 3.45Å; C54-G61 PolarHBondContact N-O 2.91Å; C54-G61 PolarHBondContact O-N 3.28Å; C54-A63 HydrophobicContact CB-CB 4.09Å
55	L	91.8	Very high	84.2	Confident	62 Å²	62	70 Å²	70	33%	0.325	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.7	173.3	-172.7	79.8	0	0	0	109	T39 L41 R59 Q60	T39-L55 PolarHBondContact N-O 2.71Å; T39-L55 PolarHBondContact O-N 3.47Å; L41-L55 HydrophobicContact CD1-CB 3.98Å; L41-L55 HydrophobicContact CG-CB 4.27Å; L55-R59 WeakPolarHBondContact CA-O 3.2Å; L55-Q60 HydrophobicContact CD1-CB 4.05Å
56	L	89.9	Confident	84.8	Confident	12 Å²	12	74.9 Å²	74.9	6%	0.063	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	133.4	174.7	-178.4	63.1	0	0	0	109.6	L30 F32 D36 I37 L38 G58 R59	L30-L56 HydrophobicContact CD1-CB 4.38Å; L30-L56 HydrophobicContact CD2-CB 3.93Å; L30-L56 HydrophobicContact CG-CB 4.36Å; F32-L56 HydrophobicContact CB-CD2 3.43Å; F32-L56 VanDerWaalsContact CB-CD2 3.43Å; D36-L56 HydrophobicContact CB-CD1 4.31Å; D36-L56 HydrophobicContact CB-CD2 4.12Å; I37-L56 WeakPolarHBondContact O-CD1 3.3Å; L38-L56 HydrophobicContact CD1-CD2 4.48Å; L38-L56 HydrophobicContact CD2-CB 4.47Å; L38-L56 HydrophobicContact CG-CB 4.17Å; L38-L56 HydrophobicContact CG-CD1 4.36Å; L38-L56 HydrophobicContact CG-CD2 4.17Å; L38-L56 HydrophobicContact CG-CG 4.45Å; L56-G58 PolarHBondContact O-N 2.78Å; L56-R59 PolarHBondContact N-O 3.36Å; L56-R59 PolarHBondContact O-N 2.9Å
57	H	83.8	Confident	86.5	Confident	162 Å²	162	75.2 Å²	75.2	75%	0.75	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	35.4	-178.6	-59	118.9	0	0	0	114.3	R59	H57-R59 VanDerWaalsContact C-N 3.26Å; H57-R59 PolarHBondContact O-N 3Å
58	G	83	Confident	87.7	Confident	70 Å²	70	66.1 Å²	66.1	72%	0.722	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	0.1	-178	0	0	0	0	0	115.7	L56	L56-G58 PolarHBondContact O-N 2.78Å
59	R	85.2	Confident	88.6	Confident	194 Å²	194	68.2 Å²	68.2	73%	0.732	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	133.6	173.5	-58.9	-176.4	-172.7	-122.8	1.5	109.9	L30 L55 L56 H57	L30-R59 HydrophobicContact CD1-CB 4.12Å; L55-R59 WeakPolarHBondContact CA-O 3.2Å; L56-R59 PolarHBondContact N-O 3.36Å; L56-R59 PolarHBondContact O-N 2.9Å; H57-R59 VanDerWaalsContact C-N 3.26Å; H57-R59 PolarHBondContact O-N 3Å
60	Q	90.8	Very high	89.4	Confident	111 Å²	111	62 Å²	62	52%	0.519	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	137.9	174	-175.4	176.1	17.4	0	0	109.4	L41 K53 C54 L55	L41-Q60 HydrophobicContact CD1-CG 4.02Å; L41-Q60 VanDerWaalsContact CD1-NE2 3.29Å; K53-Q60 HydrophobicContact CG-CG 4.27Å; C54-Q60 WeakPolarHBondContact O-CA 3.45Å; L55-Q60 HydrophobicContact CD1-CB 4.05Å
61	G	90.4	Very high	89.6	Confident	8 Å²	8	62.7 Å²	62.7	8%	0.082	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	177.4	176.8	0	0	0	0	0	112.3	D28 C54	D28-G61 CarbonylContact O-C 3.48Å; D28-G61 WeakPolarHBondContact O-CA 3.23Å; C54-G61 PolarHBondContact N-O 2.91Å; C54-G61 PolarHBondContact O-N 3.28Å
62	L	91.1	Very high	88.7	Confident	36 Å²	36	64.9 Å²	64.9	19%	0.188	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	130	175.2	-60.7	178.5	0	0	0	110.3	D28 E29 L30 V45 W51 K53	D28-L62 PolarHBondContact O-N 2.71Å; E29-L62 CarbonylContact C-O 3.57Å; E29-L62 WeakPolarHBondContact CA-O 3.48Å; L30-L62 PolarHBondContact N-O 2.75Å; V45-L62 HydrophobicContact CG1-CD2 4.15Å; V45-L62 HydrophobicContact CG2-CD2 3.99Å; W51-L62 HydrophobicContact CE3-CB 3.82Å; W51-L62 HydrophobicContact CZ3-CB 4.44Å; K53-L62 HydrophobicContact CG-CD2 4.44Å
63	A	91.8	Very high	86.8	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.6	174.2	0	0	0	0	0	109.5	F32 L38 W52 C54 A65 L68	F32-A63 HydrophobicContact CD1-CB 4.38Å; F32-A63 HydrophobicContact CE1-CB 3.59Å; F32-A63 HydrophobicContact CZ-CB 4.29Å; L38-A63 HydrophobicContact CD2-CB 4.24Å; W52-A63 PolarHBondContact N-O 3.23Å; W52-A63 PolarHBondContact O-N 3.17Å; C54-A63 HydrophobicContact CB-CB 4.09Å; A63-A65 PolarHBondContact O-N 3.01Å; A63-L68 HydrophobicContact CB-CD1 3.77Å
64	P	90.8	Very high	84.2	Confident	10 Å²	10	73.4 Å²	73.4	7%	0.065	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	123.4	-175.9	29.5	-33.6	0	0	0	110.1	W51 N66 R67	W51-P64 HydrophobicContact CD2-CB 4.36Å; W51-P64 HydrophobicContact CE3-CB 4Å; W51-P64 HydrophobicContact CH2-CB 4.2Å; W51-P64 HydrophobicContact CH2-CG 4.46Å; W51-P64 HydrophobicContact CZ2-CB 4.5Å; W51-P64 HydrophobicContact CZ3-CB 3.93Å; W51-P64 HydrophobicContact CZ3-CG 4.1Å; P64-N66 PolarHBondContact O-N 3.29Å; P64-N66 VanDerWaalsContact O-N 3.13Å; P64-R67 HydrophobicContact CG-CB 4.25Å; P64-R67 HydrophobicContact CG-CG 3.88Å; P64-R67 PolarHBondContact O-N 3.38Å
65	A	88.7	Confident	81.4	Confident	20 Å²	20	78.5 Å²	78.5	17%	0.165	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-58.9	-31.5	-170.7	0	0	0	0	0	113.1	G50 W52 A63 R67 L68	G50-A65 WeakPolarHBondContact O-CB 3.37Å; G50-A65 PolarHBondContact O-N 2.89Å; W52-A65 HydrophobicContact CD2-CB 3.76Å; W52-A65 VanDerWaalsContact CE2-CB 3.43Å; W52-A65 HydrophobicContact CE3-CB 4.38Å; W52-A65 HydrophobicContact CG-CB 4.06Å; W52-A65 HydrophobicContact CH2-CB 4.35Å; W52-A65 HydrophobicContact CZ2-CB 3.77Å; A63-A65 PolarHBondContact O-N 3.01Å; A65-R67 PolarHBondContact O-N 3.37Å; A65-L68 PolarHBondContact O-N 3.35Å; A65-L68 VanDerWaalsContact O-N 3.13Å
66	N	91.3	Very high	79.1	Confident	128 Å²	128	80.6 Å²	80.6	68%	0.684	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-69.1	-12.3	177.8	67.9	-6.8	0	0	0	114.4	P64	P64-N66 PolarHBondContact O-N 3.29Å; P64-N66 VanDerWaalsContact O-N 3.13Å
67	R	88.9	Confident	76.6	Confident	93 Å²	93	86.9 Å²	86.9	35%	0.351	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-97	0.3	172.2	-56.9	-170	-160.9	-161.4	12.7	113.2	L19 Y20 D21 N22 F32 P64 A65	L19-R67 WeakPolarHBondContact CB-O 3.29Å; L19-R67 PolarHBondContact N-O 3.34Å; Y20-R67 HydrophobicContact CD2-CB 4.22Å; Y20-R67 HydrophobicContact CD2-CG 4.18Å; D21-R67 PolarHBondContact O-NH1 3.05Å; N22-R67 PolarHBondContact OD1-NE 3.16Å; N22-R67 PolarHBondContact OD1-NH1 3.29Å; F32-R67 HydrophobicContact CE2-CB 4.22Å; F32-R67 HydrophobicContact CZ-CB 4.12Å; P64-R67 HydrophobicContact CG-CB 4.25Å; P64-R67 HydrophobicContact CG-CG 3.88Å; P64-R67 PolarHBondContact O-N 3.38Å; A65-R67 PolarHBondContact O-N 3.37Å
68	L	91	Very high	74.1	Confident	12 Å²	12	90.3 Å²	90.3	6%	0.063	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	141	-173.1	-62.5	-176.8	0	0	0	112.4	A16 A18 F32 L38 W52 A63 A65	A16-L68 HydrophobicContact CB-CB 4.23Å; A18-L68 HydrophobicContact CB-CD2 4.38Å; F32-L68 HydrophobicContact CE2-CD2 4.05Å; F32-L68 HydrophobicContact CZ-CD2 3.95Å; L38-L68 HydrophobicContact CD1-CD2 3.95Å; L38-L68 HydrophobicContact CD2-CD2 4.18Å; W52-L68 HydrophobicContact CE3-CB 4.02Å; W52-L68 HydrophobicContact CE3-CD1 3.66Å; W52-L68 HydrophobicContact CE3-CG 4.47Å; W52-L68 HydrophobicContact CZ3-CB 3.69Å; W52-L68 HydrophobicContact CZ3-CD1 4.21Å; A63-L68 HydrophobicContact CB-CD1 3.77Å; A65-L68 PolarHBondContact O-N 3.35Å; A65-L68 VanDerWaalsContact O-N 3.13Å
69	Q	91.6	Very high	71.8	Confident	82 Å²	82	91.8 Å²	91.8	38%	0.383	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	112.2	174.1	-179.6	177.6	34.6	0	0	110.1	A16 R17 L19 L71	A16-Q69 CarbonylContact C-O 3.57Å; A16-Q69 WeakPolarHBondContact CA-O 3.43Å; A16-Q69 WeakPolarHBondContact CB-O 3.4Å; R17-Q69 PolarHBondContact N-O 3.49Å; R17-Q69 PolarHBondContact O-N 2.83Å; L19-Q69 HydrophobicContact CD1-CB 4.2Å; L19-Q69 HydrophobicContact CD2-CB 3.86Å; L19-Q69 HydrophobicContact CG-CB 4.01Å; Q69-L71 PolarHBondContact O-N 2.85Å
70	I	90.8	Very high	69.7	Low	61 Å²	61	88.8 Å²	88.8	31%	0.313	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	133.3	176.4	-57.6	171.9	0	0	0	110	I40 W52	I40-I70 HydrophobicContact CD1-CG1 3.96Å; W52-I70 HydrophobicContact CH2-CD1 3.74Å; W52-I70 HydrophobicContact CH2-CG1 3.68Å; W52-I70 HydrophobicContact CZ2-CD1 4.31Å; W52-I70 HydrophobicContact CZ3-CD1 4.31Å; W52-I70 HydrophobicContact CZ3-CG1 3.84Å
71	L	86.3	Confident	67	Low	67 Å²	67	88.9 Å²	88.9	35%	0.351	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	98.3	174.2	-60.1	-176.6	0	0	0	109	L15 R17 I37 Q69 E73	L15-L71 HydrophobicContact CB-CB 4.42Å; L15-L71 PolarHBondContact O-N 3.45Å; R17-L71 HydrophobicContact CB-CD1 4.26Å; R17-L71 HydrophobicContact CB-CD2 4.31Å; R17-L71 HydrophobicContact CB-CG 4.36Å; I37-L71 HydrophobicContact CD1-CD1 3.94Å; Q69-L71 PolarHBondContact O-N 2.85Å; L71-E73 PolarHBondContact O-N 2.76Å
72	T	71.6	Confident	64.9	Low	123 Å²	123	93.8 Å²	93.8	76%	0.755	53%	0.526	S	S	*	.			trans	-75.8	117.3	175.2	-50.6	0	0	0	0	110	V74	T72-V74 PolarHBondContact O-N 3.04Å
73	E	51.9	Low	62	Low	150 Å²	150	100 Å²	100	70%	0.701	55%	0.552	S	S	*	*			trans	-63.9	125.5	171.3	-70.1	-170.9	126.7	0	0	111.2	L71 T75	L71-E73 PolarHBondContact O-N 2.76Å; E73-T75 PolarHBondContact O-N 3.03Å
74	V	34.9	Very low	59.2	Low	140 Å²	140	108 Å²	108	85%	0.848	59%	0.594	S	S	*	*			trans	-81.4	104.4	168	179.1	0	0	0	0	108.2	T72 A76	T72-V74 PolarHBondContact O-N 3.04Å; V74-A76 PolarHBondContact O-N 2.87Å
75	T	34.9	Very low	56.2	Low	108 Å²	108	117.5 Å²	117.5	66%	0.663	63%	0.628	S	S	*	*			trans	-66.2	115.6	172.9	47.9	0	0	0	0	110.3	E73 D77	E73-T75 PolarHBondContact O-N 3.03Å; T75-D77 PolarHBondContact O-N 3.19Å
76	A	43.6	Very low	53.3	Low	105 Å²	105	120.1 Å²	120.1	87%	0.868	66%	0.657	S	S	*	*			trans	-82.5	97.6	-175.6	0	0	0	0	0	112.7	V74	V74-A76 PolarHBondContact O-N 2.87Å
77	D	35.9	Very low	50.3	Low	145 Å²	145	122.5 Å²	122.5	78%	0.775	67%	0.669	S	S	*	*			trans	-154.8	101.3	158	-173.6	8.8	0	0	0	112.5	T75	T75-D77 PolarHBondContact O-N 3.19Å
78	R	31.3	Very low	47.5	Very low	233 Å²	233	126.6 Å²	126.6	88%	0.879	69%	0.692	S	S	*	*				-173	160.6	130	-98.6	-138.2	159	-162.2	-6.5	112.5
79	P	34.4	Very low	44.3	Very low	102 Å²	102	135.6 Å²	135.6	66%	0.662	73%	0.734	S	S	*	*			trans	-99.6	158.9	-155.4	37.6	-37.2	0	0	0	116.3
80	C	41.1	Very low	41.3	Very low	131 Å²	131	136.3 Å²	136.3	89%	0.885	75%	0.753	S	S	*	*			trans	-79.6	139.5	166	-55.1	0	0	0	0	112.3
81	P	34.9	Very low	38.9	Very low	113 Å²	113	139.4 Å²	139.4	73%	0.734	78%	0.778	S	S	*	*			trans	-147.7	-178	132.1	40.7	-25.3	0	0	0	112.7
82	P	45.5	Very low	35.9	Very low	110 Å²	110	140.9 Å²	140.9	71%	0.714	80%	0.799	S	S	*	*				-136.8	163.1	-57.7	40.3	-25	0	0	0	115.3
83	F	30.1	Very low	33.7	Very low	168 Å²	168	140.3 Å²	140.3	74%	0.737	80%	0.801	S	S	*	*			trans	22.6	131.1	153	-71.7	-71.9	0	0	0	123.9
84	L	33.1	Very low	32.7	Very low	166 Å²	166	139.2 Å²	139.2	87%	0.869	81%	0.809	S	S	*	*				-151.7	113.8	102.7	-79.3	-174.7	0	0	0	107
85	R	29.4	Very low	32.5	Very low	211 Å²	211	141.5 Å²	141.5	80%	0.796	81%	0.811	S	S	*	*				56.2	109.9	70.6	-166.8	-179.9	-68.5	-131.9	2.2	113.5
86	G	26.3	Very low	32.3	Very low	74 Å²	74	145.8 Å²	145.8	76%	0.763	82%	0.823	S	S	*	*			trans	-108.5	-163.7	174.4	0	0	0	0	0	113.9
87	L	28.9	Very low	31.6	Very low	179 Å²	179	146 Å²	146	94%	0.937	81%	0.814	S	S	*	*			trans	-151.9	155	177	-171	60.1	0	0	0	110.4
88	E	29.3	Very low	31.2	Very low	178 Å²	178	148.5 Å²	148.5	83%	0.832	81%	0.814	S	S	*	*			trans	-85.8	162.5	177.4	-62	-176.7	114.7	0	0	113.4
89	E	24.7	Very low	30.9	Very low	202 Å²	202	145.4 Å²	145.4	94%	0.944	81%	0.809	S	S	*	*			trans	-147.8	162.9	132.8	-127.8	168.6	-160.7	0	0	110.8
90	A	27.5	Very low	30.9	Very low	96 Å²	96	146.7 Å²	146.7	79%	0.793	82%	0.815	S	S	*	*			trans	-111.2	172.6	-148.5	0	0	0	0	0	115.6
91	P	42.2	Very low	30.6	Very low	127 Å²	127	146 Å²	146	83%	0.825	81%	0.809	S	S	*	*			trans	-105.2	175.3	-161	41.1	-37.1	0	0	0	116.5
92	A	23.3	Very low	30.3	Very low	97 Å²	97	145.9 Å²	145.9	80%	0.802	81%	0.806	S	S	*	*			trans	-155.6	154	165	0	0	0	0	0	109.8
93	S	24.4	Very low	29.9	Very low	112 Å²	112	148 Å²	148	78%	0.783	81%	0.811	S	S	*	*			cis	-173.9	129.1	-19.4	52.2	0	0	0	0	110.2
94	S	30.6	Very low	30.1	Very low	126 Å²	126	146 Å²	146	88%	0.881	82%	0.815	S	S	*	*			trans	-168	151.4	151.4	53.9	0	0	0	0	111.1
95	E	30.9	Very low	29.7	Very low	188 Å²	188	143.6 Å²	143.6	88%	0.879	81%	0.81	S	S	*	*			trans	-97.8	151.7	-174.8	-58.4	162.2	117.9	0	0	111.4
96	E	30.3	Very low	30.6	Very low	198 Å²	198	138.8 Å²	138.8	93%	0.925	81%	0.807	S	S	*	*				-164.6	172.2	117.3	-112.4	-177.3	174.2	0	0	111.8
97	T	28.8	Very low	31.1	Very low	110 Å²	110	140.7 Å²	140.7	68%	0.675	81%	0.806	S	S	*	*			trans	-119.3	148.8	-162.4	-66.9	0	0	0	0	111.6
98	Y	27.7	Very low	31.1	Very low	198 Å²	198	138.6 Å²	138.6	78%	0.776	80%	0.8	S	S	*	*				171.2	109	122.4	-97.6	-74.9	0	0	0	115.2
99	Q	26	Very low	31.8	Very low	168 Å²	168	136.3 Å²	136.3	79%	0.785	80%	0.801	S	S	*	*			trans	54.6	134.5	142.6	-70.4	177.1	-2	0	0	123.4
100	V	33.1	Very low	32	Very low	129 Å²	129	130.1 Å²	130.1	78%	0.782	79%	0.792	S	S	*	*			trans	-116.2	146.4	166.8	175.3	0	0	0	0	108.6
101	P	35.6	Very low	32.7	Very low	117 Å²	117	131.3 Å²	131.3	76%	0.76	79%	0.791	S	S	*	*			trans	-143.5	160.6	130.5	27.4	-8.6	0	0	0	115.2
102	T	28.3	Very low	32.3	Very low	110 Å²	110	132.1 Å²	132.1	68%	0.675	79%	0.793	S	S	*	*			cis	-173.4	116.9	-23	-92.4	0	0	0	0	110
103	L	36.7	Very low	32.8	Very low	154 Å²	154	137.3 Å²	137.3	81%	0.806	79%	0.794	S	S	*	*			trans	56.8	173.2	150.7	-73.8	168.7	0	0	0	119.7
104	P	34.3	Very low	33.2	Very low	126 Å²	126	141.4 Å²	141.4	82%	0.818	80%	0.8	S	S	*	*			cis	-123.4	-179.4	3.9	41.7	-26	0	0	0	117.4
105	C	26	Very low	33.3	Very low	115 Å²	115	142.6 Å²	142.6	78%	0.777	79%	0.792	S	S	*	*			trans	-138	179.8	-178	-132.2	0	0	0	0	109
106	P	47.2	Very low	33.1	Very low	111 Å²	111	140.1 Å²	140.1	72%	0.721	78%	0.782	S	S	*	*			cis	-110.2	-106.3	-9.4	28.1	-4.4	0	0	0	111.3
107	P	36.7	Very low	33	Very low	114 Å²	114	140 Å²	140	74%	0.74	77%	0.773	S	S	*	*			cis	-121	-170.5	1.3	43.8	-28.1	0	0	0	115.3
108	T	30	Very low	33.4	Very low	134 Å²	134	139.6 Å²	139.6	82%	0.822	77%	0.774	S	S	*	*			trans	-145.7	-179	172.8	36.6	0	0	0	0	108.8
109	P	42.9	Very low	33.4	Very low	130 Å²	130	141.6 Å²	141.6	84%	0.844	78%	0.781	S	S	*	*			cis	-124.6	-174.3	-14.4	34.2	-15	0	0	0	113.5
110	G	30.1	Very low	33.7	Very low	73 Å²	73	140 Å²	140	75%	0.753	78%	0.782	S	S	*	*			trans	-129.8	143	172.9	0	0	0	0	0	113.7
111	P	42.4	Very low	33.7	Very low	121 Å²	121	142.7 Å²	142.7	79%	0.786	79%	0.786	S	S	*	*			trans	-106.7	158.7	-171.4	39.9	-35.6	0	0	0	116.7
112	V	32.8	Very low	33.7	Very low	143 Å²	143	140.2 Å²	140.2	87%	0.867	78%	0.782	S	S	*	*			trans	32	132.7	140.6	-170.6	0	0	0	0	121.4
113	Y	34.6	Very low	34	Very low	207 Å²	207	141.2 Å²	141.2	81%	0.812	79%	0.791	S	S	*	*			trans	-36.2	141.5	166.4	-123.1	-108.3	0	0	0	118.1
114	E	32.3	Very low	33.7	Very low	198 Å²	198	142.6 Å²	142.6	93%	0.925	79%	0.793	S	S	*	*			trans	-149.4	173.2	144.2	-144.1	177.3	-152.6	0	0	111.1
115	H	32	Very low	34.7	Very low	150 Å²	150	141.6 Å²	141.6	69%	0.694	79%	0.786	S	S	*	*			trans	-159.5	119.8	-156	-171.8	99.4	0	0	0	112.8
116	M	26.6	Very low	35.3	Very low	137 Å²	137	142.5 Å²	142.5	68%	0.675	79%	0.791	S	S	*	*			trans	171.4	132.3	145.2	-99	179.3	21.1	0	0	117.7
117	R	29.6	Very low	34.4	Very low	196 Å²	196	142.4 Å²	142.4	74%	0.74	79%	0.793	S	S	*	*			trans	55.7	113.9	136	-61.8	178.1	-165.2	159.4	6.7	124.4
118	S	36.5	Very low	34.3	Very low	101 Å²	101	140.9 Å²	140.9	71%	0.706	79%	0.79	S	S	*	*				73.6	-171.7	127.5	76.5	0	0	0	0	120
119	W	27.3	Very low	34.3	Very low	240 Å²	240	143.5 Å²	143.5	91%	0.909	79%	0.793	S	S	*	*			trans	74.3	125.8	-164.9	-57.9	76.3	0	0	0	112.5
120	V	33	Very low	34	Very low	134 Å²	134	143.8 Å²	143.8	81%	0.812	79%	0.792	S	S	*	*			cis	-140.3	158.7	0.9	-177	0	0	0	0	109.9
121	E	32	Very low	34.1	Very low	185 Å²	185	150.7 Å²	150.7	86%	0.864	80%	0.796	S	S	*	*			trans	-106.3	139.4	-175	-173.4	78.7	-123.8	0	0	113.8
122	G	37.3	Very low	33.6	Very low	66 Å²	66	152.3 Å²	152.3	68%	0.68	79%	0.794	S	S	*	*			trans	80.2	170.8	158.9	0	0	0	0	0	119.1
123	P	34	Very low	33.8	Very low	131 Å²	131	154.4 Å²	154.4	85%	0.851	79%	0.791	S	S	*	*			cis	-129.2	175.3	7.2	42.2	-27.5	0	0	0	116.9
124	Q	30.3	Very low	33.9	Very low	183 Å²	183	149.9 Å²	149.9	86%	0.855	79%	0.787	S	S	*	*			trans	-134.7	171.9	161	-91.1	-158.9	-1	0	0	108.6
125	P	55.7	Low	34	Very low	105 Å²	105	147.7 Å²	147.7	68%	0.682	78%	0.782	S	S	*	*			cis	-120.6	-162	-24.8	36.6	-19.3	0	0	0	110.6
126	P	37	Very low	34.6	Very low	133 Å²	133	145.6 Å²	145.6	86%	0.864	78%	0.782	S	S	*	*				-143.3	-176	116.8	39.1	-25.5	0	0	0	114.8
127	S	29.6	Very low	35.3	Very low	110 Å²	110	145.3 Å²	145.3	77%	0.769	79%	0.79	S	S	*	*			trans	-108.8	148.8	-159.9	57.7	0	0	0	0	117.2
128	A	33.2	Very low	35.5	Very low	82 Å²	82	142.6 Å²	142.6	68%	0.678	80%	0.796	S	S	*	*			trans	61	116.3	143.2	0	0	0	0	0	121.3
129	Q	31	Very low	35.5	Very low	189 Å²	189	143.2 Å²	143.2	88%	0.883	80%	0.8	S	S	*	*				-166.5	132.9	117.4	-105.6	151.8	99	0	0	114.3
130	V	36.1	Very low	35.6	Very low	135 Å²	135	136.2 Å²	136.2	82%	0.818	79%	0.793	S	S	*	*			trans	23.6	116.2	149.8	-170	0	0	0	0	119.8
131	Y	32.7	Very low	35.4	Very low	218 Å²	218	140.8 Å²	140.8	86%	0.855	80%	0.796	S	S	*	*			trans	-142.9	173.3	131.3	-161	-114.2	0	0	0	110.7
132	E	32	Very low	35.5	Very low	155 Å²	155	139.7 Å²	139.7	72%	0.724	79%	0.794	S	S	*	*			trans	-105.2	154.5	-147.9	-160.6	160.9	-148.5	0	0	114.2
133	F	37	Very low	35.3	Very low	187 Å²	187	143.3 Å²	143.3	82%	0.82	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-103.6	121.6	-173.9	-150.1	-77.6	0	0	0	110.4
134	P	36.5	Very low	35.1	Very low	112 Å²	112	142.6 Å²	142.6	73%	0.727	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-73.8	130.8	175.1	-17.5	32	0	0	0	112.1
135	D	35.4	Very low	35.1	Very low	153 Å²	153	142.6 Å²	142.6	82%	0.818	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-66.4	144.2	178.9	-77.9	-55.1	0	0	0	113.5
136	P	44.7	Very low	33.9	Very low	105 Å²	105	146.6 Å²	146.6	68%	0.682	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-75.1	142.8	169.9	31.8	-34.1	0	0	0	111.6
137	P	40	Very low	33.6	Very low	132 Å²	132	146 Å²	146	86%	0.857	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.7	136.6	-174.1	25.7	-34	0	0	0	114.1
138	T	34.5	Very low	33.6	Very low	139 Å²	139	149.1 Å²	149.1	85%	0.853	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-59.8	140.3	-174.3	-48.5	0	0	0	0	114.6
139	S	35.3	Very low	33.4	Very low	113 Å²	113	150.1 Å²	150.1	79%	0.79	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-69.1	141.3	177.2	56.7	0	0	0	0	114
140	A	30	Very low	33.7	Very low	94 Å²	94	150 Å²	150	78%	0.777	80%	0.8	S	S	*	*			trans	-112.6	82.2	-175	0	0	0	0	0	113.4
141	R	29.6	Very low	33.7	Very low	229 Å²	229	149.7 Å²	149.7	86%	0.864	80%	0.801	S	S	*	*			trans	46.6	95.9	142.4	-49.9	175.5	-153.7	-162.4	5.4	117.8
142	I	34.1	Very low	33.7	Very low	162 Å²	162	147.9 Å²	147.9	83%	0.831	80%	0.797	S	S	*	*			trans	-72.6	125.8	151	-62.4	176.8	0	0	0	108
143	I	31.8	Very low	33.8	Very low	142 Å²	142	149.6 Å²	149.6	73%	0.728	81%	0.806	S	S	*	*			trans	-94.7	111.5	174	-61.5	174.5	0	0	0	108.5	E145	I143-E145 HydrophobicContact CG2-CG 4.03Å
144	C	31.5	Very low	33.4	Very low	116 Å²	116	145.1 Å²	145.1	78%	0.784	80%	0.803	S	S	*	*			trans	-105.9	94.6	169.2	-68.7	0	0	0	0	109.4
145	E	30	Very low	33.4	Very low	184 Å²	184	147.5 Å²	147.5	86%	0.86	81%	0.808	S	S	*	*			trans	-72.9	161.1	170.2	-72.7	-147	130	0	0	112.4	I143	I143-E145 HydrophobicContact CG2-CG 4.03Å
146	K	30.8	Very low	33.4	Very low	189 Å²	189	147.9 Å²	147.9	82%	0.822	81%	0.808	S	S	*	*			trans	-116.4	110.8	-157.7	-176.8	179.1	178.6	179.6	0	112.5
147	T	30.2	Very low	32.8	Very low	119 Å²	119	148.4 Å²	148.4	73%	0.73	81%	0.81	S	S	*	*			trans	42.1	110.1	148	-44.6	0	0	0	0	118.2
148	L	28.5	Very low	32.4	Very low	176 Å²	176	149.6 Å²	149.6	92%	0.921	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-101.2	157.1	146.6	-85.2	167.7	0	0	0	110.7
149	S	29.2	Very low	32.5	Very low	103 Å²	103	148.3 Å²	148.3	72%	0.72	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-101.7	167.1	-157.3	48.5	0	0	0	0	115.6
150	F	37.9	Very low	32.5	Very low	186 Å²	186	153.9 Å²	153.9	82%	0.816	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-51.9	160.6	180	-48.3	-86.1	0	0	0	114.8
151	P	35.2	Very low	32.9	Very low	129 Å²	129	155.7 Å²	155.7	84%	0.838	81%	0.81	S	S	*	*				-123.8	170.6	93.6	37	-34.4	0	0	0	114.6
152	K	32.7	Very low	32.9	Very low	180 Å²	180	151.4 Å²	151.4	78%	0.783	81%	0.809	S	S	*	*			trans	-100.7	167.5	171.4	-72.8	-177.5	176	179	0	110.7
153	Q	34.9	Very low	32.9	Very low	192 Å²	192	155.4 Å²	155.4	90%	0.897	81%	0.814	S	S	*	*			trans	84.9	105.5	164.1	-49.8	-178.1	23.6	0	0	117.5
154	A	29.5	Very low	32.8	Very low	93 Å²	93	153.2 Å²	153.2	77%	0.769	82%	0.817	S	S	*	*				-153.2	146.8	119.5	0	0	0	0	0	108.7
155	I	36.2	Very low	32.7	Very low	162 Å²	162	153.3 Å²	153.3	83%	0.831	82%	0.818	S	S	*	*			trans	-102.3	124.1	169.3	-63.1	171.1	0	0	0	106.8
156	I	34.1	Very low	32.9	Very low	161 Å²	161	152 Å²	152	83%	0.826	82%	0.816	S	S	*	*			trans	-129.1	116.5	164.7	-61.4	-176.7	0	0	0	108.4
157	T	33.2	Very low	33	Very low	116 Å²	116	148.9 Å²	148.9	71%	0.712	82%	0.816	S	S	*	*			trans	-82.5	150.5	172.9	-47.9	0	0	0	0	109.8
158	L	30.6	Very low	32.9	Very low	157 Å²	157	149.3 Å²	149.3	82%	0.822	82%	0.818	S	S	*	*			trans	156.4	158.9	146.8	-85.7	159.9	0	0	0	109.7
159	P	38.2	Very low	33	Very low	111 Å²	111	148.7 Å²	148.7	72%	0.721	82%	0.815	S	S	*	*			cis	-122.4	170.4	-37.8	35.1	-21.5	0	0	0	112.3
160	R	35.2	Very low	33.7	Very low	230 Å²	230	149.2 Å²	149.2	87%	0.868	82%	0.816	S	S	*	*			trans	-84.3	141.8	163.3	-73.5	178	174.2	162.9	-3.1	110.1
161	P	37.8	Very low	33.4	Very low	133 Å²	133	145.7 Å²	145.7	86%	0.864	81%	0.814	S	S	*	*			trans	-73.8	129.5	164.3	30.5	-32.2	0	0	0	110.4
162	T	30.1	Very low	33.3	Very low	138 Å²	138	148.4 Å²	148.4	85%	0.847	82%	0.816	S	S	*	*			trans	-112.1	146	173.9	-60.1	0	0	0	0	109.7
163	R	33.4	Very low	33.1	Very low	247 Å²	247	145.5 Å²	145.5	93%	0.932	81%	0.813	S	S	*	*			trans	-94.6	115.2	-167.5	175.7	-174.4	178.4	170	0.6	113.5
164	A	28.7	Very low	32.8	Very low	96 Å²	96	145.8 Å²	145.8	79%	0.793	81%	0.807	S	S	*	*			trans	-164.5	154.7	155.4	0	0	0	0	0	107.7
165	S	30.3	Very low	32.7	Very low	117 Å²	117	147.8 Å²	147.8	82%	0.818	81%	0.805	S	S	*	*			cis	-145.1	177.2	8.4	43.8	0	0	0	0	111.7
166	L	34.1	Very low	32.4	Very low	156 Å²	156	146.1 Å²	146.1	82%	0.817	80%	0.802	S	S	*	*			trans	-87.5	156.5	174	-75	159.8	0	0	0	112.2
167	P	32.7	Very low	32.8	Very low	125 Å²	125	143.2 Å²	143.2	81%	0.812	79%	0.794	S	S	*	*			trans	-80.1	158.6	159	34.6	-33.2	0	0	0	111.9
168	T	29.4	Very low	32.6	Very low	127 Å²	127	143.4 Å²	143.4	78%	0.779	80%	0.795	S	S	*	*			trans	-120.5	143.1	-167.6	-55.8	0	0	0	0	112.4
169	L	30.6	Very low	32.7	Very low	163 Å²	163	142.8 Å²	142.8	85%	0.853	79%	0.788	S	S	*	*			trans	-160.5	167.4	153.2	-132.8	73.2	0	0	0	110
170	P	42.4	Very low	32.3	Very low	115 Å²	115	144.3 Å²	144.3	75%	0.747	79%	0.785	S	S	*	*				-119.6	-178.4	-86.7	40.8	-29.5	0	0	0	115.2
171	S	31.2	Very low	31.9	Very low	111 Å²	111	143.9 Å²	143.9	78%	0.776	78%	0.784	S	S	*	*			trans	-74.7	135.3	-170.3	179.7	0	0	0	0	116.8
172	Q	34.2	Very low	31.3	Very low	187 Å²	187	140.7 Å²	140.7	87%	0.874	77%	0.774	S	S	*	*			trans	-157.6	150.7	146.3	-70.9	-163	5.9	0	0	107.9
173	V	29.3	Very low	32.4	Very low	119 Å²	119	140.2 Å²	140.2	72%	0.721	77%	0.774	S	S	*	*			cis	-164.6	146.2	-30.9	112.1	0	0	0	0	108
174	Y	26.9	Very low	32.2	Very low	198 Å²	198	134.8 Å²	134.8	78%	0.776	77%	0.768	S	S	*	*			trans	78.2	134.6	162.8	-102.4	-114.7	0	0	0	124.6
175	D	28.8	Very low	32.2	Very low	134 Å²	134	135.6 Å²	135.6	72%	0.717	76%	0.763	S	S	*	*			trans	63.6	144.7	147.6	-75.9	4.4	0	0	0	128
176	V	28.7	Very low	32.4	Very low	128 Å²	128	136.7 Å²	136.7	78%	0.776	76%	0.758	S	S	*	*			trans	-154.1	142.9	-167.9	148.3	0	0	0	0	102.8
177	P	42.1	Very low	32.1	Very low	99 Å²	99	138.5 Å²	138.5	64%	0.643	76%	0.76	S	S	*	*				-155.3	174.7	51.4	34.4	-9.6	0	0	0	119.9
178	T	30.8	Very low	31.7	Very low	121 Å²	121	140.4 Å²	140.4	74%	0.742	76%	0.758	S	S	*	*			trans	68.9	166.8	144.6	49.8	0	0	0	0	119.6
179	Q	31.4	Very low	32.5	Very low	144 Å²	144	139.8 Å²	139.8	67%	0.673	76%	0.756	S	S	*	*			cis	-157.3	167.6	15.7	-142.5	162.3	28.1	0	0	113.9
180	H	29.5	Very low	32.5	Very low	143 Å²	143	139.7 Å²	139.7	66%	0.662	75%	0.751	S	S	*	*			trans	70.5	155.7	155.1	-69.1	-36.1	0	0	0	119.9
181	R	28.1	Very low	31.8	Very low	221 Å²	221	144.3 Å²	144.3	83%	0.834	76%	0.76	S	S	*	*			cis	-171.8	142.6	-18.6	179.9	178.7	-163	165.9	1.9	109.2
182	G	25	Very low	31.7	Very low	65 Å²	65	146.5 Å²	146.5	67%	0.67	76%	0.757	S	S	*	*			trans	-89.7	-148.7	174.5	0	0	0	0	0	113.6
183	P	52.2	Low	31.7	Very low	128 Å²	128	145.7 Å²	145.7	83%	0.831	75%	0.754	S	S	*	*			cis	-139.5	-132.1	-2.9	43.2	-22.1	0	0	0	113.8
184	V	30.8	Very low	31.7	Very low	133 Å²	133	146 Å²	146	81%	0.806	75%	0.751	S	S	*	*			trans	100	139.6	169.4	177.7	0	0	0	0	116.7
185	V	28.6	Very low	31.6	Very low	114 Å²	114	145.7 Å²	145.7	69%	0.691	75%	0.749	S	S	*	*			cis	-174.5	132	-34.1	124.8	0	0	0	0	113
186	L	33.1	Very low	31.7	Very low	139 Å²	139	145.9 Å²	145.9	73%	0.728	75%	0.751	S	S	*	*			trans	60.4	165.7	154.6	-82.9	53.1	0	0	0	121.7
187	K	27.5	Very low	31.6	Very low	194 Å²	194	146.6 Å²	146.6	84%	0.843	75%	0.748	S	S	*	*			cis	-156	173.2	7	-137.4	169.3	-174.2	177	0	115.8
188	E	25.1	Very low	31.7	Very low	165 Å²	165	147.5 Å²	147.5	77%	0.771	75%	0.754	S	S	*	*			trans	-105.6	-168.2	175	-124.8	-168.2	154.5	0	0	111.8
189	P	46.3	Very low	31.5	Very low	114 Å²	114	146.6 Å²	146.6	74%	0.74	76%	0.759	S	S	*	*			cis	-142.5	-151	6.3	41.4	-16.6	0	0	0	117.3
190	E	30.2	Very low	31.5	Very low	162 Å²	162	145 Å²	145	76%	0.757	76%	0.764	S	S	*	*			trans	-86.8	176	-163.9	-35.5	163.2	100.5	0	0	120.3
191	K	28.2	Very low	32.3	Very low	212 Å²	212	142.7 Å²	142.7	92%	0.922	76%	0.762	S	S	*	*			trans	-169.2	179.1	134.9	-107.9	165	-173.7	177.3	0	116.8
192	Q	28.5	Very low	32.4	Very low	156 Å²	156	141.4 Å²	141.4	73%	0.729	76%	0.762	S	S	*	*			trans	-131.1	-174.4	-155.8	-57.6	171	-14.8	0	0	115.7
193	Q	34.5	Very low	32.8	Very low	171 Å²	171	147.3 Å²	147.3	80%	0.799	77%	0.77	S	S	*	*			trans	92.6	150.6	158.3	-67.2	-174.6	6.3	0	0	120.1
194	L	29.8	Very low	31.6	Very low	126 Å²	126	146 Å²	146	66%	0.66	77%	0.77	S	S	*	*			cis	-176.3	148.3	-15.6	-179.6	70.5	0	0	0	114.1
195	Y	25.5	Very low	31.4	Very low	190 Å²	190	143.1 Å²	143.1	75%	0.745	77%	0.766	S	S	*	*			trans	57.9	168.6	165.1	-76.8	-51.5	0	0	0	120.7
196	D	29.9	Very low	31.4	Very low	139 Å²	139	146.6 Å²	146.6	74%	0.743	78%	0.78	S	S	*	*			cis	-150.6	-170.3	12.6	-141.2	-30.4	0	0	0	115.9
197	I	27.3	Very low	31.1	Very low	142 Å²	142	148.6 Å²	148.6	73%	0.728	79%	0.785	S	S	*	*			trans	-143.7	171	-159.4	-79.1	168.4	0	0	0	110.9
198	P	43.3	Very low	32.5	Very low	118 Å²	118	144 Å²	144	77%	0.766	78%	0.776	S	S	*	*			cis	-128.8	-169.7	-7.5	40.5	-22.8	0	0	0	115.8
199	A	26.6	Very low	33.6	Very low	102 Å²	102	142.5 Å²	142.5	84%	0.843	78%	0.78	S	S	*	*				152.4	153.9	123.4	0	0	0	0	0	117.5
200	S	32.6	Very low	32.8	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	79%	0.788	S	S	*	*			trans	-124.6	171	173.2	71.3	0	0	0	0	110.6
201	P	46.1	Very low	32.7	Very low	96 Å²	96	137.9 Å²	137.9	62%	0.623	79%	0.786	S	S	*	*				-168	-178.3	81.6	45.4	-23.9	0	0	0	120
202	K	29.8	Very low	32.8	Very low	194 Å²	194	137.2 Å²	137.2	84%	0.843	79%	0.786	S	S	*	*			trans	71.1	153.1	150.1	-74.9	160	-165.7	169.3	0	119.9
203	K	32	Very low	32.7	Very low	189 Å²	189	133.8 Å²	133.8	82%	0.822	78%	0.784	S	S	*	*			cis	-173.2	150.1	-16.1	-179.2	-178.6	-177.9	-170.5	0	112.1
204	A	27.9	Very low	32.5	Very low	101 Å²	101	131.8 Å²	131.8	84%	0.835	79%	0.789	S	S	*	*			trans	68.2	156.2	163.7	0	0	0	0	0	119
205	G	26.6	Very low	32.4	Very low	71 Å²	71	129.3 Å²	129.3	73%	0.732	80%	0.795	S	S	*	*			cis	169.8	-178.8	-8.2	0	0	0	0	0	114.7
206	L	28.2	Very low	32.4	Very low	188 Å²	188	129.9 Å²	129.9	98%	0.984	80%	0.804	S	S	*	*			trans	82.9	158.3	175	-61.5	168.8	0	0	0	119.1
207	H	27	Very low	32.2	Very low	180 Å²	180	127.1 Å²	127.1	83%	0.833	81%	0.808	S	S	*	*			trans	-157.9	-168.5	-161.9	-145.8	-44.5	0	0	0	110.9
208	P	58	Low	32.2	Very low	99 Å²	99	127.1 Å²	127.1	64%	0.643	81%	0.814	S	S	*	*				-88.5	-167.1	-125.9	43.6	-28	0	0	0	116.1
209	P	46.8	Very low	32.2	Very low	133 Å²	133	126.9 Å²	126.9	86%	0.864	81%	0.813	S	S	*	*				-142.7	-176.1	91.4	38	-20.6	0	0	0	116.1
210	A	30.2	Very low	32.3	Very low	109 Å²	109	129.2 Å²	129.2	90%	0.901	81%	0.81	S	S	*	*			trans	-114.7	-179.9	-162.9	0	0	0	0	0	115.3
211	G	28	Very low	32.1	Very low	70 Å²	70	131.5 Å²	131.5	72%	0.722	81%	0.812	S	S	*	*			trans	178.8	98.5	166.6	0	0	0	0	0	117.5
212	Q	30.6	Very low	31.1	Very low	197 Å²	197	131.3 Å²	131.3	92%	0.921	81%	0.813	S	S	*	*			trans	26.9	153.8	140.5	-67.9	-174.4	3.4	0	0	123
213	A	26.8	Very low	30.9	Very low	84 Å²	84	128.9 Å²	128.9	69%	0.694	81%	0.814	S	S	*	*			cis	-171.3	165.5	-13.4	0	0	0	0	0	112.1
214	S	28.7	Very low	30.6	Very low	129 Å²	129	125.5 Å²	125.5	90%	0.902	81%	0.81	S	S	*	*			trans	36.6	142	147.8	-155.3	0	0	0	0	123.5
215	G	27.5	Very low	30.5	Very low	75 Å²	75	126.5 Å²	126.5	77%	0.773	81%	0.805	S	S	*	*			trans	168.7	121.8	157.5	0	0	0	0	0	116.4
216	Q	27.1	Very low	30.6	Very low	202 Å²	202	130.3 Å²	130.3	94%	0.944	81%	0.808	S	S	*	*			trans	-107.2	158.2	164.8	-60.8	152.9	-78.5	0	0	108.9
217	G	25	Very low	30.4	Very low	80 Å²	80	132.3 Å²	132.3	83%	0.825	80%	0.803	S	S	*	*			trans	170.7	111.5	169.8	0	0	0	0	0	118
218	V	27.5	Very low	30.4	Very low	142 Å²	142	133.8 Å²	133.8	86%	0.861	81%	0.807	S	S	*	*			trans	-128.3	157.9	166.6	166.5	0	0	0	0	104.6
219	P	42.7	Very low	28.8	Very low	113 Å²	113	132.8 Å²	132.8	73%	0.734	82%	0.815	S	S	*	*			cis	-135.9	177.1	12.2	19.7	7.9	0	0	0	118.1
220	L	29.6	Very low	27.9	Very low	151 Å²	151	129.8 Å²	129.8	79%	0.791	81%	0.808	S	S	*	*			trans	-5.3	144.2	133.9	-173.4	75.8	0	0	0	120.5
221	I	28	Very low	27.8	Very low	159 Å²	159	134.9 Å²	134.9	82%	0.815	81%	0.805	S	S	*	*			trans	179.7	146.7	141.7	-97.6	150.7	0	0	0	108.6
222	S	24.6	Very low	27.9	Very low	91 Å²	91	136.5 Å²	136.5	64%	0.636	81%	0.805	S	S	*	*			cis	-169.7	-169.1	-24	-83.6	0	0	0	0	109
223	V	27.1	Very low	27.8	Very low	144 Å²	144	133 Å²	133	87%	0.873	80%	0.798	S	S	*	*			trans	104.4	154.3	162	-170.7	0	0	0	0	115.9
224	T	24.9	Very low	28.2	Very low	118 Å²	118	136.7 Å²	136.7	72%	0.724	81%	0.805	S	S	*	*			trans	-128.5	174.3	-139	-15.7	0	0	0	0	114.7
225	T	26.5	Very low	28.3	Very low	121 Å²	121	136.1 Å²	136.1	74%	0.742	80%	0.798	S	S	*	*			trans	79	109.8	150.2	39.7	0	0	0	0	122.8
226	L	28.6	Very low	28.5	Very low	152 Å²	152	138.1 Å²	138.1	80%	0.796	80%	0.8	S	S	*	*				95.6	100.2	108.3	-163.7	70.4	0	0	0	122.7
227	R	23.9	Very low	29	Very low	230 Å²	230	134.7 Å²	134.7	87%	0.868	80%	0.795	S	S	*	*			trans	81.9	152	130.6	-160.3	178.1	-170.5	-167.6	4.8	121.3
228	K	25.6	Very low	29.1	Very low	210 Å²	210	138.9 Å²	138.9	91%	0.913	79%	0.794	S	S	*	*			trans	72.2	140.5	-172.5	-68.8	-175	172.9	-177.2	0	114.1
229	G	25.1	Very low	29.2	Very low	79 Å²	79	141.1 Å²	141.1	81%	0.814	79%	0.792	S	S	*	*			cis	143.2	113.2	-9.5	0	0	0	0	0	112.5
230	G	27.3	Very low	28.8	Very low	69 Å²	69	140.2 Å²	140.2	71%	0.711	79%	0.788	S	S	*	*			trans	178.2	138.5	-178.9	0	0	0	0	0	112.9
231	Y	29.7	Very low	29	Very low	216 Å²	216	141.3 Å²	141.3	85%	0.847	79%	0.789	S	S	*	*			trans	-84	150.6	-160.4	-27.9	-88.8	0	0	0	114.6
232	S	28.9	Very low	29	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	79%	0.791	S	S	*	*			trans	63.7	124.2	141.3	-52.6	0	0	0	0	122.5
233	T	29.7	Very low	29.6	Very low	125 Å²	125	145 Å²	145	77%	0.767	79%	0.791	S	S	*	*			trans	51.9	128.8	137	57.3	0	0	0	0	120.2
234	L	34.4	Very low	29.8	Very low	160 Å²	160	146 Å²	146	84%	0.838	78%	0.78	S	S	*	*			cis	-161.2	155.1	1.8	-97.3	166.2	0	0	0	107.8
235	P	31.4	Very low	30	Very low	118 Å²	118	147.2 Å²	147.2	77%	0.766	78%	0.782	S	S	*	*			trans	-125	139.1	158.2	36.1	-24.9	0	0	0	113.4
236	S	31.1	Very low	30.2	Very low	117 Å²	117	146.2 Å²	146.2	82%	0.818	78%	0.776	S	S	*	*			trans	-81.7	146.3	166.9	50	0	0	0	0	111.5
237	P	36.8	Very low	30.9	Very low	129 Å²	129	144.3 Å²	144.3	84%	0.838	77%	0.772	S	S	*	*			trans	-114	124.1	164.3	34.5	-24.4	0	0	0	111.5
238	Q	27.7	Very low	31.3	Very low	168 Å²	168	139.8 Å²	139.8	79%	0.785	77%	0.77	S	S	*	*			trans	-133.7	96	177	-170.3	-179.4	19.5	0	0	111.9
239	K	30.5	Very low	31.7	Very low	189 Å²	189	134.5 Å²	134.5	82%	0.822	76%	0.76	S	S	*	*			trans	66.4	167.3	164	-54.8	-177.5	177.9	-175	0	114.1
240	S	32.9	Very low	32.9	Very low	95 Å²	95	136.6 Å²	136.6	66%	0.664	76%	0.759	S	S	*	*			cis	-162.8	156.9	-4.8	18.6	0	0	0	0	110.6
241	E	35.3	Very low	32.9	Very low	173 Å²	173	136.9 Å²	136.9	81%	0.808	76%	0.762	S	S	*	*			trans	48.8	164.6	137.4	-61.1	177.8	164.6	0	0	124.3
242	W	27.9	Very low	33.1	Very low	223 Å²	223	136.5 Å²	136.5	85%	0.845	77%	0.765	S	S	*	*			trans	-143.2	134.2	167.5	-79.8	69.1	0	0	0	105.6	Y244	W242-Y244 HydrophobicContact CE3-CD2 4.01Å; W242-Y244 AromaticContact CE3-CE2 3.86Å; W242-Y244 HydrophobicContact CE3-CE2 3.86Å; W242-Y244 HydrophobicContact CZ3-CD2 4.16Å; W242-Y244 AromaticContact CZ3-CE2 3.73Å; W242-Y244 HydrophobicContact CZ3-CE2 3.73Å
243	V	36.9	Very low	33.1	Very low	106 Å²	106	136.1 Å²	136.1	64%	0.642	77%	0.768	S	S	*	*			cis	70.8	116.8	31.5	-161.5	0	0	0	0	110.4
244	Y	31.6	Very low	33	Very low	165 Å²	165	135.6 Å²	135.6	65%	0.647	77%	0.77	S	S	*	*				-146.1	170.3	65.4	-91.7	-91.3	0	0	0	112.7	W242	W242-Y244 HydrophobicContact CE3-CD2 4.01Å; W242-Y244 AromaticContact CE3-CE2 3.86Å; W242-Y244 HydrophobicContact CE3-CE2 3.86Å; W242-Y244 HydrophobicContact CZ3-CD2 4.16Å; W242-Y244 AromaticContact CZ3-CE2 3.73Å; W242-Y244 HydrophobicContact CZ3-CE2 3.73Å
245	D	29	Very low	32.8	Very low	143 Å²	143	134 Å²	134	77%	0.765	77%	0.766	S	S	*	*			cis	-142.9	-174	22.4	-140.5	-46.6	0	0	0	115.8
246	T	29.9	Very low	32.6	Very low	100 Å²	100	138.8 Å²	138.8	61%	0.613	77%	0.769	S	S	*	*			trans	-117.9	169	-151	-13.6	0	0	0	0	113.2
247	P	43	Very low	32.5	Very low	111 Å²	111	140.1 Å²	140.1	72%	0.721	77%	0.767	S	S	*	*				-156.7	148.7	69.6	39.4	-16.7	0	0	0	121.1
248	V	32.5	Very low	31.8	Very low	135 Å²	135	140.1 Å²	140.1	82%	0.818	77%	0.765	S	S	*	*			trans	65.8	138.1	137.4	171.5	0	0	0	0	121.8
249	S	33.7	Very low	32.6	Very low	99 Å²	99	137.2 Å²	137.2	69%	0.692	76%	0.761	S	S	*	*			cis	-157	-55.7	-21.8	60	0	0	0	0	120.9
250	P	50.3	Low	32.4	Very low	123 Å²	123	136.3 Å²	136.3	80%	0.799	76%	0.764	S	S	*	*			trans	-122.3	152.5	-141.7	38	-23.3	0	0	0	119.1
251	G	27.1	Very low	32.7	Very low	76 Å²	76	136.5 Å²	136.5	78%	0.784	76%	0.763	S	S	*	*			trans	-160.5	-44.5	179.6	0	0	0	0	0	121.9
252	K	35.3	Very low	32.1	Very low	208 Å²	208	133.1 Å²	133.1	90%	0.904	75%	0.754	S	S	*	*			trans	62	119.8	174.4	-70.9	-175.7	176	179.2	0	122.3
253	A	29.1	Very low	32	Very low	96 Å²	96	131.2 Å²	131.2	79%	0.793	75%	0.752	S	S	*	*				76.9	106.2	123.7	0	0	0	0	0	125.1
254	S	26.1	Very low	31.5	Very low	114 Å²	114	132.9 Å²	132.9	80%	0.797	75%	0.753	S	S	*	*				46.3	132	115.8	-161.3	0	0	0	0	123.4
255	V	30.8	Very low	31.3	Very low	127 Å²	127	133.5 Å²	133.5	77%	0.77	76%	0.762	S	S	*	*				170.4	116.7	115.5	156	0	0	0	0	114.3
256	R	28.2	Very low	31.2	Very low	217 Å²	217	133.5 Å²	133.5	82%	0.819	76%	0.757	S	S	*	*			trans	42.7	138.4	134.8	-147.5	-163.2	-78.5	179.5	-6.5	124.5
257	N	27.2	Very low	31	Very low	146 Å²	146	133.2 Å²	133.2	78%	0.781	76%	0.759	S	S	*	*			trans	93.9	158	150.6	-80.7	-2.9	0	0	0	122.6
258	T	22.7	Very low	30.2	Very low	128 Å²	128	138.4 Å²	138.4	79%	0.785	76%	0.764	S	S	*	*			trans	-97	-176.1	-173.1	35.6	0	0	0	0	114
259	P	45.1	Very low	30.7	Very low	108 Å²	108	137.6 Å²	137.6	70%	0.701	76%	0.762	S	S	*	*			cis	-140.1	163.1	-36.8	36.6	-19.2	0	0	0	116.6
260	L	26.6	Very low	30.5	Very low	169 Å²	169	140.8 Å²	140.8	89%	0.885	77%	0.766	S	S	*	*			trans	59.6	178.8	160.1	-112.9	66.1	0	0	0	117.4
261	P	39.2	Very low	29.2	Very low	99 Å²	99	139.9 Å²	139.9	64%	0.643	77%	0.769	S	S	*	*			cis	-132.6	-178.4	-19.1	38.8	-19.9	0	0	0	116.2
262	T	23	Very low	29.5	Very low	103 Å²	103	144.1 Å²	144.1	63%	0.632	77%	0.772	S	S	*	*			trans	36.7	132.8	150.6	50	0	0	0	0	123.3
263	F	25.5	Very low	29.7	Very low	183 Å²	183	139.5 Å²	139.5	80%	0.803	76%	0.764	S	S	*	*				-178.9	166.5	105.2	-115.1	-81.3	0	0	0	114.3
264	E	26.8	Very low	29.6	Very low	140 Å²	140	140.1 Å²	140.1	65%	0.654	76%	0.762	S	S	*	*			trans	-103.5	-165.5	178.1	-55	65.8	-137.2	0	0	109.9
265	E	27.2	Very low	29.9	Very low	179 Å²	179	140.2 Å²	140.2	84%	0.836	76%	0.763	S	S	*	*			cis	-160.8	-179	7.3	-140.4	-172.8	-154.7	0	0	105.4
266	E	25.8	Very low	29.7	Very low	143 Å²	143	137.7 Å²	137.7	67%	0.668	76%	0.763	S	S	*	*			cis	-163.3	-173.9	-3.9	-152.2	-79.8	105.2	0	0	107.3
267	S	26.6	Very low	29.7	Very low	94 Å²	94	132.3 Å²	132.3	66%	0.657	76%	0.758	S	S	*	*			trans	103.1	144.7	137.8	-72.6	0	0	0	0	123
268	R	26.1	Very low	29.7	Very low	219 Å²	219	131.1 Å²	131.1	83%	0.826	76%	0.756	S	S	*	*			trans	-95.4	-168.5	171.6	-77.9	-178.7	170.5	174.3	-2	110
269	P	42	Very low	30.1	Very low	119 Å²	119	132.9 Å²	132.9	77%	0.773	75%	0.753	S	S	*	*			cis	-147.4	-168.1	13.9	43.2	-19.3	0	0	0	119.5
270	H	29.1	Very low	29.3	Very low	166 Å²	166	135 Å²	135	77%	0.769	75%	0.753	S	S	*	*			trans	-57.6	161.8	-174.1	-41.1	-90.7	0	0	0	120.5
271	A	24.9	Very low	29.3	Very low	104 Å²	104	133.4 Å²	133.4	86%	0.86	75%	0.746	S	S	*	*				-178.2	165.6	128	0	0	0	0	0	115.2
272	L	32.3	Very low	29.8	Very low	164 Å²	164	134 Å²	134	86%	0.859	75%	0.749	S	S	*	*			trans	-124.6	160	173.8	-141.4	85.1	0	0	0	109.5
273	P	40.3	Very low	30.9	Very low	112 Å²	112	134.3 Å²	134.3	73%	0.727	75%	0.754	S	S	*	*				-165.2	177.4	87.9	42.8	-21.2	0	0	0	120.1
274	S	27.1	Very low	30.9	Very low	108 Å²	108	131.8 Å²	131.8	76%	0.755	76%	0.759	S	S	*	*			trans	68.9	174.3	154.4	-82.1	0	0	0	0	121.6
275	S	30.8	Very low	31	Very low	117 Å²	117	128.5 Å²	128.5	82%	0.818	76%	0.762	S	S	*	*			cis	176.5	161	-36.1	-76.5	0	0	0	0	108.9
276	G	27.2	Very low	31	Very low	74 Å²	74	132 Å²	132	76%	0.763	77%	0.767	S	S	*	*			cis	163.7	152.1	-10	0	0	0	0	0	114.6
277	S	28.9	Very low	31.1	Very low	103 Å²	103	129.5 Å²	129.5	72%	0.72	77%	0.772	S	S	*	*			trans	75.7	134.1	165.2	-172.9	0	0	0	0	123.2
278	T	26.1	Very low	31.1	Very low	121 Å²	121	136.2 Å²	136.2	74%	0.742	78%	0.783	S	S	*	*				161.4	116.3	114.8	-65.8	0	0	0	0	117
279	F	31.5	Very low	31.1	Very low	166 Å²	166	130.4 Å²	130.4	73%	0.728	78%	0.776	S	S	*	*			trans	17.8	164.8	144.2	-63	-86.2	0	0	0	125
280	H	27.8	Very low	30.4	Very low	151 Å²	151	133 Å²	133	70%	0.699	78%	0.782	S	S	*	*			cis	-151.9	142.1	5	-102.6	-71.7	0	0	0	108.4
281	N	27.1	Very low	30.5	Very low	137 Å²	137	131.2 Å²	131.2	73%	0.733	78%	0.783	S	S	*	*				68.2	160.4	76.1	-92	-54.6	0	0	0	118.1
282	P	50.1	Low	31.2	Very low	110 Å²	110	131.6 Å²	131.6	71%	0.714	78%	0.777	S	S	*	*			cis	-128.4	-121.3	-35	38.6	-18.3	0	0	0	111.5
283	P	45.6	Very low	30.9	Very low	111 Å²	111	132 Å²	132	72%	0.721	77%	0.774	S	S	*	*				-128.2	175.2	-56.6	40.4	-24.4	0	0	0	117.6
284	S	26.8	Very low	30.3	Very low	130 Å²	130	133 Å²	133	91%	0.909	77%	0.773	S	S	*	*			trans	78.1	142.7	148.2	-155.9	0	0	0	0	122.2
285	G	27.3	Very low	30.1	Very low	70 Å²	70	133.4 Å²	133.4	72%	0.722	77%	0.767	S	S	*	*			cis	166.5	173.3	-9	0	0	0	0	0	117.2
286	R	28.5	Very low	29.8	Very low	252 Å²	252	132.4 Å²	132.4	95%	0.951	76%	0.755	S	S	*	*			trans	76.9	103.4	164.9	-88.1	-169.4	175.9	-169.8	0.9	124.4
287	A	27.8	Very low	29.8	Very low	92 Å²	92	136 Å²	136	76%	0.76	76%	0.757	S	S	*	*				61.1	123.3	108.6	0	0	0	0	0	126.5
288	R	26.7	Very low	29.8	Very low	235 Å²	235	137.6 Å²	137.6	89%	0.887	76%	0.762	S	S	*	*			trans	70.2	128.4	131.5	-169.4	-168.6	-88.9	-176	-6.6	121
289	S	25.1	Very low	30.8	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	76%	0.76	S	S	*	*				150.4	125.3	127.3	-64.7	0	0	0	0	116.6
290	L	27.8	Very low	30.5	Very low	172 Å²	172	137 Å²	137	90%	0.901	76%	0.764	S	S	*	*			trans	44.9	131.7	134.3	-58.5	170.8	0	0	0	124
291	T	30.3	Very low	30.6	Very low	129 Å²	129	137.7 Å²	137.7	79%	0.791	77%	0.768	S	S	*	*			trans	-80.5	158	149.7	45.3	0	0	0	0	110.9
292	P	39.5	Very low	30.6	Very low	113 Å²	113	141.2 Å²	141.2	73%	0.734	78%	0.777	S	S	*	*				-159.7	146.9	90.5	38.5	-17.5	0	0	0	119.3
293	Q	26.9	Very low	29.6	Very low	172 Å²	172	145.5 Å²	145.5	80%	0.804	78%	0.784	S	S	*	*			trans	59.8	163.5	146.9	-56.7	-64.9	13.5	0	0	119.5
294	L	28.1	Very low	28.7	Very low	133 Å²	133	148.5 Å²	148.5	70%	0.696	79%	0.793	S	S	*	*			cis	-148.5	-172.1	3.7	-150	67.5	0	0	0	106.3
295	N	23.2	Very low	28.7	Very low	117 Å²	117	147.5 Å²	147.5	63%	0.626	79%	0.786	S	S	*	*			cis	-163.6	179.4	4.7	-156.8	9	0	0	0	112.1
296	T	24.7	Very low	29.1	Very low	95 Å²	95	151.5 Å²	151.5	58%	0.583	79%	0.79	S	S	*	*			trans	19.1	139.9	148	49.1	0	0	0	0	121.9
297	N	25.8	Very low	29.4	Very low	151 Å²	151	145.2 Å²	145.2	81%	0.807	78%	0.782	S	S	*	*			cis	-154.6	172.6	24.5	-100.2	-32.9	0	0	0	113.8
298	V	29.4	Very low	29.3	Very low	136 Å²	136	149.5 Å²	149.5	82%	0.824	79%	0.786	S	S	*	*			trans	-132.9	-175.7	175.9	-120.7	0	0	0	0	108.4
299	P	46	Very low	29.8	Very low	105 Å²	105	145.8 Å²	145.8	68%	0.682	78%	0.783	S	S	*	*			cis	-134.6	178.7	-12.9	40.6	-24	0	0	0	115.4
300	M	26.1	Very low	30.2	Very low	168 Å²	168	147 Å²	147	83%	0.828	79%	0.788	S	S	*	*				-169.6	174.2	124.3	-107.4	-60.6	160.9	0	0	113.8
301	Q	29	Very low	30.5	Very low	167 Å²	167	144.2 Å²	144.2	78%	0.78	78%	0.783	S	S	*	*			trans	-104.8	149.4	-157.9	-57.3	170.4	-5.6	0	0	116
302	K	28.3	Very low	30.4	Very low	210 Å²	210	149.4 Å²	149.4	91%	0.913	79%	0.79	S	S	*	*				-165.9	152.4	117.5	-108.3	167.9	-177.1	176.3	0	112.8
303	K	28.8	Very low	29.8	Very low	200 Å²	200	146.9 Å²	146.9	87%	0.87	78%	0.784	S	S	*	*			trans	-97.8	153.4	178.1	-63.1	179.4	177	-178	0	111.3
304	L	27.4	Very low	30	Very low	175 Å²	175	148.2 Å²	148.2	92%	0.916	79%	0.788	S	S	*	*				-163.5	162.4	121.3	-102.2	160.4	0	0	0	109.1
305	S	26.6	Very low	30	Very low	109 Å²	109	150 Å²	150	76%	0.762	80%	0.797	S	S	*	*			trans	-136	161.2	-156.1	53.5	0	0	0	0	115.1
306	L	35.1	Very low	30.5	Very low	154 Å²	154	150 Å²	150	81%	0.806	80%	0.801	S	S	*	*			trans	-52.5	163.1	164.4	-84.6	146.8	0	0	0	113
307	P	35.9	Very low	30.9	Very low	120 Å²	120	151.4 Å²	151.4	78%	0.779	81%	0.811	S	S	*	*				-138	163	111.4	39.1	-29.6	0	0	0	115.4
308	E	24.5	Very low	31	Very low	181 Å²	181	154.8 Å²	154.8	85%	0.846	81%	0.813	S	S	*	*			trans	-97	-177.4	167.5	-68.6	177.2	103.7	0	0	112
309	I	37.2	Very low	31	Very low	158 Å²	158	153.6 Å²	153.6	81%	0.81	80%	0.802	S	S	*	*			trans	-78.3	146.1	-176.8	-49.3	157.5	0	0	0	111
310	P	33.9	Very low	30	Very low	123 Å²	123	155 Å²	155	80%	0.799	81%	0.808	S	S	*	*				-142.7	165.6	128.6	37.1	-23.5	0	0	0	115.2
311	S	33.1	Very low	30.2	Very low	113 Å²	113	156.7 Å²	156.7	79%	0.79	81%	0.812	S	S	*	*			trans	-100.2	153.2	-176.1	-47.6	0	0	0	0	114.2
312	Y	28.1	Very low	30.6	Very low	238 Å²	238	154.7 Å²	154.7	93%	0.933	81%	0.813	S	S	*	*			trans	-161.4	162.8	158.6	-130.6	-109.5	0	0	0	107.2
313	G	27	Very low	30.7	Very low	59 Å²	59	152.2 Å²	152.2	61%	0.608	81%	0.809	S	S	*	*			cis	161.3	149.1	-3.3	0	0	0	0	0	109.2
314	F	31.7	Very low	30.7	Very low	201 Å²	201	149.2 Å²	149.2	88%	0.882	80%	0.803	S	S	*	*			trans	-70.3	151.6	-177.2	-97.2	-103.1	0	0	0	113.5
315	L	28.5	Very low	30.9	Very low	171 Å²	171	149.2 Å²	149.2	90%	0.895	80%	0.798	S	S	*	*				-171.6	170.8	128.4	-104.1	169.2	0	0	0	113.1
316	V	34	Very low	31.2	Very low	117 Å²	117	150.8 Å²	150.8	71%	0.709	80%	0.798	S	S	*	*			trans	-113.6	149.4	-168.4	174.3	0	0	0	0	111.6
317	P	32	Very low	31.2	Very low	123 Å²	123	150.2 Å²	150.2	80%	0.799	80%	0.801	S	S	*	*			trans	-116.9	155	148.6	5	16.9	0	0	0	112.9
318	R	28	Very low	30.9	Very low	222 Å²	222	149.2 Å²	149.2	84%	0.838	80%	0.797	S	S	*	*			trans	-111.2	173.9	175.8	-138.4	-155.7	-160.9	-110.5	10	111.5
319	D	28.9	Very low	31.4	Very low	112 Å²	112	150.5 Å²	150.5	60%	0.599	80%	0.795	S	S	*	*			trans	-43.7	146.3	-175.9	-34.9	-72.5	0	0	0	116.8
320	T	26.6	Very low	31.4	Very low	133 Å²	133	152.5 Å²	152.5	82%	0.816	80%	0.798	S	S	*	*				179	128.5	118.2	-71.9	0	0	0	0	110.3
321	F	29.6	Very low	31.6	Very low	204 Å²	204	152.1 Å²	152.1	90%	0.895	79%	0.793	S	S	*	*			trans	-91.3	147	162.3	-73.3	-83.3	0	0	0	109.8
322	P	36.9	Very low	31.8	Very low	126 Å²	126	151.8 Å²	151.8	82%	0.818	79%	0.788	S	S	*	*				-140.1	-173.7	109.7	38.3	-24.9	0	0	0	114.8
323	L	30.8	Very low	32.4	Very low	157 Å²	157	146.8 Å²	146.8	82%	0.822	79%	0.788	S	S	*	*			trans	-84.6	151.8	-154.6	-157	75.1	0	0	0	116.6
324	D	28.8	Very low	33.1	Very low	138 Å²	138	148.1 Å²	148.1	74%	0.738	79%	0.788	S	S	*	*			trans	91.2	156.3	139.5	-111.3	-37.4	0	0	0	125.7
325	E	32.4	Very low	33.7	Very low	174 Å²	174	147.7 Å²	147.7	81%	0.813	79%	0.786	S	S	*	*			trans	65	88.7	166.5	-63.7	-165	134.6	0	0	122.2
326	D	32.3	Very low	34.2	Very low	143 Å²	143	147.4 Å²	147.4	77%	0.765	79%	0.785	S	S	*	*				53.6	97.1	124.5	-163.4	27.1	0	0	0	121.9
327	V	34.2	Very low	34.4	Very low	142 Å²	142	149.7 Å²	149.7	86%	0.861	79%	0.791	S	S	*	*			trans	-138.8	121.5	144.1	-177.4	0	0	0	0	110
328	S	31.4	Very low	34.8	Very low	99 Å²	99	149.4 Å²	149.4	69%	0.692	79%	0.789	S	S	*	*			trans	-75.7	148.5	-173.2	79.2	0	0	0	0	115.6
329	Y	33.7	Very low	34.9	Very low	208 Å²	208	150.7 Å²	150.7	82%	0.816	79%	0.794	S	S	*	*			trans	-126.4	142.1	156.2	60.5	-92.6	0	0	0	110.7
330	K	36.7	Very low	35.3	Very low	200 Å²	200	151.5 Å²	151.5	87%	0.87	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-89	133.7	-172.9	-72.1	-172.3	176.1	-177.4	0	113
331	V	38.8	Very low	35.9	Very low	115 Å²	115	153.3 Å²	153.3	70%	0.697	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-98.5	137.3	167	-179.9	0	0	0	0	109.6
332	P	37	Very low	36	Very low	106 Å²	106	152.8 Å²	152.8	69%	0.688	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-62.3	133.1	178.5	-25.7	35.9	0	0	0	114.4	S334	P332-S334 PolarHBondContact O-N 2.76Å
333	S	42.3	Very low	35.8	Very low	133 Å²	133	155.5 Å²	155.5	93%	0.93	80%	0.804	S	S	*	*	S	Bend	trans	-81.1	64.3	-172.3	-48.7	0	0	0	0	114
334	S	41.5	Very low	35.8	Very low	87 Å²	87	155 Å²	155	61%	0.608	80%	0.803	S	S	*	*	S	Bend	trans	-124.2	-0.3	179.5	68.3	0	0	0	0	116.2	P332	P332-S334 PolarHBondContact O-N 2.76Å
335	F	44.5	Very low	36	Very low	191 Å²	191	154.9 Å²	154.9	84%	0.838	81%	0.807	S	S	*	*	S	Bend	trans	-125.4	3.2	-173.3	-76.6	-74.1	0	0	0	116
336	L	37.4	Very low	36	Very low	166 Å²	166	155.5 Å²	155.5	87%	0.869	81%	0.807	S	S	*	*			trans	-139.4	105.1	178.1	-69.1	174.7	0	0	0	111.8
337	I	39.6	Very low	36.7	Very low	164 Å²	164	153.8 Å²	153.8	84%	0.841	80%	0.804	S	S	*	*			trans	-164.6	136.6	139.6	-102	156.5	0	0	0	108
338	P	39.4	Very low	36.5	Very low	118 Å²	118	153.8 Å²	153.8	77%	0.766	80%	0.799	S	S	*	*			trans	-86	168.2	-179.9	-2.1	21.8	0	0	0	112.4
339	R	31.3	Very low	36.8	Very low	248 Å²	248	155.2 Å²	155.2	94%	0.936	80%	0.798	S	S	*	*			trans	-135.9	137.5	165	-129.4	-179	-174.1	-166	0.6	111.4
340	V	36.7	Very low	36.7	Very low	130 Å²	130	156 Å²	156	79%	0.788	80%	0.801	S	S	*	*			trans	-105.7	128	-174.7	171.8	0	0	0	0	110.4
341	E	39.5	Very low	36.6	Very low	171 Å²	171	154 Å²	154	80%	0.799	80%	0.8	S	S	*	*			trans	24.7	129	145.7	-166.6	173.2	-166.7	0	0	121.3
342	Q	31.2	Very low	36.5	Very low	193 Å²	193	156.4 Å²	156.4	90%	0.902	81%	0.807	S	S	*	*			trans	-161.5	116.9	135.4	-113.3	173.2	41.3	0	0	111.2
343	Q	33.4	Very low	36.4	Very low	182 Å²	182	157.1 Å²	157.1	85%	0.85	81%	0.811	S	S	*	*			trans	-142.9	130.6	162.8	-77.6	-163.5	0.1	0	0	111.7
344	N	29.5	Very low	35.9	Very low	148 Å²	148	160.2 Å²	160.2	79%	0.791	81%	0.808	S	S	*	*			trans	-155.7	148.4	161	-93.3	-78.8	0	0	0	104.6
345	T	32.5	Very low	35.3	Very low	135 Å²	135	161.3 Å²	161.3	83%	0.828	82%	0.822	S	S	*	*			cis	-139.5	166.4	36.3	48.8	0	0	0	0	114.5
346	K	33.3	Very low	34.6	Very low	186 Å²	186	159.5 Å²	159.5	81%	0.809	82%	0.82	S	S	*	*			trans	-78.1	-170.8	176.6	-47.8	-177	178.3	-177.2	0	112.2
347	P	47	Very low	34	Very low	108 Å²	108	156.9 Å²	156.9	70%	0.701	82%	0.815	S	S	*	*			cis	-139.1	167.5	-3.8	41.8	-24.4	0	0	0	117.8
348	N	30.6	Very low	33.3	Very low	142 Å²	142	153.7 Å²	153.7	76%	0.759	81%	0.808	S	S	*	*			trans	158.7	149.7	138.8	-86.9	-5.1	0	0	0	111.5
349	I	37.6	Very low	32.6	Very low	129 Å²	129	155 Å²	155	66%	0.662	81%	0.813	S	S	*	*			cis	-160.8	153.2	-27.9	-125	173.1	0	0	0	108.3
350	Y	30.1	Very low	32.5	Very low	224 Å²	224	148.5 Å²	148.5	88%	0.878	81%	0.806	S	S	*	*			trans	70.5	121.5	-179.5	-75.5	-63.4	0	0	0	119.9
351	D	36	Very low	31.9	Very low	159 Å²	159	152 Å²	152	85%	0.85	81%	0.814	S	S	*	*			trans	-104.1	162.3	169.3	-70.5	-72.7	0	0	0	111.8
352	I	35.2	Very low	31.3	Very low	165 Å²	165	148.8 Å²	148.8	85%	0.846	82%	0.816	S	S	*	*			trans	-98.6	130.6	165.8	-61.8	175.3	0	0	0	108.4
353	P	35.5	Very low	31	Very low	120 Å²	120	143.4 Å²	143.4	78%	0.779	81%	0.812	S	S	*	*			trans	-77.1	137.5	-165.8	29.3	-35.9	0	0	0	114.4
354	K	31.5	Very low	31	Very low	199 Å²	199	144.4 Å²	144.4	87%	0.865	81%	0.814	S	S	*	*			trans	-108.5	138.8	152.5	-82.2	-173.6	174.3	179.4	0	109.4
355	A	28.8	Very low	30.9	Very low	110 Å²	110	146.3 Å²	146.3	91%	0.909	82%	0.818	S	S	*	*			trans	-68.1	149.4	-179.1	0	0	0	0	0	112.2
356	I	30.2	Very low	30.6	Very low	153 Å²	153	148.1 Å²	148.1	79%	0.785	82%	0.822	S	S	*	*			trans	-115.9	126.7	-175.6	-59.3	168.1	0	0	0	109.9
357	S	26	Very low	30.5	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	82%	0.817	S	S	*	*			trans	-168.7	102.5	142.1	38	0	0	0	0	108.8
358	S	25	Very low	29.6	Very low	98 Å²	98	148.3 Å²	148.3	69%	0.685	83%	0.827	S	S	*	*				77.7	107.2	58.3	78.5	0	0	0	0	114.4
359	V	24.8	Very low	29.4	Very low	146 Å²	146	145.8 Å²	145.8	89%	0.885	83%	0.827	S	S	*	*				-163.8	137.9	128.8	138.4	0	0	0	0	107.6
360	S	27.6	Very low	28.9	Very low	111 Å²	111	147.8 Å²	147.8	78%	0.776	83%	0.83	S	S	*	*			trans	-96	146.5	177.5	-59.8	0	0	0	0	111.3	A362	S360-A362 PolarHBondContact O-N 3.22Å
361	Q	25	Very low	28.7	Very low	204 Å²	204	143.7 Å²	143.7	95%	0.953	82%	0.819	S	S	*	*			trans	-74.4	106.8	162.7	-73.2	-178.9	-55.7	0	0	110.2
362	A	26.3	Very low	28.2	Very low	102 Å²	102	142.5 Å²	142.5	84%	0.843	82%	0.817	S	S	*	*			trans	-154.9	109.4	158.2	0	0	0	0	0	109.7	S360	S360-A362 PolarHBondContact O-N 3.22Å
363	G	25.2	Very low	27.8	Very low	80 Å²	80	138.4 Å²	138.4	83%	0.825	80%	0.804	S	S	*	*			trans	-172.9	106.2	-179.7	0	0	0	0	0	111.5
364	K	33.2	Very low	27.4	Very low	204 Å²	204	140.3 Å²	140.3	89%	0.887	80%	0.802	S	S	*	*			trans	-80.2	169.1	168.1	-74.5	-172.3	175.2	-174.5	0	110.4
365	E	27.1	Very low	27.2	Very low	188 Å²	188	137.5 Å²	137.5	88%	0.879	80%	0.796	S	S	*	*			trans	-45.2	139.2	172.6	-55.3	157.3	93.9	0	0	113.4
366	L	27.5	Very low	27.3	Very low	173 Å²	173	136.5 Å²	136.5	91%	0.906	78%	0.783	S	S	*	*				-164.6	149.9	104.5	-167.7	58.1	0	0	0	110
367	A	29.5	Very low	27.3	Very low	87 Å²	87	135 Å²	135	72%	0.719	78%	0.781	S	S	*	*			trans	-122.2	136.9	-177.3	0	0	0	0	0	112.8
368	K	28.1	Very low	27.3	Very low	210 Å²	210	133 Å²	133	91%	0.913	78%	0.778	S	S	*	*			trans	-176.2	156	143.4	-112.3	173.4	-178.7	178.7	0	114.9
369	A	28.3	Very low	27.6	Very low	90 Å²	90	135.5 Å²	135.5	74%	0.744	78%	0.778	S	S	*	*			trans	66.8	139	168	0	0	0	0	0	115.9
370	K	27	Very low	27.8	Very low	170 Å²	170	135.6 Å²	135.6	74%	0.739	77%	0.774	S	S	*	*			cis	64.3	135.2	46.9	-76	-169.8	154.1	-145.5	0	112.1
371	E	24.6	Very low	27.8	Very low	138 Å²	138	135.2 Å²	135.2	65%	0.645	77%	0.771	S	S	*	*			cis	-158.4	171	12.9	-134.6	155	179.7	0	0	112.2
372	V	25.4	Very low	27.8	Very low	134 Å²	134	130.2 Å²	130.2	81%	0.812	76%	0.758	S	S	*	*			trans	27.3	138.8	136.4	153.5	0	0	0	0	119.7
373	S	26.4	Very low	27.8	Very low	80 Å²	80	135 Å²	135	56%	0.559	76%	0.755	S	S	*	*			cis	-169	-178.1	-11.4	-162.1	0	0	0	0	109.3
374	E	28.5	Very low	27.9	Very low	159 Å²	159	139.6 Å²	139.6	74%	0.743	75%	0.752	S	S	*	*			trans	24.2	143	145.2	-70.8	161.7	-96.5	0	0	121.1
375	N	27.1	Very low	27.6	Very low	140 Å²	140	135.4 Å²	135.4	75%	0.749	75%	0.749	S	S	*	*			cis	-161.6	-165.5	11.2	-128.6	-45.7	0	0	0	107.3
376	S	30.1	Very low	27.6	Very low	90 Å²	90	137.6 Å²	137.6	63%	0.629	75%	0.749	S	S	*	*			cis	-157.3	166.1	9.1	87.3	0	0	0	0	112.5
377	T	29.8	Very low	27.5	Very low	122 Å²	122	139.9 Å²	139.9	75%	0.748	75%	0.746	S	S	*	*			trans	34.7	122.8	138.1	-44.8	0	0	0	0	121.6
378	G	27.5	Very low	27.4	Very low	67 Å²	67	141.8 Å²	141.8	69%	0.691	75%	0.749	S	S	*	*			trans	-165.4	10.9	173.8	0	0	0	0	0	120.7
379	H	31.6	Very low	27.3	Very low	151 Å²	151	136.1 Å²	136.1	70%	0.699	74%	0.741	S	S	*	*			trans	61.9	115.8	174.6	-62.1	-69.4	0	0	0	117.5
380	N	27.4	Very low	27.2	Very low	147 Å²	147	137.9 Å²	137.9	79%	0.786	75%	0.748	S	S	*	*				65.8	130.1	91.1	-58.9	-8.6	0	0	0	113.9
381	S	29.1	Very low	27.1	Very low	103 Å²	103	141.1 Å²	141.1	72%	0.72	76%	0.756	S	S	*	*			cis	-143.4	149.7	9.5	58.2	0	0	0	0	110.6
382	S	24.6	Very low	27	Very low	99 Å²	99	139.7 Å²	139.7	69%	0.692	76%	0.761	S	S	*	*				50.8	139.4	84.1	117.2	0	0	0	0	114.2
383	W	25.6	Very low	27.6	Very low	203 Å²	203	139.3 Å²	139.3	77%	0.769	76%	0.761	S	S	*	*			cis	-160	129.7	4.5	-161.5	-61.1	0	0	0	105.4
384	F	26.7	Very low	27.5	Very low	176 Å²	176	144.5 Å²	144.5	77%	0.772	78%	0.777	S	S	*	*				-178.3	120.3	99.6	-97.4	-78.8	0	0	0	111.8
385	S	27.3	Very low	27.7	Very low	117 Å²	117	144.5 Å²	144.5	82%	0.818	78%	0.781	S	S	*	*			trans	-99.1	148.2	156.8	175.4	0	0	0	0	109.3
386	R	27.7	Very low	27.7	Very low	233 Å²	233	144.1 Å²	144.1	88%	0.879	78%	0.779	S	S	*	*			trans	-125	113.5	176.5	-175.1	169.9	-75.2	-141.9	2.3	111.2
387	R	26.1	Very low	27.8	Very low	221 Å²	221	149.9 Å²	149.9	83%	0.834	79%	0.787	S	S	*	*			trans	-46.4	161.7	162.5	-68.8	176.3	170.4	169.9	-4.1	111.7
388	T	26.4	Very low	27.7	Very low	127 Å²	127	152.1 Å²	152.1	78%	0.779	79%	0.793	S	S	*	*			cis	-151.2	144.3	45.7	41.2	0	0	0	0	111
389	A	26.7	Very low	27.8	Very low	91 Å²	91	155 Å²	155	75%	0.752	80%	0.802	S	S	*	*			cis	75.1	106.7	45.9	0	0	0	0	0	113.8
390	S	25.1	Very low	27.6	Very low	127 Å²	127	151.5 Å²	151.5	89%	0.888	81%	0.807	S	S	*	*			trans	-84.3	161.6	170.4	50.4	0	0	0	0	111.6
391	R	25.1	Very low	27.6	Very low	239 Å²	239	150.4 Å²	150.4	90%	0.902	81%	0.811	S	S	*	*			trans	-159	124.7	172.1	-177	169.5	174.7	-170.3	-2.9	112.3
392	S	23	Very low	27.7	Very low	107 Å²	107	151.3 Å²	151.3	75%	0.748	82%	0.818	S	S	*	*			trans	-89.3	159.8	162.8	-56.7	0	0	0	0	110.5
393	P	38.7	Very low	28.1	Very low	127 Å²	127	152.1 Å²	152.1	83%	0.825	82%	0.824	S	S	*	*			trans	-87.9	148.4	177.9	35	-33.7	0	0	0	112.6
394	E	24.2	Very low	28.4	Very low	189 Å²	189	149.5 Å²	149.5	88%	0.883	82%	0.824	S	S	*	*			trans	-147	154.4	161.3	-165.3	165.1	-156.3	0	0	108.8
395	L	31.1	Very low	29	Very low	159 Å²	159	144.9 Å²	144.9	83%	0.832	81%	0.814	S	S	*	*			trans	-66.1	152.3	173	-89.3	60.2	0	0	0	109.3
396	D	28	Very low	29.5	Very low	132 Å²	132	149.9 Å²	149.9	71%	0.706	82%	0.815	S	S	*	*				-165.3	-175.7	69.6	-150.1	-12.5	0	0	0	113.9
397	R	31.5	Very low	29.7	Very low	210 Å²	210	143.5 Å²	143.5	79%	0.792	81%	0.812	S	S	*	*			trans	-45	141.8	-178.7	-56.8	136.4	171.6	-127.6	-2.9	115.5
398	L	28.6	Very low	30.1	Very low	169 Å²	169	137.6 Å²	137.6	89%	0.885	81%	0.805	S	S	*	*				-179.6	146	92.2	-92.3	174.7	0	0	0	111.9
399	S	29.2	Very low	30.4	Very low	127 Å²	127	138.9 Å²	138.9	89%	0.888	81%	0.805	S	S	*	*			trans	-92.4	142.8	174.4	-60.9	0	0	0	0	111.7
400	G	28.2	Very low	30.8	Very low	78 Å²	78	140.4 Å²	140.4	80%	0.804	81%	0.805	S	S	*	*			trans	-146.2	81.3	-176.6	0	0	0	0	0	114.2
401	S	27.8	Very low	31.2	Very low	124 Å²	124	140.2 Å²	140.2	87%	0.867	80%	0.803	S	S	*	*			trans	0.9	123.8	163.5	-174.6	0	0	0	0	120.2
402	S	30.6	Very low	31.7	Very low	122 Å²	122	133.9 Å²	133.9	85%	0.853	80%	0.796	S	S	*	*				-159.1	142.7	124.1	-168.7	0	0	0	0	110.7
403	S	33.2	Very low	31.9	Very low	117 Å²	117	134.2 Å²	134.2	82%	0.818	80%	0.797	S	S	*	*			trans	-148.3	106.1	179.1	-167.9	0	0	0	0	112
404	D	31.4	Very low	31.6	Very low	147 Å²	147	133 Å²	133	79%	0.786	79%	0.791	S	S	*	*			trans	-171.3	154.9	160.8	-120	-23.6	0	0	0	107.7
405	S	40.1	Very low	32.1	Very low	79 Å²	79	130.1 Å²	130.1	55%	0.552	79%	0.787	S	S	*	*			cis	-153.4	136.7	-2	-146.5	0	0	0	0	112.1
406	R	37.4	Very low	32.2	Very low	223 Å²	223	128.8 Å²	128.8	84%	0.842	79%	0.785	S	S	*	*			trans	45.3	136.5	137.2	-56.3	165.6	89.7	85.7	2.6	122.1
407	A	31.6	Very low	32.4	Very low	98 Å²	98	128.2 Å²	128.2	81%	0.81	79%	0.792	S	S	*	*			trans	73	148.8	148.4	0	0	0	0	0	118.5
408	S	33.8	Very low	32.8	Very low	98 Å²	98	124.7 Å²	124.7	69%	0.685	79%	0.794	S	S	*	*			cis	-165.1	140	-6.4	40.9	0	0	0	0	114.4
409	I	32.8	Very low	32.9	Very low	153 Å²	153	124.4 Å²	124.4	79%	0.785	79%	0.793	S	S	*	*			trans	61.4	122.5	131.5	-55.7	174.8	0	0	0	120.3
410	V	36.1	Very low	33.1	Very low	123 Å²	123	123.4 Å²	123.4	75%	0.745	79%	0.786	S	S	*	*			trans	51.3	130	161.5	-55.3	0	0	0	0	122.9
411	S	33.4	Very low	33.2	Very low	123 Å²	123	125.7 Å²	125.7	86%	0.86	79%	0.79	S	S	*	*				-154.8	154.5	118.7	-79.8	0	0	0	0	109.7
412	S	34.7	Very low	33.4	Very low	106 Å²	106	125.6 Å²	125.6	74%	0.741	79%	0.789	S	S	*	*			trans	-123.6	176.1	-168.8	-67.6	0	0	0	0	113.2
413	C	27.8	Very low	33.3	Very low	114 Å²	114	125.7 Å²	125.7	77%	0.77	79%	0.79	S	S	*	*			trans	63.3	95.5	160	65.5	0	0	0	0	120.9
414	S	32.8	Very low	33	Very low	101 Å²	101	125.6 Å²	125.6	71%	0.706	79%	0.789	S	S	*	*				66.7	130.8	108.2	-54.1	0	0	0	0	122.6
415	T	33.4	Very low	32.9	Very low	130 Å²	130	124 Å²	124	80%	0.798	79%	0.79	S	S	*	*			trans	60.6	131.8	140.7	56.6	0	0	0	0	118.3
416	T	34.7	Very low	32.2	Very low	130 Å²	130	125.8 Å²	125.8	80%	0.798	80%	0.802	S	S	*	*			cis	-155.4	147.7	30.5	48.9	0	0	0	0	112.4
417	S	31.9	Very low	31.8	Very low	120 Å²	120	123.8 Å²	123.8	84%	0.839	80%	0.802	S	S	*	*			trans	-177.1	134.9	136.7	50.4	0	0	0	0	111.4
418	T	38.4	Very low	31.6	Very low	136 Å²	136	128.2 Å²	128.2	83%	0.834	81%	0.806	S	S	*	*			trans	-91	127.6	161.3	46.3	0	0	0	0	109.3
419	D	31.1	Very low	31.7	Very low	163 Å²	163	128.5 Å²	128.5	87%	0.872	81%	0.808	S	S	*	*			trans	-159.6	165.8	134.9	-120.8	-36.2	0	0	0	112.8
420	S	33.8	Very low	31.8	Very low	107 Å²	107	125.3 Å²	125.3	75%	0.748	81%	0.805	S	S	*	*			trans	-88.1	140.5	-161.2	-57.1	0	0	0	0	114.9
421	S	29.4	Very low	32.1	Very low	125 Å²	125	128.5 Å²	128.5	87%	0.874	81%	0.809	S	S	*	*			trans	-170.7	119.4	143.2	-84.2	0	0	0	0	112.2
422	S	33.7	Very low	32.8	Very low	122 Å²	122	127 Å²	127	85%	0.853	79%	0.788	S	S	*	*			trans	-100.2	132.4	170.1	-56	0	0	0	0	110.4
423	S	28.1	Very low	33.7	Very low	124 Å²	124	124.9 Å²	124.9	87%	0.867	77%	0.768	S	S	*	*			trans	178.9	166.5	150.3	39.6	0	0	0	0	113.6
424	S	25.8	Very low	35	Very low	115 Å²	115	124.6 Å²	124.6	80%	0.804	77%	0.768	S	S	*	*			trans	84.8	61.5	163.6	-144.3	0	0	0	0	118.6
425	S	29.4	Very low	36.8	Very low	114 Å²	114	122.1 Å²	122.1	80%	0.797	75%	0.746	S	S	*	*	S	Bend	trans	-74.4	129.8	135.1	53.2	0	0	0	0	108.6	E427	S425-E427 PolarHBondContact O-N 3.35Å
426	S	25.9	Very low	39.2	Very low	116 Å²	116	118.2 Å²	118.2	81%	0.811	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-51.4	123.9	-172.8	-171.1	0	0	0	0	113.4	E428	S426-E428 PolarHBondContact O-N 2.77Å
427	E	28.3	Very low	41.5	Very low	182 Å²	182	112.2 Å²	112.2	85%	0.85	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-70.9	117.7	167	-67.3	177.6	107.6	0	0	109.3	S425 S429	S425-E427 PolarHBondContact O-N 3.35Å; E427-S429 PolarHBondContact O-N 3.06Å
428	E	27.8	Very low	43.9	Very low	190 Å²	190	110.8 Å²	110.8	89%	0.888	67%	0.666	S	S	*	*			trans	-73.9	104.6	160.4	-172.8	171	167.6	0	0	106.5	S426 A430	S426-E428 PolarHBondContact O-N 2.77Å; E428-A430 PolarHBondContact O-N 2.88Å
429	S	35.8	Very low	46.3	Very low	104 Å²	104	107.4 Å²	107.4	73%	0.727	65%	0.645	S	S	*	*			trans	-52.7	115	-167.1	58.8	0	0	0	0	112	E427 K431	E427-S429 PolarHBondContact O-N 3.06Å; S429-K431 PolarHBondContact O-N 3.03Å
430	A	34.9	Very low	49	Very low	87 Å²	87	99.6 Å²	99.6	72%	0.719	60%	0.604	S	S	*	*			trans	-54.6	130.3	177	0	0	0	0	0	109.9	E428 E432	E428-A430 PolarHBondContact O-N 2.88Å; A430-E432 PolarHBondContact O-N 3.46Å
431	K	42.3	Very low	51.6	Low	189 Å²	189	97.2 Å²	97.2	82%	0.822	58%	0.58	S	S	*	*			trans	-71.2	78.7	167.7	-71	174	-179.9	168.7	0	108	S429 L433	S429-K431 PolarHBondContact O-N 3.03Å; K431-L433 PolarHBondContact O-N 3.46Å
432	E	48.8	Very low	54.6	Low	92 Å²	92	97.6 Å²	97.6	43%	0.43	57%	0.568	S	S	.	*			trans	-58.5	100.8	169.6	-175	-178.1	175.1	0	0	107.1	A430 S434 K589	A430-E432 PolarHBondContact O-N 3.46Å; E432-S434 PolarHBondContact O-N 3.34Å; E432-K589 IonicContact OE1-NZ 2.9Å; E432-K589 PolarHBondContact OE1-NZ 3.02Å
433	L	53.5	Low	57.3	Low	61 Å²	61	93.9 Å²	93.9	32%	0.319	54%	0.54	S	S	.	.			trans	-71.7	85.2	170.8	-70.1	-174.7	0	0	0	107.6	K431 L435	K431-L433 PolarHBondContact O-N 3.46Å; L433-L435 HydrophobicContact CB-CB 4.45Å; L433-L435 PolarHBondContact O-N 3.3Å
434	S	56.1	Low	60.4	Low	109 Å²	109	88 Å²	88	76%	0.762	50%	0.499	S	S	*	.			trans	-69.8	46	164.6	49.1	0	0	0	0	111.1	E432	E432-S434 PolarHBondContact O-N 3.34Å
435	L	70	Confident	63.7	Low	49 Å²	49	87.5 Å²	87.5	26%	0.257	49%	0.485	S	S	.	.			trans	-75.7	135.9	179.2	-157.4	67.5	0	0	0	108.6	L433 V439 A440 F496 F588	L433-L435 HydrophobicContact CB-CB 4.45Å; L433-L435 PolarHBondContact O-N 3.3Å; L435-V439 HydrophobicContact CD1-CG1 3.86Å; L435-V439 HydrophobicContact CD2-CG1 4.38Å; L435-V439 HydrophobicContact CG-CB 4.37Å; L435-V439 HydrophobicContact CG-CG1 3.98Å; L435-A440 HydrophobicContact CD2-CB 3.91Å; L435-A440 HydrophobicContact CG-CB 4.31Å; L435-F496 HydrophobicContact CD2-CE2 3.85Å; L435-F588 WeakPolarHBondContact O-CD1 3.33Å
436	D	82.6	Confident	66.8	Low	48 Å²	48	85.8 Å²	85.8	26%	0.257	47%	0.473	S	S	.	.			trans	-63.1	148.2	177.2	-179.7	78.4	0	0	0	111.2	D438 V439 A440 N591	D436-D438 VanDerWaalsContact C-N 3.3Å; D436-D438 PolarHBondContact O-N 2.95Å; D436-D438 PolarHBondContact OD2-N 3.03Å; D436-V439 HydrophobicContact CB-CB 4.3Å; D436-V439 HydrophobicContact CB-CG2 4.06Å; D436-V439 PolarHBondContact O-N 3.26Å; D436-A440 VanDerWaalsContact O-CB 3.27Å; D436-A440 WeakPolarHBondContact O-CB 3.42Å; D436-A440 PolarHBondContact O-N 3.41Å; D436-N591 PolarHBondContact OD1-ND2 3.28Å
437	L	82.8	Confident	70	Confident	4 Å²	4	81.4 Å²	81.4	2%	0.021	44%	0.44	C	S	.	.	H	α-helix	trans	-55.9	-39.5	-175.5	173.8	59.7	0	0	0	113.6	K441 G584 R585 F588 Q590	L437-K441 WeakPolarHBondContact O-CE 3.5Å; L437-K441 WeakPolarHBondContact O-CG 3.48Å; L437-K441 PolarHBondContact O-N 3.49Å; L437-G584 WeakPolarHBondContact CD1-O 3.31Å; L437-R585 HydrophobicContact CD2-CG 4.06Å; L437-F588 HydrophobicContact CB-CB 4.2Å; L437-F588 HydrophobicContact CD1-CB 4.32Å; L437-F588 HydrophobicContact CD1-CD2 4.04Å; L437-Q590 HydrophobicContact CD2-CB 4.19Å; L437-Q590 HydrophobicContact CD2-CG 4.19Å
438	D	84.1	Confident	73.2	Confident	90 Å²	90	74.9 Å²	74.9	48%	0.481	41%	0.41	S	S	.	.	H	α-helix	trans	-84.6	-35.2	-177	-73.9	-53.4	0	0	0	111.7	D436 A440 K441 E442	D436-D438 VanDerWaalsContact C-N 3.3Å; D436-D438 PolarHBondContact O-N 2.95Å; D436-D438 PolarHBondContact OD2-N 3.03Å; D438-A440 VanDerWaalsContact C-N 3.31Å; D438-A440 PolarHBondContact O-N 3.04Å; D438-K441 PolarHBondContact O-N 3.25Å; D438-K441 IonicContact OD1-NZ 2.66Å; D438-K441 PolarHBondContact OD1-NZ 3.18Å; D438-E442 PolarHBondContact O-N 3.33Å
439	V	88.1	Confident	76.4	Confident	64 Å²	64	72.1 Å²	72.1	39%	0.388	40%	0.397	S	S	.	.	H	α-helix	trans	-58.3	-43.7	167.7	179.6	0	0	0	0	110.9	L435 D436 K441 E442 T443	L435-V439 HydrophobicContact CD1-CG1 3.86Å; L435-V439 HydrophobicContact CD2-CG1 4.38Å; L435-V439 HydrophobicContact CG-CB 4.37Å; L435-V439 HydrophobicContact CG-CG1 3.98Å; D436-V439 HydrophobicContact CB-CB 4.3Å; D436-V439 HydrophobicContact CB-CG2 4.06Å; D436-V439 PolarHBondContact O-N 3.26Å; V439-K441 VanDerWaalsContact C-N 3.33Å; V439-K441 PolarHBondContact O-N 2.9Å; V439-E442 PolarHBondContact O-N 2.98Å; V439-T443 HydrophobicContact CG1-CG2 4.41Å; V439-T443 WeakPolarHBondContact O-CG2 3.5Å; V439-T443 PolarHBondContact O-N 3.28Å; V439-T443 PolarHBondContact O-OG1 3.45Å
440	A	87.8	Confident	79.2	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-65.1	-33.4	179.8	0	0	0	0	0	113.2	L435 D436 D438 T443 V444 F588	L435-A440 HydrophobicContact CD2-CB 3.91Å; L435-A440 HydrophobicContact CG-CB 4.31Å; D436-A440 VanDerWaalsContact O-CB 3.27Å; D436-A440 WeakPolarHBondContact O-CB 3.42Å; D436-A440 PolarHBondContact O-N 3.41Å; D438-A440 VanDerWaalsContact C-N 3.31Å; D438-A440 PolarHBondContact O-N 3.04Å; A440-T443 WeakPolarHBondContact CA-OG1 3.17Å; A440-T443 PolarHBondContact O-OG1 3.44Å; A440-T443 VanDerWaalsContact O-OG1 3.09Å; A440-V444 WeakPolarHBondContact O-CB 3.3Å; A440-V444 WeakPolarHBondContact O-CG2 3.46Å; A440-V444 PolarHBondContact O-N 3.08Å; A440-V444 VanDerWaalsContact O-N 3.15Å; A440-F588 HydrophobicContact CB-CD1 3.99Å; A440-F588 HydrophobicContact CB-CD2 3.85Å; A440-F588 HydrophobicContact CB-CE1 3.73Å; A440-F588 HydrophobicContact CB-CE2 3.57Å; A440-F588 HydrophobicContact CB-CG 4.06Å; A440-F588 HydrophobicContact CB-CZ 3.52Å
441	K	88.5	Confident	82.1	Confident	56 Å²	56	65.9 Å²	65.9	24%	0.243	34%	0.34	C	S	.	.	H	α-helix	trans	-68.5	-44.8	171.4	-66.6	164.3	-159.4	160.1	0	110.7	L437 D438 V439 V444 M445 I581	L437-K441 WeakPolarHBondContact O-CE 3.5Å; L437-K441 WeakPolarHBondContact O-CG 3.48Å; L437-K441 PolarHBondContact O-N 3.49Å; D438-K441 PolarHBondContact O-N 3.25Å; D438-K441 IonicContact OD1-NZ 2.66Å; D438-K441 PolarHBondContact OD1-NZ 3.18Å; V439-K441 VanDerWaalsContact C-N 3.33Å; V439-K441 PolarHBondContact O-N 2.9Å; K441-V444 PolarHBondContact O-N 3.41Å; K441-M445 HydrophobicContact CB-CE 4.39Å; K441-M445 WeakPolarHBondContact O-CG 3.36Å; K441-M445 PolarHBondContact O-N 3.16Å; K441-I581 HydrophobicContact CG-CG1 4.39Å
442	E	91.3	Very high	84.6	Confident	134 Å²	134	59.7 Å²	59.7	63%	0.626	32%	0.318	S	S	*	.	H	α-helix	trans	-61.8	-45.4	179.5	-171.9	174.4	-171.2	0	0	111.4	D438 V439 V444 M445 S446	D438-E442 PolarHBondContact O-N 3.33Å; V439-E442 PolarHBondContact O-N 2.98Å; E442-V444 PolarHBondContact O-N 2.94Å; E442-M445 PolarHBondContact O-N 3.45Å; E442-S446 WeakPolarHBondContact O-CB 3.44Å; E442-S446 PolarHBondContact O-N 3.22Å
443	T	91.4	Very high	86.7	Confident	44 Å²	44	58.5 Å²	58.5	27%	0.27	32%	0.32	S	S	.	.	H	α-helix	trans	-62.9	-41.7	175.8	54.3	0	0	0	0	112.1	V439 A440 S446 L447 F496	V439-T443 HydrophobicContact CG1-CG2 4.41Å; V439-T443 WeakPolarHBondContact O-CG2 3.5Å; V439-T443 PolarHBondContact O-N 3.28Å; V439-T443 PolarHBondContact O-OG1 3.45Å; A440-T443 WeakPolarHBondContact CA-OG1 3.17Å; A440-T443 PolarHBondContact O-OG1 3.44Å; A440-T443 VanDerWaalsContact O-OG1 3.09Å; T443-S446 PolarHBondContact O-N 2.86Å; T443-L447 WeakPolarHBondContact O-CB 3.37Å; T443-L447 WeakPolarHBondContact O-CD1 3.48Å; T443-L447 VanDerWaalsContact O-CG 3.23Å; T443-L447 WeakPolarHBondContact O-CG 3.48Å; T443-L447 PolarHBondContact O-N 3.12Å; T443-F496 WeakPolarHBondContact OG1-CE2 3.37Å
444	V	93.6	Very high	88.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-58.5	-49.9	174	164.6	0	0	0	0	111.5	A440 K441 E442 Q448 F496 A577 V580 I581	A440-V444 WeakPolarHBondContact O-CB 3.3Å; A440-V444 WeakPolarHBondContact O-CG2 3.46Å; A440-V444 PolarHBondContact O-N 3.08Å; A440-V444 VanDerWaalsContact O-N 3.15Å; K441-V444 PolarHBondContact O-N 3.41Å; E442-V444 PolarHBondContact O-N 2.94Å; V444-Q448 VanDerWaalsContact O-CB 3.27Å; V444-Q448 WeakPolarHBondContact O-CB 3.26Å; V444-Q448 PolarHBondContact O-N 3.14Å; V444-F496 HydrophobicContact CG2-CD1 4.21Å; V444-F496 HydrophobicContact CG2-CE1 3.26Å; V444-F496 HydrophobicContact CG2-CZ 3.6Å; V444-A577 HydrophobicContact CG1-CB 3.37Å; V444-V580 HydrophobicContact CG2-CB 4.38Å; V444-V580 HydrophobicContact CG2-CG1 3.96Å; V444-I581 HydrophobicContact CG1-CD1 4.04Å; V444-I581 HydrophobicContact CG1-CG1 4.26Å
445	M	93.7	Very high	90.5	Very high	105 Å²	105	51.1 Å²	51.1	52%	0.517	27%	0.273	S	S	.	.	H	α-helix	trans	-68.2	-37.8	-177.7	-68.6	-175.4	-60.3	0	0	111.9	K441 E442 H449 I581	K441-M445 HydrophobicContact CB-CE 4.39Å; K441-M445 WeakPolarHBondContact O-CG 3.36Å; K441-M445 PolarHBondContact O-N 3.16Å; E442-M445 PolarHBondContact O-N 3.45Å; M445-H449 WeakPolarHBondContact O-CB 3.46Å; M445-H449 PolarHBondContact O-N 3.01Å; M445-I581 HydrophobicContact CG-CD1 4.15Å
446	S	95.2	Very high	91.5	Very high	77 Å²	77	51.2 Å²	51.2	54%	0.538	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-48.3	176.4	-174.4	0	0	0	0	111.7	E442 T443 H449 K450	E442-S446 WeakPolarHBondContact O-CB 3.44Å; E442-S446 PolarHBondContact O-N 3.22Å; T443-S446 PolarHBondContact O-N 2.86Å; S446-H449 PolarHBondContact O-N 2.83Å; S446-K450 PolarHBondContact O-N 2.83Å
447	L	94.2	Very high	91.9	Very high	25 Å²	25	50 Å²	50	13%	0.131	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-40.9	176.7	-68.9	165.9	0	0	0	111.8	T443 H449 K450 V451 E492 F493 F496	T443-L447 WeakPolarHBondContact O-CB 3.37Å; T443-L447 WeakPolarHBondContact O-CD1 3.48Å; T443-L447 VanDerWaalsContact O-CG 3.23Å; T443-L447 WeakPolarHBondContact O-CG 3.48Å; T443-L447 PolarHBondContact O-N 3.12Å; L447-H449 PolarHBondContact O-N 3.15Å; L447-K450 PolarHBondContact O-N 3.16Å; L447-V451 PolarHBondContact O-N 2.84Å; L447-E492 HydrophobicContact CD2-CB 3.8Å; L447-F493 HydrophobicContact CB-CB 4.47Å; L447-F493 HydrophobicContact CB-CD2 3.97Å; L447-F496 HydrophobicContact CD1-CB 3.59Å; L447-F496 HydrophobicContact CD1-CD1 4.33Å; L447-F496 HydrophobicContact CD1-CD2 4.23Å; L447-F496 HydrophobicContact CD1-CG 3.77Å
448	Q	94.6	Very high	92.4	Very high	45 Å²	45	49.8 Å²	49.8	21%	0.21	28%	0.279	C	S	.	.	H	α-helix	trans	-58.3	-46.7	171.9	176	178.6	-13.4	0	0	111.1	V444 V451 V452 I573	V444-Q448 VanDerWaalsContact O-CB 3.27Å; V444-Q448 WeakPolarHBondContact O-CB 3.26Å; V444-Q448 PolarHBondContact O-N 3.14Å; Q448-V451 PolarHBondContact O-N 2.83Å; Q448-V452 HydrophobicContact CG-CG2 4.36Å; Q448-V452 WeakPolarHBondContact O-CB 3.37Å; Q448-V452 WeakPolarHBondContact O-CG2 3.29Å; Q448-V452 PolarHBondContact O-N 3.08Å; Q448-I573 HydrophobicContact CB-CG2 4.06Å; Q448-I573 HydrophobicContact CG-CG2 4.05Å
449	H	95.1	Very high	92.7	Very high	132 Å²	132	47.6 Å²	47.6	61%	0.611	27%	0.266	S	S	*	.	H	α-helix	trans	-63.8	-40.2	177.3	-177	-91.4	0	0	0	112.1	M445 S446 L447 V452 S453	M445-H449 WeakPolarHBondContact O-CB 3.46Å; M445-H449 PolarHBondContact O-N 3.01Å; S446-H449 PolarHBondContact O-N 2.83Å; L447-H449 PolarHBondContact O-N 3.15Å; H449-V452 PolarHBondContact O-N 3.33Å; H449-S453 WeakPolarHBondContact O-CB 3.27Å; H449-S453 PolarHBondContact O-N 2.84Å
450	K	94.8	Very high	92.8	Very high	59 Å²	59	51 Å²	51	26%	0.257	28%	0.281	S	S	.	.	H	α-helix	trans	-59.5	-48.5	176.2	-169.7	-178	171.9	173.3	0	111.3	S446 L447 S453 S454 S489 E492	S446-K450 PolarHBondContact O-N 2.83Å; L447-K450 PolarHBondContact O-N 3.16Å; K450-S453 PolarHBondContact O-N 3.42Å; K450-S454 WeakPolarHBondContact O-CB 3.47Å; K450-S454 PolarHBondContact O-N 3.33Å; K450-S454 PolarHBondContact O-OG 3.05Å; K450-S489 VanDerWaalsContact CE-OG 3.24Å; K450-S489 WeakPolarHBondContact CE-OG 3.42Å; K450-S489 WeakPolarHBondContact CG-OG 3.37Å; K450-E492 WeakPolarHBondContact CD-OE2 3.42Å; K450-E492 WeakPolarHBondContact CE-OE2 3.36Å; K450-E492 IonicContact NZ-OE1 3.77Å; K450-E492 PolarHBondContact NZ-OE1 2.68Å; K450-E492 IonicContact NZ-OE2 3.28Å; K450-E492 PolarHBondContact NZ-OE2 3.2Å
451	V	95.3	Very high	92.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-67.1	-42.5	177.4	-178.6	0	0	0	0	111.9	L447 Q448 S453 S454 V455 S489 V490 F493 L569 I573	L447-V451 PolarHBondContact O-N 2.84Å; Q448-V451 PolarHBondContact O-N 2.83Å; V451-S453 VanDerWaalsContact C-N 3.32Å; V451-S453 PolarHBondContact O-N 3.34Å; V451-S454 WeakPolarHBondContact O-CB 3.16Å; V451-S454 PolarHBondContact O-N 2.84Å; V451-V455 HydrophobicContact CG1-CG2 4.22Å; V451-V455 WeakPolarHBondContact O-CG2 3.4Å; V451-V455 PolarHBondContact O-N 3.5Å; V451-S489 VanDerWaalsContact CG2-O 3.31Å; V451-S489 WeakPolarHBondContact CG2-O 3.31Å; V451-V490 HydrophobicContact CG1-CG2 3.71Å; V451-V490 HydrophobicContact CG2-CG2 3.94Å; V451-F493 HydrophobicContact CG2-CB 4.4Å; V451-L569 HydrophobicContact CG1-CD2 4.37Å; V451-I573 HydrophobicContact CB-CD1 3.9Å; V451-I573 HydrophobicContact CG1-CD1 3.53Å; V451-I573 HydrophobicContact CG2-CD1 3.93Å
452	V	94.7	Very high	92.5	Very high	59 Å²	59	51 Å²	51	36%	0.358	28%	0.282	S	S	.	.	H	α-helix	trans	-56.4	-46.2	175.2	168.1	0	0	0	0	111.1	Q448 H449 A456 P570	Q448-V452 HydrophobicContact CG-CG2 4.36Å; Q448-V452 WeakPolarHBondContact O-CB 3.37Å; Q448-V452 WeakPolarHBondContact O-CG2 3.29Å; Q448-V452 PolarHBondContact O-N 3.08Å; H449-V452 PolarHBondContact O-N 3.33Å; V452-A456 VanDerWaalsContact O-CB 3.27Å; V452-A456 WeakPolarHBondContact O-CB 3.43Å; V452-A456 PolarHBondContact O-N 3.36Å; V452-P570 HydrophobicContact CG2-CB 4.05Å
453	S	94.1	Very high	92	Very high	68 Å²	68	47.7 Å²	47.7	48%	0.476	28%	0.275	S	S	.	.	H	α-helix	trans	-65	-38.4	178.1	-168.3	0	0	0	0	112.3	H449 K450 V451 A456 G457	H449-S453 WeakPolarHBondContact O-CB 3.27Å; H449-S453 PolarHBondContact O-N 2.84Å; K450-S453 PolarHBondContact O-N 3.42Å; V451-S453 VanDerWaalsContact C-N 3.32Å; V451-S453 PolarHBondContact O-N 3.34Å; S453-A456 PolarHBondContact O-N 3.13Å; S453-G457 PolarHBondContact O-N 3.47Å
454	S	93.9	Very high	91.2	Very high	5 Å²	5	57.5 Å²	57.5	4%	0.035	31%	0.306	C	S	.	.	H	α-helix	trans	-65.2	-48	177.7	-54.5	0	0	0	0	112.1	K450 V451 A456 G457 L458 H485 S489	K450-S454 WeakPolarHBondContact O-CB 3.47Å; K450-S454 PolarHBondContact O-N 3.33Å; K450-S454 PolarHBondContact O-OG 3.05Å; V451-S454 WeakPolarHBondContact O-CB 3.16Å; V451-S454 PolarHBondContact O-N 2.84Å; S454-A456 VanDerWaalsContact C-N 3.34Å; S454-G457 PolarHBondContact O-N 3.01Å; S454-L458 PolarHBondContact O-N 2.84Å; S454-H485 WeakPolarHBondContact CB-ND1 3.29Å; S454-H485 PolarHBondContact OG-CE1 2.97Å; S454-H485 PolarHBondContact OG-ND1 2.94Å; S454-S489 PolarHBondContact OG-OG 3.23Å
455	V	94.3	Very high	90.2	Very high	9 Å²	9	63.9 Å²	63.9	6%	0.055	33%	0.334	C	S	.	.	H	α-helix	trans	-62.8	-43.1	175	172.1	0	0	0	0	110.2	V451 G457 L458 M459 I486 A566 P570	V451-V455 HydrophobicContact CG1-CG2 4.22Å; V451-V455 WeakPolarHBondContact O-CG2 3.4Å; V451-V455 PolarHBondContact O-N 3.5Å; V455-G457 VanDerWaalsContact C-N 3.3Å; V455-G457 PolarHBondContact O-N 3.33Å; V455-L458 PolarHBondContact O-N 3.43Å; V455-M459 HydrophobicContact CG1-CE 4.15Å; V455-M459 HydrophobicContact CG1-CG 4.2Å; V455-M459 VanDerWaalsContact O-CG 3.27Å; V455-M459 WeakPolarHBondContact O-CG 3.42Å; V455-M459 PolarHBondContact O-N 2.84Å; V455-I486 HydrophobicContact CG2-CD1 4.26Å; V455-I486 HydrophobicContact CG2-CG1 4.19Å; V455-A566 WeakPolarHBondContact CG1-O 3.43Å; V455-A566 WeakPolarHBondContact CG2-O 3.38Å; V455-P570 HydrophobicContact CB-CG 4.01Å; V455-P570 HydrophobicContact CG1-CG 3.89Å; V455-P570 HydrophobicContact CG2-CG 3.98Å
456	A	92.3	Very high	89.5	Confident	51 Å²	51	60.2 Å²	60.2	42%	0.421	32%	0.315	S	S	.	.	H	α-helix	trans	-58.5	-40.8	175.4	0	0	0	0	0	112.2	V452 S453 S454 M459 L460	V452-A456 VanDerWaalsContact O-CB 3.27Å; V452-A456 WeakPolarHBondContact O-CB 3.43Å; V452-A456 PolarHBondContact O-N 3.36Å; S453-A456 PolarHBondContact O-N 3.13Å; S454-A456 VanDerWaalsContact C-N 3.34Å; A456-M459 PolarHBondContact O-N 2.69Å; A456-M459 VanDerWaalsContact O-N 3.16Å; A456-L460 PolarHBondContact O-N 3.35Å
457	G	91	Very high	88.8	Confident	22 Å²	22	57.9 Å²	57.9	23%	0.227	29%	0.294	C	S	.	.	H	α-helix	trans	-54.9	-51.7	173.3	0	0	0	0	0	112.6	S453 S454 V455 M459 L460 F461	S453-G457 PolarHBondContact O-N 3.47Å; S454-G457 PolarHBondContact O-N 3.01Å; V455-G457 VanDerWaalsContact C-N 3.3Å; V455-G457 PolarHBondContact O-N 3.33Å; G457-M459 VanDerWaalsContact C-N 3.33Å; G457-M459 PolarHBondContact O-N 3Å; G457-L460 WeakPolarHBondContact O-CB 3.41Å; G457-L460 PolarHBondContact O-N 2.96Å; G457-F461 WeakPolarHBondContact O-CD2 3.45Å; G457-F461 WeakPolarHBondContact O-CE2 3.46Å
458	L	92	Very high	88.1	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-60.2	-41.8	174	179.3	62.9	0	0	0	112.1	S454 V455 L460 F461 V462 I479 I486 F562 V563 A566	S454-L458 PolarHBondContact O-N 2.84Å; V455-L458 PolarHBondContact O-N 3.43Å; L458-L460 PolarHBondContact O-N 3.11Å; L458-F461 PolarHBondContact O-N 3.48Å; L458-V462 HydrophobicContact CG-CG2 4.38Å; L458-V462 PolarHBondContact O-N 2.82Å; L458-I479 HydrophobicContact CD1-CG2 4.01Å; L458-I486 HydrophobicContact CB-CD1 3.66Å; L458-I486 HydrophobicContact CD2-CD1 3.55Å; L458-I486 HydrophobicContact CG-CD1 4.25Å; L458-F562 HydrophobicContact CD2-CD1 4.05Å; L458-F562 HydrophobicContact CD2-CE1 3.77Å; L458-V563 HydrophobicContact CD2-CG2 4.12Å; L458-A566 HydrophobicContact CD2-CB 4.18Å
459	M	91.9	Very high	87.4	Confident	44 Å²	44	64.3 Å²	64.3	22%	0.217	32%	0.318	C	S	.	.	H	α-helix	trans	-64.7	-18.7	-178	-67.8	-49.6	121.3	0	0	114.3	V455 A456 G457 F461 V462 V563 A566 R567	V455-M459 HydrophobicContact CG1-CE 4.15Å; V455-M459 HydrophobicContact CG1-CG 4.2Å; V455-M459 VanDerWaalsContact O-CG 3.27Å; V455-M459 WeakPolarHBondContact O-CG 3.42Å; V455-M459 PolarHBondContact O-N 2.84Å; A456-M459 PolarHBondContact O-N 2.69Å; A456-M459 VanDerWaalsContact O-N 3.16Å; G457-M459 VanDerWaalsContact C-N 3.33Å; G457-M459 PolarHBondContact O-N 3Å; M459-F461 VanDerWaalsContact C-N 3.26Å; M459-F461 PolarHBondContact O-N 3.35Å; M459-V462 PolarHBondContact O-N 3.48Å; M459-V462 HydrophobicContact SD-CB 4.42Å; M459-V462 HydrophobicContact SD-CG2 4.37Å; M459-V563 HydrophobicContact CE-CG1 4.4Å; M459-A566 HydrophobicContact CE-CB 4.45Å; M459-R567 HydrophobicContact CE-CG 3.68Å; M459-R567 HydrophobicContact SD-CG 3.53Å; M459-R567 VanDerWaalsContact SD-CG 3.53Å; M459-R567 VanDerWaalsContact SD-CZ 3.52Å; M459-R567 PolarHBondContact SD-NE 2.84Å; M459-R567 PolarHBondContact SD-NH2 2.99Å; M459-R567 VanDerWaalsContact SD-NH2 3.4Å
460	L	88.8	Confident	86.7	Confident	134 Å²	134	63.9 Å²	63.9	70%	0.702	32%	0.32	S	S	*	.	H	α-helix	trans	-62.9	-34.1	171.1	-65.3	173.9	0	0	0	112.1	A456 G457 L458	A456-L460 PolarHBondContact O-N 3.35Å; G457-L460 WeakPolarHBondContact O-CB 3.41Å; G457-L460 PolarHBondContact O-N 2.96Å; L458-L460 PolarHBondContact O-N 3.11Å
461	F	85.9	Confident	86.1	Confident	38 Å²	38	64.7 Å²	64.7	17%	0.167	32%	0.322	C	S	.	.	H	α-helix	trans	-83.9	-26.2	-179.8	-54.8	-74.3	0	0	0	112.7	G457 L458 M459 S463 W466 Y471 N475 A478 I479	G457-F461 WeakPolarHBondContact O-CD2 3.45Å; G457-F461 WeakPolarHBondContact O-CE2 3.46Å; L458-F461 PolarHBondContact O-N 3.48Å; M459-F461 VanDerWaalsContact C-N 3.26Å; M459-F461 PolarHBondContact O-N 3.35Å; F461-S463 PolarHBondContact O-N 2.85Å; F461-W466 WeakPolarHBondContact O-CB 3.49Å; F461-Y471 PolarHBondContact O-OH 3.3Å; F461-N475 HydrophobicContact CD1-CB 4.02Å; F461-N475 WeakPolarHBondContact CD1-OD1 3.37Å; F461-N475 HydrophobicContact CE1-CB 4.49Å; F461-N475 WeakPolarHBondContact CE1-OD1 3.23Å; F461-A478 HydrophobicContact CE1-CB 3.71Å; F461-A478 HydrophobicContact CE2-CB 4.21Å; F461-A478 HydrophobicContact CZ-CB 3.55Å; F461-I479 HydrophobicContact CB-CD1 4.15Å; F461-I479 HydrophobicContact CB-CG1 3.74Å; F461-I479 HydrophobicContact CD2-CG1 4.29Å; F461-I479 HydrophobicContact CG-CG1 3.93Å
462	V	85.1	Confident	85.5	Confident	18 Å²	18	64.7 Å²	64.7	11%	0.109	32%	0.322	C	S	.	.			trans	-80.1	59.1	-178	-168.1	0	0	0	0	111.9	L458 M459 W466 V563 R567	L458-V462 HydrophobicContact CG-CG2 4.38Å; L458-V462 PolarHBondContact O-N 2.82Å; M459-V462 PolarHBondContact O-N 3.48Å; M459-V462 HydrophobicContact SD-CB 4.42Å; M459-V462 HydrophobicContact SD-CG2 4.37Å; V462-W466 HydrophobicContact CG1-CD2 4.14Å; V462-W466 HydrophobicContact CG1-CG 4.47Å; V462-W466 HydrophobicContact CG1-CZ2 4.12Å; V462-W466 HydrophobicContact CG2-CE3 4.28Å; V462-W466 HydrophobicContact CG2-CZ3 4.3Å; V462-V563 HydrophobicContact CG1-CG1 3.81Å; V462-V563 HydrophobicContact CG2-CG1 4Å; V462-V563 HydrophobicContact CG2-CG2 3.87Å; V462-R567 VanDerWaalsContact CG1-NH2 3.32Å
463	S	80.4	Confident	85	Confident	66 Å²	66	66.2 Å²	66.2	46%	0.462	33%	0.325	S	S	.	.			trans	-81.8	167.8	172.3	-177.9	0	0	0	0	112.1	F461 K465 W466	F461-S463 PolarHBondContact O-N 2.85Å; S463-K465 PolarHBondContact O-N 3.44Å; S463-W466 WeakPolarHBondContact O-CB 3.33Å; S463-W466 PolarHBondContact O-N 2.85Å; S463-W466 VanDerWaalsContact O-N 3.08Å
464	R	74.9	Confident	84.6	Confident	249 Å²	249	66.9 Å²	66.9	94%	0.94	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-13.3	177.6	-70.3	-172.8	-179.7	-176.9	0.2	114.8
465	K	72.1	Confident	84.3	Confident	134 Å²	134	68.2 Å²	68.2	58%	0.583	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	15.3	177.7	-66.3	-163	174.4	-168	0	114	S463 R467 F468	S463-K465 PolarHBondContact O-N 3.44Å; K465-R467 PolarHBondContact O-N 3.05Å; K465-R467 VanDerWaalsContact O-N 3.15Å; K465-F468 HydrophobicContact CB-CD2 3.66Å; K465-F468 HydrophobicContact CB-CE2 4.01Å; K465-F468 HydrophobicContact CB-CG 4.44Å; K465-F468 HydrophobicContact CD-CD2 4.41Å; K465-F468 HydrophobicContact CD-CE2 4.25Å; K465-F468 HydrophobicContact CG-CD2 3.98Å; K465-F468 HydrophobicContact CG-CE2 3.8Å; K465-F468 WeakPolarHBondContact O-CB 3.26Å; K465-F468 WeakPolarHBondContact O-CD2 3.49Å; K465-F468 PolarHBondContact O-N 3.43Å; K465-F468 VanDerWaalsContact O-N 3.12Å
466	W	79.2	Confident	83.9	Confident	28 Å²	28	68.8 Å²	68.8	11%	0.106	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.9	-173.1	78.6	-60.6	0	0	0	115.7	F461 V462 S463 Y471 L559 V563	F461-W466 WeakPolarHBondContact O-CB 3.49Å; V462-W466 HydrophobicContact CG1-CD2 4.14Å; V462-W466 HydrophobicContact CG1-CG 4.47Å; V462-W466 HydrophobicContact CG1-CZ2 4.12Å; V462-W466 HydrophobicContact CG2-CE3 4.28Å; V462-W466 HydrophobicContact CG2-CZ3 4.3Å; S463-W466 WeakPolarHBondContact O-CB 3.33Å; S463-W466 PolarHBondContact O-N 2.85Å; S463-W466 VanDerWaalsContact O-N 3.08Å; W466-Y471 HydrophobicContact CB-CD1 4.27Å; W466-Y471 HydrophobicContact CB-CE1 4.04Å; W466-L559 HydrophobicContact CH2-CD1 4.36Å; W466-L559 HydrophobicContact CH2-CD2 4.17Å; W466-L559 HydrophobicContact CH2-CG 3.79Å; W466-L559 HydrophobicContact CZ3-CD1 4.22Å; W466-L559 HydrophobicContact CZ3-CD2 3.91Å; W466-L559 HydrophobicContact CZ3-CG 3.89Å; W466-V563 HydrophobicContact CH2-CB 4.27Å; W466-V563 HydrophobicContact CH2-CG2 3.62Å; W466-V563 HydrophobicContact CZ2-CG2 4.41Å; W466-V563 HydrophobicContact CZ3-CG2 4.11Å
467	R	79.4	Confident	83.6	Confident	28 Å²	28	71.9 Å²	71.9	11%	0.106	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-1	176.9	-62.8	-63.9	-176.7	90	-8.9	114.5	K465 L547 V548 T549 D557	K465-R467 PolarHBondContact O-N 3.05Å; K465-R467 VanDerWaalsContact O-N 3.15Å; R467-L547 VanDerWaalsContact CD-O 3.24Å; R467-L547 WeakPolarHBondContact CD-O 3.27Å; R467-V548 WeakPolarHBondContact O-CA 3.32Å; R467-T549 PolarHBondContact NH1-OG1 2.88Å; R467-D557 IonicContact CZ-OD2 2.79Å; R467-D557 IonicContact NH1-OD2 2.65Å; R467-D557 PolarHBondContact NH1-OD2 3.14Å; R467-D557 IonicContact NH2-OD2 2.78Å
468	F	81.1	Confident	83.6	Confident	106 Å²	106	71.9 Å²	71.9	47%	0.465	35%	0.351	S	S	.	.	S	Bend	trans	-72.4	134.9	173.4	-77.5	-105.7	0	0	0	109.6	K465 D470 Y471 L472	K465-F468 HydrophobicContact CB-CD2 3.66Å; K465-F468 HydrophobicContact CB-CE2 4.01Å; K465-F468 HydrophobicContact CB-CG 4.44Å; K465-F468 HydrophobicContact CD-CD2 4.41Å; K465-F468 HydrophobicContact CD-CE2 4.25Å; K465-F468 HydrophobicContact CG-CD2 3.98Å; K465-F468 HydrophobicContact CG-CE2 3.8Å; K465-F468 WeakPolarHBondContact O-CB 3.26Å; K465-F468 WeakPolarHBondContact O-CD2 3.49Å; K465-F468 PolarHBondContact O-N 3.43Å; K465-F468 VanDerWaalsContact O-N 3.12Å; F468-D470 PolarHBondContact O-N 2.84Å; F468-Y471 PolarHBondContact O-N 3.42Å; F468-L472 PolarHBondContact O-N 3.4Å
469	R	78.3	Confident	83.4	Confident	99 Å²	99	71.9 Å²	71.9	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-46.2	-57.8	-173.6	-167.8	177.2	-179	-61.9	-20.9	112.9	Y471 L472 E473 V548	R469-Y471 PolarHBondContact O-N 2.98Å; R469-L472 PolarHBondContact O-N 3.19Å; R469-L472 VanDerWaalsContact O-N 3.14Å; R469-E473 IonicContact CZ-OE1 3.95Å; R469-E473 IonicContact CZ-OE2 2.63Å; R469-E473 VanDerWaalsContact NH1-CD 3.31Å; R469-E473 IonicContact NH1-OE1 2.7Å; R469-E473 PolarHBondContact NH1-OE1 3.25Å; R469-E473 IonicContact NH1-OE2 3.45Å; R469-E473 PolarHBondContact NH1-OE2 3.41Å; R469-E473 IonicContact NH2-OE1 2.68Å; R469-E473 PolarHBondContact NH2-OE1 3.44Å; R469-E473 IonicContact NH2-OE2 2.68Å; R469-E473 VanDerWaalsContact O-CB 3.29Å; R469-E473 WeakPolarHBondContact O-CB 3.32Å; R469-E473 PolarHBondContact O-N 3.2Å; R469-V548 HydrophobicContact CB-CG1 4.02Å; R469-V548 HydrophobicContact CB-CG2 4Å; R469-V548 HydrophobicContact CG-CG2 4.14Å
470	D	80.6	Confident	83.2	Confident	124 Å²	124	71.9 Å²	71.9	66%	0.663	35%	0.351	S	S	*	.	H	α-helix	trans	-63.1	-28.5	-174.5	-35.1	-32.9	0	0	0	113.3	F468 A474	F468-D470 PolarHBondContact O-N 2.84Å; D470-A474 WeakPolarHBondContact O-CB 3.3Å
471	Y	83.9	Confident	83.3	Confident	75 Å²	75	73 Å²	73	29%	0.294	35%	0.346	S	S	.	.	H	α-helix	trans	-81.2	-42.5	175.4	-177.5	-86.1	0	0	0	111.4	F461 W466 F468 R469 A474 N475	F461-Y471 PolarHBondContact O-OH 3.3Å; W466-Y471 HydrophobicContact CB-CD1 4.27Å; W466-Y471 HydrophobicContact CB-CE1 4.04Å; F468-Y471 PolarHBondContact O-N 3.42Å; R469-Y471 PolarHBondContact O-N 2.98Å; Y471-A474 PolarHBondContact O-N 2.8Å; Y471-N475 HydrophobicContact CE1-CB 4.47Å; Y471-N475 WeakPolarHBondContact O-CB 3.33Å; Y471-N475 PolarHBondContact O-N 2.92Å; Y471-N475 PolarHBondContact O-ND2 3.19Å
472	L	82.7	Confident	83.6	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-66.2	-45.6	-179.8	-172.2	63.4	0	0	0	110.8	F468 R469 A474 N475 I476 I479 L547 V548	F468-L472 PolarHBondContact O-N 3.4Å; R469-L472 PolarHBondContact O-N 3.19Å; R469-L472 VanDerWaalsContact O-N 3.14Å; L472-A474 VanDerWaalsContact C-N 3.29Å; L472-A474 PolarHBondContact O-N 3.25Å; L472-N475 CarbonylContact O-C 3.56Å; L472-N475 PolarHBondContact O-N 3.09Å; L472-I476 WeakPolarHBondContact O-CB 3.49Å; L472-I476 PolarHBondContact O-N 2.96Å; L472-I479 HydrophobicContact CD1-CD1 3.76Å; L472-L547 HydrophobicContact CD2-CB 3.61Å; L472-V548 HydrophobicContact CD2-CG2 3.96Å
473	E	83.5	Confident	83.9	Confident	90 Å²	90	71.2 Å²	71.2	42%	0.421	34%	0.339	S	S	.	.	H	α-helix	trans	-54.9	-42.3	176.2	-169	160.9	-129.2	0	0	111.9	R469 N475 L544	R469-E473 IonicContact CZ-OE1 3.95Å; R469-E473 IonicContact CZ-OE2 2.63Å; R469-E473 VanDerWaalsContact NH1-CD 3.31Å; R469-E473 IonicContact NH1-OE1 2.7Å; R469-E473 PolarHBondContact NH1-OE1 3.25Å; R469-E473 IonicContact NH1-OE2 3.45Å; R469-E473 PolarHBondContact NH1-OE2 3.41Å; R469-E473 IonicContact NH2-OE1 2.68Å; R469-E473 PolarHBondContact NH2-OE1 3.44Å; R469-E473 IonicContact NH2-OE2 2.68Å; R469-E473 VanDerWaalsContact O-CB 3.29Å; R469-E473 WeakPolarHBondContact O-CB 3.32Å; R469-E473 PolarHBondContact O-N 3.2Å; E473-N475 VanDerWaalsContact C-N 3.31Å; E473-N475 PolarHBondContact O-N 3.04Å; E473-L544 HydrophobicContact CB-CD2 3.55Å; E473-L544 HydrophobicContact CG-CD2 3.62Å
474	A	86.3	Confident	84.5	Confident	82 Å²	82	71.8 Å²	71.8	68%	0.678	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-10.9	177.7	0	0	0	0	0	115.2	D470 Y471 L472	D470-A474 WeakPolarHBondContact O-CB 3.3Å; Y471-A474 PolarHBondContact O-N 2.8Å; L472-A474 VanDerWaalsContact C-N 3.29Å; L472-A474 PolarHBondContact O-N 3.25Å
475	N	86.4	Confident	85.3	Confident	33 Å²	33	63.9 Å²	63.9	18%	0.176	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	-0.8	-173.9	-69.5	-88.6	0	0	0	114.2	F461 Y471 L472 E473 D477 A478 I479	F461-N475 HydrophobicContact CD1-CB 4.02Å; F461-N475 WeakPolarHBondContact CD1-OD1 3.37Å; F461-N475 HydrophobicContact CE1-CB 4.49Å; F461-N475 WeakPolarHBondContact CE1-OD1 3.23Å; Y471-N475 HydrophobicContact CE1-CB 4.47Å; Y471-N475 WeakPolarHBondContact O-CB 3.33Å; Y471-N475 PolarHBondContact O-N 2.92Å; Y471-N475 PolarHBondContact O-ND2 3.19Å; L472-N475 CarbonylContact O-C 3.56Å; L472-N475 PolarHBondContact O-N 3.09Å; E473-N475 VanDerWaalsContact C-N 3.31Å; E473-N475 PolarHBondContact O-N 3.04Å; N475-D477 PolarHBondContact O-N 2.88Å; N475-A478 WeakPolarHBondContact O-CA 3.42Å; N475-A478 WeakPolarHBondContact O-CB 3.39Å; N475-A478 PolarHBondContact O-N 2.82Å; N475-I479 HydrophobicContact CB-CD1 4.26Å; N475-I479 WeakPolarHBondContact O-CG1 3.41Å; N475-I479 PolarHBondContact O-N 3.46Å
476	I	85.8	Confident	86.4	Confident	21 Å²	21	57.5 Å²	57.5	11%	0.108	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-42.9	-171.1	-156.8	161.1	0	0	0	112.4	L472 A478 I479 H480 W542 L544 L547	L472-I476 WeakPolarHBondContact O-CB 3.49Å; L472-I476 PolarHBondContact O-N 2.96Å; I476-A478 PolarHBondContact O-N 3.38Å; I476-I479 PolarHBondContact O-N 3.07Å; I476-H480 WeakPolarHBondContact O-CB 3.38Å; I476-H480 PolarHBondContact O-N 3.17Å; I476-W542 HydrophobicContact CD1-CB 3.97Å; I476-W542 HydrophobicContact CD1-CE3 4.44Å; I476-W542 WeakPolarHBondContact CD1-O 3.46Å; I476-W542 HydrophobicContact CG1-CB 4.4Å; I476-W542 HydrophobicContact CG1-CE3 4.03Å; I476-L544 HydrophobicContact CD1-CD1 3.92Å; I476-L544 HydrophobicContact CD1-CG 4.26Å; I476-L547 HydrophobicContact CD1-CD1 4.4Å
477	D	86.9	Confident	87.1	Confident	116 Å²	116	57.2 Å²	57.2	62%	0.62	28%	0.28	S	S	*	.	H	α-helix	trans	-66.1	-24.6	174.8	-57	-38.9	0	0	0	113.4	N475 R481	N475-D477 PolarHBondContact O-N 2.88Å; D477-R481 WeakPolarHBondContact O-CG 3.47Å; D477-R481 PolarHBondContact O-N 3.44Å; D477-R481 PolarHBondContact O-NE 2.86Å; D477-R481 PolarHBondContact O-NH2 2.79Å
478	A	89.6	Confident	87.8	Confident	22 Å²	22	60.5 Å²	60.5	18%	0.182	30%	0.296	C	S	.	.	H	α-helix	trans	-83.9	-36	177.6	0	0	0	0	0	111.3	F461 N475 I476 S482	F461-A478 HydrophobicContact CE1-CB 3.71Å; F461-A478 HydrophobicContact CE2-CB 4.21Å; F461-A478 HydrophobicContact CZ-CB 3.55Å; N475-A478 WeakPolarHBondContact O-CA 3.42Å; N475-A478 WeakPolarHBondContact O-CB 3.39Å; N475-A478 PolarHBondContact O-N 2.82Å; I476-A478 PolarHBondContact O-N 3.38Å; A478-S482 VanDerWaalsContact O-CB 3.31Å; A478-S482 WeakPolarHBondContact O-CB 3.43Å; A478-S482 PolarHBondContact O-N 3.07Å; A478-S482 PolarHBondContact O-OG 2.88Å
479	I	89.3	Confident	88.4	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-45.9	170.8	-68	165.3	0	0	0	110	L458 F461 L472 N475 I476 S482 T483 W542 L559	L458-I479 HydrophobicContact CD1-CG2 4.01Å; F461-I479 HydrophobicContact CB-CD1 4.15Å; F461-I479 HydrophobicContact CB-CG1 3.74Å; F461-I479 HydrophobicContact CD2-CG1 4.29Å; F461-I479 HydrophobicContact CG-CG1 3.93Å; L472-I479 HydrophobicContact CD1-CD1 3.76Å; N475-I479 HydrophobicContact CB-CD1 4.26Å; N475-I479 WeakPolarHBondContact O-CG1 3.41Å; N475-I479 PolarHBondContact O-N 3.46Å; I476-I479 PolarHBondContact O-N 3.07Å; I479-S482 WeakPolarHBondContact O-CB 3.17Å; I479-S482 PolarHBondContact O-N 2.77Å; I479-T483 WeakPolarHBondContact O-CB 3.37Å; I479-T483 PolarHBondContact O-N 3.24Å; I479-T483 PolarHBondContact O-OG1 2.89Å; I479-W542 HydrophobicContact CG2-CH2 4.22Å; I479-W542 HydrophobicContact CG2-CZ3 3.88Å; I479-L559 HydrophobicContact CG2-CD1 4.39Å
480	H	87.8	Confident	89.2	Confident	45 Å²	45	50.7 Å²	50.7	21%	0.208	26%	0.256	C	S	.	.	H	α-helix	trans	-55.6	-58.4	176.8	-173.9	-89.8	0	0	0	111.5	I476 S482 T483 E484 D538 W542	I476-H480 WeakPolarHBondContact O-CB 3.38Å; I476-H480 PolarHBondContact O-N 3.17Å; H480-S482 PolarHBondContact O-N 3.27Å; H480-T483 CarbonylContact O-C 3.47Å; H480-T483 WeakPolarHBondContact O-CA 3.49Å; H480-T483 VanDerWaalsContact O-CB 3.24Å; H480-T483 WeakPolarHBondContact O-CB 3.25Å; H480-T483 PolarHBondContact O-N 3.41Å; H480-E484 VanDerWaalsContact CE1-CD 3.41Å; H480-E484 IonicContact CE1-OE1 3.74Å; H480-E484 PolarHBondContact CE1-OE1 3.43Å; H480-E484 IonicContact CE1-OE2 3.16Å; H480-E484 IonicContact ND1-OE2 2.71Å; H480-E484 WeakPolarHBondContact O-CG 3.33Å; H480-E484 PolarHBondContact O-N 3.26Å; H480-D538 IonicContact CD2-OD1 3.9Å; H480-D538 IonicContact NE2-OD1 2.76Å; H480-D538 PolarHBondContact NE2-OD1 2.81Å; H480-W542 AromaticContact CD2-CE2 3.59Å; H480-W542 AromaticContact CD2-CZ2 3.73Å; H480-W542 AromaticContact CD2-NE1 3.46Å; H480-W542 PolarHBondContact CD2-NE1 2.82Å; H480-W542 AromaticContact NE2-NE1 3.99Å
481	R	90.3	Very high	89.9	Confident	157 Å²	157	49.6 Å²	49.6	59%	0.592	24%	0.243	S	C	*	.	H	α-helix	trans	-58.8	-32.1	176.7	-73.3	176.7	-69.9	166.1	-2.9	113.6	D477 H485	D477-R481 WeakPolarHBondContact O-CG 3.47Å; D477-R481 PolarHBondContact O-N 3.44Å; D477-R481 PolarHBondContact O-NE 2.86Å; D477-R481 PolarHBondContact O-NH2 2.79Å; R481-H485 WeakPolarHBondContact O-CB 3.38Å; R481-H485 PolarHBondContact O-N 2.85Å
482	S	92.2	Very high	90.4	Very high	19 Å²	19	50 Å²	50	13%	0.133	25%	0.248	C	C	.	.	H	α-helix	trans	-68.6	-39.4	173.5	-59.8	0	0	0	0	111.8	A478 I479 H480 H485 I486	A478-S482 VanDerWaalsContact O-CB 3.31Å; A478-S482 WeakPolarHBondContact O-CB 3.43Å; A478-S482 PolarHBondContact O-N 3.07Å; A478-S482 PolarHBondContact O-OG 2.88Å; I479-S482 WeakPolarHBondContact O-CB 3.17Å; I479-S482 PolarHBondContact O-N 2.77Å; H480-S482 PolarHBondContact O-N 3.27Å; S482-H485 PolarHBondContact O-N 3Å; S482-I486 WeakPolarHBondContact O-CD1 3.45Å; S482-I486 VanDerWaalsContact O-CG1 3.26Å; S482-I486 WeakPolarHBondContact O-CG1 3.44Å; S482-I486 PolarHBondContact O-N 3.34Å
483	T	91.8	Very high	91	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.4	-44.3	172.9	-83.6	0	0	0	0	111.6	I479 H480 I486 E487 K534 F562	I479-T483 WeakPolarHBondContact O-CB 3.37Å; I479-T483 PolarHBondContact O-N 3.24Å; I479-T483 PolarHBondContact O-OG1 2.89Å; H480-T483 CarbonylContact O-C 3.47Å; H480-T483 WeakPolarHBondContact O-CA 3.49Å; H480-T483 VanDerWaalsContact O-CB 3.24Å; H480-T483 WeakPolarHBondContact O-CB 3.25Å; H480-T483 PolarHBondContact O-N 3.41Å; T483-I486 PolarHBondContact O-N 3.36Å; T483-E487 PolarHBondContact O-N 3.42Å; T483-K534 HydrophobicContact CG2-CB 4.25Å; T483-K534 HydrophobicContact CG2-CD 3.95Å; T483-K534 HydrophobicContact CG2-CG 4.04Å; T483-F562 HydrophobicContact CG2-CD2 4.43Å; T483-F562 HydrophobicContact CG2-CE1 4.19Å; T483-F562 HydrophobicContact CG2-CE2 3.65Å; T483-F562 HydrophobicContact CG2-CZ 3.52Å; T483-F562 WeakPolarHBondContact OG1-CE1 3.47Å; T483-F562 WeakPolarHBondContact OG1-CZ 3.41Å
484	E	92	Very high	91.5	Very high	77 Å²	77	46.1 Å²	46.1	36%	0.36	23%	0.23	S	C	.	.	H	α-helix	trans	-62.9	-46.6	174.8	-54.7	-157.2	113.2	0	0	112.2	H480 I486 E487 E488 K534	H480-E484 VanDerWaalsContact CE1-CD 3.41Å; H480-E484 IonicContact CE1-OE1 3.74Å; H480-E484 PolarHBondContact CE1-OE1 3.43Å; H480-E484 IonicContact CE1-OE2 3.16Å; H480-E484 IonicContact ND1-OE2 2.71Å; H480-E484 WeakPolarHBondContact O-CG 3.33Å; H480-E484 PolarHBondContact O-N 3.26Å; E484-I486 VanDerWaalsContact C-N 3.28Å; E484-I486 PolarHBondContact O-N 2.83Å; E484-E487 WeakPolarHBondContact O-CA 3.3Å; E484-E487 WeakPolarHBondContact O-CB 3.38Å; E484-E487 PolarHBondContact O-N 2.81Å; E484-E488 PolarHBondContact O-N 2.85Å; E484-K534 IonicContact OE1-NZ 3.61Å; E484-K534 PolarHBondContact OE1-NZ 3.24Å
485	H	93.3	Very high	91.8	Very high	83 Å²	83	46.2 Å²	46.2	38%	0.384	22%	0.219	S	C	.	.	H	α-helix	trans	-65.8	-30.2	-179.8	-168.2	-93.8	0	0	0	112.6	S454 R481 S482 S489	S454-H485 WeakPolarHBondContact CB-ND1 3.29Å; S454-H485 PolarHBondContact OG-CE1 2.97Å; S454-H485 PolarHBondContact OG-ND1 2.94Å; R481-H485 WeakPolarHBondContact O-CB 3.38Å; R481-H485 PolarHBondContact O-N 2.85Å; S482-H485 PolarHBondContact O-N 3Å; H485-S489 VanDerWaalsContact O-CB 3.27Å; H485-S489 WeakPolarHBondContact O-CB 3.43Å; H485-S489 PolarHBondContact O-N 3.27Å; H485-S489 PolarHBondContact O-OG 2.79Å
486	I	94.1	Very high	92.1	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.3	-47.9	168.1	-71.9	163.8	0	0	0	110.4	V455 L458 S482 T483 E484 E488 S489 V490 L530 F562 A566 L569	V455-I486 HydrophobicContact CG2-CD1 4.26Å; V455-I486 HydrophobicContact CG2-CG1 4.19Å; L458-I486 HydrophobicContact CB-CD1 3.66Å; L458-I486 HydrophobicContact CD2-CD1 3.55Å; L458-I486 HydrophobicContact CG-CD1 4.25Å; S482-I486 WeakPolarHBondContact O-CD1 3.45Å; S482-I486 VanDerWaalsContact O-CG1 3.26Å; S482-I486 WeakPolarHBondContact O-CG1 3.44Å; S482-I486 PolarHBondContact O-N 3.34Å; T483-I486 PolarHBondContact O-N 3.36Å; E484-I486 VanDerWaalsContact C-N 3.28Å; E484-I486 PolarHBondContact O-N 2.83Å; I486-E488 PolarHBondContact O-N 3.47Å; I486-S489 PolarHBondContact O-N 2.8Å; I486-V490 HydrophobicContact CG2-CG2 4.21Å; I486-V490 WeakPolarHBondContact O-CB 3.43Å; I486-V490 WeakPolarHBondContact O-CG2 3.41Å; I486-V490 PolarHBondContact O-N 2.95Å; I486-L530 HydrophobicContact CG2-CD1 4.49Å; I486-F562 HydrophobicContact CD1-CE1 4.36Å; I486-F562 HydrophobicContact CG2-CZ 4.5Å; I486-A566 HydrophobicContact CD1-CB 4.44Å; I486-L569 HydrophobicContact CG2-CD2 4.49Å
487	E	93.6	Very high	92.4	Very high	22 Å²	22	44.8 Å²	44.8	10%	0.103	21%	0.21	C	C	.	.	H	α-helix	trans	-56.3	-52.9	179.6	-163.8	-157.1	147.8	0	0	111.4	T483 E484 S489 V490 R491 Y527 K534	T483-E487 PolarHBondContact O-N 3.42Å; E484-E487 WeakPolarHBondContact O-CA 3.3Å; E484-E487 WeakPolarHBondContact O-CB 3.38Å; E484-E487 PolarHBondContact O-N 2.81Å; E487-S489 PolarHBondContact O-N 3.02Å; E487-V490 PolarHBondContact O-N 3.27Å; E487-R491 WeakPolarHBondContact O-CB 3.37Å; E487-R491 PolarHBondContact O-N 3.35Å; E487-R491 IonicContact OE1-CZ 3.3Å; E487-R491 IonicContact OE1-NH2 2.67Å; E487-R491 PolarHBondContact OE1-NH2 2.88Å; E487-Y527 HydrophobicContact CG-CE2 3.83Å; E487-Y527 WeakPolarHBondContact O-CE2 3.46Å; E487-K534 VanDerWaalsContact OE2-CD 3.3Å; E487-K534 WeakPolarHBondContact OE2-CD 3.37Å; E487-K534 IonicContact OE2-NZ 2.77Å; E487-K534 PolarHBondContact OE2-NZ 2.95Å
488	E	94.3	Very high	92.6	Very high	97 Å²	97	45.8 Å²	45.8	45%	0.453	21%	0.206	S	C	.	.	H	α-helix	trans	-60.2	-46	179.5	-67	-167.9	141.7	0	0	112.6	E484 I486 V490 R491 E492	E484-E488 PolarHBondContact O-N 2.85Å; I486-E488 PolarHBondContact O-N 3.47Å; E488-V490 VanDerWaalsContact C-N 3.27Å; E488-V490 PolarHBondContact O-N 2.8Å; E488-R491 WeakPolarHBondContact O-CB 3.24Å; E488-R491 PolarHBondContact O-N 2.85Å; E488-E492 WeakPolarHBondContact O-CG 3.49Å; E488-E492 PolarHBondContact O-N 2.68Å
489	S	95	Very high	92.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-35.7	-179.7	-59.2	0	0	0	0	112.5	K450 V451 S454 H485 I486 E487 F493	K450-S489 VanDerWaalsContact CE-OG 3.24Å; K450-S489 WeakPolarHBondContact CE-OG 3.42Å; K450-S489 WeakPolarHBondContact CG-OG 3.37Å; V451-S489 VanDerWaalsContact CG2-O 3.31Å; V451-S489 WeakPolarHBondContact CG2-O 3.31Å; S454-S489 PolarHBondContact OG-OG 3.23Å; H485-S489 VanDerWaalsContact O-CB 3.27Å; H485-S489 WeakPolarHBondContact O-CB 3.43Å; H485-S489 PolarHBondContact O-N 3.27Å; H485-S489 PolarHBondContact O-OG 2.79Å; I486-S489 PolarHBondContact O-N 2.8Å; E487-S489 PolarHBondContact O-N 3.02Å; S489-F493 PolarHBondContact O-N 2.76Å
490	V	94.7	Very high	92.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-80.6	-32.5	-179.8	179.2	0	0	0	0	110.9	V451 I486 E487 E488 F493 L494 Y527 L569	V451-V490 HydrophobicContact CG1-CG2 3.71Å; V451-V490 HydrophobicContact CG2-CG2 3.94Å; I486-V490 HydrophobicContact CG2-CG2 4.21Å; I486-V490 WeakPolarHBondContact O-CB 3.43Å; I486-V490 WeakPolarHBondContact O-CG2 3.41Å; I486-V490 PolarHBondContact O-N 2.95Å; E487-V490 PolarHBondContact O-N 3.27Å; E488-V490 VanDerWaalsContact C-N 3.27Å; E488-V490 PolarHBondContact O-N 2.8Å; V490-F493 PolarHBondContact O-N 3.03Å; V490-L494 HydrophobicContact CG1-CD1 4.2Å; V490-L494 HydrophobicContact CG1-CG 4.5Å; V490-L494 WeakPolarHBondContact O-CB 3.34Å; V490-L494 WeakPolarHBondContact O-CG 3.24Å; V490-L494 PolarHBondContact O-N 3.39Å; V490-Y527 HydrophobicContact CB-CD2 3.91Å; V490-Y527 HydrophobicContact CB-CE2 4.32Å; V490-Y527 HydrophobicContact CG1-CD2 3.5Å; V490-Y527 VanDerWaalsContact CG1-CD2 3.5Å; V490-Y527 HydrophobicContact CG1-CE2 4.33Å; V490-Y527 HydrophobicContact CG1-CG 4.15Å; V490-L569 HydrophobicContact CB-CD2 4.3Å; V490-L569 HydrophobicContact CG1-CD2 4.06Å; V490-L569 HydrophobicContact CG2-CD2 3.27Å; V490-L569 HydrophobicContact CG2-CG 4.3Å
491	R	94.9	Very high	92.4	Very high	100 Å²	100	44.9 Å²	44.9	38%	0.377	20%	0.201	S	C	.	.	H	α-helix	trans	-61.2	-50.4	171.7	-165	-168.8	-60	156.8	-5	111	E487 E488 F493 L494 D495 Y527	E487-R491 WeakPolarHBondContact O-CB 3.37Å; E487-R491 PolarHBondContact O-N 3.35Å; E487-R491 IonicContact OE1-CZ 3.3Å; E487-R491 IonicContact OE1-NH2 2.67Å; E487-R491 PolarHBondContact OE1-NH2 2.88Å; E488-R491 WeakPolarHBondContact O-CB 3.24Å; E488-R491 PolarHBondContact O-N 2.85Å; R491-F493 VanDerWaalsContact C-N 3.33Å; R491-F493 PolarHBondContact O-N 3.28Å; R491-L494 PolarHBondContact O-N 3.29Å; R491-L494 VanDerWaalsContact O-N 3.16Å; R491-D495 PolarHBondContact O-N 2.87Å; R491-Y527 HydrophobicContact CB-CE2 4.2Å; R491-Y527 PolarHBondContact NE-OH 3.21Å
492	E	94.8	Very high	92.2	Very high	84 Å²	84	38.8 Å²	38.8	39%	0.393	19%	0.187	S	C	.	.	H	α-helix	trans	-57.1	-44.6	174.1	-73.4	173.8	-167.7	0	0	112.3	L447 K450 E488 D495 F496	L447-E492 HydrophobicContact CD2-CB 3.8Å; K450-E492 WeakPolarHBondContact CD-OE2 3.42Å; K450-E492 WeakPolarHBondContact CE-OE2 3.36Å; K450-E492 IonicContact NZ-OE1 3.77Å; K450-E492 PolarHBondContact NZ-OE1 2.68Å; K450-E492 IonicContact NZ-OE2 3.28Å; K450-E492 PolarHBondContact NZ-OE2 3.2Å; E488-E492 WeakPolarHBondContact O-CG 3.49Å; E488-E492 PolarHBondContact O-N 2.68Å; E492-D495 PolarHBondContact O-N 2.96Å; E492-F496 PolarHBondContact O-N 3.34Å; E492-F496 VanDerWaalsContact O-N 3.08Å
493	F	95.3	Very high	91.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-42.5	175.8	178.4	-88.4	0	0	0	112.2	L447 V451 S489 V490 R491 F496 A497 I523 I573 F576	L447-F493 HydrophobicContact CB-CB 4.47Å; L447-F493 HydrophobicContact CB-CD2 3.97Å; V451-F493 HydrophobicContact CG2-CB 4.4Å; S489-F493 PolarHBondContact O-N 2.76Å; V490-F493 PolarHBondContact O-N 3.03Å; R491-F493 VanDerWaalsContact C-N 3.33Å; R491-F493 PolarHBondContact O-N 3.28Å; F493-F496 PolarHBondContact O-N 3.48Å; F493-A497 HydrophobicContact CE1-CB 4.25Å; F493-A497 VanDerWaalsContact O-CB 3.27Å; F493-A497 WeakPolarHBondContact O-CB 3.47Å; F493-A497 PolarHBondContact O-N 2.75Å; F493-I523 HydrophobicContact CD1-CG2 4.4Å; F493-I523 HydrophobicContact CE1-CD1 3.75Å; F493-I523 HydrophobicContact CE1-CG2 4.38Å; F493-I523 HydrophobicContact CZ-CD1 4.36Å; F493-I573 HydrophobicContact CD1-CD1 4.25Å; F493-I573 HydrophobicContact CD1-CG1 3.94Å; F493-I573 HydrophobicContact CD2-CG2 4.01Å; F493-I573 HydrophobicContact CE1-CB 4.44Å; F493-I573 HydrophobicContact CE1-CG1 3.79Å; F493-I573 HydrophobicContact CE1-CG2 4.41Å; F493-I573 HydrophobicContact CE2-CB 4.49Å; F493-I573 HydrophobicContact CE2-CG2 3.65Å; F493-I573 HydrophobicContact CG-CD1 4.4Å; F493-I573 HydrophobicContact CG-CG1 4.38Å; F493-I573 HydrophobicContact CZ-CB 4.22Å; F493-I573 HydrophobicContact CZ-CG1 4.07Å; F493-I573 HydrophobicContact CZ-CG2 3.85Å; F493-F576 HydrophobicContact CE1-CD1 4.19Å; F493-F576 HydrophobicContact CE1-CG 4.43Å; F493-F576 HydrophobicContact CE2-CD1 4.32Å; F493-F576 HydrophobicContact CZ-CB 4.09Å; F493-F576 AromaticContact CZ-CD1 3.49Å; F493-F576 HydrophobicContact CZ-CD1 3.49Å; F493-F576 VanDerWaalsContact CZ-CD1 3.49Å; F493-F576 HydrophobicContact CZ-CE1 4.19Å; F493-F576 AromaticContact CZ-CG 3.99Å; F493-F576 HydrophobicContact CZ-CG 3.99Å
494	L	93.8	Very high	91.5	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.052	19%	0.185	C	C	.	.	H	α-helix	trans	-67.7	-35.9	179	-83.5	172.2	0	0	0	112.6	V490 R491 A497 R498 I523 Y527	V490-L494 HydrophobicContact CG1-CD1 4.2Å; V490-L494 HydrophobicContact CG1-CG 4.5Å; V490-L494 WeakPolarHBondContact O-CB 3.34Å; V490-L494 WeakPolarHBondContact O-CG 3.24Å; V490-L494 PolarHBondContact O-N 3.39Å; R491-L494 PolarHBondContact O-N 3.29Å; R491-L494 VanDerWaalsContact O-N 3.16Å; L494-A497 PolarHBondContact O-N 3.2Å; L494-R498 VanDerWaalsContact O-CB 3.26Å; L494-R498 WeakPolarHBondContact O-CB 3.47Å; L494-R498 PolarHBondContact O-N 3.2Å; L494-I523 HydrophobicContact CD2-CB 4.28Å; L494-I523 HydrophobicContact CD2-CG2 3.86Å; L494-I523 HydrophobicContact CG-CG2 4.22Å; L494-Y527 HydrophobicContact CD1-CD1 3.83Å; L494-Y527 HydrophobicContact CD1-CD2 4.16Å; L494-Y527 HydrophobicContact CD1-CG 3.57Å
495	D	92.9	Very high	90.9	Very high	84 Å²	84	37.6 Å²	37.6	45%	0.449	19%	0.185	S	C	.	.	H	α-helix	trans	-72.3	-35.3	176.7	-73.2	-29	0	0	0	112.4	R491 E492 R498 G499	R491-D495 PolarHBondContact O-N 2.87Å; E492-D495 PolarHBondContact O-N 2.96Å; D495-R498 IonicContact OD1-CZ 2.96Å; D495-R498 IonicContact OD1-NE 2.68Å; D495-R498 PolarHBondContact OD1-NE 2.95Å; D495-R498 VanDerWaalsContact OD1-NE 3.16Å; D495-R498 IonicContact OD1-NH2 3.7Å; D495-R498 PolarHBondContact OD1-NH2 2.92Å; D495-G499 PolarHBondContact O-N 2.99Å
496	F	92.9	Very high	90.3	Very high	22 Å²	22	39.1 Å²	39.1	10%	0.096	20%	0.197	C	C	.	.	H	α-helix	trans	-61.7	-49.1	165.7	177.4	-88.3	0	0	0	111.5	L435 T443 V444 L447 E492 F493 R498 G499 V500	L435-F496 HydrophobicContact CD2-CE2 3.85Å; T443-F496 WeakPolarHBondContact OG1-CE2 3.37Å; V444-F496 HydrophobicContact CG2-CD1 4.21Å; V444-F496 HydrophobicContact CG2-CE1 3.26Å; V444-F496 HydrophobicContact CG2-CZ 3.6Å; L447-F496 HydrophobicContact CD1-CB 3.59Å; L447-F496 HydrophobicContact CD1-CD1 4.33Å; L447-F496 HydrophobicContact CD1-CD2 4.23Å; L447-F496 HydrophobicContact CD1-CG 3.77Å; E492-F496 PolarHBondContact O-N 3.34Å; E492-F496 VanDerWaalsContact O-N 3.08Å; F493-F496 PolarHBondContact O-N 3.48Å; F496-R498 VanDerWaalsContact C-N 3.29Å; F496-R498 PolarHBondContact O-N 2.87Å; F496-G499 PolarHBondContact O-N 3.39Å; F496-G499 VanDerWaalsContact O-N 3.08Å; F496-V500 HydrophobicContact CD1-CG2 4.03Å; F496-V500 HydrophobicContact CE1-CG2 3.36Å; F496-V500 HydrophobicContact CE2-CG2 4.3Å; F496-V500 HydrophobicContact CZ-CG2 3.53Å; F496-V500 PolarHBondContact O-N 2.7Å
497	A	91.9	Very high	89.7	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-60.3	-37.4	-179.4	0	0	0	0	0	112.6	F493 L494 V500 H501 F576	F493-A497 HydrophobicContact CE1-CB 4.25Å; F493-A497 VanDerWaalsContact O-CB 3.27Å; F493-A497 WeakPolarHBondContact O-CB 3.47Å; F493-A497 PolarHBondContact O-N 2.75Å; L494-A497 PolarHBondContact O-N 3.2Å; A497-V500 PolarHBondContact O-N 2.87Å; A497-H501 WeakPolarHBondContact O-CB 3.48Å; A497-H501 PolarHBondContact O-N 3.49Å; A497-F576 HydrophobicContact CB-CD1 4.47Å; A497-F576 HydrophobicContact CB-CE1 3.66Å; A497-F576 HydrophobicContact CB-CE2 4.04Å; A497-F576 HydrophobicContact CB-CZ 3.42Å; A497-F576 VanDerWaalsContact CB-CZ 3.42Å
498	R	91.1	Very high	89	Confident	138 Å²	138	47.7 Å²	47.7	52%	0.521	25%	0.249	S	C	.	.	H	α-helix	trans	-62.6	-40.6	174.2	-165.2	-167.6	-42.3	-73.6	-1.6	111.7	L494 D495 F496 H501 G502	L494-R498 VanDerWaalsContact O-CB 3.26Å; L494-R498 WeakPolarHBondContact O-CB 3.47Å; L494-R498 PolarHBondContact O-N 3.2Å; D495-R498 IonicContact OD1-CZ 2.96Å; D495-R498 IonicContact OD1-NE 2.68Å; D495-R498 PolarHBondContact OD1-NE 2.95Å; D495-R498 VanDerWaalsContact OD1-NE 3.16Å; D495-R498 IonicContact OD1-NH2 3.7Å; D495-R498 PolarHBondContact OD1-NH2 2.92Å; F496-R498 VanDerWaalsContact C-N 3.29Å; F496-R498 PolarHBondContact O-N 2.87Å; R498-H501 PolarHBondContact O-N 3Å; R498-G502 PolarHBondContact O-N 3.03Å
499	G	87.9	Confident	88.6	Confident	12 Å²	12	46 Å²	46	12%	0.124	24%	0.243	C	C	.	.	H	α-helix	trans	-63.5	-46.3	172.9	0	0	0	0	0	112.5	D495 F496 H501 G502 T503	D495-G499 PolarHBondContact O-N 2.99Å; F496-G499 PolarHBondContact O-N 3.39Å; F496-G499 VanDerWaalsContact O-N 3.08Å; G499-H501 VanDerWaalsContact C-N 3.35Å; G499-H501 PolarHBondContact O-N 2.66Å; G499-G502 WeakPolarHBondContact O-CA 3.38Å; G499-G502 PolarHBondContact O-N 3.18Å; G499-G502 VanDerWaalsContact O-N 3.13Å; G499-T503 PolarHBondContact O-N 2.85Å; G499-T503 PolarHBondContact O-OG1 2.96Å
500	V	87.7	Confident	88.2	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.7	-37.4	176	-179.7	0	0	0	0	112.2	F496 A497 G502 T503 A504 V580 L587 F588	F496-V500 HydrophobicContact CD1-CG2 4.03Å; F496-V500 HydrophobicContact CE1-CG2 3.36Å; F496-V500 HydrophobicContact CE2-CG2 4.3Å; F496-V500 HydrophobicContact CZ-CG2 3.53Å; F496-V500 PolarHBondContact O-N 2.7Å; A497-V500 PolarHBondContact O-N 2.87Å; V500-G502 VanDerWaalsContact C-N 3.34Å; V500-T503 PolarHBondContact O-N 2.74Å; V500-A504 VanDerWaalsContact O-CB 3.32Å; V500-A504 WeakPolarHBondContact O-CB 3.08Å; V500-A504 PolarHBondContact O-N 3.18Å; V500-V580 HydrophobicContact CG1-CG1 4.17Å; V500-V580 HydrophobicContact CG1-CG2 3.89Å; V500-L587 HydrophobicContact CG1-CD1 4.15Å; V500-L587 HydrophobicContact CG1-CD2 4.22Å; V500-F588 HydrophobicContact CG1-CZ 4.27Å; V500-F588 HydrophobicContact CG2-CE1 4.38Å; V500-F588 HydrophobicContact CG2-CZ 3.89Å
501	H	86.9	Confident	87.9	Confident	37 Å²	37	54.1 Å²	54.1	17%	0.171	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-40.4	171.5	177.3	-83.4	0	0	0	111.7	A497 R498 G499 T503 A504 C505 I516 R517 M520	A497-H501 WeakPolarHBondContact O-CB 3.48Å; A497-H501 PolarHBondContact O-N 3.49Å; R498-H501 PolarHBondContact O-N 3Å; G499-H501 VanDerWaalsContact C-N 3.35Å; G499-H501 PolarHBondContact O-N 2.66Å; H501-T503 PolarHBondContact O-N 2.68Å; H501-A504 WeakPolarHBondContact O-CB 3.44Å; H501-A504 PolarHBondContact O-N 3.39Å; H501-C505 VanDerWaalsContact CE1-SG 3.53Å; H501-C505 PolarHBondContact O-N 3.35Å; H501-C505 PolarHBondContact O-SG 3.25Å; H501-C505 VanDerWaalsContact O-SG 3.38Å; H501-I516 HydrophobicContact CB-CG2 4.22Å; H501-R517 WeakPolarHBondContact NE2-CB 3.17Å; H501-M520 HydrophobicContact CB-CE 4Å; H501-M520 HydrophobicContact CB-SD 3.67Å; H501-M520 VanDerWaalsContact CD2-CE 3.46Å; H501-M520 WeakPolarHBondContact CD2-CE 3.26Å
502	G	86.2	Confident	87.6	Confident	29 Å²	29	49.4 Å²	49.4	30%	0.299	27%	0.273	S	S	.	.	H	α-helix	trans	-55.3	-49.7	172.3	0	0	0	0	0	112.3	R498 G499 V500 A504 C505	R498-G502 PolarHBondContact O-N 3.03Å; G499-G502 WeakPolarHBondContact O-CA 3.38Å; G499-G502 PolarHBondContact O-N 3.18Å; G499-G502 VanDerWaalsContact O-N 3.13Å; V500-G502 VanDerWaalsContact C-N 3.34Å; G502-A504 VanDerWaalsContact C-N 3.35Å; G502-A504 PolarHBondContact O-N 3.06Å; G502-C505 PolarHBondContact O-N 3.39Å
503	T	84.3	Confident	87.4	Confident	16 Å²	16	48 Å²	48	10%	0.098	27%	0.267	C	S	.	.	H	α-helix	trans	-67.2	-34.3	175.7	-43.9	0	0	0	0	112.3	G499 V500 H501 C505 N506 L587	G499-T503 PolarHBondContact O-N 2.85Å; G499-T503 PolarHBondContact O-OG1 2.96Å; V500-T503 PolarHBondContact O-N 2.74Å; H501-T503 PolarHBondContact O-N 2.68Å; T503-C505 VanDerWaalsContact C-N 3.32Å; T503-C505 PolarHBondContact O-N 3.22Å; T503-N506 WeakPolarHBondContact O-CB 3.27Å; T503-N506 PolarHBondContact O-N 2.85Å; T503-N506 VanDerWaalsContact O-N 3.16Å; T503-L587 WeakPolarHBondContact CG2-O 3.26Å
504	A	83.9	Confident	87.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.7	-29.6	176.4	0	0	0	0	0	113.5	V500 H501 G502 N506 L507 I516 L587	V500-A504 VanDerWaalsContact O-CB 3.32Å; V500-A504 WeakPolarHBondContact O-CB 3.08Å; V500-A504 PolarHBondContact O-N 3.18Å; H501-A504 WeakPolarHBondContact O-CB 3.44Å; H501-A504 PolarHBondContact O-N 3.39Å; G502-A504 VanDerWaalsContact C-N 3.35Å; G502-A504 PolarHBondContact O-N 3.06Å; A504-N506 PolarHBondContact O-N 3.26Å; A504-L507 WeakPolarHBondContact O-CB 3.31Å; A504-L507 PolarHBondContact O-N 3.1Å; A504-I516 HydrophobicContact CB-CD1 3.77Å; A504-I516 HydrophobicContact CB-CG2 4.41Å; A504-L587 HydrophobicContact CB-CD2 3.64Å
505	C	80.3	Confident	86.9	Confident	54 Å²	54	56.5 Å²	56.5	37%	0.365	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.5	173.5	-72.6	0	0	0	0	113.8	H501 G502 T503 L507 Q513	H501-C505 VanDerWaalsContact CE1-SG 3.53Å; H501-C505 PolarHBondContact O-N 3.35Å; H501-C505 PolarHBondContact O-SG 3.25Å; H501-C505 VanDerWaalsContact O-SG 3.38Å; G502-C505 PolarHBondContact O-N 3.39Å; T503-C505 VanDerWaalsContact C-N 3.32Å; T503-C505 PolarHBondContact O-N 3.22Å; C505-L507 VanDerWaalsContact C-N 3.31Å; C505-Q513 PolarHBondContact SG-NE2 2.8Å
506	N	79.9	Confident	86.9	Confident	116 Å²	116	52.5 Å²	52.5	62%	0.62	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	2.3	176.6	-61.4	-16.8	0	0	0	112.7	T503 A504	T503-N506 WeakPolarHBondContact O-CB 3.27Å; T503-N506 PolarHBondContact O-N 2.85Å; T503-N506 VanDerWaalsContact O-N 3.16Å; A504-N506 PolarHBondContact O-N 3.26Å
507	L	80.7	Confident	86.8	Confident	47 Å²	47	55.8 Å²	55.8	25%	0.246	29%	0.293	C	S	.	.	S	Bend	trans	-92.1	151.1	179.3	-58.1	-176.6	0	0	0	112.3	A504 C505 L512 L586 L587	A504-L507 WeakPolarHBondContact O-CB 3.31Å; A504-L507 PolarHBondContact O-N 3.1Å; C505-L507 VanDerWaalsContact C-N 3.31Å; L507-L512 HydrophobicContact CD1-CD2 3.87Å; L507-L586 HydrophobicContact CD1-CB 4.23Å; L507-L586 VanDerWaalsContact CD2-O 3.3Å; L507-L586 WeakPolarHBondContact CD2-O 3.23Å; L507-L587 HydrophobicContact CD1-CD2 3.79Å; L507-L587 HydrophobicContact CD1-CG 4.35Å
508	T	80.1	Confident	86.8	Confident	155 Å²	155	59.3 Å²	59.3	95%	0.951	31%	0.312	S	S	*	.	S	Bend	trans	-79.7	-12.8	178	48.4	0	0	0	0	114.3	S510	T508-S510 PolarHBondContact O-N 3.06Å
509	D	85.3	Confident	87	Confident	61 Å²	61	54.9 Å²	54.9	33%	0.326	30%	0.297	S	S	.	.			trans	-90.3	96.9	176.4	-177.4	17.1	0	0	0	111.9	N511 L512 Q513	D509-N511 PolarHBondContact O-N 3.22Å; D509-N511 VanDerWaalsContact OD1-CB 3.26Å; D509-N511 WeakPolarHBondContact OD1-CB 3.1Å; D509-N511 PolarHBondContact OD1-N 3.09Å; D509-N511 PolarHBondContact OD1-ND2 3.12Å; D509-L512 HydrophobicContact CB-CB 4.16Å; D509-L512 PolarHBondContact O-N 3.34Å; D509-L512 VanDerWaalsContact OD2-CB 3.31Å; D509-L512 WeakPolarHBondContact OD2-CB 3.45Å; D509-L512 PolarHBondContact OD2-N 3.02Å; D509-Q513 PolarHBondContact O-N 2.96Å
510	S	87.1	Confident	87.2	Confident	64 Å²	64	55.7 Å²	55.7	45%	0.448	30%	0.298	S	S	.	.	H	α-helix	trans	-60.9	-24	174.1	57.7	0	0	0	0	113.5	T508 N514	T508-S510 PolarHBondContact O-N 3.06Å; S510-N514 VanDerWaalsContact O-CB 3.23Å; S510-N514 WeakPolarHBondContact O-CB 3.44Å; S510-N514 PolarHBondContact O-N 3.27Å; S510-N514 PolarHBondContact O-ND2 2.99Å
511	N	88.4	Confident	87.5	Confident	106 Å²	106	60.1 Å²	60.1	57%	0.567	32%	0.318	S	S	*	.	H	α-helix	trans	-72.9	-41.7	177.4	-53.5	-85.6	0	0	0	111.1	D509 R515	D509-N511 PolarHBondContact O-N 3.22Å; D509-N511 VanDerWaalsContact OD1-CB 3.26Å; D509-N511 WeakPolarHBondContact OD1-CB 3.1Å; D509-N511 PolarHBondContact OD1-N 3.09Å; D509-N511 PolarHBondContact OD1-ND2 3.12Å; N511-R515 WeakPolarHBondContact O-CB 3.5Å; N511-R515 VanDerWaalsContact O-CG 3.23Å; N511-R515 WeakPolarHBondContact O-CG 3.24Å; N511-R515 PolarHBondContact O-N 3.31Å
512	L	88.6	Confident	87.8	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-65.5	-45.3	172.8	179.4	58.5	0	0	0	111.2	L507 D509 N514 R515 I516 I579 N583 L586	L507-L512 HydrophobicContact CD1-CD2 3.87Å; D509-L512 HydrophobicContact CB-CB 4.16Å; D509-L512 PolarHBondContact O-N 3.34Å; D509-L512 VanDerWaalsContact OD2-CB 3.31Å; D509-L512 WeakPolarHBondContact OD2-CB 3.45Å; D509-L512 PolarHBondContact OD2-N 3.02Å; L512-N514 PolarHBondContact O-N 3.25Å; L512-R515 PolarHBondContact O-N 3.29Å; L512-I516 HydrophobicContact CD1-CD1 3.74Å; L512-I516 HydrophobicContact CD1-CG1 4.08Å; L512-I516 HydrophobicContact CG-CD1 3.88Å; L512-I516 WeakPolarHBondContact O-CG1 3.43Å; L512-I516 PolarHBondContact O-N 2.87Å; L512-I579 HydrophobicContact CD1-CG2 4.02Å; L512-N583 HydrophobicContact CD1-CB 3.88Å; L512-N583 VanDerWaalsContact CD1-CG 3.44Å; L512-N583 HydrophobicContact CD2-CB 3.75Å; L512-N583 HydrophobicContact CG-CB 4.5Å; L512-L586 HydrophobicContact CD2-CD1 4.16Å
513	Q	89.3	Confident	88.2	Confident	55 Å²	55	59.4 Å²	59.4	26%	0.257	31%	0.311	S	S	.	.	H	α-helix	trans	-56.7	-49.2	175.4	-169.9	-166.9	22.1	0	0	111.3	C505 D509 I516 R517	C505-Q513 PolarHBondContact SG-NE2 2.8Å; D509-Q513 PolarHBondContact O-N 2.96Å; Q513-I516 PolarHBondContact O-N 3.47Å; Q513-R517 WeakPolarHBondContact O-CB 3.28Å; Q513-R517 PolarHBondContact O-N 3.26Å
514	N	89.3	Confident	88.7	Confident	56 Å²	56	60.7 Å²	60.7	30%	0.299	32%	0.321	S	S	.	.	H	α-helix	trans	-55.4	-53.7	175	-74.8	-28.2	0	0	0	111	S510 L512 I516 R517 D518	S510-N514 VanDerWaalsContact O-CB 3.23Å; S510-N514 WeakPolarHBondContact O-CB 3.44Å; S510-N514 PolarHBondContact O-N 3.27Å; S510-N514 PolarHBondContact O-ND2 2.99Å; L512-N514 PolarHBondContact O-N 3.25Å; N514-I516 VanDerWaalsContact C-N 3.32Å; N514-I516 PolarHBondContact O-N 3.13Å; N514-R517 PolarHBondContact O-N 2.96Å; N514-R517 VanDerWaalsContact OD1-CZ 3.23Å; N514-R517 PolarHBondContact OD1-NH1 3.3Å; N514-R517 PolarHBondContact OD1-NH2 3.39Å; N514-D518 WeakPolarHBondContact O-CB 3.35Å; N514-D518 PolarHBondContact O-N 3.35Å; N514-D518 VanDerWaalsContact O-OD2 3.11Å
515	R	91.2	Very high	89.1	Confident	132 Å²	132	63.7 Å²	63.7	50%	0.498	34%	0.337	S	S	.	.	H	α-helix	trans	-60.1	-37.4	-178.3	-72.8	169.8	65.9	-156	1	113.6	N511 L512 Q519	N511-R515 WeakPolarHBondContact O-CB 3.5Å; N511-R515 VanDerWaalsContact O-CG 3.23Å; N511-R515 WeakPolarHBondContact O-CG 3.24Å; N511-R515 PolarHBondContact O-N 3.31Å; L512-R515 PolarHBondContact O-N 3.29Å; R515-Q519 VanDerWaalsContact O-CG 3.32Å; R515-Q519 WeakPolarHBondContact O-CG 3.32Å; R515-Q519 PolarHBondContact O-N 3.08Å
516	I	91.4	Very high	89.8	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-69.6	-47.3	176.6	-69.6	171.9	0	0	0	110.2	H501 A504 L512 Q513 N514 M520 F576 I579 L587	H501-I516 HydrophobicContact CB-CG2 4.22Å; A504-I516 HydrophobicContact CB-CD1 3.77Å; A504-I516 HydrophobicContact CB-CG2 4.41Å; L512-I516 HydrophobicContact CD1-CD1 3.74Å; L512-I516 HydrophobicContact CD1-CG1 4.08Å; L512-I516 HydrophobicContact CG-CD1 3.88Å; L512-I516 WeakPolarHBondContact O-CG1 3.43Å; L512-I516 PolarHBondContact O-N 2.87Å; Q513-I516 PolarHBondContact O-N 3.47Å; N514-I516 VanDerWaalsContact C-N 3.32Å; N514-I516 PolarHBondContact O-N 3.13Å; I516-M520 VanDerWaalsContact O-CB 3.26Å; I516-M520 WeakPolarHBondContact O-CB 3.44Å; I516-M520 PolarHBondContact O-N 3.48Å; I516-F576 HydrophobicContact CG2-CE2 3.92Å; I516-F576 HydrophobicContact CG2-CZ 4.33Å; I516-I579 HydrophobicContact CD1-CG2 4.37Å; I516-I579 HydrophobicContact CG1-CG2 3.71Å; I516-L587 HydrophobicContact CD1-CD1 4.06Å; I516-L587 HydrophobicContact CD1-CD2 3.68Å; I516-L587 HydrophobicContact CD1-CG 4.45Å
517	R	91.5	Very high	90.5	Very high	91 Å²	91	58.1 Å²	58.1	34%	0.343	30%	0.302	S	S	.	.	H	α-helix	trans	-58.6	-48.2	176.1	-177.4	-164.3	61.2	-125.1	-10.3	111.8	H501 Q513 N514 Q519 M520 Q521	H501-R517 WeakPolarHBondContact NE2-CB 3.17Å; Q513-R517 WeakPolarHBondContact O-CB 3.28Å; Q513-R517 PolarHBondContact O-N 3.26Å; N514-R517 PolarHBondContact O-N 2.96Å; N514-R517 VanDerWaalsContact OD1-CZ 3.23Å; N514-R517 PolarHBondContact OD1-NH1 3.3Å; N514-R517 PolarHBondContact OD1-NH2 3.39Å; R517-Q519 PolarHBondContact O-N 3.13Å; R517-M520 PolarHBondContact O-N 3.14Å; R517-Q521 WeakPolarHBondContact O-CB 3.49Å; R517-Q521 PolarHBondContact O-N 3.2Å
518	D	92.4	Very high	91.1	Very high	76 Å²	76	62.6 Å²	62.6	41%	0.406	32%	0.316	S	S	.	.	H	α-helix	trans	-68.6	-37.5	-172.3	-59.2	-19.7	0	0	0	111	N514 Q521 T522	N514-D518 WeakPolarHBondContact O-CB 3.35Å; N514-D518 PolarHBondContact O-N 3.35Å; N514-D518 VanDerWaalsContact O-OD2 3.11Å; D518-Q521 PolarHBondContact O-N 3.2Å; D518-T522 PolarHBondContact O-N 2.87Å; D518-T522 PolarHBondContact O-OG1 2.85Å; D518-T522 VanDerWaalsContact O-OG1 3.09Å
519	Q	93.6	Very high	91.7	Very high	45 Å²	45	57.1 Å²	57.1	21%	0.21	28%	0.28	C	S	.	.	H	α-helix	trans	-72.1	-38.3	171.6	-65	-68.9	-100.3	0	0	112.9	R515 R517 Q521 T522 I523 F576 I579	R515-Q519 VanDerWaalsContact O-CG 3.32Å; R515-Q519 WeakPolarHBondContact O-CG 3.32Å; R515-Q519 PolarHBondContact O-N 3.08Å; R517-Q519 PolarHBondContact O-N 3.13Å; Q519-Q521 VanDerWaalsContact C-N 3.26Å; Q519-Q521 PolarHBondContact O-N 3.44Å; Q519-T522 PolarHBondContact O-N 3.28Å; Q519-I523 WeakPolarHBondContact O-CG1 3.3Å; Q519-I523 PolarHBondContact O-N 2.84Å; Q519-F576 HydrophobicContact CB-CD2 4.27Å; Q519-I579 HydrophobicContact CG-CD1 3.83Å
520	M	93.4	Very high	92.1	Very high	28 Å²	28	54.4 Å²	54.4	14%	0.138	27%	0.266	C	S	.	.	H	α-helix	trans	-60	-38.7	171.6	-176.5	-178.2	68.6	0	0	111	H501 I516 R517 I523 S524 F576	H501-M520 HydrophobicContact CB-CE 4Å; H501-M520 HydrophobicContact CB-SD 3.67Å; H501-M520 VanDerWaalsContact CD2-CE 3.46Å; H501-M520 WeakPolarHBondContact CD2-CE 3.26Å; I516-M520 VanDerWaalsContact O-CB 3.26Å; I516-M520 WeakPolarHBondContact O-CB 3.44Å; I516-M520 PolarHBondContact O-N 3.48Å; R517-M520 PolarHBondContact O-N 3.14Å; M520-I523 PolarHBondContact O-N 2.85Å; M520-S524 WeakPolarHBondContact O-CB 3.46Å; M520-S524 PolarHBondContact O-N 2.83Å; M520-F576 HydrophobicContact CB-CE2 4.21Å
521	Q	93.6	Very high	92.3	Very high	93 Å²	93	54.5 Å²	54.5	44%	0.435	26%	0.261	S	S	.	.	H	α-helix	trans	-68.3	-38.8	176.6	-168.7	62.7	50.5	0	0	111.9	R517 D518 Q519 S524 N525	R517-Q521 WeakPolarHBondContact O-CB 3.49Å; R517-Q521 PolarHBondContact O-N 3.2Å; D518-Q521 PolarHBondContact O-N 3.2Å; Q519-Q521 VanDerWaalsContact C-N 3.26Å; Q519-Q521 PolarHBondContact O-N 3.44Å; Q521-S524 PolarHBondContact O-N 2.8Å; Q521-N525 PolarHBondContact NE2-OD1 3.29Å; Q521-N525 WeakPolarHBondContact O-CB 3.41Å; Q521-N525 PolarHBondContact O-N 3.32Å; Q521-N525 PolarHBondContact O-ND2 3.32Å; Q521-N525 PolarHBondContact O-OD1 2.79Å
522	T	93.4	Very high	92.5	Very high	51 Å²	51	52.2 Å²	52.2	31%	0.313	25%	0.247	S	C	.	.	H	α-helix	trans	-57.9	-50.4	171.8	-56.2	0	0	0	0	111.2	D518 Q519 S524 N525 S526	D518-T522 PolarHBondContact O-N 2.87Å; D518-T522 PolarHBondContact O-OG1 2.85Å; D518-T522 VanDerWaalsContact O-OG1 3.09Å; Q519-T522 PolarHBondContact O-N 3.28Å; T522-S524 PolarHBondContact O-N 3.46Å; T522-N525 PolarHBondContact O-N 3.45Å; T522-S526 PolarHBondContact O-N 3.01Å; T522-S526 PolarHBondContact O-OG 3.19Å
523	I	94.4	Very high	92.5	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-38	-179.1	-59.8	168.9	0	0	0	111	F493 L494 Q519 M520 S526 Y527 L569 D572 I573 F576	F493-I523 HydrophobicContact CD1-CG2 4.4Å; F493-I523 HydrophobicContact CE1-CD1 3.75Å; F493-I523 HydrophobicContact CE1-CG2 4.38Å; F493-I523 HydrophobicContact CZ-CD1 4.36Å; L494-I523 HydrophobicContact CD2-CB 4.28Å; L494-I523 HydrophobicContact CD2-CG2 3.86Å; L494-I523 HydrophobicContact CG-CG2 4.22Å; Q519-I523 WeakPolarHBondContact O-CG1 3.3Å; Q519-I523 PolarHBondContact O-N 2.84Å; M520-I523 PolarHBondContact O-N 2.85Å; I523-S526 PolarHBondContact O-N 3.16Å; I523-Y527 WeakPolarHBondContact O-CB 3.43Å; I523-Y527 PolarHBondContact O-N 2.79Å; I523-L569 HydrophobicContact CG2-CD1 4.29Å; I523-D572 HydrophobicContact CD1-CB 4.4Å; I523-D572 HydrophobicContact CG1-CB 3.83Å; I523-I573 HydrophobicContact CD1-CG1 4.07Å; I523-I573 HydrophobicContact CG2-CG1 4.3Å; I523-F576 HydrophobicContact CD1-CB 3.82Å; I523-F576 HydrophobicContact CD1-CG 4.36Å
524	S	94.4	Very high	92.5	Very high	43 Å²	43	50.5 Å²	50.5	30%	0.301	24%	0.238	S	C	.	.	H	α-helix	trans	-63.9	-43.1	175.1	-174.8	0	0	0	0	112.3	M520 Q521 T522 Y527 R528	M520-S524 WeakPolarHBondContact O-CB 3.46Å; M520-S524 PolarHBondContact O-N 2.83Å; Q521-S524 PolarHBondContact O-N 2.8Å; T522-S524 PolarHBondContact O-N 3.46Å; S524-Y527 PolarHBondContact O-N 3.21Å; S524-R528 PolarHBondContact O-N 2.94Å
525	N	93.7	Very high	92.6	Very high	63 Å²	63	53.2 Å²	53.2	34%	0.337	25%	0.249	S	C	.	.	H	α-helix	trans	-61.4	-45.6	173.5	-71.6	-13.6	0	0	0	111	Q521 T522 R528 I529	Q521-N525 PolarHBondContact NE2-OD1 3.29Å; Q521-N525 WeakPolarHBondContact O-CB 3.41Å; Q521-N525 PolarHBondContact O-N 3.32Å; Q521-N525 PolarHBondContact O-ND2 3.32Å; Q521-N525 PolarHBondContact O-OD1 2.79Å; T522-N525 PolarHBondContact O-N 3.45Å; N525-R528 PolarHBondContact O-N 3.06Å; N525-I529 WeakPolarHBondContact O-CG1 3.5Å; N525-I529 PolarHBondContact O-N 3.04Å
526	S	93.8	Very high	92.3	Very high	17 Å²	17	48.7 Å²	48.7	12%	0.119	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-43.3	176.3	-65.9	0	0	0	0	112.2	T522 I523 I529 L530	T522-S526 PolarHBondContact O-N 3.01Å; T522-S526 PolarHBondContact O-OG 3.19Å; I523-S526 PolarHBondContact O-N 3.16Å; S526-I529 PolarHBondContact O-N 3.18Å; S526-L530 WeakPolarHBondContact O-CG 3.38Å; S526-L530 PolarHBondContact O-N 3.47Å
527	Y	94.4	Very high	92	Very high	35 Å²	35	48.9 Å²	48.9	14%	0.137	24%	0.239	C	C	.	.	H	α-helix	trans	-62.6	-41.2	174.4	178.3	-100.8	0	0	0	112.2	E487 V490 R491 L494 I523 S524 I529 L530 L531	E487-Y527 HydrophobicContact CG-CE2 3.83Å; E487-Y527 WeakPolarHBondContact O-CE2 3.46Å; V490-Y527 HydrophobicContact CB-CD2 3.91Å; V490-Y527 HydrophobicContact CB-CE2 4.32Å; V490-Y527 HydrophobicContact CG1-CD2 3.5Å; V490-Y527 VanDerWaalsContact CG1-CD2 3.5Å; V490-Y527 HydrophobicContact CG1-CE2 4.33Å; V490-Y527 HydrophobicContact CG1-CG 4.15Å; R491-Y527 HydrophobicContact CB-CE2 4.2Å; R491-Y527 PolarHBondContact NE-OH 3.21Å; L494-Y527 HydrophobicContact CD1-CD1 3.83Å; L494-Y527 HydrophobicContact CD1-CD2 4.16Å; L494-Y527 HydrophobicContact CD1-CG 3.57Å; I523-Y527 WeakPolarHBondContact O-CB 3.43Å; I523-Y527 PolarHBondContact O-N 2.79Å; S524-Y527 PolarHBondContact O-N 3.21Å; Y527-I529 VanDerWaalsContact C-N 3.31Å; Y527-I529 PolarHBondContact O-N 3.29Å; Y527-L530 PolarHBondContact O-N 3.14Å; Y527-L531 PolarHBondContact O-N 3.16Å
528	R	94.8	Very high	91.7	Very high	142 Å²	142	46.9 Å²	46.9	54%	0.536	24%	0.235	S	C	.	.	H	α-helix	trans	-60.7	-41	174.3	-160.5	-169.5	75.6	-149.6	-2.4	111.5	S524 N525 L531 E532	S524-R528 PolarHBondContact O-N 2.94Å; N525-R528 PolarHBondContact O-N 3.06Å; R528-L531 PolarHBondContact O-N 2.92Å; R528-E532 IonicContact CZ-OE1 2.75Å; R528-E532 IonicContact NE-OE1 2.7Å; R528-E532 PolarHBondContact NE-OE1 3.3Å; R528-E532 IonicContact NH2-OE1 3.58Å; R528-E532 PolarHBondContact NH2-OE1 3.24Å; R528-E532 VanDerWaalsContact NH2-OE1 3.17Å; R528-E532 WeakPolarHBondContact O-CB 3.23Å; R528-E532 WeakPolarHBondContact O-CG 3.45Å; R528-E532 PolarHBondContact O-N 3.24Å
529	I	92	Very high	91.4	Very high	39 Å²	39	49 Å²	49	20%	0.2	25%	0.246	C	C	.	.	H	α-helix	trans	-64.7	-38.9	176.2	-66.6	164.9	0	0	0	111.7	N525 S526 Y527 T533 R561 V565	N525-I529 WeakPolarHBondContact O-CG1 3.5Å; N525-I529 PolarHBondContact O-N 3.04Å; S526-I529 PolarHBondContact O-N 3.18Å; Y527-I529 VanDerWaalsContact C-N 3.31Å; Y527-I529 PolarHBondContact O-N 3.29Å; I529-T533 WeakPolarHBondContact O-CB 3.26Å; I529-T533 WeakPolarHBondContact O-CG2 3.46Å; I529-T533 PolarHBondContact O-N 2.69Å; I529-T533 PolarHBondContact O-OG1 3.18Å; I529-R561 HydrophobicContact CG2-CG 4.06Å; I529-V565 HydrophobicContact CB-CG2 4.45Å; I529-V565 HydrophobicContact CG2-CB 4.46Å; I529-V565 HydrophobicContact CG2-CG2 3.73Å
530	L	92.4	Very high	90.8	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-38.9	174.7	-67.7	167.6	0	0	0	111.7	I486 S526 Y527 T533 K534 F562 V565 A566 L569	I486-L530 HydrophobicContact CG2-CD1 4.49Å; S526-L530 WeakPolarHBondContact O-CG 3.38Å; S526-L530 PolarHBondContact O-N 3.47Å; Y527-L530 PolarHBondContact O-N 3.14Å; L530-T533 WeakPolarHBondContact CA-OG1 3.32Å; L530-T533 PolarHBondContact O-OG1 3.42Å; L530-K534 VanDerWaalsContact O-CB 3.29Å; L530-K534 WeakPolarHBondContact O-CB 3.34Å; L530-K534 PolarHBondContact O-N 2.98Å; L530-F562 HydrophobicContact CB-CD2 4.24Å; L530-F562 HydrophobicContact CB-CE2 3.86Å; L530-F562 HydrophobicContact CD2-CB 4.49Å; L530-F562 HydrophobicContact CD2-CD1 4Å; L530-F562 HydrophobicContact CD2-CD2 3.62Å; L530-F562 HydrophobicContact CD2-CE1 3.99Å; L530-F562 HydrophobicContact CD2-CE2 3.62Å; L530-F562 HydrophobicContact CD2-CG 3.79Å; L530-F562 HydrophobicContact CD2-CZ 3.8Å; L530-F562 WeakPolarHBondContact CD2-O 3.31Å; L530-F562 HydrophobicContact CG-CE2 4.33Å; L530-F562 WeakPolarHBondContact O-CD2 3.41Å; L530-F562 WeakPolarHBondContact O-CE2 3.38Å; L530-V565 HydrophobicContact CD1-CG1 4.14Å; L530-V565 HydrophobicContact CD2-CB 4.02Å; L530-V565 HydrophobicContact CD2-CG1 4.07Å; L530-V565 HydrophobicContact CG-CB 4.31Å; L530-V565 HydrophobicContact CG-CG1 3.83Å; L530-A566 HydrophobicContact CD2-CB 4.18Å; L530-L569 HydrophobicContact CD1-CD2 3.63Å
531	L	92.4	Very high	90.1	Very high	65 Å²	65	57.3 Å²	57.3	34%	0.34	29%	0.285	S	S	.	.	H	α-helix	trans	-68.8	-48.3	175.7	-169.4	65	0	0	0	111.7	Y527 R528 T533 K534 E535	Y527-L531 PolarHBondContact O-N 3.16Å; R528-L531 PolarHBondContact O-N 2.92Å; L531-T533 VanDerWaalsContact C-N 3.27Å; L531-T533 PolarHBondContact O-N 3.2Å; L531-K534 PolarHBondContact O-N 3.39Å; L531-E535 VanDerWaalsContact O-CB 3.29Å; L531-E535 WeakPolarHBondContact O-CB 3.49Å; L531-E535 PolarHBondContact O-N 3.39Å
532	E	92.1	Very high	89.5	Confident	58 Å²	58	53.9 Å²	53.9	27%	0.271	27%	0.268	S	S	.	.	H	α-helix	trans	-50.9	-46.7	173.3	-75.1	164.9	-156.9	0	0	111.3	R528 S536 R561	R528-E532 IonicContact CZ-OE1 2.75Å; R528-E532 IonicContact NE-OE1 2.7Å; R528-E532 PolarHBondContact NE-OE1 3.3Å; R528-E532 IonicContact NH2-OE1 3.58Å; R528-E532 PolarHBondContact NH2-OE1 3.24Å; R528-E532 VanDerWaalsContact NH2-OE1 3.17Å; R528-E532 WeakPolarHBondContact O-CB 3.23Å; R528-E532 WeakPolarHBondContact O-CG 3.45Å; R528-E532 PolarHBondContact O-N 3.24Å; E532-S536 WeakPolarHBondContact O-CB 3.34Å; E532-S536 PolarHBondContact O-N 3.01Å; E532-R561 IonicContact OE2-CZ 3.23Å; E532-R561 VanDerWaalsContact OE2-CZ 3.28Å; E532-R561 IonicContact OE2-NH1 3.4Å; E532-R561 PolarHBondContact OE2-NH1 3.09Å; E532-R561 IonicContact OE2-NH2 3.39Å; E532-R561 PolarHBondContact OE2-NH2 2.92Å
533	T	89.7	Confident	88.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-75.9	-38.9	-178	44.7	0	0	0	0	112.9	I529 L530 L531 S536 L537 D558 R561 F562	I529-T533 WeakPolarHBondContact O-CB 3.26Å; I529-T533 WeakPolarHBondContact O-CG2 3.46Å; I529-T533 PolarHBondContact O-N 2.69Å; I529-T533 PolarHBondContact O-OG1 3.18Å; L530-T533 WeakPolarHBondContact CA-OG1 3.32Å; L530-T533 PolarHBondContact O-OG1 3.42Å; L531-T533 VanDerWaalsContact C-N 3.27Å; L531-T533 PolarHBondContact O-N 3.2Å; T533-S536 PolarHBondContact O-N 3.41Å; T533-L537 WeakPolarHBondContact O-CD1 3.34Å; T533-L537 WeakPolarHBondContact O-CG 3.37Å; T533-L537 PolarHBondContact O-N 2.92Å; T533-L537 VanDerWaalsContact O-N 3.11Å; T533-D558 WeakPolarHBondContact CB-O 3.27Å; T533-D558 HydrophobicContact CG2-CB 4.07Å; T533-D558 WeakPolarHBondContact CG2-O 3.46Å; T533-R561 HydrophobicContact CG2-CB 3.87Å; T533-R561 HydrophobicContact CG2-CG 3.69Å; T533-F562 WeakPolarHBondContact OG1-CD2 3.27Å
534	K	89.4	Confident	87.6	Confident	20 Å²	20	54.6 Å²	54.6	9%	0.087	27%	0.271	C	S	.	.	H	α-helix	trans	-60	-54	172.1	173.8	179.7	169.8	178.3	0	110.9	T483 E484 E487 L530 L531 S536 L537 D538 F562	T483-K534 HydrophobicContact CG2-CB 4.25Å; T483-K534 HydrophobicContact CG2-CD 3.95Å; T483-K534 HydrophobicContact CG2-CG 4.04Å; E484-K534 IonicContact OE1-NZ 3.61Å; E484-K534 PolarHBondContact OE1-NZ 3.24Å; E487-K534 VanDerWaalsContact OE2-CD 3.3Å; E487-K534 WeakPolarHBondContact OE2-CD 3.37Å; E487-K534 IonicContact OE2-NZ 2.77Å; E487-K534 PolarHBondContact OE2-NZ 2.95Å; L530-K534 VanDerWaalsContact O-CB 3.29Å; L530-K534 WeakPolarHBondContact O-CB 3.34Å; L530-K534 PolarHBondContact O-N 2.98Å; L531-K534 PolarHBondContact O-N 3.39Å; K534-S536 VanDerWaalsContact C-N 3.26Å; K534-S536 PolarHBondContact O-N 3.28Å; K534-L537 WeakPolarHBondContact O-CA 3.48Å; K534-L537 WeakPolarHBondContact O-CB 3.46Å; K534-L537 PolarHBondContact O-N 3.48Å; K534-D538 WeakPolarHBondContact CE-OD2 3.5Å; K534-D538 VanDerWaalsContact CG-OD2 3.23Å; K534-D538 WeakPolarHBondContact CG-OD2 3.21Å; K534-D538 PolarHBondContact O-N 2.94Å; K534-F562 HydrophobicContact CB-CE2 4.28Å
535	E	90	Very high	86.1	Confident	114 Å²	114	59.3 Å²	59.3	53%	0.533	29%	0.289	S	S	.	.	H	α-helix	trans	-58.5	-39.4	179.7	178.5	174.5	-166.2	0	0	111.4	L531 L537 N539	L531-E535 VanDerWaalsContact O-CB 3.29Å; L531-E535 WeakPolarHBondContact O-CB 3.49Å; L531-E535 PolarHBondContact O-N 3.39Å; E535-L537 VanDerWaalsContact C-N 3.27Å; E535-L537 PolarHBondContact O-N 3.44Å; E535-N539 VanDerWaalsContact CG-ND2 3.26Å; E535-N539 WeakPolarHBondContact CG-ND2 3.44Å; E535-N539 WeakPolarHBondContact O-CB 3.32Å; E535-N539 VanDerWaalsContact O-CG 3.3Å; E535-N539 PolarHBondContact O-N 3.47Å; E535-N539 PolarHBondContact O-ND2 2.84Å; E535-N539 VanDerWaalsContact O-ND2 3.07Å
536	S	86.4	Confident	84.8	Confident	37 Å²	37	60 Å²	60	26%	0.259	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-24	174.7	-173.5	0	0	0	0	113.9	E532 T533 K534 R540 D558	E532-S536 WeakPolarHBondContact O-CB 3.34Å; E532-S536 PolarHBondContact O-N 3.01Å; T533-S536 PolarHBondContact O-N 3.41Å; K534-S536 VanDerWaalsContact C-N 3.26Å; K534-S536 PolarHBondContact O-N 3.28Å; S536-R540 PolarHBondContact O-NE 3.33Å; S536-R540 PolarHBondContact O-NH2 2.84Å; S536-R540 PolarHBondContact OG-NH2 3.15Å; S536-D558 PolarHBondContact OG-OD2 3.2Å
537	L	84.4	Confident	83.6	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-90.3	-43.6	175.7	-68.6	164.7	0	0	0	112	T533 K534 E535 R540 N541 W542 L547 D558 L559	T533-L537 WeakPolarHBondContact O-CD1 3.34Å; T533-L537 WeakPolarHBondContact O-CG 3.37Å; T533-L537 PolarHBondContact O-N 2.92Å; T533-L537 VanDerWaalsContact O-N 3.11Å; K534-L537 WeakPolarHBondContact O-CA 3.48Å; K534-L537 WeakPolarHBondContact O-CB 3.46Å; K534-L537 PolarHBondContact O-N 3.48Å; E535-L537 VanDerWaalsContact C-N 3.27Å; E535-L537 PolarHBondContact O-N 3.44Å; L537-R540 CarbonylContact O-C 3.54Å; L537-R540 PolarHBondContact O-N 3.31Å; L537-R540 VanDerWaalsContact O-N 3.1Å; L537-N541 PolarHBondContact O-N 2.88Å; L537-W542 HydrophobicContact CB-CD2 4.23Å; L537-W542 HydrophobicContact CB-CZ2 3.94Å; L537-W542 HydrophobicContact CD1-CH2 3.99Å; L537-W542 HydrophobicContact CD1-CZ2 4.02Å; L537-W542 HydrophobicContact CD1-CZ3 4.46Å; L537-W542 PolarHBondContact O-N 3.18Å; L537-W542 VanDerWaalsContact O-N 3.17Å; L537-L547 HydrophobicContact CD2-CD2 3.63Å; L537-D558 HydrophobicContact CD2-CB 4.27Å; L537-D558 HydrophobicContact CG-CB 4.2Å; L537-L559 HydrophobicContact CD1-CB 4.06Å; L537-L559 HydrophobicContact CD1-CD1 4.18Å; L537-L559 HydrophobicContact CD2-CB 4.18Å
538	D	85.9	Confident	82.5	Confident	49 Å²	49	59.3 Å²	59.3	26%	0.262	29%	0.294	S	S	.	.	H	α-helix	trans	-60.4	-46.7	176.2	-72.5	-22.7	0	0	0	110.6	H480 K534 R540 N541 W542	H480-D538 IonicContact CD2-OD1 3.9Å; H480-D538 IonicContact NE2-OD1 2.76Å; H480-D538 PolarHBondContact NE2-OD1 2.81Å; K534-D538 WeakPolarHBondContact CE-OD2 3.5Å; K534-D538 VanDerWaalsContact CG-OD2 3.23Å; K534-D538 WeakPolarHBondContact CG-OD2 3.21Å; K534-D538 PolarHBondContact O-N 2.94Å; D538-R540 PolarHBondContact O-N 2.94Å; D538-R540 VanDerWaalsContact O-N 3.07Å; D538-N541 PolarHBondContact O-N 3.09Å; D538-N541 PolarHBondContact O-OD1 3.23Å; D538-W542 PolarHBondContact OD1-NE1 3.23Å
539	N	85.5	Confident	81	Confident	120 Å²	120	54.9 Å²	54.9	64%	0.642	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-9.9	175.7	-76.6	-39.2	0	0	0	114.4	E535	E535-N539 VanDerWaalsContact CG-ND2 3.26Å; E535-N539 WeakPolarHBondContact CG-ND2 3.44Å; E535-N539 WeakPolarHBondContact O-CB 3.32Å; E535-N539 VanDerWaalsContact O-CG 3.3Å; E535-N539 PolarHBondContact O-N 3.47Å; E535-N539 PolarHBondContact O-ND2 2.84Å; E535-N539 VanDerWaalsContact O-ND2 3.07Å
540	R	80	Confident	79.2	Confident	105 Å²	105	59.3 Å²	59.3	40%	0.396	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	4.1	172.8	-79.5	-177.6	-75.9	-179.4	-4.1	112.9	S536 L537 D538 W542 P543 D558	S536-R540 PolarHBondContact O-NE 3.33Å; S536-R540 PolarHBondContact O-NH2 2.84Å; S536-R540 PolarHBondContact OG-NH2 3.15Å; L537-R540 CarbonylContact O-C 3.54Å; L537-R540 PolarHBondContact O-N 3.31Å; L537-R540 VanDerWaalsContact O-N 3.1Å; D538-R540 PolarHBondContact O-N 2.94Å; D538-R540 VanDerWaalsContact O-N 3.07Å; R540-W542 VanDerWaalsContact C-N 3.25Å; R540-W542 PolarHBondContact O-N 3.47Å; R540-P543 HydrophobicContact CB-CG 4.14Å; R540-P543 VanDerWaalsContact O-CD 3.23Å; R540-P543 WeakPolarHBondContact O-CD 3.18Å; R540-P543 WeakPolarHBondContact O-CG 3.48Å; R540-D558 IonicContact CZ-OD2 3.72Å; R540-D558 IonicContact NH1-OD2 2.76Å; R540-D558 IonicContact NH2-OD2 3.52Å; R540-D558 PolarHBondContact NH2-OD2 3.26Å
541	N	78.7	Confident	77	Confident	144 Å²	144	65.5 Å²	65.5	77%	0.77	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	34.4	-175.4	-61.2	1.8	0	0	0	113.7	L537 D538	L537-N541 PolarHBondContact O-N 2.88Å; D538-N541 PolarHBondContact O-N 3.09Å; D538-N541 PolarHBondContact O-OD1 3.23Å
542	W	81.5	Confident	75	Confident	21 Å²	21	68.6 Å²	68.6	8%	0.08	36%	0.361	C	S	.	.			trans	47.8	57.6	177.8	-71	71.6	0	0	0	114.6	I476 I479 H480 L537 D538 R540 L544 L547 L559	I476-W542 HydrophobicContact CD1-CB 3.97Å; I476-W542 HydrophobicContact CD1-CE3 4.44Å; I476-W542 WeakPolarHBondContact CD1-O 3.46Å; I476-W542 HydrophobicContact CG1-CB 4.4Å; I476-W542 HydrophobicContact CG1-CE3 4.03Å; I479-W542 HydrophobicContact CG2-CH2 4.22Å; I479-W542 HydrophobicContact CG2-CZ3 3.88Å; H480-W542 AromaticContact CD2-CE2 3.59Å; H480-W542 AromaticContact CD2-CZ2 3.73Å; H480-W542 AromaticContact CD2-NE1 3.46Å; H480-W542 PolarHBondContact CD2-NE1 2.82Å; H480-W542 AromaticContact NE2-NE1 3.99Å; L537-W542 HydrophobicContact CB-CD2 4.23Å; L537-W542 HydrophobicContact CB-CZ2 3.94Å; L537-W542 HydrophobicContact CD1-CH2 3.99Å; L537-W542 HydrophobicContact CD1-CZ2 4.02Å; L537-W542 HydrophobicContact CD1-CZ3 4.46Å; L537-W542 PolarHBondContact O-N 3.18Å; L537-W542 VanDerWaalsContact O-N 3.17Å; D538-W542 PolarHBondContact OD1-NE1 3.23Å; R540-W542 VanDerWaalsContact C-N 3.25Å; R540-W542 PolarHBondContact O-N 3.47Å; W542-L544 PolarHBondContact O-N 3.03Å; W542-L547 HydrophobicContact CB-CD1 4.26Å; W542-L547 HydrophobicContact CE3-CD1 3.91Å; W542-L559 HydrophobicContact CH2-CD1 4.14Å; W542-L559 HydrophobicContact CZ3-CD1 3.89Å
543	P	77.2	Confident	73.3	Confident	35 Å²	35	72.4 Å²	72.4	23%	0.227	38%	0.379	C	S	.	.			trans	-75.5	118.9	-168.1	27.3	-22.6	0	0	0	110.3	R540 E545 V546 L547	R540-P543 HydrophobicContact CB-CG 4.14Å; R540-P543 VanDerWaalsContact O-CD 3.23Å; R540-P543 WeakPolarHBondContact O-CD 3.18Å; R540-P543 WeakPolarHBondContact O-CG 3.48Å; P543-E545 PolarHBondContact O-N 3.27Å; P543-V546 HydrophobicContact CB-CG2 4.27Å; P543-V546 HydrophobicContact CG-CB 4.03Å; P543-V546 HydrophobicContact CG-CG2 3.82Å; P543-V546 PolarHBondContact O-N 3.33Å; P543-L547 WeakPolarHBondContact O-CG 3.46Å; P543-L547 PolarHBondContact O-N 2.82Å; P543-L547 VanDerWaalsContact O-N 3.15Å
544	L	71.1	Confident	71.4	Confident	31 Å²	31	80.2 Å²	80.2	16%	0.162	42%	0.421	C	S	.	.	H	α-helix	trans	-56.6	-37.5	-175.1	-76.3	75.6	0	0	0	111.3	E473 I476 W542 V546 L547 V548	E473-L544 HydrophobicContact CB-CD2 3.55Å; E473-L544 HydrophobicContact CG-CD2 3.62Å; I476-L544 HydrophobicContact CD1-CD1 3.92Å; I476-L544 HydrophobicContact CD1-CG 4.26Å; W542-L544 PolarHBondContact O-N 3.03Å; L544-V546 PolarHBondContact O-N 3.43Å; L544-V546 VanDerWaalsContact O-N 3.14Å; L544-L547 PolarHBondContact O-N 3.34Å; L544-L547 VanDerWaalsContact O-N 3.12Å; L544-V548 VanDerWaalsContact O-CB 3.26Å; L544-V548 WeakPolarHBondContact O-CB 3.41Å; L544-V548 WeakPolarHBondContact O-CG2 3.34Å; L544-V548 PolarHBondContact O-N 3.41Å
545	E	62	Low	69.9	Low	142 Å²	142	82.3 Å²	82.3	66%	0.664	44%	0.438	S	S	*	.	H	α-helix	trans	-64.8	-17.6	-178.4	-65	63.5	-138.7	0	0	113.3	P543	P543-E545 PolarHBondContact O-N 3.27Å
546	V	66.9	Low	68.8	Low	77 Å²	77	80.7 Å²	80.7	47%	0.467	44%	0.437	S	S	.	.	H	α-helix	trans	-101.1	-29.3	174.5	-175.7	0	0	0	0	111.4	P543 L544	P543-V546 HydrophobicContact CB-CG2 4.27Å; P543-V546 HydrophobicContact CG-CB 4.03Å; P543-V546 HydrophobicContact CG-CG2 3.82Å; P543-V546 PolarHBondContact O-N 3.33Å; L544-V546 PolarHBondContact O-N 3.43Å; L544-V546 VanDerWaalsContact O-N 3.14Å
547	L	68.8	Low	68.5	Low	5 Å²	5	80.6 Å²	80.6	3%	0.026	43%	0.434	C	S	.	.	H	α-helix	trans	-90.7	-13.8	-177.1	-57.6	177.4	0	0	0	113.5	R467 L472 I476 L537 W542 P543 L544 T549 L559	R467-L547 VanDerWaalsContact CD-O 3.24Å; R467-L547 WeakPolarHBondContact CD-O 3.27Å; L472-L547 HydrophobicContact CD2-CB 3.61Å; I476-L547 HydrophobicContact CD1-CD1 4.4Å; L537-L547 HydrophobicContact CD2-CD2 3.63Å; W542-L547 HydrophobicContact CB-CD1 4.26Å; W542-L547 HydrophobicContact CE3-CD1 3.91Å; P543-L547 WeakPolarHBondContact O-CG 3.46Å; P543-L547 PolarHBondContact O-N 2.82Å; P543-L547 VanDerWaalsContact O-N 3.15Å; L544-L547 PolarHBondContact O-N 3.34Å; L544-L547 VanDerWaalsContact O-N 3.12Å; L547-T549 PolarHBondContact O-N 2.96Å; L547-L559 HydrophobicContact CB-CD2 4.35Å; L547-L559 HydrophobicContact CD1-CD2 4.29Å; L547-L559 HydrophobicContact CD2-CB 4.03Å; L547-L559 HydrophobicContact CD2-CD2 3.99Å; L547-L559 HydrophobicContact CG-CD2 4.43Å
548	V	70.8	Confident	68.5	Low	34 Å²	34	82.4 Å²	82.4	21%	0.206	44%	0.443	C	S	.	.			trans	-86.9	96.6	174.8	171.3	0	0	0	0	110.2	R467 R469 L472 L544 D550	R467-V548 WeakPolarHBondContact O-CA 3.32Å; R469-V548 HydrophobicContact CB-CG1 4.02Å; R469-V548 HydrophobicContact CB-CG2 4Å; R469-V548 HydrophobicContact CG-CG2 4.14Å; L472-V548 HydrophobicContact CD2-CG2 3.96Å; L544-V548 VanDerWaalsContact O-CB 3.26Å; L544-V548 WeakPolarHBondContact O-CB 3.41Å; L544-V548 WeakPolarHBondContact O-CG2 3.34Å; L544-V548 PolarHBondContact O-N 3.41Å; V548-D550 VanDerWaalsContact C-N 3.33Å; V548-D550 PolarHBondContact O-N 3.27Å
549	T	64.6	Low	68.5	Low	49 Å²	49	80.1 Å²	80.1	30%	0.301	43%	0.431	S	S	.	.			trans	-85	70.2	-178.6	-39.4	0	0	0	0	111.6	R467 L547 N551	R467-T549 PolarHBondContact NH1-OG1 2.88Å; L547-T549 PolarHBondContact O-N 2.96Å; T549-N551 VanDerWaalsContact C-N 3.31Å; T549-N551 VanDerWaalsContact CG2-O 3.26Å; T549-N551 WeakPolarHBondContact CG2-O 3.45Å
550	D	52.2	Low	68.6	Low	132 Å²	132	78.9 Å²	78.9	71%	0.706	42%	0.422	S	S	*	.			trans	-76.3	-20.4	173.6	-164.3	49.5	0	0	0	112.4	V548	V548-D550 VanDerWaalsContact C-N 3.33Å; V548-D550 PolarHBondContact O-N 3.27Å
551	N	47.3	Very low	69.1	Low	135 Å²	135	77.4 Å²	77.4	72%	0.722	42%	0.416	S	S	*	.	S	Bend	trans	-114.5	140.8	172.3	-94	-67.7	0	0	0	112	T549 Q553	T549-N551 VanDerWaalsContact C-N 3.31Å; T549-N551 VanDerWaalsContact CG2-O 3.26Å; T549-N551 WeakPolarHBondContact CG2-O 3.45Å; N551-Q553 PolarHBondContact O-N 2.92Å
552	V	50.1	Low	69.7	Low	130 Å²	130	70.7 Å²	70.7	79%	0.788	38%	0.38	S	S	*	.			trans	-72.6	95.5	-176.4	-175.7	0	0	0	0	110.9
553	Q	55.9	Low	70.2	Confident	137 Å²	137	69.9 Å²	69.9	64%	0.64	38%	0.377	S	S	*	.			trans	-80.8	146.8	165.7	-65.9	-138.2	15.9	0	0	111.1	N551	N551-Q553 PolarHBondContact O-N 2.92Å
554	N	51.5	Low	70.8	Confident	165 Å²	165	73.3 Å²	73.3	88%	0.882	39%	0.391	S	S	*	.	S	Bend	trans	-99.4	19	-178.8	-66.6	-67	0	0	0	112.9
555	S	56.1	Low	71.9	Confident	63 Å²	63	72.7 Å²	72.7	44%	0.441	39%	0.389	S	S	.	.	S	Bend	trans	-127.7	129.5	176.9	47.4	0	0	0	0	108.9	D557	S555-D557 PolarHBondContact O-N 2.82Å
556	P	68.1	Low	73.4	Confident	81 Å²	81	65.9 Å²	65.9	53%	0.526	36%	0.357	S	S	.	.			trans	-69.4	121.6	-179.8	28.1	-33.5	0	0	0	110.1	E560	P556-E560 HydrophobicContact CB-CB 4.29Å; P556-E560 HydrophobicContact CB-CG 4.38Å
557	D	80.4	Confident	74.6	Confident	34 Å²	34	68.2 Å²	68.2	18%	0.182	36%	0.358	C	S	.	.			trans	-59.5	158	174.8	-49	-61.1	0	0	0	110.8	R467 S555 L559 E560 R561	R467-D557 IonicContact CZ-OD2 2.79Å; R467-D557 IonicContact NH1-OD2 2.65Å; R467-D557 PolarHBondContact NH1-OD2 3.14Å; R467-D557 IonicContact NH2-OD2 2.78Å; S555-D557 PolarHBondContact O-N 2.82Å; D557-L559 PolarHBondContact O-N 3.02Å; D557-L559 VanDerWaalsContact O-N 3.11Å; D557-E560 CarbonylContact O-C 3.58Å; D557-E560 WeakPolarHBondContact O-CA 3.21Å; D557-E560 WeakPolarHBondContact O-CB 3.45Å; D557-E560 PolarHBondContact O-N 3.12Å; D557-R561 PolarHBondContact O-N 3.15Å
558	D	83.5	Confident	75.7	Confident	42 Å²	42	73.2 Å²	73.2	23%	0.225	38%	0.382	C	S	.	.	H	α-helix	trans	-55.2	-33.6	174.5	-68.8	-74.6	0	0	0	112.7	T533 S536 L537 R540 R561 F562	T533-D558 WeakPolarHBondContact CB-O 3.27Å; T533-D558 HydrophobicContact CG2-CB 4.07Å; T533-D558 WeakPolarHBondContact CG2-O 3.46Å; S536-D558 PolarHBondContact OG-OD2 3.2Å; L537-D558 HydrophobicContact CD2-CB 4.27Å; L537-D558 HydrophobicContact CG-CB 4.2Å; R540-D558 IonicContact CZ-OD2 3.72Å; R540-D558 IonicContact NH1-OD2 2.76Å; R540-D558 IonicContact NH2-OD2 3.52Å; R540-D558 PolarHBondContact NH2-OD2 3.26Å; D558-R561 PolarHBondContact O-N 3.4Å; D558-F562 WeakPolarHBondContact O-CB 3.5Å; D558-F562 PolarHBondContact O-N 3.49Å
559	L	86.3	Confident	76.8	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.005	37%	0.372	C	S	.	.	H	α-helix	trans	-71.3	-29.3	173.8	-177.7	60	0	0	0	113.3	W466 I479 L537 W542 L547 D557 V563	W466-L559 HydrophobicContact CH2-CD1 4.36Å; W466-L559 HydrophobicContact CH2-CD2 4.17Å; W466-L559 HydrophobicContact CH2-CG 3.79Å; W466-L559 HydrophobicContact CZ3-CD1 4.22Å; W466-L559 HydrophobicContact CZ3-CD2 3.91Å; W466-L559 HydrophobicContact CZ3-CG 3.89Å; I479-L559 HydrophobicContact CG2-CD1 4.39Å; L537-L559 HydrophobicContact CD1-CB 4.06Å; L537-L559 HydrophobicContact CD1-CD1 4.18Å; L537-L559 HydrophobicContact CD2-CB 4.18Å; W542-L559 HydrophobicContact CH2-CD1 4.14Å; W542-L559 HydrophobicContact CZ3-CD1 3.89Å; L547-L559 HydrophobicContact CB-CD2 4.35Å; L547-L559 HydrophobicContact CD1-CD2 4.29Å; L547-L559 HydrophobicContact CD2-CB 4.03Å; L547-L559 HydrophobicContact CD2-CD2 3.99Å; L547-L559 HydrophobicContact CG-CD2 4.43Å; D557-L559 PolarHBondContact O-N 3.02Å; D557-L559 VanDerWaalsContact O-N 3.11Å; L559-V563 WeakPolarHBondContact O-CB 3.18Å; L559-V563 WeakPolarHBondContact O-CG2 3.36Å; L559-V563 PolarHBondContact O-N 3Å
560	E	87.8	Confident	78.2	Confident	94 Å²	94	70.2 Å²	70.2	44%	0.439	36%	0.364	S	S	.	.	H	α-helix	trans	-76.2	-42.8	170.8	-170.1	167	-149.1	0	0	111.3	P556 D557 F562 V563 M564	P556-E560 HydrophobicContact CB-CB 4.29Å; P556-E560 HydrophobicContact CB-CG 4.38Å; D557-E560 CarbonylContact O-C 3.58Å; D557-E560 WeakPolarHBondContact O-CA 3.21Å; D557-E560 WeakPolarHBondContact O-CB 3.45Å; D557-E560 PolarHBondContact O-N 3.12Å; E560-F562 VanDerWaalsContact C-N 3.31Å; E560-F562 PolarHBondContact O-N 3.38Å; E560-V563 PolarHBondContact O-N 3Å; E560-M564 VanDerWaalsContact O-CB 3.3Å; E560-M564 WeakPolarHBondContact O-CB 3.34Å; E560-M564 PolarHBondContact O-N 3.35Å
561	R	90	Very high	80.1	Confident	74 Å²	74	68.2 Å²	68.2	28%	0.279	35%	0.351	S	S	.	.	H	α-helix	trans	-57.1	-43.8	173.9	-176.3	179.2	-178.3	-121.5	-0.6	111	I529 E532 T533 D557 D558 V565	I529-R561 HydrophobicContact CG2-CG 4.06Å; E532-R561 IonicContact OE2-CZ 3.23Å; E532-R561 VanDerWaalsContact OE2-CZ 3.28Å; E532-R561 IonicContact OE2-NH1 3.4Å; E532-R561 PolarHBondContact OE2-NH1 3.09Å; E532-R561 IonicContact OE2-NH2 3.39Å; E532-R561 PolarHBondContact OE2-NH2 2.92Å; T533-R561 HydrophobicContact CG2-CB 3.87Å; T533-R561 HydrophobicContact CG2-CG 3.69Å; D557-R561 PolarHBondContact O-N 3.15Å; D558-R561 PolarHBondContact O-N 3.4Å; R561-V565 WeakPolarHBondContact O-CG2 3.36Å; R561-V565 PolarHBondContact O-N 3.44Å; R561-V565 VanDerWaalsContact O-N 3.1Å
562	F	91.6	Very high	82.3	Confident	3 Å²	3	63 Å²	63	1%	0.013	32%	0.323	C	S	.	.	H	α-helix	trans	-58.7	-55.2	172.9	-171.5	-78.3	0	0	0	111.3	L458 T483 I486 L530 T533 K534 D558 E560 M564 V565 A566	L458-F562 HydrophobicContact CD2-CD1 4.05Å; L458-F562 HydrophobicContact CD2-CE1 3.77Å; T483-F562 HydrophobicContact CG2-CD2 4.43Å; T483-F562 HydrophobicContact CG2-CE1 4.19Å; T483-F562 HydrophobicContact CG2-CE2 3.65Å; T483-F562 HydrophobicContact CG2-CZ 3.52Å; T483-F562 WeakPolarHBondContact OG1-CE1 3.47Å; T483-F562 WeakPolarHBondContact OG1-CZ 3.41Å; I486-F562 HydrophobicContact CD1-CE1 4.36Å; I486-F562 HydrophobicContact CG2-CZ 4.5Å; L530-F562 HydrophobicContact CB-CD2 4.24Å; L530-F562 HydrophobicContact CB-CE2 3.86Å; L530-F562 HydrophobicContact CD2-CB 4.49Å; L530-F562 HydrophobicContact CD2-CD1 4Å; L530-F562 HydrophobicContact CD2-CD2 3.62Å; L530-F562 HydrophobicContact CD2-CE1 3.99Å; L530-F562 HydrophobicContact CD2-CE2 3.62Å; L530-F562 HydrophobicContact CD2-CG 3.79Å; L530-F562 HydrophobicContact CD2-CZ 3.8Å; L530-F562 WeakPolarHBondContact CD2-O 3.31Å; L530-F562 HydrophobicContact CG-CE2 4.33Å; L530-F562 WeakPolarHBondContact O-CD2 3.41Å; L530-F562 WeakPolarHBondContact O-CE2 3.38Å; T533-F562 WeakPolarHBondContact OG1-CD2 3.27Å; K534-F562 HydrophobicContact CB-CE2 4.28Å; D558-F562 WeakPolarHBondContact O-CB 3.5Å; D558-F562 PolarHBondContact O-N 3.49Å; E560-F562 VanDerWaalsContact C-N 3.31Å; E560-F562 PolarHBondContact O-N 3.38Å; F562-M564 VanDerWaalsContact C-N 3.31Å; F562-M564 PolarHBondContact O-N 3.39Å; F562-V565 PolarHBondContact O-N 3.38Å; F562-A566 HydrophobicContact CD1-CB 4.39Å; F562-A566 HydrophobicContact CE1-CB 4.24Å; F562-A566 VanDerWaalsContact O-CB 3.28Å; F562-A566 WeakPolarHBondContact O-CB 3.3Å; F562-A566 PolarHBondContact O-N 3.47Å
563	V	91.5	Very high	84.4	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.024	29%	0.285	C	S	.	.	H	α-helix	trans	-61.6	-36.6	-178.5	160	0	0	0	0	112.7	L458 M459 V462 W466 L559 E560 R567	L458-V563 HydrophobicContact CD2-CG2 4.12Å; M459-V563 HydrophobicContact CE-CG1 4.4Å; V462-V563 HydrophobicContact CG1-CG1 3.81Å; V462-V563 HydrophobicContact CG2-CG1 4Å; V462-V563 HydrophobicContact CG2-CG2 3.87Å; W466-V563 HydrophobicContact CH2-CB 4.27Å; W466-V563 HydrophobicContact CH2-CG2 3.62Å; W466-V563 HydrophobicContact CZ2-CG2 4.41Å; W466-V563 HydrophobicContact CZ3-CG2 4.11Å; L559-V563 WeakPolarHBondContact O-CB 3.18Å; L559-V563 WeakPolarHBondContact O-CG2 3.36Å; L559-V563 PolarHBondContact O-N 3Å; E560-V563 PolarHBondContact O-N 3Å; V563-R567 WeakPolarHBondContact O-CG 3.11Å; V563-R567 PolarHBondContact O-N 3.16Å; V563-R567 VanDerWaalsContact O-N 3.09Å
564	M	90.8	Very high	86.2	Confident	106 Å²	106	54.3 Å²	54.3	52%	0.522	27%	0.272	S	S	.	.	H	α-helix	trans	-65.2	-46.9	176.6	179.9	173.9	60.4	0	0	111.5	E560 F562 R567 M568	E560-M564 VanDerWaalsContact O-CB 3.3Å; E560-M564 WeakPolarHBondContact O-CB 3.34Å; E560-M564 PolarHBondContact O-N 3.35Å; F562-M564 VanDerWaalsContact C-N 3.31Å; F562-M564 PolarHBondContact O-N 3.39Å; M564-R567 PolarHBondContact O-N 3.44Å; M564-M568 PolarHBondContact O-N 2.95Å
565	V	93.3	Very high	88.3	Confident	18 Å²	18	53.4 Å²	53.4	11%	0.109	26%	0.256	C	S	.	.	H	α-helix	trans	-70.2	-40.2	178.4	175.9	0	0	0	0	111.3	I529 L530 R561 F562 R567 M568 L569	I529-V565 HydrophobicContact CB-CG2 4.45Å; I529-V565 HydrophobicContact CG2-CB 4.46Å; I529-V565 HydrophobicContact CG2-CG2 3.73Å; L530-V565 HydrophobicContact CD1-CG1 4.14Å; L530-V565 HydrophobicContact CD2-CB 4.02Å; L530-V565 HydrophobicContact CD2-CG1 4.07Å; L530-V565 HydrophobicContact CG-CB 4.31Å; L530-V565 HydrophobicContact CG-CG1 3.83Å; R561-V565 WeakPolarHBondContact O-CG2 3.36Å; R561-V565 PolarHBondContact O-N 3.44Å; R561-V565 VanDerWaalsContact O-N 3.1Å; F562-V565 PolarHBondContact O-N 3.38Å; V565-R567 PolarHBondContact O-N 3.01Å; V565-M568 PolarHBondContact O-N 3.28Å; V565-L569 PolarHBondContact O-N 2.99Å; V565-L569 VanDerWaalsContact O-N 3.12Å
566	A	93.1	Very high	90.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.4	-31.5	174.6	0	0	0	0	0	112.5	V455 L458 M459 I486 L530 F562 P570	V455-A566 WeakPolarHBondContact CG1-O 3.43Å; V455-A566 WeakPolarHBondContact CG2-O 3.38Å; L458-A566 HydrophobicContact CD2-CB 4.18Å; M459-A566 HydrophobicContact CE-CB 4.45Å; I486-A566 HydrophobicContact CD1-CB 4.44Å; L530-A566 HydrophobicContact CD2-CB 4.18Å; F562-A566 HydrophobicContact CD1-CB 4.39Å; F562-A566 HydrophobicContact CE1-CB 4.24Å; F562-A566 VanDerWaalsContact O-CB 3.28Å; F562-A566 WeakPolarHBondContact O-CB 3.3Å; F562-A566 PolarHBondContact O-N 3.47Å; A566-P570 WeakPolarHBondContact O-CD 3.26Å
567	R	92.6	Very high	91.3	Very high	126 Å²	126	46.6 Å²	46.6	48%	0.475	21%	0.211	S	C	.	.	H	α-helix	trans	-70.3	-31.8	174.4	-83.2	179.9	164.8	136.8	7.1	114.5	M459 V462 V563 M564 V565	M459-R567 HydrophobicContact CE-CG 3.68Å; M459-R567 HydrophobicContact SD-CG 3.53Å; M459-R567 VanDerWaalsContact SD-CG 3.53Å; M459-R567 VanDerWaalsContact SD-CZ 3.52Å; M459-R567 PolarHBondContact SD-NE 2.84Å; M459-R567 PolarHBondContact SD-NH2 2.99Å; M459-R567 VanDerWaalsContact SD-NH2 3.4Å; V462-R567 VanDerWaalsContact CG1-NH2 3.32Å; V563-R567 WeakPolarHBondContact O-CG 3.11Å; V563-R567 PolarHBondContact O-N 3.16Å; V563-R567 VanDerWaalsContact O-N 3.09Å; M564-R567 PolarHBondContact O-N 3.44Å; V565-R567 PolarHBondContact O-N 3.01Å
568	M	92.1	Very high	91.9	Very high	109 Å²	109	48.2 Å²	48.2	54%	0.537	23%	0.225	S	C	.	.	H	α-helix	trans	-82.1	-34.3	-179.3	-63.7	-55.1	-61.3	0	0	112.4	M564 V565 E571 D572	M564-M568 PolarHBondContact O-N 2.95Å; V565-M568 PolarHBondContact O-N 3.28Å; M568-E571 PolarHBondContact O-N 2.82Å; M568-D572 PolarHBondContact O-N 3.41Å
569	L	93.6	Very high	92.3	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-49.9	-40.2	-172.7	-156.1	67.9	0	0	0	115.8	V451 I486 V490 I523 L530 V565 E571 D572 I573	V451-L569 HydrophobicContact CG1-CD2 4.37Å; I486-L569 HydrophobicContact CG2-CD2 4.49Å; V490-L569 HydrophobicContact CB-CD2 4.3Å; V490-L569 HydrophobicContact CG1-CD2 4.06Å; V490-L569 HydrophobicContact CG2-CD2 3.27Å; V490-L569 HydrophobicContact CG2-CG 4.3Å; I523-L569 HydrophobicContact CG2-CD1 4.29Å; L530-L569 HydrophobicContact CD1-CD2 3.63Å; V565-L569 PolarHBondContact O-N 2.99Å; V565-L569 VanDerWaalsContact O-N 3.12Å; L569-E571 VanDerWaalsContact C-N 3.31Å; L569-E571 PolarHBondContact O-N 3.04Å; L569-D572 PolarHBondContact O-N 2.97Å; L569-I573 HydrophobicContact CG-CD1 3.98Å; L569-I573 WeakPolarHBondContact O-CB 3.38Å; L569-I573 VanDerWaalsContact O-CG1 3.32Å; L569-I573 WeakPolarHBondContact O-CG1 3.25Å; L569-I573 PolarHBondContact O-N 2.89Å
570	P	93.9	Very high	92.5	Very high	20 Å²	20	47.1 Å²	47.1	13%	0.13	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-32.3	177.7	-23.5	35.6	0	0	0	113.9	V452 V455 A566 K574	V452-P570 HydrophobicContact CG2-CB 4.05Å; V455-P570 HydrophobicContact CB-CG 4.01Å; V455-P570 HydrophobicContact CG1-CG 3.89Å; V455-P570 HydrophobicContact CG2-CG 3.98Å; A566-P570 WeakPolarHBondContact O-CD 3.26Å; P570-K574 WeakPolarHBondContact O-CB 3.4Å; P570-K574 PolarHBondContact O-N 3.02Å
571	E	93.3	Very high	92.6	Very high	91 Å²	91	45.8 Å²	45.8	43%	0.425	21%	0.214	S	C	.	.	H	α-helix	trans	-78.2	-35	179.2	-72	-64.4	141.2	0	0	111.6	M568 L569 K574 R575	M568-E571 PolarHBondContact O-N 2.82Å; L569-E571 VanDerWaalsContact C-N 3.31Å; L569-E571 PolarHBondContact O-N 3.04Å; E571-K574 PolarHBondContact O-N 3.32Å; E571-K574 IonicContact OE1-NZ 2.71Å; E571-K574 PolarHBondContact OE1-NZ 3.05Å; E571-K574 IonicContact OE2-NZ 2.75Å; E571-K574 PolarHBondContact OE2-NZ 3.44Å; E571-R575 VanDerWaalsContact O-CG 3.26Å; E571-R575 WeakPolarHBondContact O-CG 3.43Å; E571-R575 PolarHBondContact O-N 3.31Å
572	D	93.4	Very high	92.6	Very high	25 Å²	25	46.2 Å²	46.2	13%	0.134	23%	0.233	C	C	.	.	H	α-helix	trans	-67.1	-44.3	173	-66.2	-31.7	0	0	0	111.5	I523 M568 L569 K574 R575 F576	I523-D572 HydrophobicContact CD1-CB 4.4Å; I523-D572 HydrophobicContact CG1-CB 3.83Å; M568-D572 PolarHBondContact O-N 3.41Å; L569-D572 PolarHBondContact O-N 2.97Å; D572-K574 VanDerWaalsContact C-N 3.33Å; D572-K574 PolarHBondContact O-N 2.94Å; D572-R575 WeakPolarHBondContact O-CB 3.45Å; D572-R575 PolarHBondContact O-N 2.93Å; D572-R575 VanDerWaalsContact O-N 3.16Å; D572-F576 PolarHBondContact O-N 2.89Å
573	I	94.3	Very high	92.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.6	-43.5	173.7	-75.9	171.1	0	0	0	111.2	Q448 V451 F493 I523 L569 R575 F576 A577	Q448-I573 HydrophobicContact CB-CG2 4.06Å; Q448-I573 HydrophobicContact CG-CG2 4.05Å; V451-I573 HydrophobicContact CB-CD1 3.9Å; V451-I573 HydrophobicContact CG1-CD1 3.53Å; V451-I573 HydrophobicContact CG2-CD1 3.93Å; F493-I573 HydrophobicContact CD1-CD1 4.25Å; F493-I573 HydrophobicContact CD1-CG1 3.94Å; F493-I573 HydrophobicContact CD2-CG2 4.01Å; F493-I573 HydrophobicContact CE1-CB 4.44Å; F493-I573 HydrophobicContact CE1-CG1 3.79Å; F493-I573 HydrophobicContact CE1-CG2 4.41Å; F493-I573 HydrophobicContact CE2-CB 4.49Å; F493-I573 HydrophobicContact CE2-CG2 3.65Å; F493-I573 HydrophobicContact CG-CD1 4.4Å; F493-I573 HydrophobicContact CG-CG1 4.38Å; F493-I573 HydrophobicContact CZ-CB 4.22Å; F493-I573 HydrophobicContact CZ-CG1 4.07Å; F493-I573 HydrophobicContact CZ-CG2 3.85Å; I523-I573 HydrophobicContact CD1-CG1 4.07Å; I523-I573 HydrophobicContact CG2-CG1 4.3Å; L569-I573 HydrophobicContact CG-CD1 3.98Å; L569-I573 WeakPolarHBondContact O-CB 3.38Å; L569-I573 VanDerWaalsContact O-CG1 3.32Å; L569-I573 WeakPolarHBondContact O-CG1 3.25Å; L569-I573 PolarHBondContact O-N 2.89Å; I573-R575 VanDerWaalsContact C-N 3.35Å; I573-R575 PolarHBondContact O-N 2.79Å; I573-F576 PolarHBondContact O-N 3.15Å; I573-A577 VanDerWaalsContact O-CB 3.3Å; I573-A577 WeakPolarHBondContact O-CB 3.18Å; I573-A577 PolarHBondContact O-N 3.28Å
574	K	93.9	Very high	92.1	Very high	84 Å²	84	47.5 Å²	47.5	37%	0.365	24%	0.241	S	C	.	.	H	α-helix	trans	-64.4	-34	175.4	174.1	-180	162.9	-148.5	0	112.8	P570 E571 D572 S578	P570-K574 WeakPolarHBondContact O-CB 3.4Å; P570-K574 PolarHBondContact O-N 3.02Å; E571-K574 PolarHBondContact O-N 3.32Å; E571-K574 IonicContact OE1-NZ 2.71Å; E571-K574 PolarHBondContact OE1-NZ 3.05Å; E571-K574 IonicContact OE2-NZ 2.75Å; E571-K574 PolarHBondContact OE2-NZ 3.44Å; D572-K574 VanDerWaalsContact C-N 3.33Å; D572-K574 PolarHBondContact O-N 2.94Å; K574-S578 VanDerWaalsContact O-CB 3.31Å; K574-S578 WeakPolarHBondContact O-CB 3.45Å; K574-S578 PolarHBondContact O-N 3.22Å; K574-S578 PolarHBondContact O-OG 3.49Å
575	R	93.9	Very high	91.7	Very high	146 Å²	146	52 Å²	52	55%	0.551	25%	0.252	S	S	*	.	H	α-helix	trans	-65.1	-48	171	-70.9	162.6	-173.5	-103.5	0.9	111.2	E571 D572 I573 S578 I579	E571-R575 VanDerWaalsContact O-CG 3.26Å; E571-R575 WeakPolarHBondContact O-CG 3.43Å; E571-R575 PolarHBondContact O-N 3.31Å; D572-R575 WeakPolarHBondContact O-CB 3.45Å; D572-R575 PolarHBondContact O-N 2.93Å; D572-R575 VanDerWaalsContact O-N 3.16Å; I573-R575 VanDerWaalsContact C-N 3.35Å; I573-R575 PolarHBondContact O-N 2.79Å; R575-S578 PolarHBondContact O-N 2.85Å; R575-I579 WeakPolarHBondContact O-CG1 3.21Å; R575-I579 PolarHBondContact O-N 2.85Å
576	F	94.4	Very high	91.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.3	-49.7	176.1	-175.9	-83.7	0	0	0	111.6	F493 A497 I516 Q519 M520 I523 D572 I573 S578 I579 V580	F493-F576 HydrophobicContact CE1-CD1 4.19Å; F493-F576 HydrophobicContact CE1-CG 4.43Å; F493-F576 HydrophobicContact CE2-CD1 4.32Å; F493-F576 HydrophobicContact CZ-CB 4.09Å; F493-F576 AromaticContact CZ-CD1 3.49Å; F493-F576 HydrophobicContact CZ-CD1 3.49Å; F493-F576 VanDerWaalsContact CZ-CD1 3.49Å; F493-F576 HydrophobicContact CZ-CE1 4.19Å; F493-F576 AromaticContact CZ-CG 3.99Å; F493-F576 HydrophobicContact CZ-CG 3.99Å; A497-F576 HydrophobicContact CB-CD1 4.47Å; A497-F576 HydrophobicContact CB-CE1 3.66Å; A497-F576 HydrophobicContact CB-CE2 4.04Å; A497-F576 HydrophobicContact CB-CZ 3.42Å; A497-F576 VanDerWaalsContact CB-CZ 3.42Å; I516-F576 HydrophobicContact CG2-CE2 3.92Å; I516-F576 HydrophobicContact CG2-CZ 4.33Å; Q519-F576 HydrophobicContact CB-CD2 4.27Å; M520-F576 HydrophobicContact CB-CE2 4.21Å; I523-F576 HydrophobicContact CD1-CB 3.82Å; I523-F576 HydrophobicContact CD1-CG 4.36Å; D572-F576 PolarHBondContact O-N 2.89Å; I573-F576 PolarHBondContact O-N 3.15Å; F576-S578 VanDerWaalsContact C-N 3.3Å; F576-S578 PolarHBondContact O-N 3.45Å; F576-I579 WeakPolarHBondContact O-CB 3.41Å; F576-I579 PolarHBondContact O-N 3.45Å; F576-V580 HydrophobicContact CD1-CG2 3.82Å; F576-V580 HydrophobicContact CE1-CG2 3.44Å; F576-V580 VanDerWaalsContact CE1-CG2 3.44Å; F576-V580 HydrophobicContact CZ-CG2 3.94Å; F576-V580 WeakPolarHBondContact O-CG2 3.38Å; F576-V580 PolarHBondContact O-N 3.41Å
577	A	93.3	Very high	90.5	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-54.4	-44.5	175.5	0	0	0	0	0	112.2	V444 I573 I579 V580 I581	V444-A577 HydrophobicContact CG1-CB 3.37Å; I573-A577 VanDerWaalsContact O-CB 3.3Å; I573-A577 WeakPolarHBondContact O-CB 3.18Å; I573-A577 PolarHBondContact O-N 3.28Å; A577-I579 VanDerWaalsContact C-N 3.32Å; A577-I579 PolarHBondContact O-N 3.19Å; A577-V580 PolarHBondContact O-N 3.48Å; A577-I581 WeakPolarHBondContact O-CB 3.09Å; A577-I581 VanDerWaalsContact O-CG1 3.28Å; A577-I581 WeakPolarHBondContact O-CG1 3.28Å; A577-I581 PolarHBondContact O-N 2.86Å
578	S	93.6	Very high	90	Very high	69 Å²	69	50.7 Å²	50.7	48%	0.483	25%	0.253	S	S	.	.	H	α-helix	trans	-61.8	-37.9	176.1	-59.7	0	0	0	0	112.5	K574 R575 F576 A582	K574-S578 VanDerWaalsContact O-CB 3.31Å; K574-S578 WeakPolarHBondContact O-CB 3.45Å; K574-S578 PolarHBondContact O-N 3.22Å; K574-S578 PolarHBondContact O-OG 3.49Å; R575-S578 PolarHBondContact O-N 2.85Å; F576-S578 VanDerWaalsContact C-N 3.3Å; F576-S578 PolarHBondContact O-N 3.45Å; S578-A582 WeakPolarHBondContact O-CB 3.27Å; S578-A582 PolarHBondContact O-N 3.49Å
579	I	91.5	Very high	88.9	Confident	17 Å²	17	53.2 Å²	53.2	9%	0.087	26%	0.261	C	S	.	.	H	α-helix	trans	-67.3	-45.8	175.5	-67.3	163.4	0	0	0	110.6	L512 I516 Q519 R575 F576 A577 N583	L512-I579 HydrophobicContact CD1-CG2 4.02Å; I516-I579 HydrophobicContact CD1-CG2 4.37Å; I516-I579 HydrophobicContact CG1-CG2 3.71Å; Q519-I579 HydrophobicContact CG-CD1 3.83Å; R575-I579 WeakPolarHBondContact O-CG1 3.21Å; R575-I579 PolarHBondContact O-N 2.85Å; F576-I579 WeakPolarHBondContact O-CB 3.41Å; F576-I579 PolarHBondContact O-N 3.45Å; A577-I579 VanDerWaalsContact C-N 3.32Å; A577-I579 PolarHBondContact O-N 3.19Å; I579-N583 WeakPolarHBondContact O-CB 3.33Å; I579-N583 PolarHBondContact O-N 3.39Å; I579-N583 PolarHBondContact O-ND2 3.38Å
580	V	90.6	Very high	87.2	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-64.7	-44.7	179.8	178.1	0	0	0	0	111.5	V444 V500 F576 A577 N583 G584 L587 F588	V444-V580 HydrophobicContact CG2-CB 4.38Å; V444-V580 HydrophobicContact CG2-CG1 3.96Å; V500-V580 HydrophobicContact CG1-CG1 4.17Å; V500-V580 HydrophobicContact CG1-CG2 3.89Å; F576-V580 HydrophobicContact CD1-CG2 3.82Å; F576-V580 HydrophobicContact CE1-CG2 3.44Å; F576-V580 VanDerWaalsContact CE1-CG2 3.44Å; F576-V580 HydrophobicContact CZ-CG2 3.94Å; F576-V580 WeakPolarHBondContact O-CG2 3.38Å; F576-V580 PolarHBondContact O-N 3.41Å; A577-V580 PolarHBondContact O-N 3.48Å; V580-N583 CarbonylContact O-C 3.58Å; V580-N583 PolarHBondContact O-N 2.89Å; V580-G584 VanDerWaalsContact O-CA 3.25Å; V580-G584 WeakPolarHBondContact O-CA 3.33Å; V580-G584 PolarHBondContact O-N 2.9Å; V580-L587 HydrophobicContact CB-CD1 4.41Å; V580-L587 HydrophobicContact CG1-CD1 4.19Å; V580-F588 HydrophobicContact CG1-CE2 3.82Å; V580-F588 HydrophobicContact CG1-CZ 4.12Å
581	I	89.7	Confident	84.8	Confident	67 Å²	67	61.2 Å²	61.2	34%	0.344	30%	0.3	S	S	.	.	H	α-helix	trans	-66.5	-44.1	179.4	-65.9	166.7	0	0	0	111	K441 V444 M445 A577 N583 G584	K441-I581 HydrophobicContact CG-CG1 4.39Å; V444-I581 HydrophobicContact CG1-CD1 4.04Å; V444-I581 HydrophobicContact CG1-CG1 4.26Å; M445-I581 HydrophobicContact CG-CD1 4.15Å; A577-I581 WeakPolarHBondContact O-CB 3.09Å; A577-I581 VanDerWaalsContact O-CG1 3.28Å; A577-I581 WeakPolarHBondContact O-CG1 3.28Å; A577-I581 PolarHBondContact O-N 2.86Å; I581-N583 VanDerWaalsContact C-N 3.34Å; I581-N583 PolarHBondContact O-N 2.87Å; I581-G584 PolarHBondContact O-N 2.89Å
582	A	89.6	Confident	82.4	Confident	82 Å²	82	62 Å²	62	68%	0.678	31%	0.314	S	S	*	.	H	α-helix	trans	-65.9	-34.3	179.9	0	0	0	0	0	113.3	S578	S578-A582 WeakPolarHBondContact O-CB 3.27Å; S578-A582 PolarHBondContact O-N 3.49Å
583	N	88.8	Confident	80	Confident	32 Å²	32	69.1 Å²	69.1	17%	0.171	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	11.4	-179.1	-58.8	-83.6	0	0	0	113	L512 I579 V580 I581 R585 L586 L587	L512-N583 HydrophobicContact CD1-CB 3.88Å; L512-N583 VanDerWaalsContact CD1-CG 3.44Å; L512-N583 HydrophobicContact CD2-CB 3.75Å; L512-N583 HydrophobicContact CG-CB 4.5Å; I579-N583 WeakPolarHBondContact O-CB 3.33Å; I579-N583 PolarHBondContact O-N 3.39Å; I579-N583 PolarHBondContact O-ND2 3.38Å; V580-N583 CarbonylContact O-C 3.58Å; V580-N583 PolarHBondContact O-N 2.89Å; I581-N583 VanDerWaalsContact C-N 3.34Å; I581-N583 PolarHBondContact O-N 2.87Å; N583-R585 VanDerWaalsContact C-N 3.26Å; N583-R585 PolarHBondContact O-N 2.98Å; N583-R585 VanDerWaalsContact O-N 3.15Å; N583-L586 WeakPolarHBondContact O-CB 3.14Å; N583-L586 PolarHBondContact O-N 3.45Å; N583-L587 HydrophobicContact CB-CD1 4.07Å; N583-L587 HydrophobicContact CB-CG 4.47Å; N583-L587 PolarHBondContact O-N 2.68Å; N583-L587 VanDerWaalsContact O-N 3.09Å
584	G	84.9	Confident	77.6	Confident	2 Å²	2	78.3 Å²	78.3	2%	0.021	39%	0.387	C	S	.	.	H	α-helix	trans	-56.9	-36.1	-170.8	0	0	0	0	0	114	L437 V580 I581 L586 L587 F588	L437-G584 WeakPolarHBondContact CD1-O 3.31Å; V580-G584 VanDerWaalsContact O-CA 3.25Å; V580-G584 WeakPolarHBondContact O-CA 3.33Å; V580-G584 PolarHBondContact O-N 2.9Å; I581-G584 PolarHBondContact O-N 2.89Å; G584-L586 PolarHBondContact O-N 2.63Å; G584-L587 PolarHBondContact O-N 3.08Å; G584-F588 WeakPolarHBondContact O-CD2 3.41Å; G584-F588 PolarHBondContact O-N 2.7Å
585	R	82.3	Confident	74.8	Confident	200 Å²	200	83.5 Å²	83.5	76%	0.755	41%	0.412	S	S	*	.	H	α-helix	trans	-65	-16.6	176.1	-69.9	-176.8	176.8	-130.9	0.2	114.6	L437 N583	L437-R585 HydrophobicContact CD2-CG 4.06Å; N583-R585 VanDerWaalsContact C-N 3.26Å; N583-R585 PolarHBondContact O-N 2.98Å; N583-R585 VanDerWaalsContact O-N 3.15Å
586	L	81.1	Confident	72.1	Confident	107 Å²	107	85.3 Å²	85.3	56%	0.56	43%	0.427	S	S	*	.	H	α-helix	trans	-94.9	-43.1	173.1	-57.8	175.2	0	0	0	110.2	L507 L512 N583 G584	L507-L586 HydrophobicContact CD1-CB 4.23Å; L507-L586 VanDerWaalsContact CD2-O 3.3Å; L507-L586 WeakPolarHBondContact CD2-O 3.23Å; L512-L586 HydrophobicContact CD2-CD1 4.16Å; N583-L586 WeakPolarHBondContact O-CB 3.14Å; N583-L586 PolarHBondContact O-N 3.45Å; G584-L586 PolarHBondContact O-N 2.63Å
587	L	79.5	Confident	69	Low	3 Å²	3	92.3 Å²	92.3	2%	0.016	47%	0.47	C	S	.	.	H	α-helix	trans	-71	-29.8	-177.5	-68.1	164.7	0	0	0	113.8	V500 T503 A504 L507 I516 V580 N583 G584	V500-L587 HydrophobicContact CG1-CD1 4.15Å; V500-L587 HydrophobicContact CG1-CD2 4.22Å; T503-L587 WeakPolarHBondContact CG2-O 3.26Å; A504-L587 HydrophobicContact CB-CD2 3.64Å; L507-L587 HydrophobicContact CD1-CD2 3.79Å; L507-L587 HydrophobicContact CD1-CG 4.35Å; I516-L587 HydrophobicContact CD1-CD1 4.06Å; I516-L587 HydrophobicContact CD1-CD2 3.68Å; I516-L587 HydrophobicContact CD1-CG 4.45Å; V580-L587 HydrophobicContact CB-CD1 4.41Å; V580-L587 HydrophobicContact CG1-CD1 4.19Å; N583-L587 HydrophobicContact CB-CD1 4.07Å; N583-L587 HydrophobicContact CB-CG 4.47Å; N583-L587 PolarHBondContact O-N 2.68Å; N583-L587 VanDerWaalsContact O-N 3.09Å; G584-L587 PolarHBondContact O-N 3.08Å
588	F	82.4	Confident	66.3	Low	7 Å²	7	98.7 Å²	98.7	3%	0.031	51%	0.508	C	S	.	.	S	Bend	trans	-127.1	130.5	-176.7	-51.9	-73.2	0	0	0	110.3	L435 L437 A440 V500 V580 G584 Q590	L435-F588 WeakPolarHBondContact O-CD1 3.33Å; L437-F588 HydrophobicContact CB-CB 4.2Å; L437-F588 HydrophobicContact CD1-CB 4.32Å; L437-F588 HydrophobicContact CD1-CD2 4.04Å; A440-F588 HydrophobicContact CB-CD1 3.99Å; A440-F588 HydrophobicContact CB-CD2 3.85Å; A440-F588 HydrophobicContact CB-CE1 3.73Å; A440-F588 HydrophobicContact CB-CE2 3.57Å; A440-F588 HydrophobicContact CB-CG 4.06Å; A440-F588 HydrophobicContact CB-CZ 3.52Å; V500-F588 HydrophobicContact CG1-CZ 4.27Å; V500-F588 HydrophobicContact CG2-CE1 4.38Å; V500-F588 HydrophobicContact CG2-CZ 3.89Å; V580-F588 HydrophobicContact CG1-CE2 3.82Å; V580-F588 HydrophobicContact CG1-CZ 4.12Å; G584-F588 WeakPolarHBondContact O-CD2 3.41Å; G584-F588 PolarHBondContact O-N 2.7Å; F588-Q590 PolarHBondContact O-N 3.47Å
589	K	69.6	Low	63.4	Low	162 Å²	162	103.1 Å²	103.1	70%	0.704	52%	0.521	S	S	*	.			trans	-67.7	101.3	174.8	-68.8	163.2	-175.7	152.9	0	108.3	E432 N591	E432-K589 IonicContact OE1-NZ 2.9Å; E432-K589 PolarHBondContact OE1-NZ 3.02Å; K589-N591 PolarHBondContact O-N 2.69Å
590	Q	56.5	Low	60.4	Low	86 Å²	86	109.2 Å²	109.2	40%	0.402	55%	0.554	S	S	.	*			trans	-64.4	126	175.2	-174.9	164.2	10	0	0	109.5	L437 F588 C592	L437-Q590 HydrophobicContact CD2-CB 4.19Å; L437-Q590 HydrophobicContact CD2-CG 4.19Å; F588-Q590 PolarHBondContact O-N 3.47Å; Q590-C592 VanDerWaalsContact C-N 3.27Å; Q590-C592 PolarHBondContact O-N 3.12Å
591	N	44.7	Very low	57.4	Low	102 Å²	102	115.1 Å²	115.1	55%	0.545	59%	0.59	S	S	.	*			trans	-72.4	73.4	-176.3	-74.4	-67.8	0	0	0	112.3	D436 K589 E593	D436-N591 PolarHBondContact OD1-ND2 3.28Å; K589-N591 PolarHBondContact O-N 2.69Å; N591-E593 PolarHBondContact O-N 3.36Å
592	C	43	Very low	54.9	Low	109 Å²	109	117.1 Å²	117.1	74%	0.736	61%	0.607	S	S	*	*			trans	-74.4	60	168.4	-68.6	0	0	0	0	111.7	Q590	Q590-C592 VanDerWaalsContact C-N 3.27Å; Q590-C592 PolarHBondContact O-N 3.12Å
593	E	42.5	Very low	51.9	Low	174 Å²	174	120.9 Å²	120.9	81%	0.813	62%	0.616	S	S	*	*			trans	179.9	93.7	163.2	-107.6	167.1	-138.9	0	0	110.1	N591	N591-E593 PolarHBondContact O-N 3.36Å
594	K	43.4	Very low	49.1	Very low	192 Å²	192	123.5 Å²	123.5	84%	0.835	64%	0.641	S	S	*	*			trans	-170.9	31.9	160.5	-108.5	148.2	-163.7	164.9	0	117.1
595	E	35.2	Very low	46.4	Very low	194 Å²	194	132.4 Å²	132.4	91%	0.907	68%	0.683	S	S	*	*	S	Bend	trans	-166.3	118	162.6	-106.7	162.6	-163.8	0	0	104.4
596	E	37.3	Very low	43.8	Very low	184 Å²	184	132.8 Å²	132.8	86%	0.86	69%	0.69	S	S	*	*	S	Bend	cis	-120.7	142.3	10	-54.2	162.8	106.4	0	0	111.5
597	T	30.7	Very low	41.3	Very low	146 Å²	146	137.6 Å²	137.6	90%	0.896	71%	0.706	S	S	*	*			trans	-164.5	73.8	157.2	-1.4	0	0	0	0	113.7
598	V	35.1	Very low	38.8	Very low	135 Å²	135	143.2 Å²	143.2	82%	0.818	75%	0.745	S	S	*	*			trans	-144.9	110.3	169.1	178.2	0	0	0	0	104.5
599	Q	32.6	Very low	36.2	Very low	162 Å²	162	150.1 Å²	150.1	76%	0.757	78%	0.782	S	S	*	*			cis	-135.4	161.1	23.4	-52.5	172	3.1	0	0	108.9
600	L	29.8	Very low	34.2	Very low	146 Å²	146	151.1 Å²	151.1	76%	0.764	79%	0.787	S	S	*	*				-168.2	134.9	74.4	-84.2	166.6	0	0	0	112.1
601	T	27.8	Very low	32.8	Very low	126 Å²	126	152.5 Å²	152.5	77%	0.773	80%	0.804	S	S	*	*			trans	42.2	132.1	152.7	50.8	0	0	0	0	122.6
602	P	36	Very low	32.1	Very low	108 Å²	108	155.1 Å²	155.1	70%	0.701	82%	0.817	S	S	*	*			trans	-88.7	-174.4	174.3	39.4	-38	0	0	0	114.1
603	N	26	Very low	31.4	Very low	162 Å²	162	158 Å²	158	87%	0.866	82%	0.819	S	S	*	*			trans	90.3	138	-176.5	-50.3	-44.5	0	0	0	113.2
604	A	31	Very low	31.3	Very low	86 Å²	86	154.9 Å²	154.9	71%	0.711	81%	0.814	S	S	*	*			cis	-149.6	173.2	8.8	0	0	0	0	0	114.1
605	E	27.4	Very low	30.8	Very low	190 Å²	190	151.7 Å²	151.7	89%	0.888	81%	0.813	S	S	*	*			trans	73.6	139.3	157	-69.6	-178.1	-168.5	0	0	121.6
606	F	29.3	Very low	30.3	Very low	207 Å²	207	150.3 Å²	150.3	91%	0.908	81%	0.806	S	S	*	*			trans	-93.1	144.3	178.4	-68.9	-111.1	0	0	0	111.1
607	K	27.6	Very low	29.9	Very low	208 Å²	208	151.7 Å²	151.7	90%	0.904	80%	0.804	S	S	*	*				-169.2	130.3	126.3	-107.4	157.6	-174.2	170.8	0	112.3
608	C	27.7	Very low	29.7	Very low	122 Å²	122	153.2 Å²	153.2	82%	0.824	80%	0.801	S	S	*	*			trans	-79.9	147.3	157.4	-54.5	0	0	0	0	108.9
609	D	27.1	Very low	29.3	Very low	151 Å²	151	151.9 Å²	151.9	81%	0.807	79%	0.793	S	S	*	*				-165.4	161.3	115.1	-130.5	-31.8	0	0	0	114.5
610	K	27.5	Very low	28.9	Very low	184 Å²	184	152.9 Å²	152.9	80%	0.8	80%	0.798	S	S	*	*			trans	55.9	106.4	163.6	-77.2	-179.6	175.3	173.9	0	121.5
611	C	26.9	Very low	28.7	Very low	114 Å²	114	151 Å²	151	77%	0.77	80%	0.797	S	S	*	*			trans	-59.2	145.8	147.3	171.4	0	0	0	0	113
612	I	30.5	Very low	28.6	Very low	158 Å²	158	153.2 Å²	153.2	81%	0.81	80%	0.798	S	S	*	*			trans	-158.5	144.2	147.9	-98.7	149.9	0	0	0	107.1
613	Q	28.8	Very low	28.2	Very low	169 Å²	169	156.8 Å²	156.8	79%	0.79	81%	0.805	S	S	*	*			trans	-94.5	-163	175.4	-52.1	-167.9	-20.3	0	0	112.4
614	P	40.4	Very low	28.1	Very low	109 Å²	109	158.1 Å²	158.1	71%	0.708	80%	0.803	S	S	*	*				-108.7	172.3	-127.7	36.7	-18	0	0	0	114.4
615	P	31.1	Very low	27.9	Very low	124 Å²	124	159.6 Å²	159.6	81%	0.805	81%	0.809	S	S	*	*			trans	-92.4	148.4	162.4	34.7	-30.3	0	0	0	112.4
616	Q	25.8	Very low	27.8	Very low	165 Å²	165	157 Å²	157	77%	0.771	81%	0.806	S	S	*	*			trans	-92.4	166.1	166.8	-62.8	-177.3	-72.6	0	0	111
617	R	29.3	Very low	28.2	Very low	213 Å²	213	152.7 Å²	152.7	80%	0.804	80%	0.799	S	S	*	*			trans	31.2	129.7	149.7	-61.3	173.8	177.3	174.1	-1.3	118.2
618	E	25.9	Very low	28	Very low	178 Å²	178	147.4 Å²	147.4	83%	0.832	79%	0.788	S	S	*	*				-165.6	136	83.4	-91.8	167.9	-175.8	0	0	108.7
619	T	26.6	Very low	27.8	Very low	108 Å²	108	147.3 Å²	147.3	66%	0.663	78%	0.784	S	S	*	*				87.4	133.1	75.2	-51.5	0	0	0	0	113.2
620	E	24.9	Very low	28	Very low	182 Å²	182	148.7 Å²	148.7	85%	0.85	78%	0.782	S	S	*	*			trans	67.2	155.7	168.6	-87	164.2	-131.4	0	0	118.2
621	S	25.5	Very low	27.9	Very low	106 Å²	106	147.6 Å²	147.6	74%	0.741	78%	0.78	S	S	*	*			cis	-148.6	178.7	-3.8	52.3	0	0	0	0	112
622	H	26.3	Very low	27.9	Very low	174 Å²	174	150.9 Å²	150.9	81%	0.806	78%	0.776	S	S	*	*			trans	-80.5	151.6	-179.4	-47.9	-89.6	0	0	0	113.8
623	Q	26.8	Very low	27.7	Very low	183 Å²	183	150 Å²	150	86%	0.855	77%	0.769	S	S	*	*				176.6	121.8	108.5	-95.5	178.3	63.4	0	0	116.4
624	K	24.2	Very low	27.5	Very low	189 Å²	189	148.3 Å²	148.3	82%	0.822	77%	0.765	S	S	*	*				29.7	111.1	124.2	-175	-171.9	179.8	-175.7	0	119.3
625	S	25.6	Very low	26.8	Very low	118 Å²	118	152 Å²	152	83%	0.825	77%	0.773	S	S	*	*				-174.4	140.1	119.8	39.4	0	0	0	0	114.3
626	T	25.5	Very low	26.6	Very low	134 Å²	134	154.4 Å²	154.4	82%	0.822	77%	0.773	S	S	*	*			trans	-106.8	158.4	157.3	52.4	0	0	0	0	107.7
627	P	37.7	Very low	26.7	Very low	118 Å²	118	151.8 Å²	151.8	77%	0.766	77%	0.773	S	S	*	*				-155.3	153.3	92.7	39.1	-20.1	0	0	0	118
628	S	23.5	Very low	26.6	Very low	96 Å²	96	146.4 Å²	146.4	67%	0.671	77%	0.768	S	S	*	*			trans	46.3	132.4	134.9	-174.8	0	0	0	0	122.3
629	T	24.7	Very low	26.5	Very low	120 Å²	120	145.8 Å²	145.8	74%	0.736	77%	0.765	S	S	*	*				-174.3	124.7	98.5	-72.7	0	0	0	0	116
630	K	30.2	Very low	26.5	Very low	180 Å²	180	146.4 Å²	146.4	78%	0.783	76%	0.764	S	S	*	*			trans	10.2	140.9	147.6	-49.6	174.1	-175	176	0	119.4
631	Q	25	Very low	26.6	Very low	161 Å²	161	144 Å²	144	75%	0.752	76%	0.756	S	S	*	*				-160.5	145	72	-88.5	-176.9	-122.9	0	0	112.2
632	R	27.4	Very low	26.7	Very low	183 Å²	183	147.2 Å²	147.2	69%	0.691	76%	0.757	S	S	*	*				59.7	149.1	110.3	-57.9	-153.2	-164.4	-173.3	2.7	116.7
633	E	26.6	Very low	26.9	Very low	140 Å²	140	147.2 Å²	147.2	65%	0.654	75%	0.754	S	S	*	*			cis	-161.5	157.5	9.8	-124.7	142.4	171.2	0	0	107.7
634	D	24.2	Very low	26.8	Very low	134 Å²	134	144.8 Å²	144.8	72%	0.717	75%	0.747	S	S	*	*			cis	-169.8	-160	-37.9	-121	-78.1	0	0	0	109.5
635	E	25.9	Very low	26.8	Very low	186 Å²	186	146.4 Å²	146.4	87%	0.869	75%	0.748	S	S	*	*			trans	84.9	167	166.6	-62.1	-148.5	112.2	0	0	121.9
636	H	26.6	Very low	26.8	Very low	175 Å²	175	144.6 Å²	144.6	81%	0.81	74%	0.74	S	S	*	*			trans	-139	151.2	-142.3	-83.2	-84.6	0	0	0	117.5
637	S	28.2	Very low	26.7	Very low	110 Å²	110	144.9 Å²	144.9	77%	0.769	74%	0.737	S	S	*	*			trans	179.5	137.4	131.8	25.6	0	0	0	0	109.4
638	S	27.4	Very low	26.1	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	74%	0.736	S	S	*	*				76.9	136.7	54.8	-59.2	0	0	0	0	112.8
639	E	23.5	Very low	26.2	Very low	164 Å²	164	147 Å²	147	77%	0.766	74%	0.74	S	S	*	*			cis	-160.1	179.6	11.2	-132.6	177.2	110.8	0	0	115.4
640	L	26.1	Very low	26.2	Very low	121 Å²	121	148.8 Å²	148.8	63%	0.634	74%	0.74	S	S	*	*			trans	-5.3	167.9	165.6	-94.2	97.1	0	0	0	123.4
641	L	27.5	Very low	25.9	Very low	133 Å²	133	147.6 Å²	147.6	70%	0.696	74%	0.737	S	S	*	*			cis	175.6	165.8	-36.4	-141.2	143.2	0	0	0	110.2
642	K	27.8	Very low	25.7	Very low	172 Å²	172	145.8 Å²	145.8	75%	0.748	74%	0.737	S	S	*	*			trans	82.8	131.5	162.9	-54.1	160.3	-170.8	167.1	0	116.5
643	K	30	Very low	25.7	Very low	174 Å²	174	143.9 Å²	143.9	76%	0.757	74%	0.74	S	S	*	*			cis	115.2	107.1	8.2	-176.3	179.5	179.2	178.6	0	114
644	N	25.2	Very low	26.2	Very low	132 Å²	132	143.4 Å²	143.4	71%	0.706	75%	0.749	S	S	*	*			trans	70.4	160.2	150.3	-65.9	6.3	0	0	0	118.9
645	R	24	Very low	26.3	Very low	224 Å²	224	143.6 Å²	143.6	85%	0.845	75%	0.75	S	S	*	*			cis	-174.5	126.4	-16.7	163.3	-178.6	-180	175.9	2.2	112.2
646	A	25.3	Very low	26.3	Very low	79 Å²	79	142.7 Å²	142.7	65%	0.653	75%	0.75	S	S	*	*			trans	56.9	148.3	145.6	0	0	0	0	0	125.6
647	N	24.5	Very low	26.5	Very low	140 Å²	140	140.9 Å²	140.9	75%	0.749	74%	0.742	S	S	*	*			trans	86.4	112.2	143.3	-71.6	4.3	0	0	0	125.4
648	I	24.6	Very low	26.6	Very low	148 Å²	148	143.2 Å²	143.2	76%	0.759	74%	0.739	S	S	*	*				75.2	108.9	119.9	-63.2	172.9	0	0	0	122.5
649	C	26.5	Very low	26.6	Very low	111 Å²	111	146 Å²	146	75%	0.75	74%	0.738	S	S	*	*			trans	65.8	123.5	132.9	-164.5	0	0	0	0	124.1
650	Q	23.3	Very low	26.7	Very low	158 Å²	158	145.5 Å²	145.5	74%	0.738	74%	0.736	S	S	*	*				-170.5	153.3	122.1	-112.6	179.8	79.2	0	0	117
651	Q	23.8	Very low	26.8	Very low	154 Å²	154	149.1 Å²	149.1	72%	0.72	75%	0.747	S	S	*	*			trans	87.4	117.4	141.9	-83.4	-172.5	50.6	0	0	126.4
652	T	20.6	Very low	28	Very low	123 Å²	123	148.3 Å²	148.3	76%	0.755	75%	0.749	S	S	*	*				101.4	146.3	124.7	-56.4	0	0	0	0	121.9
653	L	29	Very low	27.9	Very low	144 Å²	144	148 Å²	148	75%	0.754	75%	0.754	S	S	*	*			trans	-110.5	167.1	-167.7	-80.6	161.1	0	0	0	113.3
654	P	36.1	Very low	27.6	Very low	130 Å²	130	147 Å²	147	84%	0.844	76%	0.756	S	S	*	*				-138.9	-169.5	99.5	37.2	-22.1	0	0	0	114.5
655	N	25.7	Very low	28	Very low	137 Å²	137	149 Å²	149	73%	0.733	76%	0.761	S	S	*	*			trans	-131.2	149	-154.9	-135.6	-28.6	0	0	0	113.3
656	L	26.8	Very low	28	Very low	167 Å²	167	147.4 Å²	147.4	87%	0.874	76%	0.763	S	S	*	*			trans	-155.9	145.4	140.2	-142.4	73.1	0	0	0	112.2
657	E	30.7	Very low	27.9	Very low	137 Å²	137	153.2 Å²	153.2	64%	0.64	77%	0.768	S	S	*	*			trans	-74.9	175.9	-170.3	-51.1	170.1	87.4	0	0	113.6
658	K	30.2	Very low	28.1	Very low	160 Å²	160	151.9 Å²	151.9	70%	0.696	76%	0.761	S	S	*	*			cis	-166.7	172.1	31.6	-131.7	138.7	-174.2	149.9	0	107
659	K	28.3	Very low	28.1	Very low	159 Å²	159	151 Å²	151	69%	0.691	76%	0.757	S	S	*	*			cis	-167.9	129.4	7.8	-167.4	-177.8	-177	-114.8	0	111.5
660	Q	24.5	Very low	28.3	Very low	152 Å²	152	153 Å²	153	71%	0.71	76%	0.756	S	S	*	*			trans	60.2	169.6	160.4	-72	170.8	-67.9	0	0	120
661	K	27.6	Very low	28.5	Very low	198 Å²	198	151.2 Å²	151.2	86%	0.861	75%	0.751	S	S	*	*				-170.1	159.1	-62.6	-110.8	-168	175.7	-170.5	0	109
662	P	53	Low	28.8	Very low	115 Å²	115	151.5 Å²	151.5	75%	0.747	75%	0.753	S	S	*	*			trans	-107.3	-179.7	-169.9	42	-36.2	0	0	0	114.3
663	I	25.2	Very low	29.1	Very low	166 Å²	166	151.1 Å²	151.1	85%	0.851	75%	0.746	S	S	*	*			trans	-166.1	132.4	148	-111.8	156.6	0	0	0	116.1
664	L	24.8	Very low	29.1	Very low	153 Å²	153	150.9 Å²	150.9	80%	0.801	75%	0.745	S	S	*	*			trans	51.5	146.5	141.2	-142.4	69.2	0	0	0	125.2
665	E	33.5	Very low	28.6	Very low	174 Å²	174	147.9 Å²	147.9	81%	0.813	74%	0.738	S	S	*	*			trans	-82.1	159.2	165.7	-51.7	161.3	93.1	0	0	112.9
666	Q	24	Very low	28.5	Very low	191 Å²	191	146.3 Å²	146.3	89%	0.893	73%	0.733	S	S	*	*			trans	-159.6	-177	147.4	-126.8	174.7	-10.3	0	0	114.7
667	R	23.9	Very low	28.4	Very low	200 Å²	200	147.2 Å²	147.2	76%	0.755	74%	0.735	S	S	*	*			trans	-163.4	170.9	-160.4	-122.3	-166.3	-47.8	110.8	3.8	108.2
668	L	27.9	Very low	28.1	Very low	113 Å²	113	147.2 Å²	147.2	59%	0.592	74%	0.739	S	S	*	*			cis	-133.5	-165.4	9.7	-48.6	74.7	0	0	0	110.6
669	D	25.2	Very low	28.4	Very low	129 Å²	129	145.3 Å²	145.3	69%	0.69	74%	0.743	S	S	*	*				34	151.9	128	-51.8	-15.9	0	0	0	120.5
670	E	30	Very low	28.1	Very low	152 Å²	152	140.5 Å²	140.5	71%	0.71	74%	0.739	S	S	*	*			cis	-167.4	151.7	4.9	-126.5	-176.3	122.9	0	0	112.6
671	N	27.8	Very low	28.9	Very low	121 Å²	121	139.2 Å²	139.2	65%	0.647	74%	0.744	S	S	*	*			trans	54.5	143.1	134.4	-80.4	-17.8	0	0	0	127.9
672	E	31.1	Very low	28.9	Very low	161 Å²	161	137.3 Å²	137.3	75%	0.752	74%	0.742	S	S	*	*			trans	62.3	158	151.6	-60	-48.8	75.2	0	0	123.5
673	D	26.2	Very low	27.6	Very low	115 Å²	115	136.5 Å²	136.5	62%	0.615	74%	0.735	S	S	*	*			cis	-172.1	163.2	-26.6	179.4	37.9	0	0	0	111.6
674	L	28.6	Very low	27.9	Very low	139 Å²	139	135 Å²	135	73%	0.728	74%	0.736	S	S	*	*			trans	50.4	153.1	164.6	-81.9	169	0	0	0	120.2	T676	L674-T676 WeakPolarHBondContact CD2-OG1 3.38Å
675	G	24.9	Very low	27.9	Very low	67 Å²	67	135.6 Å²	135.6	69%	0.691	74%	0.735	S	S	*	*			cis	157.1	-176	2.9	0	0	0	0	0	110
676	T	25.1	Very low	28.4	Very low	103 Å²	103	131.9 Å²	131.9	63%	0.632	73%	0.726	S	S	*	*			cis	-175.1	126.1	-26.1	-82.9	0	0	0	0	107.5	L674	L674-T676 WeakPolarHBondContact CD2-OG1 3.38Å
677	M	24.3	Very low	28.4	Very low	187 Å²	187	128.2 Å²	128.2	92%	0.921	72%	0.721	S	S	*	*			trans	-149.5	159.3	172.3	-102.4	-54.2	126.2	0	0	115.7
678	N	24.4	Very low	28.5	Very low	136 Å²	136	123.6 Å²	123.6	73%	0.727	72%	0.72	S	S	*	*			trans	-124.3	-177.2	-158.7	-111.5	-57.9	0	0	0	111.6
679	P	35.3	Very low	28.6	Very low	120 Å²	120	126.9 Å²	126.9	78%	0.779	73%	0.732	S	S	*	*			cis	-139.6	174.1	27.8	42.1	-22.4	0	0	0	118.6
680	G	23.3	Very low	28.9	Very low	58 Å²	58	130 Å²	130	60%	0.598	74%	0.743	S	S	*	*			trans	-85.4	-129.3	167.9	0	0	0	0	0	113.5
681	P	40.1	Very low	28.9	Very low	126 Å²	126	128.9 Å²	128.9	82%	0.818	75%	0.746	S	S	*	*			cis	-101.2	-151.5	22.4	10.8	13.9	0	0	0	111.4
682	L	27.7	Very low	29.8	Very low	158 Å²	158	128.6 Å²	128.6	83%	0.827	75%	0.751	S	S	*	*			cis	-146.9	178.7	22.4	-106.3	179.7	0	0	0	113.7
683	T	26.4	Very low	30.4	Very low	97 Å²	97	127.9 Å²	127.9	60%	0.595	75%	0.748	S	S	*	*			trans	-106.3	162.8	-167.1	13.5	0	0	0	0	113	Q685	T683-Q685 HydrophobicContact CG2-CB 4.13Å; T683-Q685 HydrophobicContact CG2-CG 3.95Å
684	P	31	Very low	31.2	Very low	135 Å²	135	132 Å²	132	88%	0.877	75%	0.754	S	S	*	*				-106.6	178.7	69	-13.1	33.2	0	0	0	117.5
685	Q	26.2	Very low	32.3	Very low	165 Å²	165	131.4 Å²	131.4	77%	0.771	75%	0.746	S	S	*	*			trans	-156.6	174.9	-170.8	-113	-147.8	-27	0	0	109.3	T683	T683-Q685 HydrophobicContact CG2-CB 4.13Å; T683-Q685 HydrophobicContact CG2-CG 3.95Å
686	P	42.3	Very low	33.7	Very low	97 Å²	97	132.1 Å²	132.1	63%	0.63	73%	0.731	S	S	*	*			cis	-141.8	-176.3	-35.7	38.2	-20.3	0	0	0	115.1
687	S	24.9	Very low	35.1	Very low	113 Å²	113	133.3 Å²	133.3	79%	0.79	74%	0.742	S	S	*	*			trans	79.2	143.2	154.5	-126.3	0	0	0	0	117.7
688	S	26.2	Very low	37.2	Very low	104 Å²	104	125.5 Å²	125.5	73%	0.727	70%	0.704	S	S	*	*			cis	-115.9	134.4	15.2	58.9	0	0	0	0	116.3
689	Q	29.6	Very low	39.5	Very low	181 Å²	181	120.9 Å²	120.9	85%	0.846	68%	0.683	S	S	*	*			trans	-0.8	116.2	155.7	-65.5	164.3	-21.6	0	0	118.1
690	Q	32.4	Very low	41.5	Very low	195 Å²	195	121.8 Å²	121.8	91%	0.911	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-96.5	132.8	146.6	-74.6	-178.4	-24.8	0	0	108.5
691	T	28.2	Very low	44.2	Very low	129 Å²	129	124.6 Å²	124.6	79%	0.791	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-84.8	141.6	173.8	48.8	0	0	0	0	110.9
692	P	47.3	Very low	46.3	Very low	115 Å²	115	118.6 Å²	118.6	75%	0.747	64%	0.635	S	S	*	*	S	Bend	trans	-69.1	161.7	170.3	32	-35.3	0	0	0	111.5
693	E	43.4	Very low	49.1	Very low	146 Å²	146	119 Å²	119	68%	0.682	63%	0.625	S	S	*	*			trans	55.7	83.2	168.6	-55.7	-138.3	156.2	0	0	118.2	K695	E693-K695 IonicContact OE1-NZ 3.03Å; E693-K695 PolarHBondContact OE1-NZ 3.48Å; E693-K695 IonicContact OE2-NZ 3.17Å; E693-K695 PolarHBondContact OE2-NZ 3.32Å
694	R	43	Very low	52.1	Low	200 Å²	200	119.6 Å²	119.6	76%	0.755	62%	0.624	S	S	*	*			trans	-100.2	89.1	130.8	-87	-172.8	173	-179.4	-1.2	108.8	H696 E752	R694-H696 PolarHBondContact O-N 3.32Å; R694-E752 IonicContact NH1-OE1 2.78Å
695	K	52	Low	55	Low	127 Å²	127	116.9 Å²	116.9	55%	0.552	60%	0.597	S	S	*	*			trans	-62.5	122.4	159.4	-66.2	-165	175.8	90.4	0	106.9	E693 C697	E693-K695 IonicContact OE1-NZ 3.03Å; E693-K695 PolarHBondContact OE1-NZ 3.48Å; E693-K695 IonicContact OE2-NZ 3.17Å; E693-K695 PolarHBondContact OE2-NZ 3.32Å; K695-C697 PolarHBondContact O-N 2.78Å
696	H	55.1	Low	58.2	Low	82 Å²	82	109 Å²	109	38%	0.38	56%	0.56	S	S	.	*			trans	-71.6	113.9	-172.5	-69.1	-80.1	0	0	0	110	R694 L698	R694-H696 PolarHBondContact O-N 3.32Å; H696-L698 VanDerWaalsContact C-N 3.28Å; H696-L698 PolarHBondContact O-N 3.18Å
697	C	53.7	Low	60.4	Low	128 Å²	128	105.7 Å²	105.7	87%	0.865	54%	0.544	S	S	*	.			trans	-74.1	83	172.9	-69.3	0	0	0	0	110.1	K695 S699	K695-C697 PolarHBondContact O-N 2.78Å; C697-S699 PolarHBondContact O-N 2.82Å
698	L	67.8	Low	63.7	Low	24 Å²	24	102.1 Å²	102.1	13%	0.126	52%	0.521	C	S	.	.			trans	-46	137	161.6	-80	175.2	0	0	0	110.3	H696 C702 R703 F706 L746 L811	H696-L698 VanDerWaalsContact C-N 3.28Å; H696-L698 PolarHBondContact O-N 3.18Å; L698-C702 HydrophobicContact CB-CB 4.28Å; L698-C702 HydrophobicContact CD2-CB 4.06Å; L698-R703 HydrophobicContact CB-CG 4.17Å; L698-F706 HydrophobicContact CD1-CD2 4.22Å; L698-F706 HydrophobicContact CD1-CE2 3.77Å; L698-L746 HydrophobicContact CD2-CD2 3.68Å; L698-L811 HydrophobicContact CD1-CB 3.67Å; L698-L811 HydrophobicContact CD1-CD1 4.43Å; L698-L811 HydrophobicContact CD2-CB 4.28Å; L698-L811 HydrophobicContact CD2-CD1 4.36Å; L698-L811 HydrophobicContact CG-CB 4.01Å; L698-L811 WeakPolarHBondContact CG-O 3.33Å
699	S	74.3	Confident	66.9	Low	39 Å²	39	97.1 Å²	97.1	27%	0.273	49%	0.486	S	S	.	.			trans	-48.7	144.8	170.4	-178.2	0	0	0	0	111.1	C697 H701 C702 R703 E749	C697-S699 PolarHBondContact O-N 2.82Å; S699-H701 PolarHBondContact O-N 3.07Å; S699-H701 VanDerWaalsContact O-N 3.12Å; S699-H701 PolarHBondContact OG-N 2.89Å; S699-H701 PolarHBondContact OG-ND1 2.97Å; S699-C702 PolarHBondContact O-N 2.92Å; S699-R703 PolarHBondContact O-N 3.38Å; S699-E749 WeakPolarHBondContact CB-OE1 3.21Å; S699-E749 WeakPolarHBondContact CB-OE2 3.36Å; S699-E749 PolarHBondContact N-OE1 3.36Å
700	E	76.8	Confident	69.9	Low	139 Å²	139	90.1 Å²	90.1	65%	0.65	45%	0.453	S	S	*	.	H	α-helix	trans	-52.8	-34.2	173.3	-172.4	169.1	-167.4	0	0	111.3	R703 L704	E700-R703 PolarHBondContact O-N 3.32Å; E700-L704 HydrophobicContact CG-CD1 4.08Å; E700-L704 HydrophobicContact CG-CG 4.37Å; E700-L704 WeakPolarHBondContact O-CB 3.36Å; E700-L704 WeakPolarHBondContact O-CG 3.49Å; E700-L704 PolarHBondContact O-N 2.69Å
701	H	80.5	Confident	72.8	Confident	116 Å²	116	88.7 Å²	88.7	54%	0.537	44%	0.444	S	S	.	.	H	α-helix	trans	-60.1	-49.5	173.9	-63	88.3	0	0	0	112.7	S699 R703 L704 Y705	S699-H701 PolarHBondContact O-N 3.07Å; S699-H701 VanDerWaalsContact O-N 3.12Å; S699-H701 PolarHBondContact OG-N 2.89Å; S699-H701 PolarHBondContact OG-ND1 2.97Å; H701-R703 VanDerWaalsContact C-N 3.35Å; H701-R703 PolarHBondContact O-N 3.17Å; H701-L704 PolarHBondContact O-N 2.73Å; H701-Y705 WeakPolarHBondContact O-CD2 3.25Å; H701-Y705 PolarHBondContact O-N 3.01Å
702	C	84.4	Confident	75.9	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-60.7	-43.5	174.8	-81.7	0	0	0	0	111.6	L698 S699 L704 Y705 F706 T745 L746 E749	L698-C702 HydrophobicContact CB-CB 4.28Å; L698-C702 HydrophobicContact CD2-CB 4.06Å; S699-C702 PolarHBondContact O-N 2.92Å; C702-L704 VanDerWaalsContact C-N 3.35Å; C702-L704 PolarHBondContact O-N 3.13Å; C702-Y705 PolarHBondContact O-N 3.4Å; C702-F706 WeakPolarHBondContact O-CD2 3.47Å; C702-F706 PolarHBondContact O-N 3.17Å; C702-T745 VanDerWaalsContact SG-CG2 3.5Å; C702-L746 HydrophobicContact CB-CD2 4.31Å; C702-L746 VanDerWaalsContact SG-CD2 3.58Å; C702-E749 PolarHBondContact SG-OE2 3.27Å
703	R	86.4	Confident	78	Confident	166 Å²	166	77.3 Å²	77.3	63%	0.626	37%	0.372	S	S	*	.	H	α-helix	trans	-60.8	-41	175.9	-69.7	174.1	54.4	-175.3	-5.4	112.5	L698 S699 E700 H701 G707	L698-R703 HydrophobicContact CB-CG 4.17Å; S699-R703 PolarHBondContact O-N 3.38Å; E700-R703 PolarHBondContact O-N 3.32Å; H701-R703 VanDerWaalsContact C-N 3.35Å; H701-R703 PolarHBondContact O-N 3.17Å; R703-G707 PolarHBondContact O-N 3.02Å
704	L	89.6	Confident	80.3	Confident	110 Å²	110	73.9 Å²	73.9	58%	0.576	37%	0.365	S	S	*	.	H	α-helix	trans	-65.9	-43.1	175.4	-73.6	168.3	0	0	0	111.5	E700 H701 C702 G707 A708	E700-L704 HydrophobicContact CG-CD1 4.08Å; E700-L704 HydrophobicContact CG-CG 4.37Å; E700-L704 WeakPolarHBondContact O-CB 3.36Å; E700-L704 WeakPolarHBondContact O-CG 3.49Å; E700-L704 PolarHBondContact O-N 2.69Å; H701-L704 PolarHBondContact O-N 2.73Å; C702-L704 VanDerWaalsContact C-N 3.35Å; C702-L704 PolarHBondContact O-N 3.13Å; L704-G707 PolarHBondContact O-N 3.15Å; L704-A708 WeakPolarHBondContact O-CB 3.15Å; L704-A708 PolarHBondContact O-N 3.33Å
705	Y	91.4	Very high	82.5	Confident	78 Å²	78	66.3 Å²	66.3	31%	0.306	35%	0.345	S	S	.	.	H	α-helix	trans	-65.9	-40.5	176.5	-75.5	-54.2	0	0	0	113	H701 C702 G707 A708 L709 K741 T745	H701-Y705 WeakPolarHBondContact O-CD2 3.25Å; H701-Y705 PolarHBondContact O-N 3.01Å; C702-Y705 PolarHBondContact O-N 3.4Å; Y705-G707 VanDerWaalsContact C-N 3.34Å; Y705-G707 PolarHBondContact O-N 2.84Å; Y705-A708 PolarHBondContact O-N 3.46Å; Y705-L709 WeakPolarHBondContact O-CB 3.23Å; Y705-L709 PolarHBondContact O-N 2.79Å; Y705-K741 HydrophobicContact CD1-CB 4.19Å; Y705-K741 HydrophobicContact CE1-CB 3.88Å; Y705-T745 WeakPolarHBondContact CE2-OG1 3.43Å
706	F	92	Very high	84.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-56.2	-48	168.8	-84.7	-67.7	0	0	0	111.1	L698 C702 A708 L709 F710 L742 L746 T804 F807 R808 L811	L698-F706 HydrophobicContact CD1-CD2 4.22Å; L698-F706 HydrophobicContact CD1-CE2 3.77Å; C702-F706 WeakPolarHBondContact O-CD2 3.47Å; C702-F706 PolarHBondContact O-N 3.17Å; F706-A708 PolarHBondContact O-N 3.48Å; F706-L709 PolarHBondContact O-N 3.04Å; F706-F710 HydrophobicContact CB-CE2 4.49Å; F706-F710 WeakPolarHBondContact O-CD2 3.23Å; F706-F710 PolarHBondContact O-N 3.35Å; F706-F710 VanDerWaalsContact O-N 3.14Å; F706-L742 HydrophobicContact CD1-CD1 4.44Å; F706-L742 HydrophobicContact CD1-CD2 3.62Å; F706-L742 HydrophobicContact CD2-CD1 3.84Å; F706-L742 HydrophobicContact CD2-CD2 4.48Å; F706-L742 HydrophobicContact CE1-CD1 4.49Å; F706-L742 HydrophobicContact CE1-CD2 3.7Å; F706-L742 HydrophobicContact CE2-CD1 3.87Å; F706-L742 HydrophobicContact CG-CD1 4.12Å; F706-L742 HydrophobicContact CG-CD2 4.04Å; F706-L742 HydrophobicContact CZ-CD1 4.2Å; F706-L742 HydrophobicContact CZ-CD2 4.16Å; F706-L746 HydrophobicContact CE2-CD1 4.46Å; F706-L746 HydrophobicContact CZ-CD1 4.29Å; F706-T804 HydrophobicContact CD1-CG2 3.73Å; F706-T804 HydrophobicContact CE1-CG2 3.98Å; F706-F807 HydrophobicContact CE1-CD1 4.34Å; F706-F807 HydrophobicContact CZ-CD1 4.11Å; F706-R808 HydrophobicContact CD1-CB 3.89Å; F706-R808 HydrophobicContact CD1-CG 4.34Å; F706-R808 HydrophobicContact CD2-CG 4.38Å; F706-R808 HydrophobicContact CE1-CB 3.76Å; F706-R808 HydrophobicContact CE2-CB 4.49Å; F706-R808 HydrophobicContact CG-CB 4.31Å; F706-R808 HydrophobicContact CG-CG 4.27Å; F706-R808 HydrophobicContact CZ-CB 4.09Å; F706-L811 HydrophobicContact CE2-CD1 4.43Å; F706-L811 HydrophobicContact CZ-CD1 4.19Å
707	G	90.3	Very high	86	Confident	28 Å²	28	58.6 Å²	58.6	29%	0.289	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-38.1	178	0	0	0	0	0	114	R703 L704 Y705 K711	R703-G707 PolarHBondContact O-N 3.02Å; L704-G707 PolarHBondContact O-N 3.15Å; Y705-G707 VanDerWaalsContact C-N 3.34Å; Y705-G707 PolarHBondContact O-N 2.84Å; G707-K711 WeakPolarHBondContact O-CG 3.47Å; G707-K711 PolarHBondContact O-N 3.25Å
708	A	92.7	Very high	87.5	Confident	37 Å²	37	54.7 Å²	54.7	31%	0.306	29%	0.292	S	S	.	.	H	α-helix	trans	-68.3	-38.6	174.8	0	0	0	0	0	112	L704 Y705 F706 K711 A712 V738	L704-A708 WeakPolarHBondContact O-CB 3.15Å; L704-A708 PolarHBondContact O-N 3.33Å; Y705-A708 PolarHBondContact O-N 3.46Å; F706-A708 PolarHBondContact O-N 3.48Å; A708-K711 PolarHBondContact O-N 2.98Å; A708-A712 WeakPolarHBondContact O-CB 3.25Å; A708-A712 PolarHBondContact O-N 2.83Å; A708-V738 HydrophobicContact CB-CG1 3.71Å
709	L	93.4	Very high	88.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65	-44.5	178.9	-176.7	54.2	0	0	0	111.7	Y705 F706 K711 A712 I713 V735 V738 L742 T804	Y705-L709 WeakPolarHBondContact O-CB 3.23Å; Y705-L709 PolarHBondContact O-N 2.79Å; F706-L709 PolarHBondContact O-N 3.04Å; L709-K711 VanDerWaalsContact C-N 3.32Å; L709-K711 PolarHBondContact O-N 3.3Å; L709-A712 PolarHBondContact O-N 3.45Å; L709-I713 HydrophobicContact CD1-CD1 4.06Å; L709-I713 HydrophobicContact CD1-CG1 4.29Å; L709-I713 HydrophobicContact CG-CD1 4.01Å; L709-I713 WeakPolarHBondContact O-CG1 3.4Å; L709-I713 PolarHBondContact O-N 2.78Å; L709-V735 HydrophobicContact CD1-CG1 4.04Å; L709-V738 HydrophobicContact CB-CG1 4.01Å; L709-L742 HydrophobicContact CD2-CD2 3.8Å; L709-T804 HydrophobicContact CD2-CG2 3.68Å; L709-T804 HydrophobicContact CG-CG2 4.31Å
710	F	93.3	Very high	88.7	Confident	33 Å²	33	53 Å²	53	15%	0.145	28%	0.28	C	S	.	.	H	α-helix	trans	-62.7	-36.8	174.3	-69	-62.8	0	0	0	112.9	F706 S714 E801 T804 R805	F706-F710 HydrophobicContact CB-CE2 4.49Å; F706-F710 WeakPolarHBondContact O-CD2 3.23Å; F706-F710 PolarHBondContact O-N 3.35Å; F706-F710 VanDerWaalsContact O-N 3.14Å; F710-S714 WeakPolarHBondContact O-CB 3.45Å; F710-S714 PolarHBondContact O-N 3.06Å; F710-S714 PolarHBondContact O-OG 3.01Å; F710-E801 HydrophobicContact CD1-CG 4.04Å; F710-E801 HydrophobicContact CE1-CG 4.09Å; F710-T804 HydrophobicContact CE1-CG2 3.94Å; F710-T804 HydrophobicContact CE2-CG2 4.1Å; F710-T804 HydrophobicContact CZ-CG2 3.59Å; F710-R805 HydrophobicContact CE1-CB 4.18Å; F710-R805 HydrophobicContact CZ-CB 4.11Å
711	K	93.1	Very high	88.5	Confident	165 Å²	165	51.4 Å²	51.4	72%	0.717	28%	0.284	S	S	*	.	H	α-helix	trans	-65.3	-42.8	173.6	-73.7	175.8	179.3	-179.6	0	111.8	G707 A708 L709 S714 A715	G707-K711 WeakPolarHBondContact O-CG 3.47Å; G707-K711 PolarHBondContact O-N 3.25Å; A708-K711 PolarHBondContact O-N 2.98Å; L709-K711 VanDerWaalsContact C-N 3.32Å; L709-K711 PolarHBondContact O-N 3.3Å; K711-S714 PolarHBondContact O-N 3.06Å; K711-A715 PolarHBondContact O-N 3.34Å
712	A	93.7	Very high	87.8	Confident	4 Å²	4	47.7 Å²	47.7	3%	0.033	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-43.3	176.4	0	0	0	0	0	112.1	A708 L709 S714 A715 F716 L734 V735	A708-A712 WeakPolarHBondContact O-CB 3.25Å; A708-A712 PolarHBondContact O-N 2.83Å; L709-A712 PolarHBondContact O-N 3.45Å; A712-S714 VanDerWaalsContact C-N 3.34Å; A712-S714 PolarHBondContact O-N 3.46Å; A712-A715 PolarHBondContact O-N 2.79Å; A712-F716 VanDerWaalsContact O-CB 3.31Å; A712-F716 WeakPolarHBondContact O-CB 3.09Å; A712-F716 PolarHBondContact O-N 3.45Å; A712-L734 HydrophobicContact CB-CD2 4.17Å; A712-L734 HydrophobicContact CB-CG 4Å; A712-V735 HydrophobicContact CB-CG2 3.74Å
713	I	91.9	Very high	86.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-39.4	176	-66.9	167.1	0	0	0	110.9	L709 F716 H717 V735 L800 E801	L709-I713 HydrophobicContact CD1-CD1 4.06Å; L709-I713 HydrophobicContact CD1-CG1 4.29Å; L709-I713 HydrophobicContact CG-CD1 4.01Å; L709-I713 WeakPolarHBondContact O-CG1 3.4Å; L709-I713 PolarHBondContact O-N 2.78Å; I713-F716 WeakPolarHBondContact O-CB 3.27Å; I713-F716 PolarHBondContact O-N 3.4Å; I713-H717 VanDerWaalsContact CG2-CE1 3.48Å; I713-H717 WeakPolarHBondContact CG2-CE1 3.42Å; I713-H717 PolarHBondContact O-N 3.12Å; I713-V735 HydrophobicContact CG1-CG1 4Å; I713-V735 HydrophobicContact CG1-CG2 4.06Å; I713-L800 HydrophobicContact CD1-CD2 4.03Å; I713-L800 HydrophobicContact CD1-CG 4.1Å; I713-L800 HydrophobicContact CG1-CD2 4.38Å; I713-E801 HydrophobicContact CD1-CB 4.27Å; I713-E801 HydrophobicContact CD1-CG 4.37Å; I713-E801 HydrophobicContact CG2-CB 4.13Å; I713-E801 HydrophobicContact CG2-CG 4.07Å
714	S	90.3	Very high	86.4	Confident	74 Å²	74	50.2 Å²	50.2	52%	0.517	30%	0.302	S	S	.	.	H	α-helix	trans	-64.4	-43.5	176.5	-58.4	0	0	0	0	112.1	F710 K711 A712 F716 H717 G718	F710-S714 WeakPolarHBondContact O-CB 3.45Å; F710-S714 PolarHBondContact O-N 3.06Å; F710-S714 PolarHBondContact O-OG 3.01Å; K711-S714 PolarHBondContact O-N 3.06Å; A712-S714 VanDerWaalsContact C-N 3.34Å; A712-S714 PolarHBondContact O-N 3.46Å; S714-F716 VanDerWaalsContact C-N 3.32Å; S714-H717 PolarHBondContact O-N 3.36Å; S714-G718 PolarHBondContact O-N 3.09Å; S714-G718 VanDerWaalsContact O-N 3.11Å
715	A	89.8	Confident	85.7	Confident	41 Å²	41	46.8 Å²	46.8	34%	0.339	29%	0.287	S	S	.	.	H	α-helix	trans	-64.9	-35.9	173.4	0	0	0	0	0	112.1	K711 A712 G718 S719	K711-A715 PolarHBondContact O-N 3.34Å; A712-A715 PolarHBondContact O-N 2.79Å; A715-G718 PolarHBondContact O-N 3.12Å; A715-S719 WeakPolarHBondContact O-CB 3.38Å; A715-S719 PolarHBondContact O-N 2.84Å
716	F	90.8	Very high	85.2	Confident	1 Å²	1	47 Å²	47	0%	0.004	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-46.7	174.6	-178.3	-107.1	0	0	0	112.4	A712 I713 S714 G718 S719 L720 I728 Q731 V735 L793 A797	A712-F716 VanDerWaalsContact O-CB 3.31Å; A712-F716 WeakPolarHBondContact O-CB 3.09Å; A712-F716 PolarHBondContact O-N 3.45Å; I713-F716 WeakPolarHBondContact O-CB 3.27Å; I713-F716 PolarHBondContact O-N 3.4Å; S714-F716 VanDerWaalsContact C-N 3.32Å; F716-G718 VanDerWaalsContact C-N 3.3Å; F716-G718 PolarHBondContact O-N 3.26Å; F716-S719 CarbonylContact O-C 3.5Å; F716-S719 WeakPolarHBondContact O-CA 3.19Å; F716-S719 PolarHBondContact O-N 3.38Å; F716-L720 HydrophobicContact CD1-CD1 4.21Å; F716-L720 HydrophobicContact CD1-CG 4.45Å; F716-L720 HydrophobicContact CE1-CD1 3.74Å; F716-L720 HydrophobicContact CE1-CD2 4.25Å; F716-L720 HydrophobicContact CE1-CG 4.07Å; F716-L720 HydrophobicContact CE2-CD2 4.35Å; F716-L720 HydrophobicContact CZ-CD1 4.24Å; F716-L720 HydrophobicContact CZ-CD2 3.89Å; F716-L720 HydrophobicContact CZ-CG 4.16Å; F716-L720 PolarHBondContact O-N 2.97Å; F716-I728 HydrophobicContact CE2-CG2 3.96Å; F716-I728 HydrophobicContact CZ-CG2 4.42Å; F716-Q731 HydrophobicContact CB-CB 4.16Å; F716-Q731 HydrophobicContact CD2-CB 3.75Å; F716-Q731 HydrophobicContact CG-CB 4.47Å; F716-V735 HydrophobicContact CB-CG2 4.05Å; F716-V735 HydrophobicContact CG-CG2 4.49Å; F716-L793 HydrophobicContact CE1-CD1 4.22Å; F716-L793 HydrophobicContact CE1-CG 4.16Å; F716-L793 HydrophobicContact CZ-CD1 3.72Å; F716-L793 HydrophobicContact CZ-CD2 3.84Å; F716-L793 HydrophobicContact CZ-CG 3.65Å; F716-A797 HydrophobicContact CD1-CB 3.85Å; F716-A797 HydrophobicContact CE1-CB 3.68Å
717	H	89.3	Confident	84.8	Confident	47 Å²	47	50.2 Å²	50.2	22%	0.218	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-36.2	174.7	-66	163.7	0	0	0	112.4	I713 S714 L720 S721 A797 E801	I713-H717 VanDerWaalsContact CG2-CE1 3.48Å; I713-H717 WeakPolarHBondContact CG2-CE1 3.42Å; I713-H717 PolarHBondContact O-N 3.12Å; S714-H717 PolarHBondContact O-N 3.36Å; H717-L720 PolarHBondContact O-N 2.9Å; H717-S721 PolarHBondContact O-OG 3.38Å; H717-A797 WeakPolarHBondContact NE2-CB 3.31Å; H717-E801 IonicContact CE1-OE2 3.48Å; H717-E801 PolarHBondContact CE1-OE2 3.4Å; H717-E801 IonicContact ND1-OE2 3.88Å
718	G	85.4	Confident	84.6	Confident	45 Å²	45	49 Å²	49	46%	0.464	30%	0.298	S	S	.	.	H	α-helix	trans	-59.4	-45.6	168.2	0	0	0	0	0	112.5	S714 A715 F716 L720 S721 S722	S714-G718 PolarHBondContact O-N 3.09Å; S714-G718 VanDerWaalsContact O-N 3.11Å; A715-G718 PolarHBondContact O-N 3.12Å; F716-G718 VanDerWaalsContact C-N 3.3Å; F716-G718 PolarHBondContact O-N 3.26Å; G718-L720 VanDerWaalsContact C-N 3.33Å; G718-L720 PolarHBondContact O-N 3.44Å; G718-S721 WeakPolarHBondContact O-CB 3.48Å; G718-S721 PolarHBondContact O-N 2.85Å; G718-S722 PolarHBondContact O-N 3.08Å
719	S	85.6	Confident	84.4	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.014	30%	0.296	C	S	.	.	H	α-helix	trans	-71.4	-19	178.4	176.1	0	0	0	0	114.9	A715 F716 S721 S722 E727 I728	A715-S719 WeakPolarHBondContact O-CB 3.38Å; A715-S719 PolarHBondContact O-N 2.84Å; F716-S719 CarbonylContact O-C 3.5Å; F716-S719 WeakPolarHBondContact O-CA 3.19Å; F716-S719 PolarHBondContact O-N 3.38Å; S719-S721 PolarHBondContact O-N 3.47Å; S719-S722 WeakPolarHBondContact CA-OG 3.37Å; S719-S722 PolarHBondContact O-N 3.27Å; S719-S722 VanDerWaalsContact O-O 3.08Å; S719-S722 PolarHBondContact O-OG 3.35Å; S719-S722 VanDerWaalsContact O-OG 3.11Å; S719-E727 VanDerWaalsContact OG-C 3.23Å; S719-E727 WeakPolarHBondContact OG-CB 3.36Å; S719-E727 VanDerWaalsContact OG-CG 3.29Å; S719-E727 WeakPolarHBondContact OG-CG 3.32Å; S719-I728 PolarHBondContact OG-N 3.08Å
720	L	81.3	Confident	84.3	Confident	27 Å²	27	53.6 Å²	53.6	14%	0.141	32%	0.32	C	S	.	.	H	α-helix	trans	-71.9	-19.4	168.1	-68.4	178.3	0	0	0	112.1	F716 H717 G718 I728 L790 L793 Q794	F716-L720 HydrophobicContact CD1-CD1 4.21Å; F716-L720 HydrophobicContact CD1-CG 4.45Å; F716-L720 HydrophobicContact CE1-CD1 3.74Å; F716-L720 HydrophobicContact CE1-CD2 4.25Å; F716-L720 HydrophobicContact CE1-CG 4.07Å; F716-L720 HydrophobicContact CE2-CD2 4.35Å; F716-L720 HydrophobicContact CZ-CD1 4.24Å; F716-L720 HydrophobicContact CZ-CD2 3.89Å; F716-L720 HydrophobicContact CZ-CG 4.16Å; F716-L720 PolarHBondContact O-N 2.97Å; H717-L720 PolarHBondContact O-N 2.9Å; G718-L720 VanDerWaalsContact C-N 3.33Å; G718-L720 PolarHBondContact O-N 3.44Å; L720-I728 HydrophobicContact CD2-CD1 4.27Å; L720-I728 HydrophobicContact CD2-CG1 4.36Å; L720-I728 HydrophobicContact CD2-CG2 4.11Å; L720-L790 HydrophobicContact CD2-CD2 4.16Å; L720-L793 HydrophobicContact CD2-CD2 3.87Å; L720-L793 HydrophobicContact CD2-CG 4.17Å; L720-Q794 HydrophobicContact CD1-CB 3.89Å; L720-Q794 HydrophobicContact CD1-CG 4.25Å
721	S	73.3	Confident	84.2	Confident	105 Å²	105	53.9 Å²	53.9	73%	0.734	32%	0.322	S	S	*	.	H	α-helix	trans	-89.6	-17.4	175	-53.5	0	0	0	0	113	H717 G718 S719	H717-S721 PolarHBondContact O-OG 3.38Å; G718-S721 WeakPolarHBondContact O-CB 3.48Å; G718-S721 PolarHBondContact O-N 2.85Å; S719-S721 PolarHBondContact O-N 3.47Å
722	S	66.1	Low	84.1	Confident	38 Å²	38	46.1 Å²	46.1	27%	0.266	29%	0.288	S	S	.	.	S	Bend	trans	-89.8	125.1	170.1	58.4	0	0	0	0	110.5	G718 S719 Q724 E727	G718-S722 PolarHBondContact O-N 3.08Å; S719-S722 WeakPolarHBondContact CA-OG 3.37Å; S719-S722 PolarHBondContact O-N 3.27Å; S719-S722 VanDerWaalsContact O-O 3.08Å; S719-S722 PolarHBondContact O-OG 3.35Å; S719-S722 VanDerWaalsContact O-OG 3.11Å; S722-Q724 PolarHBondContact O-N 3.34Å; S722-E727 WeakPolarHBondContact CB-OE2 3.46Å; S722-E727 PolarHBondContact OG-OE2 3.41Å
723	S	62.1	Low	84.1	Confident	107 Å²	107	52.2 Å²	52.2	75%	0.748	31%	0.314	S	S	*	.	S	Bend	trans	-76.9	45	-172.4	-47.3	0	0	0	0	114.3	Y784	S723-Y784 WeakPolarHBondContact CA-OH 3.4Å; S723-Y784 PolarHBondContact O-OH 3.31Å
724	Q	78.6	Confident	84.2	Confident	111 Å²	111	56 Å²	56	52%	0.519	33%	0.334	S	S	.	.			trans	-127.4	112	-178.9	-156.3	-177.7	9	0	0	112.9	S722 T726 E727	S722-Q724 PolarHBondContact O-N 3.34Å; Q724-T726 WeakPolarHBondContact CG-OG1 3.29Å; Q724-T726 PolarHBondContact NE2-OG1 3.37Å; Q724-T726 PolarHBondContact O-N 2.99Å; Q724-T726 VanDerWaalsContact O-N 3.14Å; Q724-E727 PolarHBondContact O-N 2.87Å; Q724-E727 VanDerWaalsContact O-N 3.08Å
725	P	76.3	Confident	84.4	Confident	39 Å²	39	52.5 Å²	52.5	25%	0.253	31%	0.31	S	S	.	.	H	α-helix	trans	-67.4	-20.4	-173.1	26.7	-34.7	0	0	0	113.8	E727 I729 Y784	P725-E727 VanDerWaalsContact C-N 3.34Å; P725-I729 WeakPolarHBondContact O-CD1 3.32Å; P725-I729 VanDerWaalsContact O-CG1 3.24Å; P725-I729 WeakPolarHBondContact O-CG1 3.44Å; P725-I729 PolarHBondContact O-N 3.1Å; P725-Y784 HydrophobicContact CB-CD1 4.26Å; P725-Y784 HydrophobicContact CB-CD2 4.12Å; P725-Y784 HydrophobicContact CB-CE2 4.4Å; P725-Y784 HydrophobicContact CB-CG 4.06Å; P725-Y784 HydrophobicContact CG-CD1 3.95Å; P725-Y784 HydrophobicContact CG-CE1 4.04Å; P725-Y784 HydrophobicContact CG-CG 4.26Å
726	T	80.5	Confident	84.6	Confident	82 Å²	82	52.9 Å²	52.9	50%	0.503	31%	0.305	S	S	.	.	H	α-helix	trans	-67.9	-33.2	174.1	47.8	0	0	0	0	112.9	Q724 T730	Q724-T726 WeakPolarHBondContact CG-OG1 3.29Å; Q724-T726 PolarHBondContact NE2-OG1 3.37Å; Q724-T726 PolarHBondContact O-N 2.99Å; Q724-T726 VanDerWaalsContact O-N 3.14Å; T726-T730 PolarHBondContact O-N 3.48Å; T726-T730 PolarHBondContact O-OG1 3.29Å
727	E	84.1	Confident	84.7	Confident	67 Å²	67	56.9 Å²	56.9	31%	0.313	33%	0.33	S	S	.	.	H	α-helix	trans	-75.4	-41.9	-180	-158.5	-178.2	-173.8	0	0	110.7	S719 S722 Q724 P725 I729 T730 Q731	S719-E727 VanDerWaalsContact OG-C 3.23Å; S719-E727 WeakPolarHBondContact OG-CB 3.36Å; S719-E727 VanDerWaalsContact OG-CG 3.29Å; S719-E727 WeakPolarHBondContact OG-CG 3.32Å; S722-E727 WeakPolarHBondContact CB-OE2 3.46Å; S722-E727 PolarHBondContact OG-OE2 3.41Å; Q724-E727 PolarHBondContact O-N 2.87Å; Q724-E727 VanDerWaalsContact O-N 3.08Å; P725-E727 VanDerWaalsContact C-N 3.34Å; E727-I729 PolarHBondContact O-N 2.89Å; E727-T730 PolarHBondContact O-N 2.68Å; E727-T730 VanDerWaalsContact O-N 3.09Å; E727-T730 PolarHBondContact O-OG1 2.99Å; E727-Q731 HydrophobicContact CG-CG 4.32Å; E727-Q731 WeakPolarHBondContact O-CB 3.35Å; E727-Q731 WeakPolarHBondContact O-CG 3.18Å; E727-Q731 PolarHBondContact O-N 3.3Å
728	I	85.4	Confident	84.9	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.015	33%	0.326	C	S	.	.	H	α-helix	trans	-55.8	-40.3	173.4	-58.2	175.8	0	0	0	110.6	F716 S719 L720 S732 L790 L793	F716-I728 HydrophobicContact CE2-CG2 3.96Å; F716-I728 HydrophobicContact CZ-CG2 4.42Å; S719-I728 PolarHBondContact OG-N 3.08Å; L720-I728 HydrophobicContact CD2-CD1 4.27Å; L720-I728 HydrophobicContact CD2-CG1 4.36Å; L720-I728 HydrophobicContact CD2-CG2 4.11Å; I728-S732 WeakPolarHBondContact O-CB 3.29Å; I728-S732 PolarHBondContact O-N 3.31Å; I728-L790 HydrophobicContact CD1-CD2 3.69Å; I728-L793 HydrophobicContact CG2-CD2 3.78Å
729	I	89.2	Confident	85.3	Confident	51 Å²	51	53.6 Å²	53.6	26%	0.262	30%	0.304	S	S	.	.	H	α-helix	trans	-67.5	-43	176.6	-67.1	163.2	0	0	0	112.3	P725 E727 K733 V781	P725-I729 WeakPolarHBondContact O-CD1 3.32Å; P725-I729 VanDerWaalsContact O-CG1 3.24Å; P725-I729 WeakPolarHBondContact O-CG1 3.44Å; P725-I729 PolarHBondContact O-N 3.1Å; E727-I729 PolarHBondContact O-N 2.89Å; I729-K733 HydrophobicContact CG2-CD 4.07Å; I729-K733 WeakPolarHBondContact O-CB 3.38Å; I729-K733 VanDerWaalsContact O-CG 3.24Å; I729-K733 WeakPolarHBondContact O-CG 3.43Å; I729-K733 PolarHBondContact O-N 3.41Å; I729-V781 HydrophobicContact CD1-CG1 3.96Å; I729-V781 HydrophobicContact CD1-CG2 3.85Å; I729-V781 HydrophobicContact CG1-CG2 3.59Å
730	T	90.2	Very high	85.7	Confident	83 Å²	83	57 Å²	57	51%	0.509	32%	0.32	S	S	.	.	H	α-helix	trans	-71.2	-42.2	-178.7	50.8	0	0	0	0	111.6	T726 E727 K733 L734	T726-T730 PolarHBondContact O-N 3.48Å; T726-T730 PolarHBondContact O-OG1 3.29Å; E727-T730 PolarHBondContact O-N 2.68Å; E727-T730 VanDerWaalsContact O-N 3.09Å; E727-T730 PolarHBondContact O-OG1 2.99Å; T730-K733 PolarHBondContact O-N 2.89Å; T730-L734 PolarHBondContact O-N 3.04Å
731	Q	90.3	Very high	86.2	Confident	38 Å²	38	60.3 Å²	60.3	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-69	-40.6	177.9	-61	-62.2	-4.1	0	0	111.9	F716 E727 K733 L734 V735	F716-Q731 HydrophobicContact CB-CB 4.16Å; F716-Q731 HydrophobicContact CD2-CB 3.75Å; F716-Q731 HydrophobicContact CG-CB 4.47Å; E727-Q731 HydrophobicContact CG-CG 4.32Å; E727-Q731 WeakPolarHBondContact O-CB 3.35Å; E727-Q731 WeakPolarHBondContact O-CG 3.18Å; E727-Q731 PolarHBondContact O-N 3.3Å; Q731-K733 PolarHBondContact O-N 3.12Å; Q731-L734 WeakPolarHBondContact O-CB 3.16Å; Q731-L734 PolarHBondContact O-N 3Å; Q731-L734 VanDerWaalsContact O-N 3.15Å; Q731-V735 WeakPolarHBondContact O-CG2 3.38Å; Q731-V735 PolarHBondContact O-N 2.9Å
732	S	92.5	Very high	87.1	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-60.3	-45.1	172.7	175.7	0	0	0	0	112	I728 L734 V735 I736 T777	I728-S732 WeakPolarHBondContact O-CB 3.29Å; I728-S732 PolarHBondContact O-N 3.31Å; S732-L734 VanDerWaalsContact C-N 3.29Å; S732-L734 PolarHBondContact O-N 3.27Å; S732-V735 PolarHBondContact O-N 3.46Å; S732-I736 WeakPolarHBondContact O-CD1 3.47Å; S732-I736 VanDerWaalsContact O-CG1 3.27Å; S732-I736 WeakPolarHBondContact O-CG1 3.37Å; S732-I736 PolarHBondContact O-N 3.29Å; S732-T777 WeakPolarHBondContact CB-OG1 3.35Å; S732-T777 PolarHBondContact OG-OG1 2.91Å
733	K	93.6	Very high	88.3	Confident	131 Å²	131	54 Å²	54	57%	0.57	29%	0.289	S	S	*	.	H	α-helix	trans	-59.7	-37.3	173.6	-77.1	173.4	178.7	-179.9	0	112.6	I729 T730 Q731 T737	I729-K733 HydrophobicContact CG2-CD 4.07Å; I729-K733 WeakPolarHBondContact O-CB 3.38Å; I729-K733 VanDerWaalsContact O-CG 3.24Å; I729-K733 WeakPolarHBondContact O-CG 3.43Å; I729-K733 PolarHBondContact O-N 3.41Å; T730-K733 PolarHBondContact O-N 2.89Å; Q731-K733 PolarHBondContact O-N 3.12Å; K733-T737 VanDerWaalsContact O-CB 3.32Å; K733-T737 WeakPolarHBondContact O-CB 3.13Å; K733-T737 PolarHBondContact O-N 3.44Å; K733-T737 PolarHBondContact O-OG1 3.17Å
734	L	93.9	Very high	89.6	Confident	80 Å²	80	51.5 Å²	51.5	42%	0.419	27%	0.267	S	S	.	.	H	α-helix	trans	-64.7	-48.4	175.8	-178.5	63.2	0	0	0	111.2	A712 T730 Q731 S732 I736 T737 V738	A712-L734 HydrophobicContact CB-CD2 4.17Å; A712-L734 HydrophobicContact CB-CG 4Å; T730-L734 PolarHBondContact O-N 3.04Å; Q731-L734 WeakPolarHBondContact O-CB 3.16Å; Q731-L734 PolarHBondContact O-N 3Å; Q731-L734 VanDerWaalsContact O-N 3.15Å; S732-L734 VanDerWaalsContact C-N 3.29Å; S732-L734 PolarHBondContact O-N 3.27Å; L734-I736 VanDerWaalsContact C-N 3.35Å; L734-I736 PolarHBondContact O-N 2.92Å; L734-T737 PolarHBondContact O-N 3.27Å; L734-V738 HydrophobicContact CD1-CG2 4.04Å; L734-V738 WeakPolarHBondContact O-CG2 3.22Å; L734-V738 PolarHBondContact O-N 2.78Å
735	V	93.9	Very high	90	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-56	-47.7	175	171.8	0	0	0	0	111.2	L709 A712 I713 F716 Q731 S732 G739 L770 L800	L709-V735 HydrophobicContact CD1-CG1 4.04Å; A712-V735 HydrophobicContact CB-CG2 3.74Å; I713-V735 HydrophobicContact CG1-CG1 4Å; I713-V735 HydrophobicContact CG1-CG2 4.06Å; F716-V735 HydrophobicContact CB-CG2 4.05Å; F716-V735 HydrophobicContact CG-CG2 4.49Å; Q731-V735 WeakPolarHBondContact O-CG2 3.38Å; Q731-V735 PolarHBondContact O-N 2.9Å; S732-V735 PolarHBondContact O-N 3.46Å; V735-G739 PolarHBondContact O-N 3.2Å; V735-L770 HydrophobicContact CG1-CD2 4.39Å; V735-L800 HydrophobicContact CG1-CD2 3.47Å; V735-L800 VanDerWaalsContact CG1-CD2 3.47Å
736	I	93.7	Very high	90.4	Very high	48 Å²	48	45.9 Å²	45.9	25%	0.246	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-43.7	178.6	-65.6	160	0	0	0	111.5	S732 L734 Q740 A774	S732-I736 WeakPolarHBondContact O-CD1 3.47Å; S732-I736 VanDerWaalsContact O-CG1 3.27Å; S732-I736 WeakPolarHBondContact O-CG1 3.37Å; S732-I736 PolarHBondContact O-N 3.29Å; L734-I736 VanDerWaalsContact C-N 3.35Å; L734-I736 PolarHBondContact O-N 2.92Å; I736-Q740 WeakPolarHBondContact O-CB 3.4Å; I736-Q740 PolarHBondContact O-N 3.33Å; I736-A774 HydrophobicContact CD1-CB 3.66Å
737	T	93.8	Very high	90.5	Very high	86 Å²	86	44.5 Å²	44.5	53%	0.528	23%	0.233	S	C	.	.	H	α-helix	trans	-67	-44.9	-177.8	-55.8	0	0	0	0	111.9	K733 L734 K741	K733-T737 VanDerWaalsContact O-CB 3.32Å; K733-T737 WeakPolarHBondContact O-CB 3.13Å; K733-T737 PolarHBondContact O-N 3.44Å; K733-T737 PolarHBondContact O-OG1 3.17Å; L734-T737 PolarHBondContact O-N 3.27Å; T737-K741 WeakPolarHBondContact O-CG 3.47Å; T737-K741 PolarHBondContact O-N 3.35Å; T737-K741 VanDerWaalsContact O-N 3.1Å
738	V	94.2	Very high	90.4	Very high	22 Å²	22	47 Å²	47	13%	0.133	25%	0.252	C	S	.	.	H	α-helix	trans	-70.1	-39.8	178.1	178.7	0	0	0	0	110.9	A708 L709 L734 K741 L742	A708-V738 HydrophobicContact CB-CG1 3.71Å; L709-V738 HydrophobicContact CB-CG1 4.01Å; L734-V738 HydrophobicContact CD1-CG2 4.04Å; L734-V738 WeakPolarHBondContact O-CG2 3.22Å; L734-V738 PolarHBondContact O-N 2.78Å; V738-K741 PolarHBondContact O-N 3.49Å; V738-L742 PolarHBondContact O-N 2.9Å
739	G	93.3	Very high	89.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.7	-40.9	175.8	0	0	0	0	0	113.2	V735 L742 V743 L770	V735-G739 PolarHBondContact O-N 3.2Å; G739-L742 PolarHBondContact O-N 3.03Å; G739-V743 WeakPolarHBondContact O-CG2 3.47Å; G739-V743 PolarHBondContact O-N 3.17Å; G739-V743 VanDerWaalsContact O-N 3.08Å; G739-L770 VanDerWaalsContact C-CD1 3.43Å
740	Q	93.1	Very high	88.9	Confident	73 Å²	73	48.8 Å²	48.8	34%	0.341	26%	0.261	S	S	.	.	H	α-helix	trans	-66.3	-41	174.3	-172.9	59.7	51.5	0	0	111.2	I736 L742 V743 D744	I736-Q740 WeakPolarHBondContact O-CB 3.4Å; I736-Q740 PolarHBondContact O-N 3.33Å; Q740-L742 VanDerWaalsContact C-N 3.32Å; Q740-L742 PolarHBondContact O-N 2.92Å; Q740-V743 WeakPolarHBondContact O-CB 3.4Å; Q740-V743 PolarHBondContact O-N 3Å; Q740-V743 VanDerWaalsContact O-N 3.12Å; Q740-D744 PolarHBondContact NE2-OD1 3.02Å; Q740-D744 PolarHBondContact O-N 3.31Å
741	K	92.8	Very high	87.6	Confident	98 Å²	98	52.8 Å²	52.8	43%	0.426	27%	0.274	S	S	.	.	H	α-helix	trans	-61.2	-39.5	175.7	-76.5	-74.9	153.5	-129	0	112.7	Y705 T737 V738 D744 T745	Y705-K741 HydrophobicContact CD1-CB 4.19Å; Y705-K741 HydrophobicContact CE1-CB 3.88Å; T737-K741 WeakPolarHBondContact O-CG 3.47Å; T737-K741 PolarHBondContact O-N 3.35Å; T737-K741 VanDerWaalsContact O-N 3.1Å; V738-K741 PolarHBondContact O-N 3.49Å; K741-D744 IonicContact NZ-OD2 3.57Å; K741-D744 PolarHBondContact NZ-OD2 3.46Å; K741-D744 PolarHBondContact O-N 3.46Å; K741-T745 PolarHBondContact O-N 3.09Å; K741-T745 PolarHBondContact O-OG1 3.41Å; K741-T745 VanDerWaalsContact O-OG1 3.06Å
742	L	91.8	Very high	86.2	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.1	-44.4	172	179.4	59.1	0	0	0	112.2	F706 L709 V738 G739 Q740 L746 L766	F706-L742 HydrophobicContact CD1-CD1 4.44Å; F706-L742 HydrophobicContact CD1-CD2 3.62Å; F706-L742 HydrophobicContact CD2-CD1 3.84Å; F706-L742 HydrophobicContact CD2-CD2 4.48Å; F706-L742 HydrophobicContact CE1-CD1 4.49Å; F706-L742 HydrophobicContact CE1-CD2 3.7Å; F706-L742 HydrophobicContact CE2-CD1 3.87Å; F706-L742 HydrophobicContact CG-CD1 4.12Å; F706-L742 HydrophobicContact CG-CD2 4.04Å; F706-L742 HydrophobicContact CZ-CD1 4.2Å; F706-L742 HydrophobicContact CZ-CD2 4.16Å; L709-L742 HydrophobicContact CD2-CD2 3.8Å; V738-L742 PolarHBondContact O-N 2.9Å; G739-L742 PolarHBondContact O-N 3.03Å; Q740-L742 VanDerWaalsContact C-N 3.32Å; Q740-L742 PolarHBondContact O-N 2.92Å; L742-L746 HydrophobicContact CD1-CD1 3.81Å; L742-L746 HydrophobicContact CD1-CG 4.16Å; L742-L746 HydrophobicContact CG-CD1 3.94Å; L742-L746 WeakPolarHBondContact O-CB 3.27Å; L742-L746 VanDerWaalsContact O-CG 3.29Å; L742-L746 WeakPolarHBondContact O-CG 3.24Å; L742-L746 PolarHBondContact O-N 3.26Å; L742-L766 HydrophobicContact CD2-CD2 4Å; L742-L766 HydrophobicContact CG-CD2 4.35Å
743	V	91.2	Very high	84.5	Confident	11 Å²	11	65.3 Å²	65.3	7%	0.067	32%	0.323	C	S	.	.	H	α-helix	trans	-62	-46.8	174.8	168.7	0	0	0	0	111.3	G739 Q740 T745 L746 C747 L766	G739-V743 WeakPolarHBondContact O-CG2 3.47Å; G739-V743 PolarHBondContact O-N 3.17Å; G739-V743 VanDerWaalsContact O-N 3.08Å; Q740-V743 WeakPolarHBondContact O-CB 3.4Å; Q740-V743 PolarHBondContact O-N 3Å; Q740-V743 VanDerWaalsContact O-N 3.12Å; V743-T745 PolarHBondContact O-N 3.46Å; V743-L746 PolarHBondContact O-N 2.96Å; V743-C747 WeakPolarHBondContact O-CB 3.36Å; V743-C747 PolarHBondContact O-N 3.01Å; V743-C747 PolarHBondContact O-SG 2.84Å; V743-L766 HydrophobicContact CG2-CB 4.24Å; V743-L766 HydrophobicContact CG2-CD2 3.74Å; V743-L766 HydrophobicContact CG2-CG 3.97Å
744	D	89.8	Confident	82.9	Confident	53 Å²	53	65.5 Å²	65.5	28%	0.283	33%	0.331	S	S	.	.	H	α-helix	trans	-57.7	-48.2	179.7	-60.8	-17.3	0	0	0	111.1	Q740 K741 T748	Q740-D744 PolarHBondContact NE2-OD1 3.02Å; Q740-D744 PolarHBondContact O-N 3.31Å; K741-D744 IonicContact NZ-OD2 3.57Å; K741-D744 PolarHBondContact NZ-OD2 3.46Å; K741-D744 PolarHBondContact O-N 3.46Å; D744-T748 WeakPolarHBondContact O-CB 3.42Å; D744-T748 PolarHBondContact O-N 2.79Å; D744-T748 VanDerWaalsContact O-N 3.13Å; D744-T748 PolarHBondContact O-OG1 2.99Å
745	T	87.3	Confident	81.5	Confident	31 Å²	31	63 Å²	63	19%	0.19	32%	0.319	C	S	.	.	H	α-helix	trans	-65.2	-49.6	179.9	-52.4	0	0	0	0	111.4	C702 Y705 K741 V743 C747 T748 E749	C702-T745 VanDerWaalsContact SG-CG2 3.5Å; Y705-T745 WeakPolarHBondContact CE2-OG1 3.43Å; K741-T745 PolarHBondContact O-N 3.09Å; K741-T745 PolarHBondContact O-OG1 3.41Å; K741-T745 VanDerWaalsContact O-OG1 3.06Å; V743-T745 PolarHBondContact O-N 3.46Å; T745-C747 VanDerWaalsContact C-N 3.3Å; T745-C747 PolarHBondContact O-N 3.45Å; T745-T748 PolarHBondContact O-N 2.95Å; T745-E749 WeakPolarHBondContact O-CB 3.31Å; T745-E749 PolarHBondContact O-N 3.4Å
746	L	84.6	Confident	80.7	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-60	-36.5	178.8	-74	169.8	0	0	0	113.2	L698 C702 F706 L742 V743 T748 T750 I759 F807 L811	L698-L746 HydrophobicContact CD2-CD2 3.68Å; C702-L746 HydrophobicContact CB-CD2 4.31Å; C702-L746 VanDerWaalsContact SG-CD2 3.58Å; F706-L746 HydrophobicContact CE2-CD1 4.46Å; F706-L746 HydrophobicContact CZ-CD1 4.29Å; L742-L746 HydrophobicContact CD1-CD1 3.81Å; L742-L746 HydrophobicContact CD1-CG 4.16Å; L742-L746 HydrophobicContact CG-CD1 3.94Å; L742-L746 WeakPolarHBondContact O-CB 3.27Å; L742-L746 VanDerWaalsContact O-CG 3.29Å; L742-L746 WeakPolarHBondContact O-CG 3.24Å; L742-L746 PolarHBondContact O-N 3.26Å; V743-L746 PolarHBondContact O-N 2.96Å; L746-T748 VanDerWaalsContact C-N 3.32Å; L746-T750 VanDerWaalsContact O-CG2 3.27Å; L746-T750 WeakPolarHBondContact O-CG2 3.42Å; L746-T750 PolarHBondContact O-OG1 2.88Å; L746-I759 HydrophobicContact CB-CG2 3.9Å; L746-I759 HydrophobicContact CD2-CG2 4.4Å; L746-F807 HydrophobicContact CD1-CE1 3.58Å; L746-F807 HydrophobicContact CD1-CZ 4.02Å; L746-L811 HydrophobicContact CD2-CD1 4.27Å
747	C	82.5	Confident	80	Confident	54 Å²	54	67.9 Å²	67.9	37%	0.365	34%	0.34	S	S	.	.	H	α-helix	trans	-72.2	-23.8	174.6	-70	0	0	0	0	113.4	V743 T745 S763	V743-C747 WeakPolarHBondContact O-CB 3.36Å; V743-C747 PolarHBondContact O-N 3.01Å; V743-C747 PolarHBondContact O-SG 2.84Å; T745-C747 VanDerWaalsContact C-N 3.3Å; T745-C747 PolarHBondContact O-N 3.45Å; C747-S763 PolarHBondContact SG-OG 3.46Å; C747-S763 VanDerWaalsContact SG-OG 3.33Å
748	T	80.4	Confident	79.3	Confident	118 Å²	118	69.8 Å²	69.8	72%	0.724	34%	0.343	S	S	*	.	H	α-helix	trans	-86.1	-36.1	177.7	-52.7	0	0	0	0	112.1	D744 T745 L746 T750	D744-T748 WeakPolarHBondContact O-CB 3.42Å; D744-T748 PolarHBondContact O-N 2.79Å; D744-T748 VanDerWaalsContact O-N 3.13Å; D744-T748 PolarHBondContact O-OG1 2.99Å; T745-T748 PolarHBondContact O-N 2.95Å; L746-T748 VanDerWaalsContact C-N 3.32Å; T748-T750 VanDerWaalsContact C-N 3.3Å; T748-T750 PolarHBondContact O-N 2.67Å
749	E	73.9	Confident	78.8	Confident	74 Å²	74	69.2 Å²	69.2	35%	0.346	34%	0.339	S	S	.	.	H	α-helix	trans	-75.2	-13.9	-174.1	-162.6	173.1	133	0	0	113.5	S699 C702 T745 Q751	S699-E749 WeakPolarHBondContact CB-OE1 3.21Å; S699-E749 WeakPolarHBondContact CB-OE2 3.36Å; S699-E749 PolarHBondContact N-OE1 3.36Å; C702-E749 PolarHBondContact SG-OE2 3.27Å; T745-E749 WeakPolarHBondContact O-CB 3.31Å; T745-E749 PolarHBondContact O-N 3.4Å; E749-Q751 PolarHBondContact O-N 2.96Å; E749-Q751 VanDerWaalsContact O-N 3.07Å
750	T	70.5	Confident	78.4	Confident	18 Å²	18	72.4 Å²	72.4	11%	0.11	36%	0.355	C	S	.	.			trans	-91.2	65.7	-166.4	38.3	0	0	0	0	115.1	L746 T748 R756 I759	L746-T750 VanDerWaalsContact O-CG2 3.27Å; L746-T750 WeakPolarHBondContact O-CG2 3.42Å; L746-T750 PolarHBondContact O-OG1 2.88Å; T748-T750 VanDerWaalsContact C-N 3.3Å; T748-T750 PolarHBondContact O-N 2.67Å; T750-R756 PolarHBondContact O-NE 3.43Å; T750-I759 HydrophobicContact CG2-CB 3.79Å; T750-I759 HydrophobicContact CG2-CD1 3.28Å; T750-I759 HydrophobicContact CG2-CG1 4.1Å; T750-I759 HydrophobicContact CG2-CG2 3.62Å
751	Q	62.1	Low	78	Confident	168 Å²	168	76.1 Å²	76.1	79%	0.785	37%	0.367	S	S	*	.			trans	-74.7	-28.3	178.5	-165	66.2	-13.5	0	0	113.9	E749 R756	E749-Q751 PolarHBondContact O-N 2.96Å; E749-Q751 VanDerWaalsContact O-N 3.07Å; Q751-R756 PolarHBondContact O-NH2 3.26Å
752	E	60.6	Low	77.7	Confident	105 Å²	105	71.9 Å²	71.9	49%	0.491	35%	0.351	S	S	.	.	S	Bend	trans	-75.5	140.1	-179.7	-164.4	165.9	-134.1	0	0	112.3	R694 R756	R694-E752 IonicContact NH1-OE1 2.78Å; E752-R756 WeakPolarHBondContact O-CB 3.33Å; E752-R756 PolarHBondContact O-NH2 2.96Å
753	R	56.8	Low	77.6	Confident	199 Å²	199	72 Å²	72	75%	0.751	35%	0.351	S	S	*	.	H	α-helix	trans	-72.3	-41.9	-161.8	-80.6	-170.8	172.8	-169.6	-1.4	115.4	R756	R753-R756 PolarHBondContact O-NH1 2.92Å
754	D	59.8	Low	77.6	Confident	135 Å²	135	74.9 Å²	74.9	72%	0.722	37%	0.372	S	S	*	.	H	α-helix	trans	-83	-44.9	-168.7	-54.3	-57.9	0	0	0	111.4	R756 N757	D754-R756 VanDerWaalsContact C-N 3.29Å; D754-R756 PolarHBondContact O-N 3.26Å; D754-N757 PolarHBondContact O-N 2.91Å
755	V	66.2	Low	77.7	Confident	27 Å²	27	76.9 Å²	76.9	16%	0.164	38%	0.379	C	S	.	.	H	α-helix	trans	-62.1	-33.5	177.2	-157.9	0	0	0	0	112.4	N757 E758 I759	V755-N757 PolarHBondContact O-N 3.35Å; V755-E758 PolarHBondContact O-N 3.15Å; V755-I759 HydrophobicContact CG1-CD1 3.69Å; V755-I759 HydrophobicContact CG1-CG1 4.33Å; V755-I759 PolarHBondContact O-N 3.42Å
756	R	76.6	Confident	78	Confident	69 Å²	69	75.4 Å²	75.4	26%	0.26	37%	0.37	S	S	.	.	H	α-helix	trans	-55.3	-37.5	179.7	-171.4	-172.8	-41.5	98.1	2.7	112.4	T750 Q751 E752 R753 D754 E758 I759 L760	T750-R756 PolarHBondContact O-NE 3.43Å; Q751-R756 PolarHBondContact O-NH2 3.26Å; E752-R756 WeakPolarHBondContact O-CB 3.33Å; E752-R756 PolarHBondContact O-NH2 2.96Å; R753-R756 PolarHBondContact O-NH1 2.92Å; D754-R756 VanDerWaalsContact C-N 3.29Å; D754-R756 PolarHBondContact O-N 3.26Å; R756-E758 VanDerWaalsContact C-N 3.26Å; R756-E758 PolarHBondContact O-N 2.99Å; R756-I759 PolarHBondContact O-N 3.48Å; R756-L760 HydrophobicContact CG-CD1 3.71Å; R756-L760 HydrophobicContact CG-CG 3.95Å; R756-L760 VanDerWaalsContact O-CB 3.25Å; R756-L760 WeakPolarHBondContact O-CB 3.21Å; R756-L760 VanDerWaalsContact O-CG 3.25Å; R756-L760 WeakPolarHBondContact O-CG 3.03Å; R756-L760 PolarHBondContact O-N 3.47Å
757	N	78.3	Confident	78.4	Confident	83 Å²	83	76.5 Å²	76.5	44%	0.444	38%	0.378	S	S	.	.	H	α-helix	trans	-66.2	-29.5	-179.3	-72.7	-50.8	0	0	0	112.6	D754 V755 R761	D754-N757 PolarHBondContact O-N 2.91Å; V755-N757 PolarHBondContact O-N 3.35Å; N757-R761 WeakPolarHBondContact O-CB 3.38Å; N757-R761 VanDerWaalsContact O-CG 3.23Å; N757-R761 WeakPolarHBondContact O-CG 3.43Å; N757-R761 VanDerWaalsContact O-CZ 3.27Å; N757-R761 PolarHBondContact O-N 3.02Å; N757-R761 PolarHBondContact O-NE 3.46Å
758	E	80.3	Confident	79	Confident	126 Å²	126	76.6 Å²	76.6	59%	0.589	38%	0.379	S	S	*	.	H	α-helix	trans	-83	-43.1	177.2	-68.9	-172.4	165	0	0	111.6	V755 R756 L760 R761 G762	V755-E758 PolarHBondContact O-N 3.15Å; R756-E758 VanDerWaalsContact C-N 3.26Å; R756-E758 PolarHBondContact O-N 2.99Å; E758-L760 PolarHBondContact O-N 3.41Å; E758-R761 PolarHBondContact O-N 3.14Å; E758-R761 IonicContact OE1-NH2 3.41Å; E758-G762 PolarHBondContact O-N 3.27Å
759	I	83.7	Confident	79.7	Confident	11 Å²	11	71 Å²	71	6%	0.056	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-40.2	175.5	-69.8	164.7	0	0	0	111.3	L746 T750 V755 R756 G762 S763 F807 L811	L746-I759 HydrophobicContact CB-CG2 3.9Å; L746-I759 HydrophobicContact CD2-CG2 4.4Å; T750-I759 HydrophobicContact CG2-CB 3.79Å; T750-I759 HydrophobicContact CG2-CD1 3.28Å; T750-I759 HydrophobicContact CG2-CG1 4.1Å; T750-I759 HydrophobicContact CG2-CG2 3.62Å; V755-I759 HydrophobicContact CG1-CD1 3.69Å; V755-I759 HydrophobicContact CG1-CG1 4.33Å; V755-I759 PolarHBondContact O-N 3.42Å; R756-I759 PolarHBondContact O-N 3.48Å; I759-G762 PolarHBondContact O-N 2.89Å; I759-S763 VanDerWaalsContact O-CB 3.23Å; I759-S763 WeakPolarHBondContact O-CB 3.24Å; I759-S763 PolarHBondContact O-N 3.13Å; I759-S763 PolarHBondContact O-OG 3.06Å; I759-F807 HydrophobicContact CG2-CZ 4.39Å; I759-L811 HydrophobicContact CD1-CD2 3.72Å; I759-L811 HydrophobicContact CG1-CD1 4.48Å; I759-L811 HydrophobicContact CG1-CD2 3.44Å; I759-L811 VanDerWaalsContact CG1-CD2 3.44Å
760	L	83.3	Confident	80.7	Confident	66 Å²	66	67.9 Å²	67.9	35%	0.346	33%	0.33	S	S	.	.	H	α-helix	trans	-67	-34.2	174.3	-72.3	178	0	0	0	112.8	R756 E758 S763 S764	R756-L760 HydrophobicContact CG-CD1 3.71Å; R756-L760 HydrophobicContact CG-CG 3.95Å; R756-L760 VanDerWaalsContact O-CB 3.25Å; R756-L760 WeakPolarHBondContact O-CB 3.21Å; R756-L760 VanDerWaalsContact O-CG 3.25Å; R756-L760 WeakPolarHBondContact O-CG 3.03Å; R756-L760 PolarHBondContact O-N 3.47Å; E758-L760 PolarHBondContact O-N 3.41Å; L760-S763 PolarHBondContact O-OG 3.13Å; L760-S764 WeakPolarHBondContact O-CB 3.41Å; L760-S764 PolarHBondContact O-N 3.46Å; L760-S764 PolarHBondContact O-OG 2.82Å
761	R	85.6	Confident	81.9	Confident	152 Å²	152	72.5 Å²	72.5	57%	0.574	35%	0.349	S	S	*	.	H	α-helix	trans	-66.1	-48.6	174.1	-81.3	-175.7	-67.9	-107.3	10.9	110.8	N757 E758 S764 H765	N757-R761 WeakPolarHBondContact O-CB 3.38Å; N757-R761 VanDerWaalsContact O-CG 3.23Å; N757-R761 WeakPolarHBondContact O-CG 3.43Å; N757-R761 VanDerWaalsContact O-CZ 3.27Å; N757-R761 PolarHBondContact O-N 3.02Å; N757-R761 PolarHBondContact O-NE 3.46Å; E758-R761 PolarHBondContact O-N 3.14Å; E758-R761 IonicContact OE1-NH2 3.41Å; R761-S764 PolarHBondContact O-N 3.21Å; R761-H765 PolarHBondContact O-N 2.82Å
762	G	86.8	Confident	83.5	Confident	9 Å²	9	67.1 Å²	67.1	9%	0.093	33%	0.325	C	S	.	.	H	α-helix	trans	-66.3	-41.4	178.3	0	0	0	0	0	113.7	E758 I759 H765 L766 H803	E758-G762 PolarHBondContact O-N 3.27Å; I759-G762 PolarHBondContact O-N 2.89Å; G762-H765 PolarHBondContact O-N 2.65Å; G762-L766 VanDerWaalsContact O-CB 3.29Å; G762-L766 WeakPolarHBondContact O-CB 3.48Å; G762-L766 PolarHBondContact O-N 2.67Å; G762-H803 PolarHBondContact O-CE1 3.32Å; G762-H803 VanDerWaalsContact O-CE1 3.29Å
763	S	89.7	Confident	85	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-69.8	-34.8	177.2	76.5	0	0	0	0	111.9	C747 I759 L760 L766 C767	C747-S763 PolarHBondContact SG-OG 3.46Å; C747-S763 VanDerWaalsContact SG-OG 3.33Å; I759-S763 VanDerWaalsContact O-CB 3.23Å; I759-S763 WeakPolarHBondContact O-CB 3.24Å; I759-S763 PolarHBondContact O-N 3.13Å; I759-S763 PolarHBondContact O-OG 3.06Å; L760-S763 PolarHBondContact O-OG 3.13Å; S763-L766 PolarHBondContact O-N 3.43Å; S763-C767 WeakPolarHBondContact O-CB 3.49Å; S763-C767 PolarHBondContact O-N 2.94Å
764	S	90.6	Very high	86.9	Confident	71 Å²	71	54.4 Å²	54.4	50%	0.497	28%	0.281	S	S	.	.	H	α-helix	trans	-64.8	-43.5	171.3	-64.2	0	0	0	0	112	L760 R761 C767 S768	L760-S764 WeakPolarHBondContact O-CB 3.41Å; L760-S764 PolarHBondContact O-N 3.46Å; L760-S764 PolarHBondContact O-OG 2.82Å; R761-S764 PolarHBondContact O-N 3.21Å; S764-C767 PolarHBondContact O-N 3.39Å; S764-S768 PolarHBondContact O-N 2.66Å; S764-S768 VanDerWaalsContact O-N 3.08Å; S764-S768 PolarHBondContact O-OG 3.5Å
765	H	92.4	Very high	88.5	Confident	95 Å²	95	52.7 Å²	52.7	44%	0.44	27%	0.271	S	S	.	.	H	α-helix	trans	-65	-44.1	175.4	-168.4	98.8	0	0	0	111.2	R761 G762 C767 S768 L769 H803	R761-H765 PolarHBondContact O-N 2.82Å; G762-H765 PolarHBondContact O-N 2.65Å; H765-C767 VanDerWaalsContact C-N 3.33Å; H765-C767 PolarHBondContact O-N 3.33Å; H765-S768 WeakPolarHBondContact O-CB 3.43Å; H765-S768 PolarHBondContact O-N 2.78Å; H765-S768 VanDerWaalsContact O-N 3.09Å; H765-L769 WeakPolarHBondContact O-CG 3.36Å; H765-L769 PolarHBondContact O-N 3.03Å; H765-H803 AromaticContact CD2-CD2 3.26Å; H765-H803 PolarHBondContact CD2-CD2 3.02Å; H765-H803 AromaticContact CD2-CE1 3.84Å; H765-H803 AromaticContact CD2-CG 3.63Å; H765-H803 AromaticContact CD2-ND1 3.96Å; H765-H803 AromaticContact CD2-NE2 3.41Å; H765-H803 PolarHBondContact CD2-NE2 3.48Å; H765-H803 AromaticContact CG-NE2 3.74Å; H765-H803 AromaticContact NE2-CD2 3.85Å
766	L	93.1	Very high	89.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-56.6	-45.2	173.7	-177.8	60.3	0	0	0	111.5	L742 V743 G762 S763 S768 L769 L770 L800 F807	L742-L766 HydrophobicContact CD2-CD2 4Å; L742-L766 HydrophobicContact CG-CD2 4.35Å; V743-L766 HydrophobicContact CG2-CB 4.24Å; V743-L766 HydrophobicContact CG2-CD2 3.74Å; V743-L766 HydrophobicContact CG2-CG 3.97Å; G762-L766 VanDerWaalsContact O-CB 3.29Å; G762-L766 WeakPolarHBondContact O-CB 3.48Å; G762-L766 PolarHBondContact O-N 2.67Å; S763-L766 PolarHBondContact O-N 3.43Å; L766-S768 VanDerWaalsContact C-N 3.31Å; L766-S768 PolarHBondContact O-N 2.85Å; L766-L769 PolarHBondContact O-N 2.98Å; L766-L770 HydrophobicContact CG-CD1 4.39Å; L766-L770 VanDerWaalsContact O-CG 3.31Å; L766-L770 WeakPolarHBondContact O-CG 3.19Å; L766-L770 PolarHBondContact O-N 3.27Å; L766-L800 HydrophobicContact CD1-CD1 3.48Å; L766-L800 VanDerWaalsContact CD1-CD1 3.48Å; L766-F807 HydrophobicContact CD2-CD1 4.43Å; L766-F807 HydrophobicContact CD2-CE1 4.45Å
767	C	93.9	Very high	90.5	Very high	24 Å²	24	48.8 Å²	48.8	16%	0.162	26%	0.256	C	S	.	.	H	α-helix	trans	-60.7	-35.9	175.3	-173.5	0	0	0	0	112.9	S763 S764 H765 K771	S763-C767 WeakPolarHBondContact O-CB 3.49Å; S763-C767 PolarHBondContact O-N 2.94Å; S764-C767 PolarHBondContact O-N 3.39Å; H765-C767 VanDerWaalsContact C-N 3.33Å; H765-C767 PolarHBondContact O-N 3.33Å; C767-K771 WeakPolarHBondContact O-CD 3.34Å; C767-K771 WeakPolarHBondContact O-CG 3.26Å; C767-K771 PolarHBondContact O-N 2.99Å; C767-K771 VanDerWaalsContact SG-CE 3.54Å; C767-K771 PolarHBondContact SG-NZ 3.23Å; C767-K771 VanDerWaalsContact SG-NZ 3.35Å
768	S	95.2	Very high	91.2	Very high	56 Å²	56	51 Å²	51	39%	0.392	26%	0.261	S	S	.	.	H	α-helix	trans	-66.3	-45.7	172.6	-64.8	0	0	0	0	112.1	S764 H765 L766 L770 K771 D772	S764-S768 PolarHBondContact O-N 2.66Å; S764-S768 VanDerWaalsContact O-N 3.08Å; S764-S768 PolarHBondContact O-OG 3.5Å; H765-S768 WeakPolarHBondContact O-CB 3.43Å; H765-S768 PolarHBondContact O-N 2.78Å; H765-S768 VanDerWaalsContact O-N 3.09Å; L766-S768 VanDerWaalsContact C-N 3.31Å; L766-S768 PolarHBondContact O-N 2.85Å; S768-L770 VanDerWaalsContact C-N 3.3Å; S768-L770 PolarHBondContact O-N 2.69Å; S768-K771 WeakPolarHBondContact O-CA 3.41Å; S768-K771 WeakPolarHBondContact O-CB 3.25Å; S768-K771 PolarHBondContact O-N 2.72Å; S768-D772 PolarHBondContact O-N 2.85Å
769	L	95	Very high	91.7	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-35	177.8	-61.1	-178.8	0	0	0	112.8	H765 L766 K771 D772 V773 K799 L800 H803	H765-L769 WeakPolarHBondContact O-CG 3.36Å; H765-L769 PolarHBondContact O-N 3.03Å; L766-L769 PolarHBondContact O-N 2.98Å; L769-K771 VanDerWaalsContact C-N 3.3Å; L769-K771 PolarHBondContact O-N 2.91Å; L769-D772 PolarHBondContact O-N 3.26Å; L769-V773 WeakPolarHBondContact O-CG2 3.32Å; L769-V773 PolarHBondContact O-N 3.39Å; L769-K799 HydrophobicContact CD2-CD 3.66Å; L769-K799 HydrophobicContact CD2-CG 3.8Å; L769-L800 HydrophobicContact CB-CB 4.31Å; L769-L800 HydrophobicContact CB-CD1 3.77Å; L769-H803 HydrophobicContact CD1-CB 3.39Å
770	L	94.5	Very high	91.9	Very high	7 Å²	7	48.7 Å²	48.7	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-66.2	-31.5	173.5	-64.4	169.2	0	0	0	112.3	V735 G739 L766 S768 A774 L800	V735-L770 HydrophobicContact CG1-CD2 4.39Å; G739-L770 VanDerWaalsContact C-CD1 3.43Å; L766-L770 HydrophobicContact CG-CD1 4.39Å; L766-L770 VanDerWaalsContact O-CG 3.31Å; L766-L770 WeakPolarHBondContact O-CG 3.19Å; L766-L770 PolarHBondContact O-N 3.27Å; S768-L770 VanDerWaalsContact C-N 3.3Å; S768-L770 PolarHBondContact O-N 2.69Å; L770-A774 WeakPolarHBondContact O-CB 3.42Å; L770-A774 PolarHBondContact O-N 3.2Å; L770-A774 VanDerWaalsContact O-N 3.09Å; L770-L800 HydrophobicContact CD2-CD1 3.74Å; L770-L800 HydrophobicContact CD2-CD2 3.75Å; L770-L800 HydrophobicContact CD2-CG 4.42Å; L770-L800 HydrophobicContact CG-CD1 4.08Å
771	K	95.6	Very high	92.2	Very high	115 Å²	115	47.7 Å²	47.7	50%	0.5	25%	0.25	S	S	.	.	H	α-helix	trans	-73.1	-41.8	172.5	-66.7	160.7	-171.3	159.5	0	111.5	C767 S768 L769 V773 A774 L775	C767-K771 WeakPolarHBondContact O-CD 3.34Å; C767-K771 WeakPolarHBondContact O-CG 3.26Å; C767-K771 PolarHBondContact O-N 2.99Å; C767-K771 VanDerWaalsContact SG-CE 3.54Å; C767-K771 PolarHBondContact SG-NZ 3.23Å; C767-K771 VanDerWaalsContact SG-NZ 3.35Å; S768-K771 WeakPolarHBondContact O-CA 3.41Å; S768-K771 WeakPolarHBondContact O-CB 3.25Å; S768-K771 PolarHBondContact O-N 2.72Å; L769-K771 VanDerWaalsContact C-N 3.3Å; L769-K771 PolarHBondContact O-N 2.91Å; K771-V773 PolarHBondContact O-N 2.86Å; K771-A774 WeakPolarHBondContact O-CB 3.43Å; K771-A774 PolarHBondContact O-N 3.37Å; K771-A774 VanDerWaalsContact O-N 3.17Å; K771-L775 WeakPolarHBondContact O-CG 3.46Å; K771-L775 PolarHBondContact O-N 3.07Å
772	D	94.6	Very high	92.3	Very high	55 Å²	55	46.5 Å²	46.5	29%	0.294	26%	0.255	S	S	.	.	H	α-helix	trans	-59.7	-46.3	176.4	-65.9	-13.5	0	0	0	110.6	S768 L769 A774 L775 A776 E796 K799	S768-D772 PolarHBondContact O-N 2.85Å; L769-D772 PolarHBondContact O-N 3.26Å; D772-A774 PolarHBondContact O-N 2.97Å; D772-L775 PolarHBondContact O-N 3.32Å; D772-A776 WeakPolarHBondContact O-CB 3.08Å; D772-A776 PolarHBondContact O-N 2.97Å; D772-E796 HydrophobicContact CB-CG 4.36Å; D772-E796 WeakPolarHBondContact CB-OE2 3.42Å; D772-K799 IonicContact OD2-NZ 2.73Å; D772-K799 PolarHBondContact OD2-NZ 3.41Å
773	V	93.9	Very high	92.4	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-61.2	-40.8	173.3	169.5	0	0	0	0	112	L769 K771 A776 T777 L793 E796 L800	L769-V773 WeakPolarHBondContact O-CG2 3.32Å; L769-V773 PolarHBondContact O-N 3.39Å; K771-V773 PolarHBondContact O-N 2.86Å; V773-A776 PolarHBondContact O-N 3.09Å; V773-T777 WeakPolarHBondContact O-CB 3.38Å; V773-T777 PolarHBondContact O-N 2.91Å; V773-T777 PolarHBondContact O-OG1 3.41Å; V773-L793 HydrophobicContact CG1-CD1 4.39Å; V773-E796 HydrophobicContact CG2-CB 3.98Å; V773-L800 HydrophobicContact CG2-CB 4.36Å; V773-L800 HydrophobicContact CG2-CD2 4.2Å
774	A	94.9	Very high	92.1	Very high	37 Å²	37	53.1 Å²	53.1	31%	0.306	29%	0.285	S	S	.	.	H	α-helix	trans	-64.1	-41.4	176.7	0	0	0	0	0	112.7	I736 L770 K771 D772 T777 K778	I736-A774 HydrophobicContact CD1-CB 3.66Å; L770-A774 WeakPolarHBondContact O-CB 3.42Å; L770-A774 PolarHBondContact O-N 3.2Å; L770-A774 VanDerWaalsContact O-N 3.09Å; K771-A774 WeakPolarHBondContact O-CB 3.43Å; K771-A774 PolarHBondContact O-N 3.37Å; K771-A774 VanDerWaalsContact O-N 3.17Å; D772-A774 PolarHBondContact O-N 2.97Å; A774-T777 PolarHBondContact O-N 3.34Å; A774-K778 PolarHBondContact O-N 2.89Å
775	L	94.3	Very high	91.6	Very high	98 Å²	98	54.6 Å²	54.6	51%	0.513	29%	0.293	S	S	.	.	H	α-helix	trans	-68.9	-44.3	176.5	-70.3	172.1	0	0	0	111.6	K771 D772 T777 K778 N779	K771-L775 WeakPolarHBondContact O-CG 3.46Å; K771-L775 PolarHBondContact O-N 3.07Å; D772-L775 PolarHBondContact O-N 3.32Å; L775-T777 VanDerWaalsContact C-N 3.3Å; L775-T777 PolarHBondContact O-N 2.88Å; L775-K778 WeakPolarHBondContact O-CB 3.43Å; L775-K778 PolarHBondContact O-N 2.9Å; L775-N779 VanDerWaalsContact O-CG 3.25Å; L775-N779 PolarHBondContact O-N 2.97Å
776	A	92.1	Very high	91.3	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-37	174.6	0	0	0	0	0	111.7	D772 V773 N779 A780 L793	D772-A776 WeakPolarHBondContact O-CB 3.08Å; D772-A776 PolarHBondContact O-N 2.97Å; V773-A776 PolarHBondContact O-N 3.09Å; A776-N779 PolarHBondContact O-N 3.29Å; A776-A780 WeakPolarHBondContact O-CB 3.24Å; A776-A780 PolarHBondContact O-N 3.3Å; A776-L793 HydrophobicContact CB-CB 4.17Å; A776-L793 HydrophobicContact CB-CD1 3.76Å
777	T	92.1	Very high	90.9	Very high	11 Å²	11	57 Å²	57	7%	0.067	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-48.6	174.1	-58.2	0	0	0	0	110.7	S732 V773 A774 L775 N779 A780 V781 L793	S732-T777 WeakPolarHBondContact CB-OG1 3.35Å; S732-T777 PolarHBondContact OG-OG1 2.91Å; V773-T777 WeakPolarHBondContact O-CB 3.38Å; V773-T777 PolarHBondContact O-N 2.91Å; V773-T777 PolarHBondContact O-OG1 3.41Å; A774-T777 PolarHBondContact O-N 3.34Å; L775-T777 VanDerWaalsContact C-N 3.3Å; L775-T777 PolarHBondContact O-N 2.88Å; T777-N779 VanDerWaalsContact C-N 3.3Å; T777-N779 PolarHBondContact O-N 3.38Å; T777-A780 PolarHBondContact O-N 3.39Å; T777-V781 HydrophobicContact CG2-CG2 4.46Å; T777-V781 WeakPolarHBondContact O-CB 3.26Å; T777-V781 VanDerWaalsContact O-CG2 3.25Å; T777-V781 WeakPolarHBondContact O-CG2 3.45Å; T777-V781 PolarHBondContact O-N 3.23Å; T777-L793 WeakPolarHBondContact OG1-CD1 3.41Å
778	K	93.5	Very high	90.5	Very high	129 Å²	129	59.6 Å²	59.6	56%	0.561	34%	0.341	S	S	*	.	H	α-helix	trans	-56.1	-46.1	175.5	177.5	-174.4	173	-172.3	0	111.1	A774 L775 L782	A774-K778 PolarHBondContact O-N 2.89Å; L775-K778 WeakPolarHBondContact O-CB 3.43Å; L775-K778 PolarHBondContact O-N 2.9Å; K778-L782 HydrophobicContact CG-CD1 3.84Å; K778-L782 HydrophobicContact CG-CG 4.49Å; K778-L782 WeakPolarHBondContact O-CB 3.5Å; K778-L782 VanDerWaalsContact O-CG 3.24Å; K778-L782 WeakPolarHBondContact O-CG 3.5Å; K778-L782 PolarHBondContact O-N 3.29Å
779	N	90.6	Very high	90.2	Very high	86 Å²	86	57.7 Å²	57.7	46%	0.46	33%	0.329	S	S	.	.	H	α-helix	trans	-65.8	-48.8	-179	-67.7	-12.8	0	0	0	111.6	L775 A776 T777 V781 L782 T783	L775-N779 VanDerWaalsContact O-CG 3.25Å; L775-N779 PolarHBondContact O-N 2.97Å; A776-N779 PolarHBondContact O-N 3.29Å; T777-N779 VanDerWaalsContact C-N 3.3Å; T777-N779 PolarHBondContact O-N 3.38Å; N779-V781 VanDerWaalsContact C-N 3.29Å; N779-V781 PolarHBondContact O-N 3.49Å; N779-L782 PolarHBondContact O-N 3.09Å; N779-L782 VanDerWaalsContact O-N 3.15Å; N779-T783 PolarHBondContact O-N 2.93Å; N779-T783 PolarHBondContact O-OG1 3.15Å; N779-T783 VanDerWaalsContact O-OG1 3.09Å
780	A	88.6	Confident	89.8	Confident	2 Å²	2	59.4 Å²	59.4	2%	0.017	34%	0.338	C	S	.	.	H	α-helix	trans	-60.5	-35.5	179	0	0	0	0	0	113.3	A776 T777 Y784 A789 L790 L793	A776-A780 WeakPolarHBondContact O-CB 3.24Å; A776-A780 PolarHBondContact O-N 3.3Å; T777-A780 PolarHBondContact O-N 3.39Å; A780-Y784 WeakPolarHBondContact O-CB 3.38Å; A780-Y784 PolarHBondContact O-N 3.42Å; A780-A789 HydrophobicContact CB-CB 4.16Å; A780-L790 HydrophobicContact CB-CD2 4.19Å; A780-L793 HydrophobicContact CB-CB 4.4Å; A780-L793 HydrophobicContact CB-CD2 3.76Å
781	V	89.2	Confident	89.5	Confident	46 Å²	46	60.8 Å²	60.8	28%	0.279	35%	0.354	S	S	.	.	H	α-helix	trans	-71.1	-42.8	174.1	169.5	0	0	0	0	111.8	I729 T777 N779 Y784	I729-V781 HydrophobicContact CD1-CG1 3.96Å; I729-V781 HydrophobicContact CD1-CG2 3.85Å; I729-V781 HydrophobicContact CG1-CG2 3.59Å; T777-V781 HydrophobicContact CG2-CG2 4.46Å; T777-V781 WeakPolarHBondContact O-CB 3.26Å; T777-V781 VanDerWaalsContact O-CG2 3.25Å; T777-V781 WeakPolarHBondContact O-CG2 3.45Å; T777-V781 PolarHBondContact O-N 3.23Å; N779-V781 VanDerWaalsContact C-N 3.29Å; N779-V781 PolarHBondContact O-N 3.49Å; V781-Y784 WeakPolarHBondContact O-CB 3.34Å; V781-Y784 PolarHBondContact O-N 2.87Å
782	L	88.6	Confident	89.2	Confident	127 Å²	127	60.6 Å²	60.6	67%	0.665	36%	0.355	S	S	*	.	H	α-helix	trans	-68.7	-33	179.7	-74.4	172.8	0	0	0	112.9	K778 N779	K778-L782 HydrophobicContact CG-CD1 3.84Å; K778-L782 HydrophobicContact CG-CG 4.49Å; K778-L782 WeakPolarHBondContact O-CB 3.5Å; K778-L782 VanDerWaalsContact O-CG 3.24Å; K778-L782 WeakPolarHBondContact O-CG 3.5Å; K778-L782 PolarHBondContact O-N 3.29Å; N779-L782 PolarHBondContact O-N 3.09Å; N779-L782 VanDerWaalsContact O-N 3.15Å
783	T	87.1	Confident	89.1	Confident	75 Å²	75	58 Å²	58	46%	0.46	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	23.9	176.7	66.5	0	0	0	0	112.7	N779 P785 S786 A789	N779-T783 PolarHBondContact O-N 2.93Å; N779-T783 PolarHBondContact O-OG1 3.15Å; N779-T783 VanDerWaalsContact O-OG1 3.09Å; T783-P785 CarbonylContact O-C 3.28Å; T783-P785 VanDerWaalsContact O-C 3.28Å; T783-S786 WeakPolarHBondContact O-CB 3.44Å; T783-S786 PolarHBondContact O-N 3.27Å; T783-S786 VanDerWaalsContact O-N 3.12Å; T783-A789 VanDerWaalsContact OG1-CB 3.28Å; T783-A789 WeakPolarHBondContact OG1-CB 3.46Å
784	Y	84.5	Confident	88.9	Confident	74 Å²	74	62.1 Å²	62.1	29%	0.29	36%	0.36	S	S	.	.			trans	-74.6	134.1	-173.3	-169.2	-93.4	0	0	0	112.5	S723 P725 A780 V781 L790	S723-Y784 WeakPolarHBondContact CA-OH 3.4Å; S723-Y784 PolarHBondContact O-OH 3.31Å; P725-Y784 HydrophobicContact CB-CD1 4.26Å; P725-Y784 HydrophobicContact CB-CD2 4.12Å; P725-Y784 HydrophobicContact CB-CE2 4.4Å; P725-Y784 HydrophobicContact CB-CG 4.06Å; P725-Y784 HydrophobicContact CG-CD1 3.95Å; P725-Y784 HydrophobicContact CG-CE1 4.04Å; P725-Y784 HydrophobicContact CG-CG 4.26Å; A780-Y784 WeakPolarHBondContact O-CB 3.38Å; A780-Y784 PolarHBondContact O-N 3.42Å; V781-Y784 WeakPolarHBondContact O-CB 3.34Å; V781-Y784 PolarHBondContact O-N 2.87Å; Y784-L790 HydrophobicContact CE2-CD1 4.46Å
785	P	80.6	Confident	88.8	Confident	102 Å²	102	62.6 Å²	62.6	66%	0.662	36%	0.364	S	S	*	.	S	Bend	cis	-88	123.2	-6.5	33.1	-30.7	0	0	0	112.2	T783	T783-P785 CarbonylContact O-C 3.28Å; T783-P785 VanDerWaalsContact O-C 3.28Å
786	S	85.3	Confident	88.8	Confident	31 Å²	31	59.2 Å²	59.2	22%	0.217	35%	0.345	C	S	.	.			trans	-130.5	113.2	173.1	171	0	0	0	0	110	T783 A788 A789 L790	T783-S786 WeakPolarHBondContact O-CB 3.44Å; T783-S786 PolarHBondContact O-N 3.27Å; T783-S786 VanDerWaalsContact O-N 3.12Å; S786-A788 VanDerWaalsContact C-N 3.25Å; S786-A788 PolarHBondContact O-N 3.41Å; S786-A789 PolarHBondContact O-N 2.88Å; S786-A789 PolarHBondContact OG-N 3.1Å; S786-L790 WeakPolarHBondContact O-CG 3.28Å; S786-L790 PolarHBondContact O-N 3.15Å
787	P	84.1	Confident	88.8	Confident	115 Å²	115	59.1 Å²	59.1	75%	0.747	34%	0.344	S	S	*	.	H	α-helix	trans	-66.4	-28.9	-179.6	26.9	-33.8	0	0	0	112.1	G791	P787-G791 PolarHBondContact O-N 3.07Å
788	A	87.1	Confident	88.8	Confident	78 Å²	78	61.9 Å²	61.9	65%	0.645	36%	0.357	S	S	*	.	H	α-helix	trans	-67.4	-40.1	175	0	0	0	0	0	112.1	S786 G791 H792	S786-A788 VanDerWaalsContact C-N 3.25Å; S786-A788 PolarHBondContact O-N 3.41Å; A788-G791 PolarHBondContact O-N 2.95Å; A788-H792 PolarHBondContact O-N 3.38Å
789	A	87.4	Confident	88.8	Confident	17 Å²	17	58.7 Å²	58.7	14%	0.14	34%	0.343	C	S	.	.	H	α-helix	trans	-73.3	-35.4	177.6	0	0	0	0	0	112.2	A780 T783 S786 H792 L793	A780-A789 HydrophobicContact CB-CB 4.16Å; T783-A789 VanDerWaalsContact OG1-CB 3.28Å; T783-A789 WeakPolarHBondContact OG1-CB 3.46Å; S786-A789 PolarHBondContact O-N 2.88Å; S786-A789 PolarHBondContact OG-N 3.1Å; A789-H792 PolarHBondContact O-N 3.5Å; A789-L793 WeakPolarHBondContact O-CB 3.36Å; A789-L793 PolarHBondContact O-N 3.2Å
790	L	87.6	Confident	89	Confident	37 Å²	37	54.7 Å²	54.7	19%	0.194	32%	0.321	C	S	.	.	H	α-helix	trans	-66	-40.6	171.4	-68.9	169.3	0	0	0	111.8	L720 I728 A780 Y784 S786 L793 Q794	L720-L790 HydrophobicContact CD2-CD2 4.16Å; I728-L790 HydrophobicContact CD1-CD2 3.69Å; A780-L790 HydrophobicContact CB-CD2 4.19Å; Y784-L790 HydrophobicContact CE2-CD1 4.46Å; S786-L790 WeakPolarHBondContact O-CG 3.28Å; S786-L790 PolarHBondContact O-N 3.15Å; L790-L793 WeakPolarHBondContact O-CB 3.47Å; L790-L793 PolarHBondContact O-N 3.03Å; L790-Q794 PolarHBondContact O-N 3.36Å
791	G	87	Confident	89.3	Confident	37 Å²	37	56.4 Å²	56.4	38%	0.381	33%	0.329	S	S	.	.	H	α-helix	trans	-63.5	-40.3	174.3	0	0	0	0	0	113.3	P787 A788 L793 Q794 A795	P787-G791 PolarHBondContact O-N 3.07Å; A788-G791 PolarHBondContact O-N 2.95Å; G791-L793 VanDerWaalsContact C-N 3.33Å; G791-L793 PolarHBondContact O-N 3.5Å; G791-Q794 PolarHBondContact O-N 2.85Å; G791-A795 WeakPolarHBondContact O-CB 3.46Å; G791-A795 PolarHBondContact O-N 2.85Å
792	H	90.1	Very high	89.4	Confident	111 Å²	111	60.5 Å²	60.5	51%	0.514	34%	0.339	S	S	.	.	H	α-helix	trans	-63.4	-39.3	172.1	-172.3	-40.9	0	0	0	111.8	A788 A789 A795 E796	A788-H792 PolarHBondContact O-N 3.38Å; A789-H792 PolarHBondContact O-N 3.5Å; H792-A795 PolarHBondContact O-N 3.07Å; H792-E796 PolarHBondContact O-N 3.08Å; H792-E796 VanDerWaalsContact O-N 3.15Å
793	L	91.8	Very high	89.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.4	-39.4	176.9	177.2	54.6	0	0	0	112.2	F716 L720 I728 V773 A776 T777 A780 A789 L790 G791 A797	F716-L793 HydrophobicContact CE1-CD1 4.22Å; F716-L793 HydrophobicContact CE1-CG 4.16Å; F716-L793 HydrophobicContact CZ-CD1 3.72Å; F716-L793 HydrophobicContact CZ-CD2 3.84Å; F716-L793 HydrophobicContact CZ-CG 3.65Å; L720-L793 HydrophobicContact CD2-CD2 3.87Å; L720-L793 HydrophobicContact CD2-CG 4.17Å; I728-L793 HydrophobicContact CG2-CD2 3.78Å; V773-L793 HydrophobicContact CG1-CD1 4.39Å; A776-L793 HydrophobicContact CB-CB 4.17Å; A776-L793 HydrophobicContact CB-CD1 3.76Å; T777-L793 WeakPolarHBondContact OG1-CD1 3.41Å; A780-L793 HydrophobicContact CB-CB 4.4Å; A780-L793 HydrophobicContact CB-CD2 3.76Å; A789-L793 WeakPolarHBondContact O-CB 3.36Å; A789-L793 PolarHBondContact O-N 3.2Å; L790-L793 WeakPolarHBondContact O-CB 3.47Å; L790-L793 PolarHBondContact O-N 3.03Å; G791-L793 VanDerWaalsContact C-N 3.33Å; G791-L793 PolarHBondContact O-N 3.5Å; L793-A797 PolarHBondContact O-N 3.26Å; L793-A797 VanDerWaalsContact O-N 3.1Å
794	Q	91.1	Very high	89.8	Confident	88 Å²	88	52.3 Å²	52.3	41%	0.411	29%	0.292	S	S	.	.	H	α-helix	trans	-62.4	-48.1	171.5	-172	-175.5	-37	0	0	111.4	L720 L790 G791 E796 A797 E798	L720-Q794 HydrophobicContact CD1-CB 3.89Å; L720-Q794 HydrophobicContact CD1-CG 4.25Å; L790-Q794 PolarHBondContact O-N 3.36Å; G791-Q794 PolarHBondContact O-N 2.85Å; Q794-E796 VanDerWaalsContact C-N 3.27Å; Q794-E796 PolarHBondContact O-N 3.36Å; Q794-A797 PolarHBondContact O-N 2.73Å; Q794-E798 HydrophobicContact CG-CG 4.38Å; Q794-E798 PolarHBondContact NE2-OE1 3.46Å; Q794-E798 WeakPolarHBondContact O-CG 3.45Å; Q794-E798 PolarHBondContact O-N 2.7Å
795	A	92.5	Very high	90.1	Very high	46 Å²	46	55.1 Å²	55.1	38%	0.38	30%	0.302	S	S	.	.	H	α-helix	trans	-59.2	-37	-178.5	0	0	0	0	0	113.1	G791 H792 K799	G791-A795 WeakPolarHBondContact O-CB 3.46Å; G791-A795 PolarHBondContact O-N 2.85Å; H792-A795 PolarHBondContact O-N 3.07Å; A795-K799 VanDerWaalsContact O-CB 3.26Å; A795-K799 WeakPolarHBondContact O-CB 3.41Å; A795-K799 PolarHBondContact O-N 3.23Å; A795-K799 VanDerWaalsContact O-N 3.07Å
796	E	93	Very high	90.5	Very high	28 Å²	28	56.8 Å²	56.8	13%	0.131	30%	0.301	C	S	.	.	H	α-helix	trans	-72.4	-36.7	174.4	-74.3	-61.5	144.7	0	0	112.8	D772 V773 H792 Q794 K799 L800	D772-E796 HydrophobicContact CB-CG 4.36Å; D772-E796 WeakPolarHBondContact CB-OE2 3.42Å; V773-E796 HydrophobicContact CG2-CB 3.98Å; H792-E796 PolarHBondContact O-N 3.08Å; H792-E796 VanDerWaalsContact O-N 3.15Å; Q794-E796 VanDerWaalsContact C-N 3.27Å; Q794-E796 PolarHBondContact O-N 3.36Å; E796-K799 PolarHBondContact O-N 3.14Å; E796-K799 WeakPolarHBondContact OE1-CD 3.39Å; E796-K799 IonicContact OE1-NZ 3.46Å; E796-K799 PolarHBondContact OE1-NZ 2.89Å; E796-K799 WeakPolarHBondContact OE2-CD 3.48Å; E796-K799 IonicContact OE2-NZ 3.81Å; E796-K799 PolarHBondContact OE2-NZ 3.04Å; E796-L800 WeakPolarHBondContact O-CB 3.4Å; E796-L800 PolarHBondContact O-N 3.4Å
797	A	92.1	Very high	90.6	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-68.4	-38.6	173.8	0	0	0	0	0	112.7	F716 H717 L793 Q794 K799 L800 E801	F716-A797 HydrophobicContact CD1-CB 3.85Å; F716-A797 HydrophobicContact CE1-CB 3.68Å; H717-A797 WeakPolarHBondContact NE2-CB 3.31Å; L793-A797 PolarHBondContact O-N 3.26Å; L793-A797 VanDerWaalsContact O-N 3.1Å; Q794-A797 PolarHBondContact O-N 2.73Å; A797-K799 VanDerWaalsContact C-N 3.34Å; A797-L800 WeakPolarHBondContact O-CB 3.46Å; A797-L800 PolarHBondContact O-N 2.87Å; A797-E801 WeakPolarHBondContact O-CB 3.31Å; A797-E801 PolarHBondContact O-N 3.48Å
798	E	93.6	Very high	90.8	Very high	70 Å²	70	56.3 Å²	56.3	33%	0.327	28%	0.28	S	S	.	.	H	α-helix	trans	-65.8	-35.9	172.1	-70.5	176.1	-164.7	0	0	112.5	Q794 E801 R802	Q794-E798 HydrophobicContact CG-CG 4.38Å; Q794-E798 PolarHBondContact NE2-OE1 3.46Å; Q794-E798 WeakPolarHBondContact O-CG 3.45Å; Q794-E798 PolarHBondContact O-N 2.7Å; E798-E801 PolarHBondContact O-N 2.89Å; E798-R802 VanDerWaalsContact CB-NH2 3.33Å; E798-R802 VanDerWaalsContact O-CB 3.31Å; E798-R802 WeakPolarHBondContact O-CB 3.5Å; E798-R802 VanDerWaalsContact O-CG 3.31Å; E798-R802 WeakPolarHBondContact O-CG 3.38Å; E798-R802 PolarHBondContact O-N 3.23Å; E798-R802 PolarHBondContact O-NE 2.74Å; E798-R802 IonicContact OE2-NH2 3.84Å
799	K	93.9	Very high	90.6	Very high	62 Å²	62	55.2 Å²	55.2	27%	0.27	28%	0.277	S	S	.	.	H	α-helix	trans	-66.8	-43.1	175.3	178.8	-163.6	173.7	-156.2	0	110.4	L769 D772 A795 E796 A797 H803	L769-K799 HydrophobicContact CD2-CD 3.66Å; L769-K799 HydrophobicContact CD2-CG 3.8Å; D772-K799 IonicContact OD2-NZ 2.73Å; D772-K799 PolarHBondContact OD2-NZ 3.41Å; A795-K799 VanDerWaalsContact O-CB 3.26Å; A795-K799 WeakPolarHBondContact O-CB 3.41Å; A795-K799 PolarHBondContact O-N 3.23Å; A795-K799 VanDerWaalsContact O-N 3.07Å; E796-K799 PolarHBondContact O-N 3.14Å; E796-K799 WeakPolarHBondContact OE1-CD 3.39Å; E796-K799 IonicContact OE1-NZ 3.46Å; E796-K799 PolarHBondContact OE1-NZ 2.89Å; E796-K799 WeakPolarHBondContact OE2-CD 3.48Å; E796-K799 IonicContact OE2-NZ 3.81Å; E796-K799 PolarHBondContact OE2-NZ 3.04Å; A797-K799 VanDerWaalsContact C-N 3.34Å; K799-H803 WeakPolarHBondContact O-CB 3.29Å; K799-H803 PolarHBondContact O-N 3.35Å
800	L	94	Very high	90.2	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-57.5	-46.9	168.7	177.4	68.3	0	0	0	111.8	I713 V735 L766 L769 L770 V773 E796 A797 T804	I713-L800 HydrophobicContact CD1-CD2 4.03Å; I713-L800 HydrophobicContact CD1-CG 4.1Å; I713-L800 HydrophobicContact CG1-CD2 4.38Å; V735-L800 HydrophobicContact CG1-CD2 3.47Å; V735-L800 VanDerWaalsContact CG1-CD2 3.47Å; L766-L800 HydrophobicContact CD1-CD1 3.48Å; L766-L800 VanDerWaalsContact CD1-CD1 3.48Å; L769-L800 HydrophobicContact CB-CB 4.31Å; L769-L800 HydrophobicContact CB-CD1 3.77Å; L770-L800 HydrophobicContact CD2-CD1 3.74Å; L770-L800 HydrophobicContact CD2-CD2 3.75Å; L770-L800 HydrophobicContact CD2-CG 4.42Å; L770-L800 HydrophobicContact CG-CD1 4.08Å; V773-L800 HydrophobicContact CG2-CB 4.36Å; V773-L800 HydrophobicContact CG2-CD2 4.2Å; E796-L800 WeakPolarHBondContact O-CB 3.4Å; E796-L800 PolarHBondContact O-N 3.4Å; A797-L800 WeakPolarHBondContact O-CB 3.46Å; A797-L800 PolarHBondContact O-N 2.87Å; L800-T804 VanDerWaalsContact O-CB 3.26Å; L800-T804 WeakPolarHBondContact O-CB 3.37Å; L800-T804 PolarHBondContact O-N 3.34Å; L800-T804 PolarHBondContact O-OG1 3.35Å
801	E	93.6	Very high	89.5	Confident	39 Å²	39	57.4 Å²	57.4	18%	0.182	29%	0.29	C	S	.	.	H	α-helix	trans	-64.8	-46	179.9	-159.4	-159.3	114.6	0	0	112.3	F710 I713 H717 A797 E798 T804 R805	F710-E801 HydrophobicContact CD1-CG 4.04Å; F710-E801 HydrophobicContact CE1-CG 4.09Å; I713-E801 HydrophobicContact CD1-CB 4.27Å; I713-E801 HydrophobicContact CD1-CG 4.37Å; I713-E801 HydrophobicContact CG2-CB 4.13Å; I713-E801 HydrophobicContact CG2-CG 4.07Å; H717-E801 IonicContact CE1-OE2 3.48Å; H717-E801 PolarHBondContact CE1-OE2 3.4Å; H717-E801 IonicContact ND1-OE2 3.88Å; A797-E801 WeakPolarHBondContact O-CB 3.31Å; A797-E801 PolarHBondContact O-N 3.48Å; E798-E801 PolarHBondContact O-N 2.89Å; E801-T804 PolarHBondContact O-N 3.24Å; E801-R805 WeakPolarHBondContact O-CB 3.31Å; E801-R805 PolarHBondContact O-N 2.87Å; E801-R805 IonicContact OE1-CZ 3.18Å; E801-R805 IonicContact OE1-NH1 3.53Å; E801-R805 PolarHBondContact OE1-NH1 3.12Å; E801-R805 IonicContact OE1-NH2 2.7Å; E801-R805 PolarHBondContact OE1-NH2 2.92Å
802	R	92.6	Very high	88.2	Confident	132 Å²	132	59.5 Å²	59.5	50%	0.498	31%	0.311	S	S	.	.	H	α-helix	trans	-59.5	-49.2	176.7	-80.1	178.6	-92.6	113.7	-5.3	111.3	E798 R805 Q806	E798-R802 VanDerWaalsContact CB-NH2 3.33Å; E798-R802 VanDerWaalsContact O-CB 3.31Å; E798-R802 WeakPolarHBondContact O-CB 3.5Å; E798-R802 VanDerWaalsContact O-CG 3.31Å; E798-R802 WeakPolarHBondContact O-CG 3.38Å; E798-R802 PolarHBondContact O-N 3.23Å; E798-R802 PolarHBondContact O-NE 2.74Å; E798-R802 IonicContact OE2-NH2 3.84Å; R802-R805 PolarHBondContact O-N 3.04Å; R802-Q806 PolarHBondContact O-N 2.81Å
803	H	92.1	Very high	88.1	Confident	30 Å²	30	56.9 Å²	56.9	14%	0.139	30%	0.301	C	S	.	.	H	α-helix	trans	-63.3	-43.3	176	-179.9	-92.5	0	0	0	111.9	G762 H765 L769 K799 R805 Q806 F807	G762-H803 PolarHBondContact O-CE1 3.32Å; G762-H803 VanDerWaalsContact O-CE1 3.29Å; H765-H803 AromaticContact CD2-CD2 3.26Å; H765-H803 PolarHBondContact CD2-CD2 3.02Å; H765-H803 AromaticContact CD2-CE1 3.84Å; H765-H803 AromaticContact CD2-CG 3.63Å; H765-H803 AromaticContact CD2-ND1 3.96Å; H765-H803 AromaticContact CD2-NE2 3.41Å; H765-H803 PolarHBondContact CD2-NE2 3.48Å; H765-H803 AromaticContact CG-NE2 3.74Å; H765-H803 AromaticContact NE2-CD2 3.85Å; L769-H803 HydrophobicContact CD1-CB 3.39Å; K799-H803 WeakPolarHBondContact O-CB 3.29Å; K799-H803 PolarHBondContact O-N 3.35Å; H803-R805 VanDerWaalsContact C-N 3.29Å; H803-R805 PolarHBondContact O-N 2.97Å; H803-Q806 PolarHBondContact O-N 2.97Å; H803-F807 WeakPolarHBondContact O-CB 3.44Å; H803-F807 PolarHBondContact O-N 2.8Å
804	T	91.3	Very high	87.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.3	-38.5	178.1	-57.9	0	0	0	0	111.7	F706 L709 F710 L800 E801 R808	F706-T804 HydrophobicContact CD1-CG2 3.73Å; F706-T804 HydrophobicContact CE1-CG2 3.98Å; L709-T804 HydrophobicContact CD2-CG2 3.68Å; L709-T804 HydrophobicContact CG-CG2 4.31Å; F710-T804 HydrophobicContact CE1-CG2 3.94Å; F710-T804 HydrophobicContact CE2-CG2 4.1Å; F710-T804 HydrophobicContact CZ-CG2 3.59Å; L800-T804 VanDerWaalsContact O-CB 3.26Å; L800-T804 WeakPolarHBondContact O-CB 3.37Å; L800-T804 PolarHBondContact O-N 3.34Å; L800-T804 PolarHBondContact O-OG1 3.35Å; E801-T804 PolarHBondContact O-N 3.24Å; T804-R808 WeakPolarHBondContact O-CB 3.07Å; T804-R808 PolarHBondContact O-N 3.11Å
805	R	90.4	Very high	87.7	Confident	132 Å²	132	58.3 Å²	58.3	50%	0.498	31%	0.311	S	S	.	.	H	α-helix	trans	-67.6	-45	175.4	-176.2	179.5	-74.1	104.3	-4.2	112	F710 E801 R802 H803 G809	F710-R805 HydrophobicContact CE1-CB 4.18Å; F710-R805 HydrophobicContact CZ-CB 4.11Å; E801-R805 WeakPolarHBondContact O-CB 3.31Å; E801-R805 PolarHBondContact O-N 2.87Å; E801-R805 IonicContact OE1-CZ 3.18Å; E801-R805 IonicContact OE1-NH1 3.53Å; E801-R805 PolarHBondContact OE1-NH1 3.12Å; E801-R805 IonicContact OE1-NH2 2.7Å; E801-R805 PolarHBondContact OE1-NH2 2.92Å; R802-R805 PolarHBondContact O-N 3.04Å; H803-R805 VanDerWaalsContact C-N 3.29Å; H803-R805 PolarHBondContact O-N 2.97Å; R805-G809 PolarHBondContact O-N 3.42Å; R805-G809 VanDerWaalsContact O-N 3.13Å
806	Q	89.6	Confident	87.4	Confident	137 Å²	137	59.1 Å²	59.1	64%	0.64	31%	0.307	S	S	*	.	H	α-helix	trans	-62.6	-49.1	175.4	-177.1	178.2	0.5	0	0	111.5	R802 H803 R808 G809 T810	R802-Q806 PolarHBondContact O-N 2.81Å; H803-Q806 PolarHBondContact O-N 2.97Å; Q806-R808 VanDerWaalsContact C-N 3.33Å; Q806-R808 PolarHBondContact O-N 2.8Å; Q806-G809 CarbonylContact O-C 3.6Å; Q806-G809 WeakPolarHBondContact O-CA 3.37Å; Q806-G809 PolarHBondContact O-N 3.04Å; Q806-T810 PolarHBondContact O-N 3.49Å; Q806-T810 PolarHBondContact O-OG1 3.11Å
807	F	87.8	Confident	87.1	Confident	9 Å²	9	61 Å²	61	4%	0.039	32%	0.318	C	S	.	.	H	α-helix	trans	-64	-36.6	-178.1	-174.2	-141.9	0	0	0	112.2	F706 L746 I759 L766 H803 T810 L811	F706-F807 HydrophobicContact CE1-CD1 4.34Å; F706-F807 HydrophobicContact CZ-CD1 4.11Å; L746-F807 HydrophobicContact CD1-CE1 3.58Å; L746-F807 HydrophobicContact CD1-CZ 4.02Å; I759-F807 HydrophobicContact CG2-CZ 4.39Å; L766-F807 HydrophobicContact CD2-CD1 4.43Å; L766-F807 HydrophobicContact CD2-CE1 4.45Å; H803-F807 WeakPolarHBondContact O-CB 3.44Å; H803-F807 PolarHBondContact O-N 2.8Å; F807-T810 WeakPolarHBondContact CA-OG1 3.42Å; F807-T810 PolarHBondContact O-N 3.39Å; F807-T810 PolarHBondContact O-OG1 3.47Å; F807-L811 HydrophobicContact CD1-CD1 4.45Å; F807-L811 HydrophobicContact CD2-CD1 3.85Å; F807-L811 HydrophobicContact CD2-CG 4.34Å; F807-L811 HydrophobicContact CE1-CD1 4.26Å; F807-L811 HydrophobicContact CE2-CD1 3.6Å; F807-L811 HydrophobicContact CE2-CG 4.26Å; F807-L811 HydrophobicContact CG-CD1 4.26Å; F807-L811 HydrophobicContact CZ-CD1 3.83Å; F807-L811 WeakPolarHBondContact O-CD1 3.36Å; F807-L811 WeakPolarHBondContact O-CG 3.46Å
808	R	87.3	Confident	86.8	Confident	128 Å²	128	65 Å²	65	48%	0.483	34%	0.339	S	S	.	.	H	α-helix	trans	-62.3	-41.9	169.2	-177.4	179.7	165.4	-162.2	-7.9	112	F706 T804 Q806 T810 L811 G812	F706-R808 HydrophobicContact CD1-CB 3.89Å; F706-R808 HydrophobicContact CD1-CG 4.34Å; F706-R808 HydrophobicContact CD2-CG 4.38Å; F706-R808 HydrophobicContact CE1-CB 3.76Å; F706-R808 HydrophobicContact CE2-CB 4.49Å; F706-R808 HydrophobicContact CG-CB 4.31Å; F706-R808 HydrophobicContact CG-CG 4.27Å; F706-R808 HydrophobicContact CZ-CB 4.09Å; T804-R808 WeakPolarHBondContact O-CB 3.07Å; T804-R808 PolarHBondContact O-N 3.11Å; Q806-R808 VanDerWaalsContact C-N 3.33Å; Q806-R808 PolarHBondContact O-N 2.8Å; R808-T810 VanDerWaalsContact C-N 3.3Å; R808-T810 PolarHBondContact O-N 3.38Å; R808-L811 PolarHBondContact O-N 2.6Å; R808-L811 VanDerWaalsContact O-N 3.13Å; R808-G812 PolarHBondContact O-N 3.47Å
809	G	83.2	Confident	86.3	Confident	55 Å²	55	64.6 Å²	64.6	57%	0.567	34%	0.339	S	S	*	.	H	α-helix	trans	-74	-13.6	179	0	0	0	0	0	115.1	R805 Q806 L811	R805-G809 PolarHBondContact O-N 3.42Å; R805-G809 VanDerWaalsContact O-N 3.13Å; Q806-G809 CarbonylContact O-C 3.6Å; Q806-G809 WeakPolarHBondContact O-CA 3.37Å; Q806-G809 PolarHBondContact O-N 3.04Å; G809-L811 VanDerWaalsContact C-N 3.34Å
810	T	80.2	Confident	85.7	Confident	92 Å²	92	64.8 Å²	64.8	56%	0.564	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-1.8	166.9	50.8	0	0	0	0	113.1	Q806 F807 R808	Q806-T810 PolarHBondContact O-N 3.49Å; Q806-T810 PolarHBondContact O-OG1 3.11Å; F807-T810 WeakPolarHBondContact CA-OG1 3.42Å; F807-T810 PolarHBondContact O-N 3.39Å; F807-T810 PolarHBondContact O-OG1 3.47Å; R808-T810 VanDerWaalsContact C-N 3.3Å; R808-T810 PolarHBondContact O-N 3.38Å
811	L	72.7	Confident	85	Confident	8 Å²	8	70.2 Å²	70.2	4%	0.042	37%	0.373	C	S	.	.			trans	-124.1	5	-171.5	-67.3	175.4	0	0	0	114.7	L698 F706 L746 I759 F807 R808 G809	L698-L811 HydrophobicContact CD1-CB 3.67Å; L698-L811 HydrophobicContact CD1-CD1 4.43Å; L698-L811 HydrophobicContact CD2-CB 4.28Å; L698-L811 HydrophobicContact CD2-CD1 4.36Å; L698-L811 HydrophobicContact CG-CB 4.01Å; L698-L811 WeakPolarHBondContact CG-O 3.33Å; F706-L811 HydrophobicContact CE2-CD1 4.43Å; F706-L811 HydrophobicContact CZ-CD1 4.19Å; L746-L811 HydrophobicContact CD2-CD1 4.27Å; I759-L811 HydrophobicContact CD1-CD2 3.72Å; I759-L811 HydrophobicContact CG1-CD1 4.48Å; I759-L811 HydrophobicContact CG1-CD2 3.44Å; I759-L811 VanDerWaalsContact CG1-CD2 3.44Å; F807-L811 HydrophobicContact CD1-CD1 4.45Å; F807-L811 HydrophobicContact CD2-CD1 3.85Å; F807-L811 HydrophobicContact CD2-CG 4.34Å; F807-L811 HydrophobicContact CE1-CD1 4.26Å; F807-L811 HydrophobicContact CE2-CD1 3.6Å; F807-L811 HydrophobicContact CE2-CG 4.26Å; F807-L811 HydrophobicContact CG-CD1 4.26Å; F807-L811 HydrophobicContact CZ-CD1 3.83Å; F807-L811 WeakPolarHBondContact O-CD1 3.36Å; F807-L811 WeakPolarHBondContact O-CG 3.46Å; R808-L811 PolarHBondContact O-N 2.6Å; R808-L811 VanDerWaalsContact O-N 3.13Å; G809-L811 VanDerWaalsContact C-N 3.34Å
812	G	59.1	Low	84.2	Confident	80 Å²	80	73 Å²	73	83%	0.825	39%	0.391	S	S	*	.			trans	-166.7	0	176.6	0	0	0	0	0	112.4	R808	R808-G812 PolarHBondContact O-N 3.47Å

Retrieved 812 of 812 residues in 497.1 ms (Link to these results)

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