A0A077Z4H0_TRITR Loading...

Pre mRNA splicing factor SYF1

AlphaFold DB , UniProt , Accession A0A077Z4H0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 867 aa.

						>A0A077Z4H0_TRITR|A0A077Z4H0
MASVMVEDAAAESSGLHFTDEDLPFEEDLLRNPFSLRCWLRYVEHKKQTSSNYFAIYNVYERGLRELPGSYKLWHQYLTFRMTRTMRKCITDPEYDALNQCFRRALVFMNKMPRIWIMFCSILVRQRLVTQTRRSFDDALRSLPATQHNRIWPLYLKFLGLHSITETTVRVYRRYLKFAPEDAELYVEYLKSIDRLDEAAQYLAQIVNDDNFVSREEKTNHQLWHELCELVAKNPSKVTSFKVEPIILQGISRYSDQVGALWCALADYYIRDGQFERARDIYEQAMQNVITVRDFTQIFDAYAQFMERLIAVEIETENTSSGKDASNVRVDLLMARFEDLMDRRSLLVNSVLLRQNPHNVHEWLKRVELTKDNEAKTLEVFEDAVKTVNPKLQVGKLSDIWTSYARYYERCNRIEKARQVFEEAVQVQFAKVEELSVVYCSWAEMELRQKWKNQRTTQSLFLLLFRNWKQAIKVLKRCLLSSSSKVHYFDQSEPVQNRVHKSLRAWSMYADLEENFGTFESCKAVYEKILDLRIATPQLVINYAAFLEENKHFEESFKAFEKGVALFPWPNVGAIWHTYLIKFLRRYAGTKLERIRDLFEQCLESCPPEYAAKLYLLYAKVEEDYGLGRNAMALYERAAEAVPNDQKNDVFKIYIKRTCDLYGITNTRPIYERAIESLPENEAREMCLRFANLERKLGEIDRARAIFAYCSQLCNPKVHSGFWELWKEFEVKHGNEDTVREMLRIKRSVMASTNTDVNFMSAQMLAGTVPFVRAPDEATSANSMAVLEAQAQVLTEEITKSDAVGSKKFSSISFIRGEPTTAEKSASVNPDEIDIEGEAEETSENTVLLEKLSVPSEVFGNLAPDDD
					

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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	37.1	Very low	35.4	Very low	235 Å²	235	120.4 Å²	120.4	100%	1.158	73%	0.73	S	S	*	*				0	-7.6	0	-79.5	-174.5	-172.9	0	0	114.7
2	A	36.7	Very low	35.1	Very low	88 Å²	88	125.5 Å²	125.5	73%	0.727	74%	0.74	S	S	*	*			trans	-96.2	-1.5	177.9	0	0	0	0	0	115.3
3	S	36.4	Very low	35.2	Very low	108 Å²	108	121.4 Å²	121.4	76%	0.755	72%	0.722	S	S	*	*	S	Bend	trans	-97.1	0.8	-171.6	-153.3	0	0	0	0	114.8
4	V	41.4	Very low	35.2	Very low	115 Å²	115	119.2 Å²	119.2	70%	0.697	72%	0.716	S	S	*	*	S	Bend	trans	-107.4	-11	-178.4	-179.4	0	0	0	0	111.7
5	M	34	Very low	35	Very low	161 Å²	161	115.1 Å²	115.1	79%	0.793	71%	0.707	S	S	*	*	S	Bend	trans	-97	1.6	-177.3	-69.8	-165.9	172.4	0	0	115.1
6	V	38.6	Very low	35.7	Very low	109 Å²	109	114.4 Å²	114.4	66%	0.661	70%	0.697	S	S	*	*	S	Bend	trans	-99.6	-18.6	-178.7	-178.6	0	0	0	0	112.2
7	E	33	Very low	36.3	Very low	159 Å²	159	117.6 Å²	117.6	74%	0.743	70%	0.702	S	S	*	*	S	Bend	trans	-76.5	-27.1	-179.3	-70.1	-173.4	154.6	0	0	113.2
8	D	31.9	Very low	37.5	Very low	133 Å²	133	116.6 Å²	116.6	71%	0.711	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-78.9	-23.6	179.3	-73.8	-25.9	0	0	0	113.8	A10	D8-A10 PolarHBondContact O-N 3.5Å
9	A	34.2	Very low	38.8	Very low	76 Å²	76	113.8 Å²	113.8	63%	0.628	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-81.3	-12.4	-179	0	0	0	0	0	114.2
10	A	33.2	Very low	40.2	Very low	72 Å²	72	115.4 Å²	115.4	60%	0.595	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-92.4	-11.2	179.6	0	0	0	0	0	113.5	D8	D8-A10 PolarHBondContact O-N 3.5Å
11	A	33	Very low	41.6	Very low	68 Å²	68	115.4 Å²	115.4	56%	0.562	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-79.3	-16.4	179.1	0	0	0	0	0	113.5	S14	A11-S14 PolarHBondContact O-OG 3.24Å
12	E	31.6	Very low	43.3	Very low	182 Å²	182	104.3 Å²	104.3	85%	0.85	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-88.7	-3.8	-175.7	-68.5	-174.5	157.4	0	0	114.7
13	S	35.9	Very low	45	Very low	72 Å²	72	104.7 Å²	104.7	50%	0.503	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-106.8	16.8	178.7	67.1	0	0	0	0	114.8	G15	S13-G15 PolarHBondContact O-N 3.29Å
14	S	35.5	Very low	46.9	Very low	91 Å²	91	103 Å²	103	64%	0.636	59%	0.592	S	S	*	*			trans	-85.2	28.7	173	57	0	0	0	0	113.4	A11 L16	A11-S14 PolarHBondContact O-OG 3.24Å; S14-L16 PolarHBondContact O-N 3.06Å
15	G	32.1	Very low	48.3	Very low	57 Å²	57	99.8 Å²	99.8	59%	0.588	57%	0.568	S	S	*	*			trans	-78.3	109.6	172.1	0	0	0	0	0	110.7	S13 H17	S13-G15 PolarHBondContact O-N 3.29Å; G15-H17 PolarHBondContact O-N 3.42Å
16	L	46.9	Very low	50.3	Low	104 Å²	104	93.3 Å²	93.3	55%	0.545	54%	0.536	S	S	.	.			trans	-63.6	94.4	172.5	-74.7	145.5	0	0	0	110.1	S14 F18	S14-L16 PolarHBondContact O-N 3.06Å; L16-F18 VanDerWaalsContact C-N 3.3Å; L16-F18 HydrophobicContact CB-CD2 3.75Å; L16-F18 HydrophobicContact CB-CE2 3.44Å; L16-F18 VanDerWaalsContact CB-CE2 3.44Å; L16-F18 HydrophobicContact CB-CZ 3.98Å; L16-F18 HydrophobicContact CD1-CE2 3.9Å; L16-F18 HydrophobicContact CD1-CZ 4.09Å; L16-F18 HydrophobicContact CD2-CE1 3.83Å; L16-F18 HydrophobicContact CD2-CE2 3.75Å; L16-F18 HydrophobicContact CD2-CZ 3.33Å; L16-F18 HydrophobicContact CG-CE2 3.86Å; L16-F18 HydrophobicContact CG-CZ 3.97Å; L16-F18 PolarHBondContact O-N 2.7Å; L16-F18 VanDerWaalsContact O-N 3.11Å
17	H	46.3	Very low	52.1	Low	169 Å²	169	93.1 Å²	93.1	78%	0.782	53%	0.528	S	S	*	.			trans	-77.2	88.2	159.9	-88.1	-60	0	0	0	108.6	G15	G15-H17 PolarHBondContact O-N 3.42Å
18	F	57.2	Low	54.2	Low	100 Å²	100	88.1 Å²	88.1	44%	0.439	51%	0.507	S	S	.	.			trans	-77.9	128.8	161.1	-61.8	-69.5	0	0	0	108.3	L16 E26	L16-F18 VanDerWaalsContact C-N 3.3Å; L16-F18 HydrophobicContact CB-CD2 3.75Å; L16-F18 HydrophobicContact CB-CE2 3.44Å; L16-F18 VanDerWaalsContact CB-CE2 3.44Å; L16-F18 HydrophobicContact CB-CZ 3.98Å; L16-F18 HydrophobicContact CD1-CE2 3.9Å; L16-F18 HydrophobicContact CD1-CZ 4.09Å; L16-F18 HydrophobicContact CD2-CE1 3.83Å; L16-F18 HydrophobicContact CD2-CE2 3.75Å; L16-F18 HydrophobicContact CD2-CZ 3.33Å; L16-F18 HydrophobicContact CG-CE2 3.86Å; L16-F18 HydrophobicContact CG-CZ 3.97Å; L16-F18 PolarHBondContact O-N 2.7Å; L16-F18 VanDerWaalsContact O-N 3.11Å; F18-E26 HydrophobicContact CE1-CG 4.45Å; F18-E26 WeakPolarHBondContact CE1-OE1 3.34Å
19	T	62.5	Low	56.3	Low	64 Å²	64	82.2 Å²	82.2	39%	0.393	48%	0.475	S	S	.	.			trans	-92.8	153.9	165.6	52.6	0	0	0	0	108.6	E21 D22	T19-E21 PolarHBondContact O-N 3.49Å; T19-D22 PolarHBondContact N-OD2 2.82Å; T19-D22 WeakPolarHBondContact O-CB 3.46Å; T19-D22 PolarHBondContact O-N 3.34Å; T19-D22 PolarHBondContact OG1-OD2 3.4Å
20	D	67.3	Low	58.3	Low	144 Å²	144	85.3 Å²	85.3	77%	0.77	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-56.7	-22.4	177.8	-69.9	-21.3	0	0	0	112.5	D22 L23	D20-D22 VanDerWaalsContact C-N 3.25Å; D20-D22 PolarHBondContact O-N 3.15Å; D20-L23 HydrophobicContact CB-CD1 4.49Å
21	E	68.2	Low	60.3	Low	117 Å²	117	90 Å²	90	55%	0.547	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-68.3	-17.1	174.6	-59.6	177	165.2	0	0	113.9	T19 H45 T49	T19-E21 PolarHBondContact O-N 3.49Å; E21-H45 PolarHBondContact O-CE1 3.15Å; E21-H45 VanDerWaalsContact O-CE1 3.29Å; E21-T49 WeakPolarHBondContact OE2-CG2 3.45Å
22	D	72.4	Confident	62.4	Low	1 Å²	1	91.1 Å²	91.1	1%	0.005	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-86.9	-17.3	-179.7	-61.5	-47.7	0	0	0	113.9	T19 D20 P24 F25 E26 Y42 H45 K46	T19-D22 PolarHBondContact N-OD2 2.82Å; T19-D22 WeakPolarHBondContact O-CB 3.46Å; T19-D22 PolarHBondContact O-N 3.34Å; T19-D22 PolarHBondContact OG1-OD2 3.4Å; D20-D22 VanDerWaalsContact C-N 3.25Å; D20-D22 PolarHBondContact O-N 3.15Å; D22-P24 VanDerWaalsContact C-CD 3.47Å; D22-F25 PolarHBondContact O-N 2.92Å; D22-F25 VanDerWaalsContact O-N 3.11Å; D22-E26 PolarHBondContact O-N 3.45Å; D22-Y42 HydrophobicContact CB-CE2 4.29Å; D22-H45 IonicContact OD1-CE1 3.34Å; D22-H45 IonicContact OD1-ND1 2.95Å; D22-K46 WeakPolarHBondContact OD1-CE 3.21Å; D22-K46 IonicContact OD1-NZ 3.96Å; D22-K46 PolarHBondContact OD1-NZ 3.42Å; D22-K46 IonicContact OD2-NZ 2.78Å; D22-K46 PolarHBondContact OD2-NZ 3.36Å
23	L	72.7	Confident	64.4	Low	97 Å²	97	84.3 Å²	84.3	51%	0.508	45%	0.45	S	S	.	.	H	α-helix	trans	-55.1	-43.5	-173.8	-67.9	169.4	0	0	0	113.8	D20 F25 E26 E27	D20-L23 HydrophobicContact CB-CD1 4.49Å; L23-F25 VanDerWaalsContact C-N 3.27Å; L23-F25 PolarHBondContact O-N 3.37Å; L23-E26 PolarHBondContact O-N 2.84Å; L23-E27 WeakPolarHBondContact O-CG 3.43Å; L23-E27 PolarHBondContact O-N 3.28Å
24	P	76.4	Confident	66.4	Low	73 Å²	73	88 Å²	88	47%	0.474	46%	0.458	S	S	.	.	H	α-helix	trans	-62.6	-34.5	178.9	-22.6	34.6	0	0	0	113.1	D22 D28	D22-P24 VanDerWaalsContact C-CD 3.47Å; P24-D28 PolarHBondContact O-N 2.97Å; P24-D28 VanDerWaalsContact O-N 3.09Å
25	F	72.1	Confident	68.6	Low	46 Å²	46	85.3 Å²	85.3	20%	0.202	44%	0.439	C	S	.	.	H	α-helix	trans	-77.6	-36.1	179.4	-60.6	-82.6	0	0	0	111.6	D22 L23 D28 L29 R41 Y42 H45	D22-F25 PolarHBondContact O-N 2.92Å; D22-F25 VanDerWaalsContact O-N 3.11Å; L23-F25 VanDerWaalsContact C-N 3.27Å; L23-F25 PolarHBondContact O-N 3.37Å; F25-D28 PolarHBondContact O-N 3.13Å; F25-L29 WeakPolarHBondContact O-CB 3.32Å; F25-L29 WeakPolarHBondContact O-CG 3.29Å; F25-L29 PolarHBondContact O-N 3.07Å; F25-R41 HydrophobicContact CD1-CB 4.43Å; F25-R41 HydrophobicContact CE1-CB 4.28Å; F25-Y42 HydrophobicContact CB-CD2 3.28Å; F25-Y42 HydrophobicContact CB-CE2 3.87Å; F25-Y42 HydrophobicContact CB-CG 3.94Å; F25-Y42 HydrophobicContact CD1-CD2 4.43Å; F25-Y42 HydrophobicContact CD2-CD2 4.38Å; F25-Y42 AromaticContact CG-CD2 3.81Å; F25-Y42 HydrophobicContact CG-CD2 3.81Å; F25-H45 HydrophobicContact CD1-CB 4.41Å; F25-H45 HydrophobicContact CD2-CB 4.19Å; F25-H45 AromaticContact CD2-CG 3.78Å; F25-H45 AromaticContact CD2-ND1 3.61Å; F25-H45 HydrophobicContact CE1-CB 3.92Å; F25-H45 HydrophobicContact CE2-CB 3.69Å; F25-H45 AromaticContact CE2-CD2 3.34Å; F25-H45 WeakPolarHBondContact CE2-CD2 3.45Å; F25-H45 AromaticContact CE2-CE1 3.69Å; F25-H45 AromaticContact CE2-CG 3.19Å; F25-H45 AromaticContact CE2-ND1 3.44Å; F25-H45 WeakPolarHBondContact CE2-ND1 3.34Å; F25-H45 AromaticContact CE2-NE2 3.66Å; F25-H45 HydrophobicContact CZ-CB 3.53Å; F25-H45 AromaticContact CZ-CD2 3.66Å; F25-H45 AromaticContact CZ-CG 3.53Å
26	E	76.1	Confident	70.8	Confident	26 Å²	26	84.9 Å²	84.9	12%	0.121	42%	0.423	C	S	.	.	H	α-helix	trans	-65.5	-39.2	173	-68.6	-69.2	162.8	0	0	111.4	F18 D22 L23 L29 L30 Y42 R62	F18-E26 HydrophobicContact CE1-CG 4.45Å; F18-E26 WeakPolarHBondContact CE1-OE1 3.34Å; D22-E26 PolarHBondContact O-N 3.45Å; L23-E26 PolarHBondContact O-N 2.84Å; E26-L29 PolarHBondContact O-N 3.5Å; E26-L30 VanDerWaalsContact O-CG 3.31Å; E26-L30 WeakPolarHBondContact O-CG 3.36Å; E26-L30 PolarHBondContact O-N 3.47Å; E26-Y42 WeakPolarHBondContact OE1-CE1 3.48Å; E26-Y42 PolarHBondContact OE1-OH 3.05Å; E26-R62 VanDerWaalsContact CD-NH1 3.31Å; E26-R62 IonicContact OE1-CZ 3.36Å; E26-R62 IonicContact OE1-NH1 3.1Å; E26-R62 PolarHBondContact OE1-NH1 2.8Å; E26-R62 IonicContact OE1-NH2 2.73Å; E26-R62 IonicContact OE2-CZ 3.81Å; E26-R62 IonicContact OE2-NH1 3.65Å; E26-R62 PolarHBondContact OE2-NH1 2.73Å; E26-R62 VanDerWaalsContact OE2-NH1 3.1Å; E26-R62 IonicContact OE2-NH2 2.71Å; E26-R62 PolarHBondContact OE2-NH2 3.26Å
27	E	76	Confident	72.6	Confident	104 Å²	104	89.3 Å²	89.3	49%	0.486	43%	0.433	S	S	.	.	H	α-helix	trans	-63	-41.5	172.1	-73.5	-176	-172.6	0	0	112.3	L23 L29 L30 R31	L23-E27 WeakPolarHBondContact O-CG 3.43Å; L23-E27 PolarHBondContact O-N 3.28Å; E27-L29 VanDerWaalsContact C-N 3.32Å; E27-L29 PolarHBondContact O-N 2.85Å; E27-L30 PolarHBondContact O-N 3.15Å; E27-R31 WeakPolarHBondContact O-CB 3.28Å; E27-R31 VanDerWaalsContact O-CG 3.24Å; E27-R31 WeakPolarHBondContact O-CG 3.47Å; E27-R31 PolarHBondContact O-N 2.86Å; E27-R31 IonicContact OE2-NH2 3.81Å
28	D	77.5	Confident	74.3	Confident	55 Å²	55	82 Å²	82	29%	0.294	40%	0.401	S	S	.	.	H	α-helix	trans	-65	-34.5	175.5	-85.2	-11.2	0	0	0	112.7	P24 F25 N32	P24-D28 PolarHBondContact O-N 2.97Å; P24-D28 VanDerWaalsContact O-N 3.09Å; F25-D28 PolarHBondContact O-N 3.13Å; D28-N32 PolarHBondContact O-N 3.34Å
29	L	74.9	Confident	75.5	Confident	8 Å²	8	77.7 Å²	77.7	4%	0.042	38%	0.381	C	S	.	.	H	α-helix	trans	-73.4	-37.9	176.2	-72.3	171.8	0	0	0	112.4	F25 E26 E27 R31 N32 P33 C38 W39 Y42	F25-L29 WeakPolarHBondContact O-CB 3.32Å; F25-L29 WeakPolarHBondContact O-CG 3.29Å; F25-L29 PolarHBondContact O-N 3.07Å; E26-L29 PolarHBondContact O-N 3.5Å; E27-L29 VanDerWaalsContact C-N 3.32Å; E27-L29 PolarHBondContact O-N 2.85Å; L29-R31 VanDerWaalsContact C-N 3.32Å; L29-N32 CarbonylContact O-C 3.59Å; L29-N32 PolarHBondContact O-N 3.28Å; L29-P33 WeakPolarHBondContact O-CA 3.45Å; L29-P33 WeakPolarHBondContact O-CD 3.37Å; L29-P33 VanDerWaalsContact O-N 3.1Å; L29-C38 HydrophobicContact CD2-CB 3.99Å; L29-W39 HydrophobicContact CD1-CE3 4.12Å; L29-W39 HydrophobicContact CD1-CH2 4.03Å; L29-W39 HydrophobicContact CD1-CZ3 3.73Å; L29-W39 HydrophobicContact CD2-CD2 3.44Å; L29-W39 VanDerWaalsContact CD2-CD2 3.44Å; L29-W39 HydrophobicContact CD2-CE3 3.62Å; L29-W39 HydrophobicContact CD2-CG 3.97Å; L29-W39 HydrophobicContact CD2-CH2 3.92Å; L29-W39 HydrophobicContact CD2-CZ2 3.77Å; L29-W39 HydrophobicContact CD2-CZ3 3.86Å; L29-W39 HydrophobicContact CG-CH2 4.47Å; L29-W39 HydrophobicContact CG-CZ3 4.43Å; L29-Y42 HydrophobicContact CD1-CD1 3.41Å; L29-Y42 VanDerWaalsContact CD1-CD1 3.41Å; L29-Y42 HydrophobicContact CD1-CE1 3.78Å; L29-Y42 HydrophobicContact CD1-CG 4Å
30	L	76.1	Confident	76.5	Confident	142 Å²	142	76 Å²	76	74%	0.743	37%	0.37	S	S	*	.	H	α-helix	trans	-65.1	-38.5	172.7	-73	172.9	0	0	0	111.4	E26 E27	E26-L30 VanDerWaalsContact O-CG 3.31Å; E26-L30 WeakPolarHBondContact O-CG 3.36Å; E26-L30 PolarHBondContact O-N 3.47Å; E27-L30 PolarHBondContact O-N 3.15Å
31	R	75.9	Confident	77.2	Confident	171 Å²	171	76.2 Å²	76.2	65%	0.645	36%	0.36	S	S	*	.	H	α-helix	trans	-69	-39.1	176.4	-72.4	172.8	-172.7	-169.7	6.8	112.4	E27 L29	E27-R31 WeakPolarHBondContact O-CB 3.28Å; E27-R31 VanDerWaalsContact O-CG 3.24Å; E27-R31 WeakPolarHBondContact O-CG 3.47Å; E27-R31 PolarHBondContact O-N 2.86Å; E27-R31 IonicContact OE2-NH2 3.81Å; L29-R31 VanDerWaalsContact C-N 3.32Å
32	N	76.1	Confident	77.9	Confident	90 Å²	90	70.8 Å²	70.8	48%	0.481	33%	0.334	S	S	.	.			trans	-138.6	73.8	-174	-69	-59.3	0	0	0	112.6	D28 L29 F34 S35	D28-N32 PolarHBondContact O-N 3.34Å; L29-N32 CarbonylContact O-C 3.59Å; L29-N32 PolarHBondContact O-N 3.28Å; N32-F34 VanDerWaalsContact C-N 3.27Å; N32-F34 PolarHBondContact O-N 3.33Å; N32-S35 PolarHBondContact O-N 3.38Å
33	P	74.6	Confident	78.3	Confident	39 Å²	39	70.8 Å²	70.8	25%	0.253	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-28.2	-177	23.2	-32.8	0	0	0	113.3	L29 W39	L29-P33 WeakPolarHBondContact O-CA 3.45Å; L29-P33 WeakPolarHBondContact O-CD 3.37Å; L29-P33 VanDerWaalsContact O-N 3.1Å; P33-W39 PolarHBondContact O-NE1 3.46Å
34	F	77.3	Confident	78.8	Confident	149 Å²	149	71 Å²	71	65%	0.654	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-1.4	-179.7	-54.9	-68.7	0	0	0	114.2	N32 L36 L67	N32-F34 VanDerWaalsContact C-N 3.27Å; N32-F34 PolarHBondContact O-N 3.33Å; F34-L36 PolarHBondContact O-N 3.31Å; F34-L67 HydrophobicContact CB-CD2 4.47Å; F34-L67 HydrophobicContact CD1-CD2 4.37Å
35	S	81.3	Confident	79.1	Confident	36 Å²	36	68.8 Å²	68.8	25%	0.252	32%	0.316	S	S	.	.			trans	-83.7	109.6	-177.7	179	0	0	0	0	111.3	N32 R37 C38 W39	N32-S35 PolarHBondContact O-N 3.38Å; S35-R37 PolarHBondContact O-N 3.16Å; S35-R37 VanDerWaalsContact O-N 3.13Å; S35-R37 PolarHBondContact OG-N 3.38Å; S35-C38 PolarHBondContact O-N 3.39Å; S35-C38 VanDerWaalsContact O-N 3.13Å; S35-C38 PolarHBondContact OG-SG 2.92Å; S35-W39 VanDerWaalsContact O-CD1 3.28Å; S35-W39 PolarHBondContact O-N 3.48Å
36	L	79.7	Confident	79.4	Confident	48 Å²	48	66.9 Å²	66.9	25%	0.251	31%	0.307	S	S	.	.	H	α-helix	trans	-51.4	-35.8	171.5	179.1	70.7	0	0	0	112.3	F34 W39 L40 K72 L73	F34-L36 PolarHBondContact O-N 3.31Å; L36-W39 PolarHBondContact O-N 3.39Å; L36-L40 HydrophobicContact CD1-CD1 4.39Å; L36-L40 HydrophobicContact CD1-CG 4.33Å; L36-L40 HydrophobicContact CD2-CD1 4.27Å; L36-L40 HydrophobicContact CG-CD1 3.92Å; L36-L40 HydrophobicContact CG-CG 4.24Å; L36-L40 WeakPolarHBondContact O-CB 3.42Å; L36-L40 VanDerWaalsContact O-CG 3.23Å; L36-L40 WeakPolarHBondContact O-CG 3.35Å; L36-L40 PolarHBondContact O-N 3.09Å; L36-K72 HydrophobicContact CD1-CB 4.32Å; L36-K72 HydrophobicContact CD2-CB 4.08Å; L36-K72 HydrophobicContact CD2-CD 3.63Å; L36-K72 HydrophobicContact CD2-CG 4.41Å; L36-L73 HydrophobicContact CD1-CD1 3.94Å; L36-L73 HydrophobicContact CD1-CD2 3.55Å; L36-L73 HydrophobicContact CD1-CG 3.37Å
37	R	83.4	Confident	79.5	Confident	197 Å²	197	69.6 Å²	69.6	74%	0.743	32%	0.319	S	S	*	.	H	α-helix	trans	-67.1	-39	-177.7	-67.7	-177.9	178.6	174.9	-0.2	112.1	S35 L40 R41	S35-R37 PolarHBondContact O-N 3.16Å; S35-R37 VanDerWaalsContact O-N 3.13Å; S35-R37 PolarHBondContact OG-N 3.38Å; R37-L40 PolarHBondContact O-N 2.86Å; R37-R41 WeakPolarHBondContact O-CB 3.37Å; R37-R41 WeakPolarHBondContact O-CG 3.32Å; R37-R41 PolarHBondContact O-N 2.91Å
38	C	82	Confident	79.7	Confident	16 Å²	16	72.5 Å²	72.5	11%	0.108	33%	0.332	C	S	.	.	H	α-helix	trans	-65.8	-44.7	178.5	-60.2	0	0	0	0	110.3	L29 S35 L40 R41 Y42	L29-C38 HydrophobicContact CD2-CB 3.99Å; S35-C38 PolarHBondContact O-N 3.39Å; S35-C38 VanDerWaalsContact O-N 3.13Å; S35-C38 PolarHBondContact OG-SG 2.92Å; C38-L40 PolarHBondContact O-N 3Å; C38-R41 PolarHBondContact O-N 3.48Å; C38-Y42 WeakPolarHBondContact O-CB 3.36Å; C38-Y42 PolarHBondContact O-N 3.03Å
39	W	83.3	Confident	79.4	Confident	9 Å²	9	72.3 Å²	72.3	3%	0.034	33%	0.333	C	S	.	.	H	α-helix	trans	-60.7	-43.6	173.8	-70.7	110.1	0	0	0	112.9	L29 P33 S35 L36 Y42 V43 V59 R62 G63 E66 L73	L29-W39 HydrophobicContact CD1-CE3 4.12Å; L29-W39 HydrophobicContact CD1-CH2 4.03Å; L29-W39 HydrophobicContact CD1-CZ3 3.73Å; L29-W39 HydrophobicContact CD2-CD2 3.44Å; L29-W39 VanDerWaalsContact CD2-CD2 3.44Å; L29-W39 HydrophobicContact CD2-CE3 3.62Å; L29-W39 HydrophobicContact CD2-CG 3.97Å; L29-W39 HydrophobicContact CD2-CH2 3.92Å; L29-W39 HydrophobicContact CD2-CZ2 3.77Å; L29-W39 HydrophobicContact CD2-CZ3 3.86Å; L29-W39 HydrophobicContact CG-CH2 4.47Å; L29-W39 HydrophobicContact CG-CZ3 4.43Å; P33-W39 PolarHBondContact O-NE1 3.46Å; S35-W39 VanDerWaalsContact O-CD1 3.28Å; S35-W39 PolarHBondContact O-N 3.48Å; L36-W39 PolarHBondContact O-N 3.39Å; W39-Y42 PolarHBondContact O-N 2.95Å; W39-V43 WeakPolarHBondContact O-CB 3.23Å; W39-V43 VanDerWaalsContact O-CG2 3.23Å; W39-V43 WeakPolarHBondContact O-CG2 3.44Å; W39-V43 PolarHBondContact O-N 3.37Å; W39-V59 HydrophobicContact CE3-CG1 4.41Å; W39-R62 HydrophobicContact CH2-CB 3.74Å; W39-R62 HydrophobicContact CZ3-CB 3.76Å; W39-G63 VanDerWaalsContact CD2-CA 3.5Å; W39-E66 HydrophobicContact CZ2-CB 4.31Å; W39-E66 HydrophobicContact CZ2-CG 3.82Å; W39-L73 HydrophobicContact CB-CD1 4.3Å; W39-L73 HydrophobicContact CB-CD2 4.13Å; W39-L73 HydrophobicContact CG-CD1 4.46Å
40	L	83.7	Confident	79	Confident	28 Å²	28	73.2 Å²	73.2	15%	0.147	34%	0.34	C	S	.	.	H	α-helix	trans	-64.6	-43.1	178.1	-72.1	177.9	0	0	0	112.5	L36 R37 C38 Y42 V43 E44 L73 Q76	L36-L40 HydrophobicContact CD1-CD1 4.39Å; L36-L40 HydrophobicContact CD1-CG 4.33Å; L36-L40 HydrophobicContact CD2-CD1 4.27Å; L36-L40 HydrophobicContact CG-CD1 3.92Å; L36-L40 HydrophobicContact CG-CG 4.24Å; L36-L40 WeakPolarHBondContact O-CB 3.42Å; L36-L40 VanDerWaalsContact O-CG 3.23Å; L36-L40 WeakPolarHBondContact O-CG 3.35Å; L36-L40 PolarHBondContact O-N 3.09Å; R37-L40 PolarHBondContact O-N 2.86Å; C38-L40 PolarHBondContact O-N 3Å; L40-Y42 VanDerWaalsContact C-N 3.34Å; L40-Y42 PolarHBondContact O-N 2.96Å; L40-V43 PolarHBondContact O-N 3.31Å; L40-E44 WeakPolarHBondContact O-CB 3.13Å; L40-E44 WeakPolarHBondContact O-CG 3.39Å; L40-E44 PolarHBondContact O-N 3.37Å; L40-L73 HydrophobicContact CD2-CD2 3.9Å; L40-L73 HydrophobicContact CG-CD2 4.32Å; L40-Q76 VanDerWaalsContact CD2-CD 3.44Å
41	R	82.6	Confident	78.3	Confident	149 Å²	149	72.5 Å²	72.5	56%	0.562	35%	0.347	S	S	*	.	H	α-helix	trans	-61.2	-43.2	174.9	-78.1	-179.5	177.3	-179.3	-2.2	111.8	F25 R37 C38 V43 E44 H45	F25-R41 HydrophobicContact CD1-CB 4.43Å; F25-R41 HydrophobicContact CE1-CB 4.28Å; R37-R41 WeakPolarHBondContact O-CB 3.37Å; R37-R41 WeakPolarHBondContact O-CG 3.32Å; R37-R41 PolarHBondContact O-N 2.91Å; C38-R41 PolarHBondContact O-N 3.48Å; R41-V43 VanDerWaalsContact C-N 3.34Å; R41-V43 PolarHBondContact O-N 2.91Å; R41-E44 PolarHBondContact O-N 3.41Å; R41-H45 WeakPolarHBondContact O-CB 3.41Å; R41-H45 PolarHBondContact O-N 3.23Å
42	Y	82.3	Confident	78.2	Confident	3 Å²	3	68 Å²	68	1%	0.012	34%	0.336	C	S	.	.	H	α-helix	trans	-66.1	-39.2	178.3	-174.2	-141.6	0	0	0	112	D22 F25 E26 L29 C38 W39 L40 H45 K46 V59	D22-Y42 HydrophobicContact CB-CE2 4.29Å; F25-Y42 HydrophobicContact CB-CD2 3.28Å; F25-Y42 HydrophobicContact CB-CE2 3.87Å; F25-Y42 HydrophobicContact CB-CG 3.94Å; F25-Y42 HydrophobicContact CD1-CD2 4.43Å; F25-Y42 HydrophobicContact CD2-CD2 4.38Å; F25-Y42 AromaticContact CG-CD2 3.81Å; F25-Y42 HydrophobicContact CG-CD2 3.81Å; E26-Y42 WeakPolarHBondContact OE1-CE1 3.48Å; E26-Y42 PolarHBondContact OE1-OH 3.05Å; L29-Y42 HydrophobicContact CD1-CD1 3.41Å; L29-Y42 VanDerWaalsContact CD1-CD1 3.41Å; L29-Y42 HydrophobicContact CD1-CE1 3.78Å; L29-Y42 HydrophobicContact CD1-CG 4Å; C38-Y42 WeakPolarHBondContact O-CB 3.36Å; C38-Y42 PolarHBondContact O-N 3.03Å; W39-Y42 PolarHBondContact O-N 2.95Å; L40-Y42 VanDerWaalsContact C-N 3.34Å; L40-Y42 PolarHBondContact O-N 2.96Å; Y42-H45 PolarHBondContact O-N 3.11Å; Y42-K46 HydrophobicContact CD2-CG 4.18Å; Y42-K46 HydrophobicContact CE2-CD 4.29Å; Y42-K46 HydrophobicContact CE2-CG 3.93Å; Y42-K46 WeakPolarHBondContact O-CB 3.38Å; Y42-K46 WeakPolarHBondContact O-CG 3.38Å; Y42-K46 PolarHBondContact O-N 2.99Å; Y42-K46 WeakPolarHBondContact OH-CE 3.36Å; Y42-V59 HydrophobicContact CD1-CB 4.07Å; Y42-V59 HydrophobicContact CD1-CG1 3.22Å; Y42-V59 HydrophobicContact CD1-CG2 3.69Å; Y42-V59 HydrophobicContact CE1-CB 4Å; Y42-V59 HydrophobicContact CE1-CG1 3.66Å; Y42-V59 HydrophobicContact CE1-CG2 3.19Å; Y42-V59 HydrophobicContact CG-CG1 4.03Å
43	V	81.1	Confident	78.2	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.006	33%	0.327	C	S	.	.	H	α-helix	trans	-63.5	-41.9	172.3	165.7	0	0	0	0	111.7	W39 L40 R41 K46 K47 V59 Y60	W39-V43 WeakPolarHBondContact O-CB 3.23Å; W39-V43 VanDerWaalsContact O-CG2 3.23Å; W39-V43 WeakPolarHBondContact O-CG2 3.44Å; W39-V43 PolarHBondContact O-N 3.37Å; L40-V43 PolarHBondContact O-N 3.31Å; R41-V43 VanDerWaalsContact C-N 3.34Å; R41-V43 PolarHBondContact O-N 2.91Å; V43-K46 PolarHBondContact O-N 3.42Å; V43-K47 HydrophobicContact CG1-CD 4.11Å; V43-K47 WeakPolarHBondContact O-CB 3.33Å; V43-K47 VanDerWaalsContact O-CG 3.24Å; V43-K47 WeakPolarHBondContact O-CG 3.31Å; V43-K47 PolarHBondContact O-N 3.22Å; V43-V59 HydrophobicContact CG2-CG1 3.6Å; V43-Y60 HydrophobicContact CB-CE1 4.42Å; V43-Y60 HydrophobicContact CG1-CE1 3.79Å; V43-Y60 HydrophobicContact CG1-CE2 3.88Å; V43-Y60 WeakPolarHBondContact CG1-OH 3.5Å; V43-Y60 HydrophobicContact CG2-CD1 3.94Å; V43-Y60 HydrophobicContact CG2-CE1 3.75Å; V43-Y60 HydrophobicContact CG2-CE2 4.37Å; V43-Y60 HydrophobicContact CG2-CG 4.35Å
44	E	83	Confident	78.3	Confident	100 Å²	100	69.5 Å²	69.5	47%	0.467	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-44.7	176.9	-77.9	170.5	-173.4	0	0	111.5	L40 R41 K47 Q48	L40-E44 WeakPolarHBondContact O-CB 3.13Å; L40-E44 WeakPolarHBondContact O-CG 3.39Å; L40-E44 PolarHBondContact O-N 3.37Å; R41-E44 PolarHBondContact O-N 3.41Å; E44-K47 PolarHBondContact O-N 3.16Å; E44-Q48 WeakPolarHBondContact O-CG 3.46Å; E44-Q48 PolarHBondContact O-N 3.44Å; E44-Q48 VanDerWaalsContact O-N 3.14Å
45	H	82.4	Confident	78.3	Confident	28 Å²	28	63.3 Å²	63.3	13%	0.13	31%	0.309	C	S	.	.	H	α-helix	trans	-58.6	-51.6	172.9	-180	-109.1	0	0	0	111	E21 D22 F25 R41 Y42 K47 Q48 T49	E21-H45 PolarHBondContact O-CE1 3.15Å; E21-H45 VanDerWaalsContact O-CE1 3.29Å; D22-H45 IonicContact OD1-CE1 3.34Å; D22-H45 IonicContact OD1-ND1 2.95Å; F25-H45 HydrophobicContact CD1-CB 4.41Å; F25-H45 HydrophobicContact CD2-CB 4.19Å; F25-H45 AromaticContact CD2-CG 3.78Å; F25-H45 AromaticContact CD2-ND1 3.61Å; F25-H45 HydrophobicContact CE1-CB 3.92Å; F25-H45 HydrophobicContact CE2-CB 3.69Å; F25-H45 AromaticContact CE2-CD2 3.34Å; F25-H45 WeakPolarHBondContact CE2-CD2 3.45Å; F25-H45 AromaticContact CE2-CE1 3.69Å; F25-H45 AromaticContact CE2-CG 3.19Å; F25-H45 AromaticContact CE2-ND1 3.44Å; F25-H45 WeakPolarHBondContact CE2-ND1 3.34Å; F25-H45 AromaticContact CE2-NE2 3.66Å; F25-H45 HydrophobicContact CZ-CB 3.53Å; F25-H45 AromaticContact CZ-CD2 3.66Å; F25-H45 AromaticContact CZ-CG 3.53Å; R41-H45 WeakPolarHBondContact O-CB 3.41Å; R41-H45 PolarHBondContact O-N 3.23Å; Y42-H45 PolarHBondContact O-N 3.11Å; H45-K47 VanDerWaalsContact C-N 3.27Å; H45-K47 PolarHBondContact O-N 3.41Å; H45-Q48 WeakPolarHBondContact O-CA 3.46Å; H45-Q48 WeakPolarHBondContact O-CB 3.29Å; H45-Q48 PolarHBondContact O-N 3.29Å; H45-T49 PolarHBondContact CD2-OG1 3.21Å; H45-T49 PolarHBondContact CE1-OG1 3.19Å; H45-T49 PolarHBondContact NE2-OG1 2.89Å; H45-T49 WeakPolarHBondContact O-CB 3.44Å; H45-T49 PolarHBondContact O-N 2.92Å; H45-T49 PolarHBondContact O-OG1 3.49Å; H45-T49 VanDerWaalsContact O-OG1 3.05Å
46	K	79.1	Confident	78.4	Confident	5 Å²	5	62 Å²	62	2%	0.022	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-31.8	177.9	-74.2	-63.6	-163.3	-177.8	0	113.6	D22 Y42 V43 Q48 S50 I56 V59	D22-K46 WeakPolarHBondContact OD1-CE 3.21Å; D22-K46 IonicContact OD1-NZ 3.96Å; D22-K46 PolarHBondContact OD1-NZ 3.42Å; D22-K46 IonicContact OD2-NZ 2.78Å; D22-K46 PolarHBondContact OD2-NZ 3.36Å; Y42-K46 HydrophobicContact CD2-CG 4.18Å; Y42-K46 HydrophobicContact CE2-CD 4.29Å; Y42-K46 HydrophobicContact CE2-CG 3.93Å; Y42-K46 WeakPolarHBondContact O-CB 3.38Å; Y42-K46 WeakPolarHBondContact O-CG 3.38Å; Y42-K46 PolarHBondContact O-N 2.99Å; Y42-K46 WeakPolarHBondContact OH-CE 3.36Å; V43-K46 PolarHBondContact O-N 3.42Å; K46-Q48 VanDerWaalsContact C-N 3.29Å; K46-S50 WeakPolarHBondContact O-CA 3.41Å; K46-S50 VanDerWaalsContact O-CB 3.27Å; K46-S50 WeakPolarHBondContact O-CB 3.46Å; K46-S50 PolarHBondContact O-N 3.44Å; K46-I56 HydrophobicContact CB-CG1 4.07Å; K46-V59 HydrophobicContact CG-CG2 3.86Å
47	K	78.3	Confident	78.6	Confident	84 Å²	84	60.6 Å²	60.6	37%	0.365	29%	0.291	S	S	.	.	H	α-helix	trans	-67.2	-29.5	172.8	-78.6	171.2	-176.3	168.1	0	112.7	V43 E44 H45 I56 Y60 F80	V43-K47 HydrophobicContact CG1-CD 4.11Å; V43-K47 WeakPolarHBondContact O-CB 3.33Å; V43-K47 VanDerWaalsContact O-CG 3.24Å; V43-K47 WeakPolarHBondContact O-CG 3.31Å; V43-K47 PolarHBondContact O-N 3.22Å; E44-K47 PolarHBondContact O-N 3.16Å; H45-K47 VanDerWaalsContact C-N 3.27Å; H45-K47 PolarHBondContact O-N 3.41Å; K47-I56 HydrophobicContact CG-CD1 4.31Å; K47-Y60 VanDerWaalsContact CE-OH 3.3Å; K47-Y60 WeakPolarHBondContact CE-OH 3.25Å; K47-Y60 PolarHBondContact NZ-OH 3.35Å; K47-Y60 VanDerWaalsContact NZ-OH 3.1Å; K47-F80 HydrophobicContact CG-CE2 4.46Å
48	Q	79.5	Confident	78.6	Confident	164 Å²	164	54.4 Å²	54.4	77%	0.766	27%	0.272	S	S	*	.	H	α-helix	trans	-83.7	-43	177.8	-68.5	173.7	1.6	0	0	111.6	E44 H45 K46	E44-Q48 WeakPolarHBondContact O-CG 3.46Å; E44-Q48 PolarHBondContact O-N 3.44Å; E44-Q48 VanDerWaalsContact O-N 3.14Å; H45-Q48 WeakPolarHBondContact O-CA 3.46Å; H45-Q48 WeakPolarHBondContact O-CB 3.29Å; H45-Q48 PolarHBondContact O-N 3.29Å; K46-Q48 VanDerWaalsContact C-N 3.29Å
49	T	71.4	Confident	78.6	Confident	52 Å²	52	53.8 Å²	53.8	32%	0.319	27%	0.268	S	S	.	.	H	α-helix	trans	-89	-38.4	-170.1	-50.3	0	0	0	0	113.1	E21 H45	E21-T49 WeakPolarHBondContact OE2-CG2 3.45Å; H45-T49 PolarHBondContact CD2-OG1 3.21Å; H45-T49 PolarHBondContact CE1-OG1 3.19Å; H45-T49 PolarHBondContact NE2-OG1 2.89Å; H45-T49 WeakPolarHBondContact O-CB 3.44Å; H45-T49 PolarHBondContact O-N 2.92Å; H45-T49 PolarHBondContact O-OG1 3.49Å; H45-T49 VanDerWaalsContact O-OG1 3.05Å
50	S	65.8	Low	78.6	Confident	26 Å²	26	53.5 Å²	53.5	18%	0.182	27%	0.267	C	S	.	.			trans	-99.1	113.3	-172.6	-63.2	0	0	0	0	112.5	K46 N52	K46-S50 WeakPolarHBondContact O-CA 3.41Å; K46-S50 VanDerWaalsContact O-CB 3.27Å; K46-S50 WeakPolarHBondContact O-CB 3.46Å; K46-S50 PolarHBondContact O-N 3.44Å; S50-N52 PolarHBondContact O-N 3.38Å
51	S	62.1	Low	78.6	Confident	128 Å²	128	53.8 Å²	53.8	90%	0.895	27%	0.268	S	S	*	.	S	Bend	trans	-67.3	-20.6	161.1	59.1	0	0	0	0	112.1	Y53	S51-Y53 PolarHBondContact O-N 3.03Å
52	N	72.7	Confident	78.7	Confident	76 Å²	76	50.2 Å²	50.2	41%	0.406	25%	0.254	S	S	.	.			trans	-82	107.5	178.4	-163.5	-9.9	0	0	0	111.6	S50 F54 A55	S50-N52 PolarHBondContact O-N 3.38Å; N52-F54 VanDerWaalsContact C-N 3.26Å; N52-F54 PolarHBondContact O-N 2.91Å; N52-F54 PolarHBondContact OD1-N 3.31Å; N52-A55 WeakPolarHBondContact O-CB 3.33Å; N52-A55 PolarHBondContact O-N 2.81Å
53	Y	76.1	Confident	78.7	Confident	72 Å²	72	50.2 Å²	50.2	28%	0.282	26%	0.255	S	S	.	.	H	α-helix	trans	-61.5	-28.6	178.4	54.9	-90.3	0	0	0	113.8	S51 A55 I56 Y57 R84	S51-Y53 PolarHBondContact O-N 3.03Å; Y53-A55 VanDerWaalsContact C-N 3.31Å; Y53-A55 PolarHBondContact O-N 2.8Å; Y53-I56 PolarHBondContact O-N 2.95Å; Y53-Y57 HydrophobicContact CD2-CD2 4.27Å; Y53-Y57 AromaticContact CD2-CE2 3.84Å; Y53-Y57 HydrophobicContact CD2-CE2 3.84Å; Y53-Y57 WeakPolarHBondContact O-CD2 3.42Å; Y53-Y57 PolarHBondContact O-N 2.65Å; Y53-R84 VanDerWaalsContact CD1-NH2 3.26Å; Y53-R84 VanDerWaalsContact CE2-CZ 3.41Å; Y53-R84 VanDerWaalsContact CG-NH2 3.27Å
54	F	77.9	Confident	78.8	Confident	89 Å²	89	50.5 Å²	50.5	39%	0.39	26%	0.256	S	S	.	.	H	α-helix	trans	-65.5	-35.9	177.7	-74.4	-68.5	0	0	0	111.7	N52 I56 Y57 N58	N52-F54 VanDerWaalsContact C-N 3.26Å; N52-F54 PolarHBondContact O-N 2.91Å; N52-F54 PolarHBondContact OD1-N 3.31Å; F54-I56 VanDerWaalsContact C-N 3.33Å; F54-I56 PolarHBondContact O-N 2.89Å; F54-Y57 HydrophobicContact CD1-CD2 4.44Å; F54-Y57 PolarHBondContact O-N 3.24Å; F54-N58 WeakPolarHBondContact O-CB 3.31Å; F54-N58 PolarHBondContact O-N 2.85Å; F54-N58 PolarHBondContact O-ND2 3.1Å
55	A	76.5	Confident	78.7	Confident	19 Å²	19	55 Å²	55	16%	0.157	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-43.5	175.6	0	0	0	0	0	110.9	N52 Y53 Y57 N58 V59	N52-A55 WeakPolarHBondContact O-CB 3.33Å; N52-A55 PolarHBondContact O-N 2.81Å; Y53-A55 VanDerWaalsContact C-N 3.31Å; Y53-A55 PolarHBondContact O-N 2.8Å; A55-Y57 PolarHBondContact O-N 3.44Å; A55-N58 PolarHBondContact O-N 3.21Å; A55-V59 WeakPolarHBondContact O-CG2 3.26Å; A55-V59 PolarHBondContact O-N 2.91Å; A55-V59 VanDerWaalsContact O-N 3.09Å
56	I	83.2	Confident	78.6	Confident	7 Å²	7	58 Å²	58	4%	0.036	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-42.6	177.2	-60.9	167.8	0	0	0	110.9	K46 K47 Y53 F54 V59 Y60 F80	K46-I56 HydrophobicContact CB-CG1 4.07Å; K47-I56 HydrophobicContact CG-CD1 4.31Å; Y53-I56 PolarHBondContact O-N 2.95Å; F54-I56 VanDerWaalsContact C-N 3.33Å; F54-I56 PolarHBondContact O-N 2.89Å; I56-V59 PolarHBondContact O-N 2.97Å; I56-Y60 HydrophobicContact CG2-CD2 3.82Å; I56-Y60 HydrophobicContact CG2-CE2 3.55Å; I56-Y60 WeakPolarHBondContact O-CD2 3.28Å; I56-Y60 PolarHBondContact O-N 3.24Å; I56-Y60 VanDerWaalsContact O-N 3.11Å; I56-F80 HydrophobicContact CB-CE1 3.96Å; I56-F80 HydrophobicContact CB-CZ 4.19Å; I56-F80 HydrophobicContact CD1-CE1 4.25Å; I56-F80 HydrophobicContact CD1-CE2 4.35Å; I56-F80 HydrophobicContact CD1-CZ 3.6Å; I56-F80 HydrophobicContact CG1-CZ 4.48Å; I56-F80 HydrophobicContact CG2-CD1 3.94Å; I56-F80 HydrophobicContact CG2-CE1 3.42Å; I56-F80 VanDerWaalsContact CG2-CE1 3.42Å; I56-F80 HydrophobicContact CG2-CE2 4.47Å; I56-F80 HydrophobicContact CG2-CZ 3.74Å
57	Y	84.5	Confident	78.7	Confident	20 Å²	20	59.4 Å²	59.4	8%	0.078	29%	0.291	C	S	.	.	H	α-helix	trans	-61.9	-43.2	175.5	-65	-27.1	0	0	0	112.4	Y53 F54 A55 V59 Y60 E61 Y77 F80 R81 R84	Y53-Y57 HydrophobicContact CD2-CD2 4.27Å; Y53-Y57 AromaticContact CD2-CE2 3.84Å; Y53-Y57 HydrophobicContact CD2-CE2 3.84Å; Y53-Y57 WeakPolarHBondContact O-CD2 3.42Å; Y53-Y57 PolarHBondContact O-N 2.65Å; F54-Y57 HydrophobicContact CD1-CD2 4.44Å; F54-Y57 PolarHBondContact O-N 3.24Å; A55-Y57 PolarHBondContact O-N 3.44Å; Y57-V59 VanDerWaalsContact C-N 3.27Å; Y57-V59 PolarHBondContact O-N 3.11Å; Y57-Y60 PolarHBondContact O-N 2.82Å; Y57-E61 WeakPolarHBondContact O-CB 3.14Å; Y57-E61 WeakPolarHBondContact O-CG 3.3Å; Y57-E61 PolarHBondContact O-N 2.92Å; Y57-Y77 AromaticContact CD1-CE2 3.85Å; Y57-Y77 HydrophobicContact CD1-CE2 3.85Å; Y57-Y77 HydrophobicContact CG-CE2 4.49Å; Y57-F80 HydrophobicContact CD1-CD1 4.2Å; Y57-F80 HydrophobicContact CD1-CE1 4.14Å; Y57-F80 AromaticContact CE1-CD1 3.73Å; Y57-F80 HydrophobicContact CE1-CD1 3.73Å; Y57-F80 AromaticContact CE1-CE1 3.71Å; Y57-F80 HydrophobicContact CE1-CE1 3.71Å; Y57-R81 HydrophobicContact CE1-CB 4.37Å; Y57-R81 HydrophobicContact CE1-CG 4.18Å; Y57-R84 WeakPolarHBondContact OH-CD 3.09Å; Y57-R84 PolarHBondContact OH-NH1 2.82Å
58	N	82.3	Confident	78.7	Confident	66 Å²	66	57.7 Å²	57.7	35%	0.353	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-37.6	178.2	-70.6	-15.3	0	0	0	111.7	F54 A55 E61 R62	F54-N58 WeakPolarHBondContact O-CB 3.31Å; F54-N58 PolarHBondContact O-N 2.85Å; F54-N58 PolarHBondContact O-ND2 3.1Å; A55-N58 PolarHBondContact O-N 3.21Å; N58-E61 PolarHBondContact O-N 3.38Å; N58-R62 WeakPolarHBondContact O-CB 3.29Å; N58-R62 VanDerWaalsContact O-CG 3.29Å; N58-R62 WeakPolarHBondContact O-CG 3.35Å; N58-R62 PolarHBondContact O-N 3.45Å
59	V	83	Confident	78.6	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-46	173.6	172.9	0	0	0	0	112.1	W39 Y42 V43 K46 A55 I56 Y57 R62 G63	W39-V59 HydrophobicContact CE3-CG1 4.41Å; Y42-V59 HydrophobicContact CD1-CB 4.07Å; Y42-V59 HydrophobicContact CD1-CG1 3.22Å; Y42-V59 HydrophobicContact CD1-CG2 3.69Å; Y42-V59 HydrophobicContact CE1-CB 4Å; Y42-V59 HydrophobicContact CE1-CG1 3.66Å; Y42-V59 HydrophobicContact CE1-CG2 3.19Å; Y42-V59 HydrophobicContact CG-CG1 4.03Å; V43-V59 HydrophobicContact CG2-CG1 3.6Å; K46-V59 HydrophobicContact CG-CG2 3.86Å; A55-V59 WeakPolarHBondContact O-CG2 3.26Å; A55-V59 PolarHBondContact O-N 2.91Å; A55-V59 VanDerWaalsContact O-N 3.09Å; I56-V59 PolarHBondContact O-N 2.97Å; Y57-V59 VanDerWaalsContact C-N 3.27Å; Y57-V59 PolarHBondContact O-N 3.11Å; V59-R62 PolarHBondContact O-N 2.71Å; V59-G63 PolarHBondContact O-N 3Å
60	Y	84.1	Confident	79.2	Confident	3 Å²	3	50.9 Å²	50.9	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-63.8	-41.8	175.4	-77.2	-68.9	0	0	0	112	V43 K47 I56 Y57 R62 G63 L64 Q76 Y77 F80	V43-Y60 HydrophobicContact CB-CE1 4.42Å; V43-Y60 HydrophobicContact CG1-CE1 3.79Å; V43-Y60 HydrophobicContact CG1-CE2 3.88Å; V43-Y60 WeakPolarHBondContact CG1-OH 3.5Å; V43-Y60 HydrophobicContact CG2-CD1 3.94Å; V43-Y60 HydrophobicContact CG2-CE1 3.75Å; V43-Y60 HydrophobicContact CG2-CE2 4.37Å; V43-Y60 HydrophobicContact CG2-CG 4.35Å; K47-Y60 VanDerWaalsContact CE-OH 3.3Å; K47-Y60 WeakPolarHBondContact CE-OH 3.25Å; K47-Y60 PolarHBondContact NZ-OH 3.35Å; K47-Y60 VanDerWaalsContact NZ-OH 3.1Å; I56-Y60 HydrophobicContact CG2-CD2 3.82Å; I56-Y60 HydrophobicContact CG2-CE2 3.55Å; I56-Y60 WeakPolarHBondContact O-CD2 3.28Å; I56-Y60 PolarHBondContact O-N 3.24Å; I56-Y60 VanDerWaalsContact O-N 3.11Å; Y57-Y60 PolarHBondContact O-N 2.82Å; Y60-R62 VanDerWaalsContact C-N 3.32Å; Y60-R62 PolarHBondContact O-N 3.26Å; Y60-G63 PolarHBondContact O-N 2.91Å; Y60-L64 WeakPolarHBondContact O-CB 3.4Å; Y60-L64 WeakPolarHBondContact O-CG 3.47Å; Y60-L64 PolarHBondContact O-N 3.23Å; Y60-Q76 HydrophobicContact CE1-CB 4.04Å; Y60-Y77 HydrophobicContact CD1-CD2 4.25Å; Y60-Y77 HydrophobicContact CD1-CG 4.35Å; Y60-Y77 AromaticContact CD2-CD2 3.6Å; Y60-Y77 HydrophobicContact CD2-CD2 3.6Å; Y60-Y77 HydrophobicContact CD2-CE2 4.32Å; Y60-Y77 HydrophobicContact CD2-CG 4.46Å; Y60-Y77 HydrophobicContact CE2-CD2 4.35Å; Y60-Y77 AromaticContact CG-CD2 3.51Å; Y60-Y77 HydrophobicContact CG-CD2 3.51Å; Y60-Y77 HydrophobicContact CG-CE2 4.33Å; Y60-Y77 HydrophobicContact CG-CG 4.02Å; Y60-F80 HydrophobicContact CE2-CB 4.36Å; Y60-F80 HydrophobicContact CE2-CD1 4.09Å; Y60-F80 HydrophobicContact CE2-CG 4.29Å
61	E	83.4	Confident	80.1	Confident	33 Å²	33	53.2 Å²	53.2	15%	0.154	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-37.3	177.5	-72.1	-69.9	162.9	0	0	111.8	Y57 N58 R65 Y77 R104	Y57-E61 WeakPolarHBondContact O-CB 3.14Å; Y57-E61 WeakPolarHBondContact O-CG 3.3Å; Y57-E61 PolarHBondContact O-N 2.92Å; N58-E61 PolarHBondContact O-N 3.38Å; E61-R65 VanDerWaalsContact O-CG 3.31Å; E61-R65 WeakPolarHBondContact O-CG 3.37Å; E61-R65 PolarHBondContact O-N 3.1Å; E61-R65 VanDerWaalsContact O-N 3.1Å; E61-Y77 PolarHBondContact OE1-OH 3.48Å; E61-R104 VanDerWaalsContact CD-NH1 3.3Å; E61-R104 IonicContact OE1-CZ 3.74Å; E61-R104 IonicContact OE1-NH1 2.8Å; E61-R104 PolarHBondContact OE1-NH1 3.03Å; E61-R104 IonicContact OE1-NH2 3.48Å; E61-R104 IonicContact OE2-CZ 3.32Å; E61-R104 IonicContact OE2-NH1 3.03Å; E61-R104 PolarHBondContact OE2-NH1 3.3Å; E61-R104 IonicContact OE2-NH2 2.7Å; E61-R104 PolarHBondContact OE2-NH2 3.48Å
62	R	83.3	Confident	81.2	Confident	75 Å²	75	53.2 Å²	53.2	28%	0.283	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-47.3	170.8	-74.3	177.1	68.5	-168.1	-3.6	111.4	E26 W39 N58 V59 Y60 L64 R65 E66	E26-R62 VanDerWaalsContact CD-NH1 3.31Å; E26-R62 IonicContact OE1-CZ 3.36Å; E26-R62 IonicContact OE1-NH1 3.1Å; E26-R62 PolarHBondContact OE1-NH1 2.8Å; E26-R62 IonicContact OE1-NH2 2.73Å; E26-R62 IonicContact OE2-CZ 3.81Å; E26-R62 IonicContact OE2-NH1 3.65Å; E26-R62 PolarHBondContact OE2-NH1 2.73Å; E26-R62 VanDerWaalsContact OE2-NH1 3.1Å; E26-R62 IonicContact OE2-NH2 2.71Å; E26-R62 PolarHBondContact OE2-NH2 3.26Å; W39-R62 HydrophobicContact CH2-CB 3.74Å; W39-R62 HydrophobicContact CZ3-CB 3.76Å; N58-R62 WeakPolarHBondContact O-CB 3.29Å; N58-R62 VanDerWaalsContact O-CG 3.29Å; N58-R62 WeakPolarHBondContact O-CG 3.35Å; N58-R62 PolarHBondContact O-N 3.45Å; V59-R62 PolarHBondContact O-N 2.71Å; Y60-R62 VanDerWaalsContact C-N 3.32Å; Y60-R62 PolarHBondContact O-N 3.26Å; R62-L64 VanDerWaalsContact C-N 3.3Å; R62-L64 PolarHBondContact O-N 3.46Å; R62-R65 PolarHBondContact O-N 2.98Å; R62-E66 PolarHBondContact O-N 3.4Å
63	G	83.2	Confident	81.7	Confident	2 Å²	2	49.7 Å²	49.7	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-34.1	177.9	0	0	0	0	0	113.8	W39 V59 Y60 E66 L67	W39-G63 VanDerWaalsContact CD2-CA 3.5Å; V59-G63 PolarHBondContact O-N 3Å; Y60-G63 PolarHBondContact O-N 2.91Å; G63-E66 PolarHBondContact O-N 2.91Å; G63-L67 PolarHBondContact O-N 3.3Å
64	L	82.1	Confident	82.4	Confident	8 Å²	8	46.4 Å²	46.4	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	-77.3	-24.2	178	-70.7	174.1	0	0	0	113.4	Y60 R62 P68 L73 W74 Y77	Y60-L64 WeakPolarHBondContact O-CB 3.4Å; Y60-L64 WeakPolarHBondContact O-CG 3.47Å; Y60-L64 PolarHBondContact O-N 3.23Å; R62-L64 VanDerWaalsContact C-N 3.3Å; R62-L64 PolarHBondContact O-N 3.46Å; L64-P68 WeakPolarHBondContact O-CA 3.16Å; L64-L73 HydrophobicContact CD2-CB 3.96Å; L64-W74 HydrophobicContact CD1-CD2 4.06Å; L64-W74 HydrophobicContact CD1-CE3 3.82Å; L64-W74 HydrophobicContact CD1-CH2 3.84Å; L64-W74 HydrophobicContact CD1-CZ2 4.07Å; L64-W74 HydrophobicContact CD1-CZ3 3.71Å; L64-W74 HydrophobicContact CD2-CD2 3.63Å; L64-W74 HydrophobicContact CD2-CE3 4.24Å; L64-W74 HydrophobicContact CD2-CG 3.79Å; L64-W74 HydrophobicContact CD2-CZ2 4.08Å; L64-W74 HydrophobicContact CG-CD2 4.49Å; L64-W74 HydrophobicContact CG-CZ2 4.48Å; L64-Y77 HydrophobicContact CD1-CD1 3.49Å; L64-Y77 VanDerWaalsContact CD1-CD1 3.49Å; L64-Y77 HydrophobicContact CD1-CE1 3.86Å; L64-Y77 HydrophobicContact CD1-CG 4.15Å
65	R	81.8	Confident	82.8	Confident	194 Å²	194	44.4 Å²	44.4	73%	0.732	22%	0.218	S	C	*	.	H	α-helix	trans	-67	-40.8	169.9	-76.2	173.9	-173.2	-173.3	1.6	111.3	E61 R62	E61-R65 VanDerWaalsContact O-CG 3.31Å; E61-R65 WeakPolarHBondContact O-CG 3.37Å; E61-R65 PolarHBondContact O-N 3.1Å; E61-R65 VanDerWaalsContact O-N 3.1Å; R62-R65 PolarHBondContact O-N 2.98Å
66	E	80	Confident	83.3	Confident	92 Å²	92	46 Å²	46	43%	0.43	22%	0.223	S	C	.	.	H	α-helix	trans	-79	-37.2	178.6	-60.7	-56	149.4	0	0	112.9	W39 R62 G63 P68	W39-E66 HydrophobicContact CZ2-CB 4.31Å; W39-E66 HydrophobicContact CZ2-CG 3.82Å; R62-E66 PolarHBondContact O-N 3.4Å; G63-E66 PolarHBondContact O-N 2.91Å; E66-P68 WeakPolarHBondContact O-CD 2.88Å
67	L	81.1	Confident	83.5	Confident	34 Å²	34	45.8 Å²	45.8	18%	0.178	22%	0.222	C	C	.	.			trans	-127.3	70.1	-175.4	-66.4	172.3	0	0	0	112.6	F34 G63 G69 S70 L73	F34-L67 HydrophobicContact CB-CD2 4.47Å; F34-L67 HydrophobicContact CD1-CD2 4.37Å; G63-L67 PolarHBondContact O-N 3.3Å; L67-G69 VanDerWaalsContact C-N 3.26Å; L67-G69 PolarHBondContact O-N 3.22Å; L67-S70 PolarHBondContact O-N 3.44Å; L67-S70 PolarHBondContact O-OG 2.81Å; L67-L73 HydrophobicContact CB-CD1 4.24Å; L67-L73 HydrophobicContact CD1-CD1 4.24Å
68	P	78.4	Confident	83.6	Confident	47 Å²	47	44.8 Å²	44.8	31%	0.305	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-24.9	-177	24.9	-34.3	0	0	0	114	L64 E66 W74 F108	L64-P68 WeakPolarHBondContact O-CA 3.16Å; E66-P68 WeakPolarHBondContact O-CD 2.88Å; P68-W74 PolarHBondContact O-NE1 2.9Å; P68-F108 HydrophobicContact CB-CD1 3.98Å; P68-F108 HydrophobicContact CB-CD2 4.37Å; P68-F108 HydrophobicContact CB-CE1 3.88Å; P68-F108 HydrophobicContact CB-CE2 4.28Å; P68-F108 HydrophobicContact CB-CG 4.22Å; P68-F108 HydrophobicContact CB-CZ 4.04Å
69	G	78.9	Confident	83.9	Confident	54 Å²	54	43.8 Å²	43.8	56%	0.557	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	1.8	-180	0	0	0	0	0	115.3	L67 Y71	L67-G69 VanDerWaalsContact C-N 3.26Å; L67-G69 PolarHBondContact O-N 3.22Å; G69-Y71 PolarHBondContact O-N 2.85Å
70	S	83.2	Confident	84	Confident	20 Å²	20	45.6 Å²	45.6	14%	0.14	22%	0.222	C	C	.	.			trans	-82.5	102.9	-173.5	64.3	0	0	0	0	112.1	L67 K72 L73 W74	L67-S70 PolarHBondContact O-N 3.44Å; L67-S70 PolarHBondContact O-OG 2.81Å; S70-K72 PolarHBondContact O-N 2.83Å; S70-L73 PolarHBondContact O-N 3.06Å; S70-L73 WeakPolarHBondContact OG-CB 3.2Å; S70-L73 VanDerWaalsContact OG-CD1 3.3Å; S70-L73 WeakPolarHBondContact OG-CD1 3.17Å; S70-L73 WeakPolarHBondContact OG-CG 3.39Å; S70-W74 PolarHBondContact O-N 2.95Å; S70-W74 VanDerWaalsContact O-N 3.12Å
71	Y	84.5	Confident	84.1	Confident	74 Å²	74	46.9 Å²	46.9	29%	0.29	23%	0.226	S	C	.	.	H	α-helix	trans	-54.6	-40.2	176.6	173.1	-107	0	0	0	112.9	G69 W74 H75 M109 M112 R114 I115	G69-Y71 PolarHBondContact O-N 2.85Å; Y71-W74 PolarHBondContact O-N 3.41Å; Y71-H75 HydrophobicContact CE1-CB 4.22Å; Y71-H75 HydrophobicContact CE2-CB 4.19Å; Y71-H75 AromaticContact CZ-CD2 3.81Å; Y71-H75 WeakPolarHBondContact O-CB 3.42Å; Y71-H75 PolarHBondContact O-N 3.25Å; Y71-H75 PolarHBondContact OH-CD2 3.13Å; Y71-H75 VanDerWaalsContact OH-CD2 3.24Å; Y71-M109 HydrophobicContact CD2-CE 4.45Å; Y71-M112 HydrophobicContact CD2-CE 4.35Å; Y71-M112 HydrophobicContact CD2-SD 3.16Å; Y71-M112 WeakPolarHBondContact CD2-SD 3.38Å; Y71-M112 HydrophobicContact CE2-SD 3.75Å; Y71-M112 HydrophobicContact CG-CE 4.27Å; Y71-M112 HydrophobicContact CG-SD 3.64Å; Y71-R114 WeakPolarHBondContact OH-CG 3.42Å; Y71-I115 HydrophobicContact CD2-CD1 3.98Å; Y71-I115 HydrophobicContact CD2-CG1 4.42Å; Y71-I115 HydrophobicContact CE2-CD1 4.05Å; Y71-I115 HydrophobicContact CE2-CG1 3.97Å
72	K	84.7	Confident	84.1	Confident	129 Å²	129	47.2 Å²	47.2	56%	0.561	23%	0.228	S	C	*	.	H	α-helix	trans	-65.1	-42.3	-176.2	-71	179.1	174.8	-179.3	0	112	L36 S70 Q76	L36-K72 HydrophobicContact CD1-CB 4.32Å; L36-K72 HydrophobicContact CD2-CB 4.08Å; L36-K72 HydrophobicContact CD2-CD 3.63Å; L36-K72 HydrophobicContact CD2-CG 4.41Å; S70-K72 PolarHBondContact O-N 2.83Å; K72-Q76 WeakPolarHBondContact O-CB 3.41Å; K72-Q76 VanDerWaalsContact O-CG 3.29Å; K72-Q76 WeakPolarHBondContact O-CG 3.31Å; K72-Q76 PolarHBondContact O-N 2.9Å
73	L	84.7	Confident	84.2	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-68.2	-46.8	175.8	-63.3	-178.3	0	0	0	110.7	L36 W39 L40 L64 L67 S70 H75 Q76 Y77	L36-L73 HydrophobicContact CD1-CD1 3.94Å; L36-L73 HydrophobicContact CD1-CD2 3.55Å; L36-L73 HydrophobicContact CD1-CG 3.37Å; W39-L73 HydrophobicContact CB-CD1 4.3Å; W39-L73 HydrophobicContact CB-CD2 4.13Å; W39-L73 HydrophobicContact CG-CD1 4.46Å; L40-L73 HydrophobicContact CD2-CD2 3.9Å; L40-L73 HydrophobicContact CG-CD2 4.32Å; L64-L73 HydrophobicContact CD2-CB 3.96Å; L67-L73 HydrophobicContact CB-CD1 4.24Å; L67-L73 HydrophobicContact CD1-CD1 4.24Å; S70-L73 PolarHBondContact O-N 3.06Å; S70-L73 WeakPolarHBondContact OG-CB 3.2Å; S70-L73 VanDerWaalsContact OG-CD1 3.3Å; S70-L73 WeakPolarHBondContact OG-CD1 3.17Å; S70-L73 WeakPolarHBondContact OG-CG 3.39Å; L73-H75 PolarHBondContact O-N 2.78Å; L73-Q76 PolarHBondContact O-N 3.4Å; L73-Y77 WeakPolarHBondContact O-CB 3.49Å; L73-Y77 PolarHBondContact O-N 3.34Å
74	W	89.6	Confident	84.2	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-57.9	-48.1	176.4	-85.2	116.1	0	0	0	112.3	L64 P68 S70 Y71 Y77 L78 R104 A105 F108	L64-W74 HydrophobicContact CD1-CD2 4.06Å; L64-W74 HydrophobicContact CD1-CE3 3.82Å; L64-W74 HydrophobicContact CD1-CH2 3.84Å; L64-W74 HydrophobicContact CD1-CZ2 4.07Å; L64-W74 HydrophobicContact CD1-CZ3 3.71Å; L64-W74 HydrophobicContact CD2-CD2 3.63Å; L64-W74 HydrophobicContact CD2-CE3 4.24Å; L64-W74 HydrophobicContact CD2-CG 3.79Å; L64-W74 HydrophobicContact CD2-CZ2 4.08Å; L64-W74 HydrophobicContact CG-CD2 4.49Å; L64-W74 HydrophobicContact CG-CZ2 4.48Å; P68-W74 PolarHBondContact O-NE1 2.9Å; S70-W74 PolarHBondContact O-N 2.95Å; S70-W74 VanDerWaalsContact O-N 3.12Å; Y71-W74 PolarHBondContact O-N 3.41Å; W74-Y77 HydrophobicContact CE3-CD1 4.14Å; W74-Y77 HydrophobicContact CZ3-CD1 4.07Å; W74-Y77 HydrophobicContact CZ3-CE1 4.32Å; W74-Y77 PolarHBondContact O-N 3.33Å; W74-L78 HydrophobicContact CE3-CG 4.42Å; W74-L78 VanDerWaalsContact O-CB 3.25Å; W74-L78 WeakPolarHBondContact O-CB 3.14Å; W74-L78 WeakPolarHBondContact O-CG 3.45Å; W74-L78 PolarHBondContact O-N 3.42Å; W74-R104 HydrophobicContact CH2-CB 3.85Å; W74-A105 HydrophobicContact CD2-CB 3.73Å; W74-A105 HydrophobicContact CE3-CB 3.37Å; W74-A105 HydrophobicContact CG-CB 4.39Å; W74-A105 HydrophobicContact CH2-CB 4.16Å; W74-A105 HydrophobicContact CZ2-CB 4.46Å; W74-A105 HydrophobicContact CZ3-CB 3.61Å; W74-F108 HydrophobicContact CZ2-CD2 4.03Å; W74-F108 HydrophobicContact CZ2-CE2 4.41Å
75	H	87	Confident	84.1	Confident	47 Å²	47	49.3 Å²	49.3	22%	0.218	25%	0.245	C	C	.	.	H	α-helix	trans	-64.3	-43.9	179.5	-177	-85.8	0	0	0	111.6	Y71 L73 T79	Y71-H75 HydrophobicContact CE1-CB 4.22Å; Y71-H75 HydrophobicContact CE2-CB 4.19Å; Y71-H75 AromaticContact CZ-CD2 3.81Å; Y71-H75 WeakPolarHBondContact O-CB 3.42Å; Y71-H75 PolarHBondContact O-N 3.25Å; Y71-H75 PolarHBondContact OH-CD2 3.13Å; Y71-H75 VanDerWaalsContact OH-CD2 3.24Å; L73-H75 PolarHBondContact O-N 2.78Å; H75-T79 VanDerWaalsContact O-CB 3.29Å; H75-T79 WeakPolarHBondContact O-CB 3.37Å; H75-T79 VanDerWaalsContact O-CG2 3.25Å; H75-T79 WeakPolarHBondContact O-CG2 3.09Å; H75-T79 PolarHBondContact O-N 3.02Å; H75-T79 PolarHBondContact O-OG1 3.44Å
76	Q	86.1	Confident	83.9	Confident	54 Å²	54	42.2 Å²	42.2	25%	0.252	22%	0.221	S	C	.	.	H	α-helix	trans	-66.1	-38.8	176.3	-74.3	-170.7	10.7	0	0	112.7	L40 Y60 K72 L73 T79 F80	L40-Q76 VanDerWaalsContact CD2-CD 3.44Å; Y60-Q76 HydrophobicContact CE1-CB 4.04Å; K72-Q76 WeakPolarHBondContact O-CB 3.41Å; K72-Q76 VanDerWaalsContact O-CG 3.29Å; K72-Q76 WeakPolarHBondContact O-CG 3.31Å; K72-Q76 PolarHBondContact O-N 2.9Å; L73-Q76 PolarHBondContact O-N 3.4Å; Q76-T79 VanDerWaalsContact CA-OG1 3.28Å; Q76-T79 WeakPolarHBondContact CA-OG1 3.39Å; Q76-T79 PolarHBondContact O-OG1 3.34Å; Q76-F80 WeakPolarHBondContact O-CB 3.43Å; Q76-F80 PolarHBondContact O-N 2.84Å
77	Y	88.1	Confident	83.8	Confident	1 Å²	1	48.8 Å²	48.8	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-65.1	-49.4	176.1	178.5	-132.1	0	0	0	111.4	Y57 Y60 E61 L64 L73 W74 F80 R81 C101	Y57-Y77 AromaticContact CD1-CE2 3.85Å; Y57-Y77 HydrophobicContact CD1-CE2 3.85Å; Y57-Y77 HydrophobicContact CG-CE2 4.49Å; Y60-Y77 HydrophobicContact CD1-CD2 4.25Å; Y60-Y77 HydrophobicContact CD1-CG 4.35Å; Y60-Y77 AromaticContact CD2-CD2 3.6Å; Y60-Y77 HydrophobicContact CD2-CD2 3.6Å; Y60-Y77 HydrophobicContact CD2-CE2 4.32Å; Y60-Y77 HydrophobicContact CD2-CG 4.46Å; Y60-Y77 HydrophobicContact CE2-CD2 4.35Å; Y60-Y77 AromaticContact CG-CD2 3.51Å; Y60-Y77 HydrophobicContact CG-CD2 3.51Å; Y60-Y77 HydrophobicContact CG-CE2 4.33Å; Y60-Y77 HydrophobicContact CG-CG 4.02Å; E61-Y77 PolarHBondContact OE1-OH 3.48Å; L64-Y77 HydrophobicContact CD1-CD1 3.49Å; L64-Y77 VanDerWaalsContact CD1-CD1 3.49Å; L64-Y77 HydrophobicContact CD1-CE1 3.86Å; L64-Y77 HydrophobicContact CD1-CG 4.15Å; L73-Y77 WeakPolarHBondContact O-CB 3.49Å; L73-Y77 PolarHBondContact O-N 3.34Å; W74-Y77 HydrophobicContact CE3-CD1 4.14Å; W74-Y77 HydrophobicContact CZ3-CD1 4.07Å; W74-Y77 HydrophobicContact CZ3-CE1 4.32Å; W74-Y77 PolarHBondContact O-N 3.33Å; Y77-F80 PolarHBondContact O-N 3.17Å; Y77-R81 VanDerWaalsContact O-CB 3.32Å; Y77-R81 WeakPolarHBondContact O-CB 3.19Å; Y77-R81 PolarHBondContact O-N 3.2Å; Y77-R81 PolarHBondContact OH-NH1 2.98Å; Y77-C101 HydrophobicContact CE1-CB 4.32Å
78	L	87.2	Confident	83.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.5	-42.4	179.7	-68.9	170.7	0	0	0	111.6	W74 R81 M82 C101 F102 A105 I115 M118	W74-L78 HydrophobicContact CE3-CG 4.42Å; W74-L78 VanDerWaalsContact O-CB 3.25Å; W74-L78 WeakPolarHBondContact O-CB 3.14Å; W74-L78 WeakPolarHBondContact O-CG 3.45Å; W74-L78 PolarHBondContact O-N 3.42Å; L78-R81 PolarHBondContact O-N 3.33Å; L78-M82 WeakPolarHBondContact O-CB 3.4Å; L78-M82 PolarHBondContact O-N 3.02Å; L78-C101 HydrophobicContact CD2-CB 4.21Å; L78-F102 HydrophobicContact CB-CE1 4.04Å; L78-F102 HydrophobicContact CB-CZ 4.08Å; L78-F102 HydrophobicContact CD1-CD1 3.83Å; L78-F102 HydrophobicContact CD1-CE1 3.7Å; L78-F102 HydrophobicContact CD2-CD1 3.75Å; L78-F102 HydrophobicContact CD2-CD2 4.15Å; L78-F102 HydrophobicContact CD2-CE1 3.78Å; L78-F102 HydrophobicContact CD2-CE2 4.14Å; L78-F102 HydrophobicContact CD2-CG 3.94Å; L78-F102 HydrophobicContact CD2-CZ 3.95Å; L78-F102 HydrophobicContact CG-CD1 4.32Å; L78-F102 HydrophobicContact CG-CE1 4.04Å; L78-F102 HydrophobicContact CG-CZ 4.4Å; L78-A105 HydrophobicContact CD1-CB 3.86Å; L78-I115 HydrophobicContact CD1-CG2 4.02Å; L78-M118 HydrophobicContact CB-CE 4.2Å
79	T	87.8	Confident	83.5	Confident	44 Å²	44	52.4 Å²	52.4	27%	0.27	26%	0.261	S	S	.	.	H	α-helix	trans	-63.8	-43.4	174.7	47	0	0	0	0	111.6	H75 Q76 M82 T83 M118	H75-T79 VanDerWaalsContact O-CB 3.29Å; H75-T79 WeakPolarHBondContact O-CB 3.37Å; H75-T79 VanDerWaalsContact O-CG2 3.25Å; H75-T79 WeakPolarHBondContact O-CG2 3.09Å; H75-T79 PolarHBondContact O-N 3.02Å; H75-T79 PolarHBondContact O-OG1 3.44Å; Q76-T79 VanDerWaalsContact CA-OG1 3.28Å; Q76-T79 WeakPolarHBondContact CA-OG1 3.39Å; Q76-T79 PolarHBondContact O-OG1 3.34Å; T79-M82 WeakPolarHBondContact O-CB 3.34Å; T79-M82 PolarHBondContact O-N 3.13Å; T79-T83 WeakPolarHBondContact O-CG2 3.36Å; T79-T83 PolarHBondContact O-N 3.01Å; T79-T83 PolarHBondContact O-OG1 2.95Å; T79-M118 HydrophobicContact CG2-CE 3.52Å; T79-M118 HydrophobicContact CG2-SD 4.34Å
80	F	86.2	Confident	83.2	Confident	43 Å²	43	53.9 Å²	53.9	19%	0.189	26%	0.255	C	S	.	.	H	α-helix	trans	-64.7	-40.4	177.3	-177.9	-102.1	0	0	0	112.4	K47 I56 Y57 Y60 Q76 Y77 T83 R84	K47-F80 HydrophobicContact CG-CE2 4.46Å; I56-F80 HydrophobicContact CB-CE1 3.96Å; I56-F80 HydrophobicContact CB-CZ 4.19Å; I56-F80 HydrophobicContact CD1-CE1 4.25Å; I56-F80 HydrophobicContact CD1-CE2 4.35Å; I56-F80 HydrophobicContact CD1-CZ 3.6Å; I56-F80 HydrophobicContact CG1-CZ 4.48Å; I56-F80 HydrophobicContact CG2-CD1 3.94Å; I56-F80 HydrophobicContact CG2-CE1 3.42Å; I56-F80 VanDerWaalsContact CG2-CE1 3.42Å; I56-F80 HydrophobicContact CG2-CE2 4.47Å; I56-F80 HydrophobicContact CG2-CZ 3.74Å; Y57-F80 HydrophobicContact CD1-CD1 4.2Å; Y57-F80 HydrophobicContact CD1-CE1 4.14Å; Y57-F80 AromaticContact CE1-CD1 3.73Å; Y57-F80 HydrophobicContact CE1-CD1 3.73Å; Y57-F80 AromaticContact CE1-CE1 3.71Å; Y57-F80 HydrophobicContact CE1-CE1 3.71Å; Y60-F80 HydrophobicContact CE2-CB 4.36Å; Y60-F80 HydrophobicContact CE2-CD1 4.09Å; Y60-F80 HydrophobicContact CE2-CG 4.29Å; Q76-F80 WeakPolarHBondContact O-CB 3.43Å; Q76-F80 PolarHBondContact O-N 2.84Å; Y77-F80 PolarHBondContact O-N 3.17Å; F80-T83 PolarHBondContact O-OG1 2.94Å; F80-R84 PolarHBondContact O-N 3.3Å
81	R	84.7	Confident	82.8	Confident	29 Å²	29	59.1 Å²	59.1	11%	0.109	29%	0.287	C	S	.	.	H	α-helix	trans	-69.2	-37.1	175.1	-158.3	179.5	175.7	126.5	3.6	111.5	Y57 Y77 L78 T85 A97 L98 C101	Y57-R81 HydrophobicContact CE1-CB 4.37Å; Y57-R81 HydrophobicContact CE1-CG 4.18Å; Y77-R81 VanDerWaalsContact O-CB 3.32Å; Y77-R81 WeakPolarHBondContact O-CB 3.19Å; Y77-R81 PolarHBondContact O-N 3.2Å; Y77-R81 PolarHBondContact OH-NH1 2.98Å; L78-R81 PolarHBondContact O-N 3.33Å; R81-T85 WeakPolarHBondContact O-CB 3.34Å; R81-T85 WeakPolarHBondContact O-CG2 3.29Å; R81-T85 PolarHBondContact O-N 3.43Å; R81-T85 PolarHBondContact O-OG1 2.82Å; R81-A97 PolarHBondContact NH2-O 2.87Å; R81-A97 VanDerWaalsContact NH2-O 3.15Å; R81-L98 HydrophobicContact CB-CD1 3.77Å; R81-L98 HydrophobicContact CG-CD1 3.66Å; R81-C101 PolarHBondContact NH1-SG 3.2Å
82	M	84.8	Confident	82.7	Confident	40 Å²	40	58.1 Å²	58.1	20%	0.197	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-49.2	174.8	-176.6	-176.5	-176.9	0	0	111.7	L78 T79 R84 T85 M86 M118 I122	L78-M82 WeakPolarHBondContact O-CB 3.4Å; L78-M82 PolarHBondContact O-N 3.02Å; T79-M82 WeakPolarHBondContact O-CB 3.34Å; T79-M82 PolarHBondContact O-N 3.13Å; M82-R84 PolarHBondContact O-N 2.86Å; M82-T85 VanDerWaalsContact CA-OG1 3.29Å; M82-T85 WeakPolarHBondContact CA-OG1 3.32Å; M82-T85 PolarHBondContact O-N 2.94Å; M82-T85 PolarHBondContact O-OG1 3.13Å; M82-M86 HydrophobicContact CE-CE 3.52Å; M82-M86 HydrophobicContact CG-CE 3.83Å; M82-M86 HydrophobicContact CG-CG 4.1Å; M82-M86 VanDerWaalsContact O-CB 3.32Å; M82-M86 WeakPolarHBondContact O-CB 3.42Å; M82-M86 WeakPolarHBondContact O-CG 3.49Å; M82-M86 PolarHBondContact O-N 2.85Å; M82-M118 HydrophobicContact SD-CE 4.02Å; M82-I122 HydrophobicContact CB-CD1 4.26Å; M82-I122 HydrophobicContact CE-CD1 4.07Å; M82-I122 HydrophobicContact CE-CG1 3.8Å; M82-I122 HydrophobicContact CG-CD1 3.74Å; M82-I122 HydrophobicContact CG-CG1 4.16Å; M82-I122 HydrophobicContact SD-CD1 3.78Å; M82-I122 HydrophobicContact SD-CG1 4.19Å
83	T	85.2	Confident	82.7	Confident	86 Å²	86	56.6 Å²	56.6	53%	0.528	29%	0.289	S	S	.	.	H	α-helix	trans	-59.8	-32.4	-179.5	51.4	0	0	0	0	112.6	T79 F80	T79-T83 WeakPolarHBondContact O-CG2 3.36Å; T79-T83 PolarHBondContact O-N 3.01Å; T79-T83 PolarHBondContact O-OG1 2.95Å; F80-T83 PolarHBondContact O-OG1 2.94Å
84	R	82.5	Confident	82.5	Confident	43 Å²	43	58 Å²	58	16%	0.162	30%	0.296	C	S	.	.	H	α-helix	trans	-75.3	-51.1	175.7	-177.2	152.6	178.7	-86.5	-11.2	112.9	Y53 Y57 F80 M82 M86 R87 E94	Y53-R84 VanDerWaalsContact CD1-NH2 3.26Å; Y53-R84 VanDerWaalsContact CE2-CZ 3.41Å; Y53-R84 VanDerWaalsContact CG-NH2 3.27Å; Y57-R84 WeakPolarHBondContact OH-CD 3.09Å; Y57-R84 PolarHBondContact OH-NH1 2.82Å; F80-R84 PolarHBondContact O-N 3.3Å; M82-R84 PolarHBondContact O-N 2.86Å; R84-M86 PolarHBondContact O-N 2.82Å; R84-R87 WeakPolarHBondContact O-CB 3.49Å; R84-R87 PolarHBondContact O-N 3.13Å; R84-R87 VanDerWaalsContact O-N 3.11Å; R84-E94 IonicContact CZ-OE1 3.5Å; R84-E94 IonicContact CZ-OE2 3.52Å; R84-E94 IonicContact NH1-OE1 2.74Å; R84-E94 PolarHBondContact NH1-OE1 3.29Å; R84-E94 IonicContact NH1-OE2 3.44Å; R84-E94 IonicContact NH2-OE1 3.5Å; R84-E94 PolarHBondContact NH2-OE1 2.95Å
85	T	80	Confident	82.3	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.4	-31.9	179	46.6	0	0	0	0	112.7	R81 M82 R87 K88 E94 Y95 L98	R81-T85 WeakPolarHBondContact O-CB 3.34Å; R81-T85 WeakPolarHBondContact O-CG2 3.29Å; R81-T85 PolarHBondContact O-N 3.43Å; R81-T85 PolarHBondContact O-OG1 2.82Å; M82-T85 VanDerWaalsContact CA-OG1 3.29Å; M82-T85 WeakPolarHBondContact CA-OG1 3.32Å; M82-T85 PolarHBondContact O-N 2.94Å; M82-T85 PolarHBondContact O-OG1 3.13Å; T85-R87 PolarHBondContact O-N 3.5Å; T85-R87 VanDerWaalsContact O-N 3.13Å; T85-K88 WeakPolarHBondContact O-CB 3.13Å; T85-K88 PolarHBondContact O-N 3.14Å; T85-E94 HydrophobicContact CG2-CB 3.73Å; T85-Y95 WeakPolarHBondContact O-CE2 3.4Å; T85-Y95 VanDerWaalsContact O-CZ 3.3Å; T85-Y95 PolarHBondContact O-OH 3.22Å; T85-L98 HydrophobicContact CG2-CB 4.25Å; T85-L98 HydrophobicContact CG2-CD2 4.03Å; T85-L98 WeakPolarHBondContact OG1-CD2 3.4Å
86	M	77.3	Confident	82.2	Confident	46 Å²	46	60.3 Å²	60.3	23%	0.227	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.4	175.7	-73.5	-67.5	168.8	0	0	114.2	M82 R84 I122 R125	M82-M86 HydrophobicContact CE-CE 3.52Å; M82-M86 HydrophobicContact CG-CE 3.83Å; M82-M86 HydrophobicContact CG-CG 4.1Å; M82-M86 VanDerWaalsContact O-CB 3.32Å; M82-M86 WeakPolarHBondContact O-CB 3.42Å; M82-M86 WeakPolarHBondContact O-CG 3.49Å; M82-M86 PolarHBondContact O-N 2.85Å; R84-M86 PolarHBondContact O-N 2.82Å; M86-I122 HydrophobicContact CE-CG1 3.72Å; M86-R125 WeakPolarHBondContact SD-CD 3.36Å; M86-R125 PolarHBondContact SD-NE 3.21Å; M86-R125 VanDerWaalsContact SD-NE 3.43Å
87	R	78.3	Confident	82.2	Confident	229 Å²	229	59 Å²	59	86%	0.864	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-13.4	174.9	-62.8	-177.8	179.4	-172.5	-1.5	113.3	R84 T85	R84-R87 WeakPolarHBondContact O-CB 3.49Å; R84-R87 PolarHBondContact O-N 3.13Å; R84-R87 VanDerWaalsContact O-N 3.11Å; T85-R87 PolarHBondContact O-N 3.5Å; T85-R87 VanDerWaalsContact O-N 3.13Å
88	K	77.4	Confident	82.2	Confident	72 Å²	72	59 Å²	59	31%	0.313	31%	0.308	S	S	.	.	S	Bend	trans	-99.4	158.9	-173.3	-71.7	-148.1	-172.7	-173.7	0	111.9	T85 D92 E94 Y95	T85-K88 WeakPolarHBondContact O-CB 3.13Å; T85-K88 PolarHBondContact O-N 3.14Å; K88-D92 HydrophobicContact CB-CB 4.28Å; K88-D92 VanDerWaalsContact CB-OD2 3.27Å; K88-D92 WeakPolarHBondContact CB-OD2 3.5Å; K88-D92 HydrophobicContact CD-CB 4.41Å; K88-E94 HydrophobicContact CD-CG 4.16Å; K88-E94 WeakPolarHBondContact CD-OE2 3.16Å; K88-E94 WeakPolarHBondContact CE-OE1 3.42Å; K88-E94 WeakPolarHBondContact CE-OE2 3.19Å; K88-E94 IonicContact NZ-OE1 2.87Å; K88-E94 PolarHBondContact NZ-OE1 2.87Å; K88-E94 IonicContact NZ-OE2 3.43Å; K88-E94 PolarHBondContact NZ-OE2 2.65Å; K88-Y95 PolarHBondContact O-OH 2.97Å
89	C	75.7	Confident	82.3	Confident	86 Å²	86	59.2 Å²	59.2	58%	0.581	31%	0.31	S	S	*	.			trans	-67.2	146	178.5	-71.6	0	0	0	0	109.9	T91 D92 Y95	C89-T91 PolarHBondContact O-N 2.92Å; C89-D92 PolarHBondContact N-OD2 2.92Å; C89-D92 VanDerWaalsContact O-CB 3.31Å; C89-D92 WeakPolarHBondContact O-CB 3.32Å; C89-D92 PolarHBondContact O-N 3.02Å; C89-Y95 WeakPolarHBondContact O-CD2 3.2Å; C89-Y95 WeakPolarHBondContact O-CE2 3.3Å
90	I	73	Confident	82.3	Confident	84 Å²	84	62.8 Å²	62.8	43%	0.431	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-23.5	-172.8	-60.1	165.7	0	0	0	112.4	Q126	I90-Q126 HydrophobicContact CG2-CB 4.41Å
91	T	73.8	Confident	82.4	Confident	131 Å²	131	61 Å²	61	80%	0.804	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.5	178.2	51.5	0	0	0	0	114.3	C89	C89-T91 PolarHBondContact O-N 2.92Å
92	D	81.9	Confident	82.5	Confident	53 Å²	53	59.6 Å²	59.6	28%	0.283	31%	0.31	S	S	.	.	S	Bend	trans	-69	139.2	-177.2	-75.6	-42.4	0	0	0	111.1	K88 C89 E94 Y95	K88-D92 HydrophobicContact CB-CB 4.28Å; K88-D92 VanDerWaalsContact CB-OD2 3.27Å; K88-D92 WeakPolarHBondContact CB-OD2 3.5Å; K88-D92 HydrophobicContact CD-CB 4.41Å; C89-D92 PolarHBondContact N-OD2 2.92Å; C89-D92 VanDerWaalsContact O-CB 3.31Å; C89-D92 WeakPolarHBondContact O-CB 3.32Å; C89-D92 PolarHBondContact O-N 3.02Å; D92-E94 PolarHBondContact O-N 3.4Å; D92-Y95 PolarHBondContact O-N 2.85Å
93	P	84.8	Confident	82.6	Confident	97 Å²	97	64.2 Å²	64.2	63%	0.63	33%	0.326	S	S	*	.	H	α-helix	trans	-60.8	-14	-178.4	25	-35.3	0	0	0	113.3	Y95 D96 A97	P93-Y95 PolarHBondContact O-N 3.35Å; P93-D96 PolarHBondContact O-N 3.42Å; P93-A97 PolarHBondContact O-N 3.34Å; P93-A97 VanDerWaalsContact O-N 3.09Å
94	E	81.8	Confident	82.7	Confident	30 Å²	30	65 Å²	65	14%	0.14	32%	0.319	C	S	.	.	H	α-helix	trans	-64.6	-28	173.3	-60.2	-159.4	159.4	0	0	113.3	R84 T85 K88 D92 L98	R84-E94 IonicContact CZ-OE1 3.5Å; R84-E94 IonicContact CZ-OE2 3.52Å; R84-E94 IonicContact NH1-OE1 2.74Å; R84-E94 PolarHBondContact NH1-OE1 3.29Å; R84-E94 IonicContact NH1-OE2 3.44Å; R84-E94 IonicContact NH2-OE1 3.5Å; R84-E94 PolarHBondContact NH2-OE1 2.95Å; T85-E94 HydrophobicContact CG2-CB 3.73Å; K88-E94 HydrophobicContact CD-CG 4.16Å; K88-E94 WeakPolarHBondContact CD-OE2 3.16Å; K88-E94 WeakPolarHBondContact CE-OE1 3.42Å; K88-E94 WeakPolarHBondContact CE-OE2 3.19Å; K88-E94 IonicContact NZ-OE1 2.87Å; K88-E94 PolarHBondContact NZ-OE1 2.87Å; K88-E94 IonicContact NZ-OE2 3.43Å; K88-E94 PolarHBondContact NZ-OE2 2.65Å; D92-E94 PolarHBondContact O-N 3.4Å; E94-L98 WeakPolarHBondContact O-CB 3.47Å; E94-L98 PolarHBondContact O-N 3.2Å
95	Y	84.2	Confident	82.9	Confident	4 Å²	4	63 Å²	63	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-68.8	-40.3	174.6	-81.9	-79.7	0	0	0	111.7	T85 K88 C89 D92 P93 L98 N99 Q126	T85-Y95 WeakPolarHBondContact O-CE2 3.4Å; T85-Y95 VanDerWaalsContact O-CZ 3.3Å; T85-Y95 PolarHBondContact O-OH 3.22Å; K88-Y95 PolarHBondContact O-OH 2.97Å; C89-Y95 WeakPolarHBondContact O-CD2 3.2Å; C89-Y95 WeakPolarHBondContact O-CE2 3.3Å; D92-Y95 PolarHBondContact O-N 2.85Å; P93-Y95 PolarHBondContact O-N 3.35Å; Y95-L98 WeakPolarHBondContact O-CB 3.16Å; Y95-L98 PolarHBondContact O-N 3.12Å; Y95-N99 PolarHBondContact O-N 2.98Å; Y95-N99 PolarHBondContact O-ND2 2.84Å; Y95-N99 PolarHBondContact O-OD1 3.24Å; Y95-Q126 HydrophobicContact CD1-CG 3.75Å; Y95-Q126 HydrophobicContact CE1-CG 4.21Å; Y95-Q126 HydrophobicContact CG-CG 4.4Å
96	D	85	Confident	83.1	Confident	94 Å²	94	63.8 Å²	63.8	50%	0.503	32%	0.316	S	S	.	.	H	α-helix	trans	-65.8	-43.9	174.7	-75.3	-30.4	0	0	0	111.5	P93 L98 N99 Q100	P93-D96 PolarHBondContact O-N 3.42Å; D96-L98 VanDerWaalsContact C-N 3.28Å; D96-L98 PolarHBondContact O-N 2.88Å; D96-N99 WeakPolarHBondContact O-CB 3.05Å; D96-N99 PolarHBondContact O-N 3.48Å; D96-N99 VanDerWaalsContact O-N 3.16Å; D96-Q100 WeakPolarHBondContact O-CG 3.37Å; D96-Q100 PolarHBondContact O-N 2.88Å
97	A	86.3	Confident	83.5	Confident	28 Å²	28	66.8 Å²	66.8	23%	0.231	34%	0.337	C	S	.	.	H	α-helix	trans	-67.5	-31.6	178.4	0	0	0	0	0	111.4	R81 P93 C101	R81-A97 PolarHBondContact NH2-O 2.87Å; R81-A97 VanDerWaalsContact NH2-O 3.15Å; P93-A97 PolarHBondContact O-N 3.34Å; P93-A97 VanDerWaalsContact O-N 3.09Å; A97-C101 PolarHBondContact O-N 3.09Å; A97-C101 VanDerWaalsContact O-N 3.11Å; A97-C101 PolarHBondContact O-SG 2.68Å
98	L	88.8	Confident	83.6	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.1	-45	169.3	177.4	69.4	0	0	0	111.9	R81 T85 E94 Y95 D96 Q100 C101 F102 I122	R81-L98 HydrophobicContact CB-CD1 3.77Å; R81-L98 HydrophobicContact CG-CD1 3.66Å; T85-L98 HydrophobicContact CG2-CB 4.25Å; T85-L98 HydrophobicContact CG2-CD2 4.03Å; T85-L98 WeakPolarHBondContact OG1-CD2 3.4Å; E94-L98 WeakPolarHBondContact O-CB 3.47Å; E94-L98 PolarHBondContact O-N 3.2Å; Y95-L98 WeakPolarHBondContact O-CB 3.16Å; Y95-L98 PolarHBondContact O-N 3.12Å; D96-L98 VanDerWaalsContact C-N 3.28Å; D96-L98 PolarHBondContact O-N 2.88Å; L98-Q100 VanDerWaalsContact C-N 3.29Å; L98-Q100 PolarHBondContact O-N 3.34Å; L98-C101 WeakPolarHBondContact O-CA 3.35Å; L98-C101 WeakPolarHBondContact O-CB 3.47Å; L98-C101 PolarHBondContact O-N 2.9Å; L98-F102 HydrophobicContact CD1-CD2 3.96Å; L98-F102 HydrophobicContact CD1-CE2 3.46Å; L98-F102 VanDerWaalsContact CD1-CE2 3.46Å; L98-F102 HydrophobicContact CD1-CZ 4.39Å; L98-F102 HydrophobicContact CD2-CE2 4.13Å; L98-F102 HydrophobicContact CG-CD2 3.85Å; L98-F102 HydrophobicContact CG-CE2 3.59Å; L98-F102 VanDerWaalsContact O-CD2 3.29Å; L98-F102 WeakPolarHBondContact O-CD2 3.46Å; L98-F102 PolarHBondContact O-N 3.48Å; L98-I122 HydrophobicContact CD2-CD1 4.11Å; L98-I122 HydrophobicContact CD2-CG2 3.84Å
99	N	88.2	Confident	83.7	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.027	31%	0.308	C	S	.	.	H	α-helix	trans	-59.1	-41.9	176.2	-70.8	-19.8	0	0	0	111.4	Y95 D96 C101 F102 R103 Q126	Y95-N99 PolarHBondContact O-N 2.98Å; Y95-N99 PolarHBondContact O-ND2 2.84Å; Y95-N99 PolarHBondContact O-OD1 3.24Å; D96-N99 WeakPolarHBondContact O-CB 3.05Å; D96-N99 PolarHBondContact O-N 3.48Å; D96-N99 VanDerWaalsContact O-N 3.16Å; N99-C101 VanDerWaalsContact C-N 3.32Å; N99-C101 PolarHBondContact O-N 3Å; N99-F102 PolarHBondContact O-N 3.27Å; N99-R103 WeakPolarHBondContact O-CG 3.37Å; N99-R103 PolarHBondContact O-N 2.91Å; N99-Q126 PolarHBondContact ND2-NE2 2.91Å; N99-Q126 PolarHBondContact ND2-OE1 3.24Å; N99-Q126 PolarHBondContact OD1-NE2 3.01Å
100	Q	88	Confident	84.1	Confident	119 Å²	119	58 Å²	58	56%	0.556	30%	0.299	S	S	*	.	H	α-helix	trans	-61.6	-39.7	173.1	-69.5	174.2	8.4	0	0	112	D96 L98 R103 R104	D96-Q100 WeakPolarHBondContact O-CG 3.37Å; D96-Q100 PolarHBondContact O-N 2.88Å; L98-Q100 VanDerWaalsContact C-N 3.29Å; L98-Q100 PolarHBondContact O-N 3.34Å; Q100-R103 PolarHBondContact O-N 3.29Å; Q100-R104 WeakPolarHBondContact O-CG 3.18Å; Q100-R104 PolarHBondContact O-N 3.1Å
101	C	87.9	Confident	84.5	Confident	4 Å²	4	61.6 Å²	61.6	3%	0.027	31%	0.311	C	S	.	.	H	α-helix	trans	-67	-39.6	176.3	-71.5	0	0	0	0	113.2	Y77 L78 R81 A97 L98 N99 R104 A105	Y77-C101 HydrophobicContact CE1-CB 4.32Å; L78-C101 HydrophobicContact CD2-CB 4.21Å; R81-C101 PolarHBondContact NH1-SG 3.2Å; A97-C101 PolarHBondContact O-N 3.09Å; A97-C101 VanDerWaalsContact O-N 3.11Å; A97-C101 PolarHBondContact O-SG 2.68Å; L98-C101 WeakPolarHBondContact O-CA 3.35Å; L98-C101 WeakPolarHBondContact O-CB 3.47Å; L98-C101 PolarHBondContact O-N 2.9Å; N99-C101 VanDerWaalsContact C-N 3.32Å; N99-C101 PolarHBondContact O-N 3Å; C101-R104 PolarHBondContact O-N 3.47Å; C101-A105 WeakPolarHBondContact O-CB 3.47Å; C101-A105 PolarHBondContact O-N 3.23Å
102	F	88.1	Confident	84.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.6	-43.6	171.4	-82	-73.4	0	0	0	111.7	L78 L98 N99 R104 A105 L106 I115 M118 F119 I122	L78-F102 HydrophobicContact CB-CE1 4.04Å; L78-F102 HydrophobicContact CB-CZ 4.08Å; L78-F102 HydrophobicContact CD1-CD1 3.83Å; L78-F102 HydrophobicContact CD1-CE1 3.7Å; L78-F102 HydrophobicContact CD2-CD1 3.75Å; L78-F102 HydrophobicContact CD2-CD2 4.15Å; L78-F102 HydrophobicContact CD2-CE1 3.78Å; L78-F102 HydrophobicContact CD2-CE2 4.14Å; L78-F102 HydrophobicContact CD2-CG 3.94Å; L78-F102 HydrophobicContact CD2-CZ 3.95Å; L78-F102 HydrophobicContact CG-CD1 4.32Å; L78-F102 HydrophobicContact CG-CE1 4.04Å; L78-F102 HydrophobicContact CG-CZ 4.4Å; L98-F102 HydrophobicContact CD1-CD2 3.96Å; L98-F102 HydrophobicContact CD1-CE2 3.46Å; L98-F102 VanDerWaalsContact CD1-CE2 3.46Å; L98-F102 HydrophobicContact CD1-CZ 4.39Å; L98-F102 HydrophobicContact CD2-CE2 4.13Å; L98-F102 HydrophobicContact CG-CD2 3.85Å; L98-F102 HydrophobicContact CG-CE2 3.59Å; L98-F102 VanDerWaalsContact O-CD2 3.29Å; L98-F102 WeakPolarHBondContact O-CD2 3.46Å; L98-F102 PolarHBondContact O-N 3.48Å; N99-F102 PolarHBondContact O-N 3.27Å; F102-R104 VanDerWaalsContact C-N 3.34Å; F102-R104 PolarHBondContact O-N 3.42Å; F102-A105 WeakPolarHBondContact O-CB 3.44Å; F102-A105 PolarHBondContact O-N 3.22Å; F102-L106 WeakPolarHBondContact O-CB 3.2Å; F102-L106 VanDerWaalsContact O-CG 3.23Å; F102-L106 WeakPolarHBondContact O-CG 3.48Å; F102-L106 PolarHBondContact O-N 3.42Å; F102-I115 HydrophobicContact CD1-CG2 4.19Å; F102-M118 HydrophobicContact CE1-CB 3.98Å; F102-M118 HydrophobicContact CZ-CB 4.28Å; F102-F119 HydrophobicContact CB-CB 4.31Å; F102-F119 HydrophobicContact CB-CD2 3.25Å; F102-F119 HydrophobicContact CB-CE2 3.57Å; F102-F119 HydrophobicContact CB-CG 3.86Å; F102-F119 HydrophobicContact CB-CZ 4.38Å; F102-F119 HydrophobicContact CD1-CB 3.7Å; F102-F119 HydrophobicContact CD1-CD2 4.05Å; F102-F119 HydrophobicContact CD1-CG 4.19Å; F102-F119 AromaticContact CD2-CD2 3.74Å; F102-F119 HydrophobicContact CD2-CD2 3.74Å; F102-F119 HydrophobicContact CD2-CE2 4.39Å; F102-F119 HydrophobicContact CE1-CB 4.18Å; F102-F119 HydrophobicContact CG-CB 4.01Å; F102-F119 AromaticContact CG-CD2 3.42Å; F102-F119 HydrophobicContact CG-CD2 3.42Å; F102-F119 VanDerWaalsContact CG-CD2 3.42Å; F102-F119 HydrophobicContact CG-CE2 4.16Å; F102-F119 HydrophobicContact CG-CG 4Å; F102-I122 HydrophobicContact CD2-CD1 4.31Å; F102-I122 HydrophobicContact CE1-CD1 4.42Å; F102-I122 HydrophobicContact CE2-CD1 3.19Å; F102-I122 HydrophobicContact CZ-CD1 3.27Å
103	R	87.1	Confident	85	Confident	138 Å²	138	56.8 Å²	56.8	52%	0.521	28%	0.28	S	S	.	.	H	α-helix	trans	-59.2	-44.8	175.5	-71.6	-179.9	-170.5	169	7.4	111.6	N99 Q100 A105 L106 V107 F119	N99-R103 WeakPolarHBondContact O-CG 3.37Å; N99-R103 PolarHBondContact O-N 2.91Å; Q100-R103 PolarHBondContact O-N 3.29Å; R103-A105 PolarHBondContact O-N 3.31Å; R103-L106 PolarHBondContact O-N 3.37Å; R103-V107 WeakPolarHBondContact O-CG2 3.23Å; R103-V107 PolarHBondContact O-N 3.35Å; R103-F119 HydrophobicContact CG-CZ 4.49Å
104	R	86.6	Confident	85	Confident	102 Å²	102	58.6 Å²	58.6	39%	0.385	27%	0.274	S	S	.	.	H	α-helix	trans	-60.2	-44	174.5	-72.2	171.3	63.4	-154.7	-2.1	112.1	E61 W74 Q100 C101 F102 L106 V107 F108	E61-R104 VanDerWaalsContact CD-NH1 3.3Å; E61-R104 IonicContact OE1-CZ 3.74Å; E61-R104 IonicContact OE1-NH1 2.8Å; E61-R104 PolarHBondContact OE1-NH1 3.03Å; E61-R104 IonicContact OE1-NH2 3.48Å; E61-R104 IonicContact OE2-CZ 3.32Å; E61-R104 IonicContact OE2-NH1 3.03Å; E61-R104 PolarHBondContact OE2-NH1 3.3Å; E61-R104 IonicContact OE2-NH2 2.7Å; E61-R104 PolarHBondContact OE2-NH2 3.48Å; W74-R104 HydrophobicContact CH2-CB 3.85Å; Q100-R104 WeakPolarHBondContact O-CG 3.18Å; Q100-R104 PolarHBondContact O-N 3.1Å; C101-R104 PolarHBondContact O-N 3.47Å; F102-R104 VanDerWaalsContact C-N 3.34Å; F102-R104 PolarHBondContact O-N 3.42Å; R104-L106 VanDerWaalsContact C-N 3.32Å; R104-L106 PolarHBondContact O-N 3.42Å; R104-V107 PolarHBondContact O-N 3.44Å; R104-F108 WeakPolarHBondContact O-CD2 3.24Å
105	A	86.9	Confident	85.2	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-42	177.4	0	0	0	0	0	112	W74 L78 C101 F102 R103 V107 F108 M109 I115	W74-A105 HydrophobicContact CD2-CB 3.73Å; W74-A105 HydrophobicContact CE3-CB 3.37Å; W74-A105 HydrophobicContact CG-CB 4.39Å; W74-A105 HydrophobicContact CH2-CB 4.16Å; W74-A105 HydrophobicContact CZ2-CB 4.46Å; W74-A105 HydrophobicContact CZ3-CB 3.61Å; L78-A105 HydrophobicContact CD1-CB 3.86Å; C101-A105 WeakPolarHBondContact O-CB 3.47Å; C101-A105 PolarHBondContact O-N 3.23Å; F102-A105 WeakPolarHBondContact O-CB 3.44Å; F102-A105 PolarHBondContact O-N 3.22Å; R103-A105 PolarHBondContact O-N 3.31Å; A105-V107 VanDerWaalsContact C-N 3.31Å; A105-V107 PolarHBondContact O-N 3.17Å; A105-F108 PolarHBondContact O-N 3.11Å; A105-M109 WeakPolarHBondContact O-CB 3.48Å; A105-M109 PolarHBondContact O-N 3.36Å; A105-I115 HydrophobicContact CB-CG2 4.44Å
106	L	85	Confident	85.4	Confident	17 Å²	17	57.8 Å²	57.8	9%	0.089	27%	0.27	C	S	.	.	H	α-helix	trans	-69.4	-25.2	-177.8	-71.7	170.9	0	0	0	113.2	F102 R103 R104 F108 N110 I115 W116 F119	F102-L106 WeakPolarHBondContact O-CB 3.2Å; F102-L106 VanDerWaalsContact O-CG 3.23Å; F102-L106 WeakPolarHBondContact O-CG 3.48Å; F102-L106 PolarHBondContact O-N 3.42Å; R103-L106 PolarHBondContact O-N 3.37Å; R104-L106 VanDerWaalsContact C-N 3.32Å; R104-L106 PolarHBondContact O-N 3.42Å; L106-F108 VanDerWaalsContact C-N 3.27Å; L106-F108 PolarHBondContact O-N 3.12Å; L106-N110 WeakPolarHBondContact O-CA 3.23Å; L106-N110 WeakPolarHBondContact O-CB 3.16Å; L106-N110 PolarHBondContact O-N 2.8Å; L106-N110 VanDerWaalsContact O-N 3.16Å; L106-I115 HydrophobicContact CD2-CB 4.42Å; L106-I115 HydrophobicContact CD2-CG2 3.78Å; L106-I115 HydrophobicContact CG-CG2 4.24Å; L106-W116 HydrophobicContact CD1-CD2 4.24Å; L106-W116 HydrophobicContact CD1-CE3 3.89Å; L106-W116 HydrophobicContact CD1-CH2 3.69Å; L106-W116 HydrophobicContact CD1-CZ2 4.02Å; L106-W116 HydrophobicContact CD1-CZ3 3.61Å; L106-W116 HydrophobicContact CD2-CD2 3.66Å; L106-W116 VanDerWaalsContact CD2-CE2 3.43Å; L106-W116 HydrophobicContact CD2-CE3 4.18Å; L106-W116 HydrophobicContact CD2-CG 4.05Å; L106-W116 HydrophobicContact CD2-CH2 4.31Å; L106-W116 HydrophobicContact CD2-CZ2 3.78Å; L106-W116 HydrophobicContact CD2-CZ3 4.49Å; L106-W116 HydrophobicContact CG-CH2 4.48Å; L106-W116 HydrophobicContact CG-CZ2 4.34Å; L106-F119 HydrophobicContact CD1-CD1 3.81Å; L106-F119 HydrophobicContact CD1-CE1 4.08Å; L106-F119 HydrophobicContact CD1-CG 4.44Å
107	V	85.1	Confident	85.6	Confident	110 Å²	110	55 Å²	55	67%	0.667	26%	0.255	S	S	*	.	H	α-helix	trans	-59.2	-40.9	172.2	174.5	0	0	0	0	110.9	R103 R104 A105	R103-V107 WeakPolarHBondContact O-CG2 3.23Å; R103-V107 PolarHBondContact O-N 3.35Å; R104-V107 PolarHBondContact O-N 3.44Å; A105-V107 VanDerWaalsContact C-N 3.31Å; A105-V107 PolarHBondContact O-N 3.17Å
108	F	80.1	Confident	85.7	Confident	111 Å²	111	54.1 Å²	54.1	49%	0.487	25%	0.246	S	C	.	.	H	α-helix	trans	-90.2	-30.5	-179.7	-58.4	-71.7	0	0	0	113	P68 W74 R104 A105 L106	P68-F108 HydrophobicContact CB-CD1 3.98Å; P68-F108 HydrophobicContact CB-CD2 4.37Å; P68-F108 HydrophobicContact CB-CE1 3.88Å; P68-F108 HydrophobicContact CB-CE2 4.28Å; P68-F108 HydrophobicContact CB-CG 4.22Å; P68-F108 HydrophobicContact CB-CZ 4.04Å; W74-F108 HydrophobicContact CZ2-CD2 4.03Å; W74-F108 HydrophobicContact CZ2-CE2 4.41Å; R104-F108 WeakPolarHBondContact O-CD2 3.24Å; A105-F108 PolarHBondContact O-N 3.11Å; L106-F108 VanDerWaalsContact C-N 3.27Å; L106-F108 PolarHBondContact O-N 3.12Å
109	M	80.5	Confident	85.6	Confident	19 Å²	19	54.6 Å²	54.6	9%	0.094	25%	0.248	C	C	.	.			trans	-123.2	42.2	-168.2	-53.7	-58.5	-61.1	0	0	113.3	Y71 A105 K111 M112 I115	Y71-M109 HydrophobicContact CD2-CE 4.45Å; A105-M109 WeakPolarHBondContact O-CB 3.48Å; A105-M109 PolarHBondContact O-N 3.36Å; M109-K111 VanDerWaalsContact C-N 3.28Å; M109-K111 PolarHBondContact O-N 3.31Å; M109-M112 HydrophobicContact CE-CE 3.34Å; M109-M112 HydrophobicContact CE-CG 3.97Å; M109-M112 HydrophobicContact CE-SD 3.19Å; M109-M112 WeakPolarHBondContact CE-SD 3.47Å; M109-M112 PolarHBondContact O-N 3.5Å; M109-I115 HydrophobicContact CB-CD1 3.63Å; M109-I115 HydrophobicContact CG-CD1 4.16Å
110	N	82.7	Confident	85.5	Confident	71 Å²	71	54.4 Å²	54.4	38%	0.38	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-27.3	-178.4	59.6	-3.9	0	0	0	114.5	L106 M112 W116	L106-N110 WeakPolarHBondContact O-CA 3.23Å; L106-N110 WeakPolarHBondContact O-CB 3.16Å; L106-N110 PolarHBondContact O-N 2.8Å; L106-N110 VanDerWaalsContact O-N 3.16Å; N110-M112 VanDerWaalsContact C-N 3.32Å; N110-M112 PolarHBondContact O-N 3.33Å; N110-W116 PolarHBondContact O-NE1 3.09Å
111	K	81.5	Confident	85.4	Confident	160 Å²	160	51 Å²	51	70%	0.696	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-2	-178.2	-63.7	-175.2	-177.1	-179	0	115	M109 P113	M109-K111 VanDerWaalsContact C-N 3.28Å; M109-K111 PolarHBondContact O-N 3.31Å; K111-P113 WeakPolarHBondContact O-CD 3.4Å
112	M	83.2	Confident	85.3	Confident	69 Å²	69	50.8 Å²	50.8	34%	0.34	24%	0.235	S	C	.	.			trans	-104.2	111.9	-173	-69.8	-161.6	171.1	0	0	112.6	Y71 M109 N110 R114 I115	Y71-M112 HydrophobicContact CD2-CE 4.35Å; Y71-M112 HydrophobicContact CD2-SD 3.16Å; Y71-M112 WeakPolarHBondContact CD2-SD 3.38Å; Y71-M112 HydrophobicContact CE2-SD 3.75Å; Y71-M112 HydrophobicContact CG-CE 4.27Å; Y71-M112 HydrophobicContact CG-SD 3.64Å; M109-M112 HydrophobicContact CE-CE 3.34Å; M109-M112 HydrophobicContact CE-CG 3.97Å; M109-M112 HydrophobicContact CE-SD 3.19Å; M109-M112 WeakPolarHBondContact CE-SD 3.47Å; M109-M112 PolarHBondContact O-N 3.5Å; N110-M112 VanDerWaalsContact C-N 3.32Å; N110-M112 PolarHBondContact O-N 3.33Å; M112-R114 VanDerWaalsContact C-N 3.29Å; M112-R114 PolarHBondContact O-N 3.22Å; M112-I115 HydrophobicContact CB-CD1 4.49Å; M112-I115 PolarHBondContact O-N 3.24Å
113	P	82.8	Confident	85.2	Confident	14 Å²	14	50.9 Å²	50.9	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-30.9	-177.5	-27.5	34.2	0	0	0	115.1	K111 I115 W116 I117 L143 Q147	K111-P113 WeakPolarHBondContact O-CD 3.4Å; P113-I115 VanDerWaalsContact C-N 3.34Å; P113-I115 PolarHBondContact O-N 3.32Å; P113-W116 WeakPolarHBondContact O-CB 3.43Å; P113-W116 PolarHBondContact O-N 2.78Å; P113-I117 HydrophobicContact CB-CD1 4.43Å; P113-I117 WeakPolarHBondContact O-CB 3.27Å; P113-I117 VanDerWaalsContact O-CG1 3.25Å; P113-I117 WeakPolarHBondContact O-CG1 3.45Å; P113-I117 PolarHBondContact O-N 2.55Å; P113-L143 HydrophobicContact CB-CD1 4.46Å; P113-L143 HydrophobicContact CG-CD2 4.03Å; P113-Q147 HydrophobicContact CG-CB 4.17Å; P113-Q147 HydrophobicContact CG-CG 4.19Å
114	R	85.1	Confident	85.1	Confident	136 Å²	136	45.7 Å²	45.7	51%	0.513	22%	0.219	S	C	.	.	H	α-helix	trans	-65.6	-38.8	-173	-173.2	59	173.9	-178.3	-0.4	112.2	Y71 M112 I117 M118	Y71-R114 WeakPolarHBondContact OH-CG 3.42Å; M112-R114 VanDerWaalsContact C-N 3.29Å; M112-R114 PolarHBondContact O-N 3.22Å; R114-I117 PolarHBondContact O-N 2.61Å; R114-M118 HydrophobicContact CG-SD 4.47Å; R114-M118 VanDerWaalsContact O-CG 3.29Å; R114-M118 WeakPolarHBondContact O-CG 3.26Å; R114-M118 PolarHBondContact O-N 3.19Å
115	I	85.6	Confident	84.9	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-67.3	-43	177.3	-62	173.4	0	0	0	109.6	Y71 L78 F102 A105 L106 M109 M112 P113 M118 F119	Y71-I115 HydrophobicContact CD2-CD1 3.98Å; Y71-I115 HydrophobicContact CD2-CG1 4.42Å; Y71-I115 HydrophobicContact CE2-CD1 4.05Å; Y71-I115 HydrophobicContact CE2-CG1 3.97Å; L78-I115 HydrophobicContact CD1-CG2 4.02Å; F102-I115 HydrophobicContact CD1-CG2 4.19Å; A105-I115 HydrophobicContact CB-CG2 4.44Å; L106-I115 HydrophobicContact CD2-CB 4.42Å; L106-I115 HydrophobicContact CD2-CG2 3.78Å; L106-I115 HydrophobicContact CG-CG2 4.24Å; M109-I115 HydrophobicContact CB-CD1 3.63Å; M109-I115 HydrophobicContact CG-CD1 4.16Å; M112-I115 HydrophobicContact CB-CD1 4.49Å; M112-I115 PolarHBondContact O-N 3.24Å; P113-I115 VanDerWaalsContact C-N 3.34Å; P113-I115 PolarHBondContact O-N 3.32Å; I115-M118 PolarHBondContact O-N 3.34Å; I115-F119 WeakPolarHBondContact O-CB 3.46Å; I115-F119 PolarHBondContact O-N 3.47Å
116	W	89.9	Confident	84.7	Confident	16 Å²	16	47.7 Å²	47.7	6%	0.061	23%	0.227	C	C	.	.	H	α-helix	trans	-59.9	-46	173.9	-77.5	112.7	0	0	0	112.7	L106 N110 P113 M118 F119 C120 S135 D138 A139 S142 L143	L106-W116 HydrophobicContact CD1-CD2 4.24Å; L106-W116 HydrophobicContact CD1-CE3 3.89Å; L106-W116 HydrophobicContact CD1-CH2 3.69Å; L106-W116 HydrophobicContact CD1-CZ2 4.02Å; L106-W116 HydrophobicContact CD1-CZ3 3.61Å; L106-W116 HydrophobicContact CD2-CD2 3.66Å; L106-W116 VanDerWaalsContact CD2-CE2 3.43Å; L106-W116 HydrophobicContact CD2-CE3 4.18Å; L106-W116 HydrophobicContact CD2-CG 4.05Å; L106-W116 HydrophobicContact CD2-CH2 4.31Å; L106-W116 HydrophobicContact CD2-CZ2 3.78Å; L106-W116 HydrophobicContact CD2-CZ3 4.49Å; L106-W116 HydrophobicContact CG-CH2 4.48Å; L106-W116 HydrophobicContact CG-CZ2 4.34Å; N110-W116 PolarHBondContact O-NE1 3.09Å; P113-W116 WeakPolarHBondContact O-CB 3.43Å; P113-W116 PolarHBondContact O-N 2.78Å; W116-M118 VanDerWaalsContact C-N 3.34Å; W116-M118 PolarHBondContact O-N 3.36Å; W116-F119 HydrophobicContact CE3-CD1 4.17Å; W116-F119 HydrophobicContact CZ3-CD1 4.15Å; W116-F119 HydrophobicContact CZ3-CE1 4.46Å; W116-F119 PolarHBondContact O-N 3.13Å; W116-C120 VanDerWaalsContact O-CB 3.32Å; W116-C120 WeakPolarHBondContact O-CB 3.43Å; W116-C120 PolarHBondContact O-N 3.03Å; W116-C120 PolarHBondContact O-SG 3.01Å; W116-S135 WeakPolarHBondContact CZ3-O 3.4Å; W116-D138 HydrophobicContact CH2-CB 3.81Å; W116-D138 HydrophobicContact CZ3-CB 4.31Å; W116-A139 HydrophobicContact CB-CB 4.34Å; W116-A139 HydrophobicContact CD2-CB 3.58Å; W116-A139 HydrophobicContact CE3-CB 3.42Å; W116-A139 VanDerWaalsContact CE3-CB 3.42Å; W116-A139 HydrophobicContact CG-CB 4.03Å; W116-A139 HydrophobicContact CH2-CB 4.41Å; W116-A139 HydrophobicContact CZ3-CB 3.86Å; W116-S142 VanDerWaalsContact CE2-OG 3.26Å; W116-S142 WeakPolarHBondContact CZ2-OG 3.15Å; W116-S142 PolarHBondContact NE1-OG 3.15Å; W116-L143 HydrophobicContact CB-CD1 4.23Å; W116-L143 HydrophobicContact CG-CD1 4.01Å
117	I	88.4	Confident	84.3	Confident	36 Å²	36	55.8 Å²	55.8	19%	0.185	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-45.9	176.8	-72	164.1	0	0	0	110.7	P113 R114 S121 R150 L154	P113-I117 HydrophobicContact CB-CD1 4.43Å; P113-I117 WeakPolarHBondContact O-CB 3.27Å; P113-I117 VanDerWaalsContact O-CG1 3.25Å; P113-I117 WeakPolarHBondContact O-CG1 3.45Å; P113-I117 PolarHBondContact O-N 2.55Å; R114-I117 PolarHBondContact O-N 2.61Å; I117-S121 WeakPolarHBondContact O-CB 3.17Å; I117-S121 PolarHBondContact O-N 3.47Å; I117-S121 PolarHBondContact O-OG 2.94Å; I117-R150 HydrophobicContact CD1-CB 4.28Å; I117-L154 HydrophobicContact CB-CD1 4.06Å; I117-L154 HydrophobicContact CG1-CD1 3.82Å; I117-L154 HydrophobicContact CG2-CD1 3.66Å
118	M	87.9	Confident	84.1	Confident	10 Å²	10	53.5 Å²	53.5	5%	0.049	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-48.6	176.6	-73.6	175.7	64.9	0	0	111	L78 T79 M82 F102 R114 I115 W116 C120 S121 I122	L78-M118 HydrophobicContact CB-CE 4.2Å; T79-M118 HydrophobicContact CG2-CE 3.52Å; T79-M118 HydrophobicContact CG2-SD 4.34Å; M82-M118 HydrophobicContact SD-CE 4.02Å; F102-M118 HydrophobicContact CE1-CB 3.98Å; F102-M118 HydrophobicContact CZ-CB 4.28Å; R114-M118 HydrophobicContact CG-SD 4.47Å; R114-M118 VanDerWaalsContact O-CG 3.29Å; R114-M118 WeakPolarHBondContact O-CG 3.26Å; R114-M118 PolarHBondContact O-N 3.19Å; I115-M118 PolarHBondContact O-N 3.34Å; W116-M118 VanDerWaalsContact C-N 3.34Å; W116-M118 PolarHBondContact O-N 3.36Å; M118-C120 PolarHBondContact O-N 3.28Å; M118-S121 PolarHBondContact O-N 3.2Å; M118-S121 PolarHBondContact O-OG 3.47Å; M118-I122 WeakPolarHBondContact O-CD1 3.46Å; M118-I122 WeakPolarHBondContact O-CG1 3.17Å; M118-I122 PolarHBondContact O-N 3.09Å; M118-I122 VanDerWaalsContact O-N 3.11Å
119	F	87.8	Confident	84	Confident	10 Å²	10	50 Å²	50	4%	0.044	23%	0.228	C	C	.	.	H	α-helix	trans	-60.2	-48.9	179.8	-177.4	-133.8	0	0	0	111.8	F102 R103 L106 I115 W116 S121 I122 L123	F102-F119 HydrophobicContact CB-CB 4.31Å; F102-F119 HydrophobicContact CB-CD2 3.25Å; F102-F119 HydrophobicContact CB-CE2 3.57Å; F102-F119 HydrophobicContact CB-CG 3.86Å; F102-F119 HydrophobicContact CB-CZ 4.38Å; F102-F119 HydrophobicContact CD1-CB 3.7Å; F102-F119 HydrophobicContact CD1-CD2 4.05Å; F102-F119 HydrophobicContact CD1-CG 4.19Å; F102-F119 AromaticContact CD2-CD2 3.74Å; F102-F119 HydrophobicContact CD2-CD2 3.74Å; F102-F119 HydrophobicContact CD2-CE2 4.39Å; F102-F119 HydrophobicContact CE1-CB 4.18Å; F102-F119 HydrophobicContact CG-CB 4.01Å; F102-F119 AromaticContact CG-CD2 3.42Å; F102-F119 HydrophobicContact CG-CD2 3.42Å; F102-F119 VanDerWaalsContact CG-CD2 3.42Å; F102-F119 HydrophobicContact CG-CE2 4.16Å; F102-F119 HydrophobicContact CG-CG 4Å; R103-F119 HydrophobicContact CG-CZ 4.49Å; L106-F119 HydrophobicContact CD1-CD1 3.81Å; L106-F119 HydrophobicContact CD1-CE1 4.08Å; L106-F119 HydrophobicContact CD1-CG 4.44Å; I115-F119 WeakPolarHBondContact O-CB 3.46Å; I115-F119 PolarHBondContact O-N 3.47Å; W116-F119 HydrophobicContact CE3-CD1 4.17Å; W116-F119 HydrophobicContact CZ3-CD1 4.15Å; W116-F119 HydrophobicContact CZ3-CE1 4.46Å; W116-F119 PolarHBondContact O-N 3.13Å; F119-S121 VanDerWaalsContact C-N 3.34Å; F119-S121 PolarHBondContact O-N 3.13Å; F119-I122 PolarHBondContact O-N 2.94Å; F119-L123 HydrophobicContact CD1-CD1 3.98Å; F119-L123 HydrophobicContact CD2-CD1 4.07Å; F119-L123 HydrophobicContact CD2-CG 4.15Å; F119-L123 HydrophobicContact CE1-CD1 3.63Å; F119-L123 HydrophobicContact CE2-CD1 3.71Å; F119-L123 HydrophobicContact CE2-CD2 4.15Å; F119-L123 HydrophobicContact CE2-CG 3.91Å; F119-L123 HydrophobicContact CG-CD1 4.21Å; F119-L123 HydrophobicContact CZ-CD1 3.5Å; F119-L123 VanDerWaalsContact CZ-CD1 3.5Å; F119-L123 HydrophobicContact CZ-CD2 4.43Å; F119-L123 HydrophobicContact CZ-CG 4.2Å; F119-L123 WeakPolarHBondContact O-CG 3.45Å; F119-L123 PolarHBondContact O-N 3.34Å
120	C	85.9	Confident	84.2	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.007	25%	0.249	C	C	.	.	H	α-helix	trans	-60.7	-43	177.1	-65.2	0	0	0	0	110.9	W116 M118 I122 L123 V124 F136	W116-C120 VanDerWaalsContact O-CB 3.32Å; W116-C120 WeakPolarHBondContact O-CB 3.43Å; W116-C120 PolarHBondContact O-N 3.03Å; W116-C120 PolarHBondContact O-SG 3.01Å; M118-C120 PolarHBondContact O-N 3.28Å; C120-I122 VanDerWaalsContact C-N 3.26Å; C120-I122 PolarHBondContact O-N 3.11Å; C120-L123 PolarHBondContact O-N 2.88Å; C120-V124 WeakPolarHBondContact O-CB 3.2Å; C120-V124 WeakPolarHBondContact O-CG2 3.43Å; C120-V124 PolarHBondContact O-N 2.95Å; C120-F136 HydrophobicContact CB-CD1 4.27Å; C120-F136 HydrophobicContact CB-CE1 3.6Å; C120-F136 HydrophobicContact CB-CE2 4.5Å; C120-F136 HydrophobicContact CB-CZ 3.74Å
121	S	86.2	Confident	84.2	Confident	46 Å²	46	53 Å²	53	32%	0.322	25%	0.246	S	C	.	.	H	α-helix	trans	-60.7	-35.8	178.7	75.3	0	0	0	0	113.2	I117 M118 F119 R125	I117-S121 WeakPolarHBondContact O-CB 3.17Å; I117-S121 PolarHBondContact O-N 3.47Å; I117-S121 PolarHBondContact O-OG 2.94Å; M118-S121 PolarHBondContact O-N 3.2Å; M118-S121 PolarHBondContact O-OG 3.47Å; F119-S121 VanDerWaalsContact C-N 3.34Å; F119-S121 PolarHBondContact O-N 3.13Å; S121-R125 PolarHBondContact O-N 2.71Å
122	I	85.9	Confident	84.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-74.1	-43.4	178.7	-69	163	0	0	0	110.3	M82 M86 L98 F102 M118 F119 C120 V124 R125 Q126	M82-I122 HydrophobicContact CB-CD1 4.26Å; M82-I122 HydrophobicContact CE-CD1 4.07Å; M82-I122 HydrophobicContact CE-CG1 3.8Å; M82-I122 HydrophobicContact CG-CD1 3.74Å; M82-I122 HydrophobicContact CG-CG1 4.16Å; M82-I122 HydrophobicContact SD-CD1 3.78Å; M82-I122 HydrophobicContact SD-CG1 4.19Å; M86-I122 HydrophobicContact CE-CG1 3.72Å; L98-I122 HydrophobicContact CD2-CD1 4.11Å; L98-I122 HydrophobicContact CD2-CG2 3.84Å; F102-I122 HydrophobicContact CD2-CD1 4.31Å; F102-I122 HydrophobicContact CE1-CD1 4.42Å; F102-I122 HydrophobicContact CE2-CD1 3.19Å; F102-I122 HydrophobicContact CZ-CD1 3.27Å; M118-I122 WeakPolarHBondContact O-CD1 3.46Å; M118-I122 WeakPolarHBondContact O-CG1 3.17Å; M118-I122 PolarHBondContact O-N 3.09Å; M118-I122 VanDerWaalsContact O-N 3.11Å; F119-I122 PolarHBondContact O-N 2.94Å; C120-I122 VanDerWaalsContact C-N 3.26Å; C120-I122 PolarHBondContact O-N 3.11Å; I122-V124 VanDerWaalsContact C-N 3.31Å; I122-V124 PolarHBondContact O-N 3.31Å; I122-R125 WeakPolarHBondContact O-CB 3.49Å; I122-R125 PolarHBondContact O-N 2.73Å; I122-R125 VanDerWaalsContact O-N 3.12Å; I122-Q126 WeakPolarHBondContact O-CG 3.25Å; I122-Q126 PolarHBondContact O-N 3.43Å
123	L	85	Confident	84.5	Confident	2 Å²	2	46 Å²	46	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-38	176.6	-69.6	176	0	0	0	111.8	F119 C120 R125 Q126 R127 T132 S135	F119-L123 HydrophobicContact CD1-CD1 3.98Å; F119-L123 HydrophobicContact CD2-CD1 4.07Å; F119-L123 HydrophobicContact CD2-CG 4.15Å; F119-L123 HydrophobicContact CE1-CD1 3.63Å; F119-L123 HydrophobicContact CE2-CD1 3.71Å; F119-L123 HydrophobicContact CE2-CD2 4.15Å; F119-L123 HydrophobicContact CE2-CG 3.91Å; F119-L123 HydrophobicContact CG-CD1 4.21Å; F119-L123 HydrophobicContact CZ-CD1 3.5Å; F119-L123 VanDerWaalsContact CZ-CD1 3.5Å; F119-L123 HydrophobicContact CZ-CD2 4.43Å; F119-L123 HydrophobicContact CZ-CG 4.2Å; F119-L123 WeakPolarHBondContact O-CG 3.45Å; F119-L123 PolarHBondContact O-N 3.34Å; C120-L123 PolarHBondContact O-N 2.88Å; L123-R125 VanDerWaalsContact C-N 3.26Å; L123-R125 PolarHBondContact O-N 3.36Å; L123-Q126 PolarHBondContact O-N 3.3Å; L123-Q126 VanDerWaalsContact O-N 3.15Å; L123-R127 PolarHBondContact O-N 3.11Å; L123-R127 VanDerWaalsContact O-N 3.16Å; L123-T132 HydrophobicContact CB-CG2 3.45Å; L123-T132 VanDerWaalsContact CB-CG2 3.45Å; L123-T132 WeakPolarHBondContact O-CG2 3.33Å; L123-S135 VanDerWaalsContact CD1-CB 3.49Å; L123-S135 WeakPolarHBondContact CD1-OG 3.48Å
124	V	84.4	Confident	84.7	Confident	30 Å²	30	53.2 Å²	53.2	18%	0.182	24%	0.236	C	C	.	.	H	α-helix	trans	-58.8	-40.7	172.9	171.6	0	0	0	0	110.4	C120 I122 R127 F136 F158 L161	C120-V124 WeakPolarHBondContact O-CB 3.2Å; C120-V124 WeakPolarHBondContact O-CG2 3.43Å; C120-V124 PolarHBondContact O-N 2.95Å; I122-V124 VanDerWaalsContact C-N 3.31Å; I122-V124 PolarHBondContact O-N 3.31Å; V124-R127 PolarHBondContact O-N 2.85Å; V124-F136 HydrophobicContact CG2-CE2 4.17Å; V124-F136 HydrophobicContact CG2-CZ 4.09Å; V124-F158 HydrophobicContact CB-CD2 4.45Å; V124-F158 HydrophobicContact CG1-CD2 4.38Å; V124-F158 HydrophobicContact CG2-CB 3.95Å; V124-F158 HydrophobicContact CG2-CD2 3.78Å; V124-F158 HydrophobicContact CG2-CG 4.17Å; V124-L161 HydrophobicContact CG1-CD1 3.66Å
125	R	83.7	Confident	84.8	Confident	130 Å²	130	47 Å²	47	49%	0.491	21%	0.213	S	C	.	.	H	α-helix	trans	-68.6	-36.7	175	-170.5	-179.9	-178.3	111.2	-5.5	113	M86 S121 I122 L123 R127	M86-R125 WeakPolarHBondContact SD-CD 3.36Å; M86-R125 PolarHBondContact SD-NE 3.21Å; M86-R125 VanDerWaalsContact SD-NE 3.43Å; S121-R125 PolarHBondContact O-N 2.71Å; I122-R125 WeakPolarHBondContact O-CB 3.49Å; I122-R125 PolarHBondContact O-N 2.73Å; I122-R125 VanDerWaalsContact O-N 3.12Å; L123-R125 VanDerWaalsContact C-N 3.26Å; L123-R125 PolarHBondContact O-N 3.36Å; R125-R127 PolarHBondContact O-N 3.11Å
126	Q	81.4	Confident	84.9	Confident	13 Å²	13	47 Å²	47	6%	0.061	21%	0.213	C	C	.	.	H	α-helix	trans	-68.9	-14.4	176.7	-70	174.1	17.1	0	0	113.2	I90 Y95 N99 I122 L123 L128	I90-Q126 HydrophobicContact CG2-CB 4.41Å; Y95-Q126 HydrophobicContact CD1-CG 3.75Å; Y95-Q126 HydrophobicContact CE1-CG 4.21Å; Y95-Q126 HydrophobicContact CG-CG 4.4Å; N99-Q126 PolarHBondContact ND2-NE2 2.91Å; N99-Q126 PolarHBondContact ND2-OE1 3.24Å; N99-Q126 PolarHBondContact OD1-NE2 3.01Å; I122-Q126 WeakPolarHBondContact O-CG 3.25Å; I122-Q126 PolarHBondContact O-N 3.43Å; L123-Q126 PolarHBondContact O-N 3.3Å; L123-Q126 VanDerWaalsContact O-N 3.15Å; Q126-L128 HydrophobicContact CB-CD1 4.3Å; Q126-L128 HydrophobicContact CB-CG 4.15Å; Q126-L128 PolarHBondContact O-N 3.39Å; Q126-L128 VanDerWaalsContact O-N 3.13Å
127	R	77.2	Confident	84.8	Confident	188 Å²	188	47.1 Å²	47.1	71%	0.709	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	57	22.7	-177.7	-60.7	-178.7	172.9	-178.1	-2.7	114.1	L123 V124 R125 V129	L123-R127 PolarHBondContact O-N 3.11Å; L123-R127 VanDerWaalsContact O-N 3.16Å; V124-R127 PolarHBondContact O-N 2.85Å; R125-R127 PolarHBondContact O-N 3.11Å; R127-V129 VanDerWaalsContact C-N 3.35Å; R127-V129 PolarHBondContact O-N 3.39Å
128	L	80	Confident	84.7	Confident	62 Å²	62	48.7 Å²	48.7	33%	0.325	22%	0.224	S	C	.	.			trans	-80.8	79.1	175.3	-67.8	176.8	0	0	0	110.7	Q126 T130 Q131 T132	Q126-L128 HydrophobicContact CB-CD1 4.3Å; Q126-L128 HydrophobicContact CB-CG 4.15Å; Q126-L128 PolarHBondContact O-N 3.39Å; Q126-L128 VanDerWaalsContact O-N 3.13Å; L128-T130 VanDerWaalsContact C-N 3.3Å; L128-T130 PolarHBondContact O-N 3.12Å; L128-T130 VanDerWaalsContact O-N 3.15Å; L128-Q131 HydrophobicContact CB-CB 4.07Å; L128-Q131 HydrophobicContact CB-CG 4.32Å; L128-Q131 PolarHBondContact O-N 3.47Å; L128-T132 WeakPolarHBondContact O-CG2 3.29Å; L128-T132 PolarHBondContact O-N 2.84Å; L128-T132 PolarHBondContact O-OG1 3.04Å; L128-T132 VanDerWaalsContact O-OG1 3.13Å
129	V	79.6	Confident	84.8	Confident	38 Å²	38	48.2 Å²	48.2	23%	0.23	22%	0.222	C	C	.	.	H	α-helix	trans	-50.6	-42.2	-171.3	179.7	0	0	0	0	114.4	R127 T132 R133 F158 I164	R127-V129 VanDerWaalsContact C-N 3.35Å; R127-V129 PolarHBondContact O-N 3.39Å; V129-T132 VanDerWaalsContact C-OG1 3.25Å; V129-T132 VanDerWaalsContact CA-OG1 3.3Å; V129-T132 WeakPolarHBondContact CA-OG1 3.33Å; V129-T132 PolarHBondContact O-OG1 3.14Å; V129-R133 WeakPolarHBondContact O-CB 3.43Å; V129-R133 PolarHBondContact O-N 3.08Å; V129-R133 VanDerWaalsContact O-N 3.14Å; V129-F158 HydrophobicContact CG1-CZ 4.25Å; V129-I164 HydrophobicContact CB-CD1 4.4Å; V129-I164 HydrophobicContact CG1-CD1 3.43Å; V129-I164 VanDerWaalsContact CG1-CD1 3.43Å; V129-I164 HydrophobicContact CG2-CD1 4.26Å
130	T	83.5	Confident	84.6	Confident	88 Å²	88	48.9 Å²	48.9	54%	0.54	23%	0.226	S	C	.	.	H	α-helix	trans	-74.1	-36.7	-177.2	53.2	0	0	0	0	111.9	L128 R134	L128-T130 VanDerWaalsContact C-N 3.3Å; L128-T130 PolarHBondContact O-N 3.12Å; L128-T130 VanDerWaalsContact O-N 3.15Å; T130-R134 WeakPolarHBondContact O-CG 3.16Å; T130-R134 PolarHBondContact O-N 2.86Å; T130-R134 VanDerWaalsContact O-N 3.13Å
131	Q	83.6	Confident	84.6	Confident	65 Å²	65	58 Å²	58	30%	0.304	26%	0.26	S	S	.	.	H	α-helix	trans	-76	-41.5	179.3	-60.8	-168.6	16.7	0	0	111.3	L128 R134 S135	L128-Q131 HydrophobicContact CB-CB 4.07Å; L128-Q131 HydrophobicContact CB-CG 4.32Å; L128-Q131 PolarHBondContact O-N 3.47Å; Q131-R134 PolarHBondContact O-N 3.43Å; Q131-S135 WeakPolarHBondContact O-CB 3.48Å; Q131-S135 PolarHBondContact O-N 3.5Å; Q131-S135 PolarHBondContact O-OG 3.45Å
132	T	84.4	Confident	84.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-56.1	-51.5	171.9	51.9	0	0	0	0	110.1	L123 L128 V129 R134 S135 F136 F158	L123-T132 HydrophobicContact CB-CG2 3.45Å; L123-T132 VanDerWaalsContact CB-CG2 3.45Å; L123-T132 WeakPolarHBondContact O-CG2 3.33Å; L128-T132 WeakPolarHBondContact O-CG2 3.29Å; L128-T132 PolarHBondContact O-N 2.84Å; L128-T132 PolarHBondContact O-OG1 3.04Å; L128-T132 VanDerWaalsContact O-OG1 3.13Å; V129-T132 VanDerWaalsContact C-OG1 3.25Å; V129-T132 VanDerWaalsContact CA-OG1 3.3Å; V129-T132 WeakPolarHBondContact CA-OG1 3.33Å; V129-T132 PolarHBondContact O-OG1 3.14Å; T132-R134 PolarHBondContact O-N 3.38Å; T132-S135 WeakPolarHBondContact CA-OG 3.42Å; T132-S135 PolarHBondContact O-N 3.4Å; T132-S135 VanDerWaalsContact O-N 3.15Å; T132-S135 PolarHBondContact O-OG 3.21Å; T132-F136 WeakPolarHBondContact O-CD2 3.41Å; T132-F136 PolarHBondContact O-N 3.4Å; T132-F158 HydrophobicContact CG2-CD2 4.38Å; T132-F158 HydrophobicContact CG2-CE2 3.82Å; T132-F158 HydrophobicContact CG2-CZ 4.31Å; T132-F158 WeakPolarHBondContact OG1-CE2 3.32Å; T132-F158 WeakPolarHBondContact OG1-CZ 3.25Å
133	R	86.3	Confident	84.5	Confident	81 Å²	81	57.9 Å²	57.9	31%	0.306	26%	0.258	S	S	.	.	H	α-helix	trans	-57.1	-48.1	178.6	-173.9	-177	69.4	120.4	-4.5	112.6	V129 S135 F136 D137	V129-R133 WeakPolarHBondContact O-CB 3.43Å; V129-R133 PolarHBondContact O-N 3.08Å; V129-R133 VanDerWaalsContact O-N 3.14Å; R133-S135 VanDerWaalsContact C-N 3.33Å; R133-S135 PolarHBondContact O-N 3.02Å; R133-F136 PolarHBondContact O-N 3.12Å; R133-D137 PolarHBondContact O-N 2.89Å
134	R	86.5	Confident	84.5	Confident	165 Å²	165	61 Å²	61	62%	0.623	28%	0.279	S	S	*	.	H	α-helix	trans	-61.4	-42.3	177.2	-74.7	177.7	-179.5	177	1.8	111.3	T130 Q131 T132 D137 D138	T130-R134 WeakPolarHBondContact O-CG 3.16Å; T130-R134 PolarHBondContact O-N 2.86Å; T130-R134 VanDerWaalsContact O-N 3.13Å; Q131-R134 PolarHBondContact O-N 3.43Å; T132-R134 PolarHBondContact O-N 3.38Å; R134-D137 PolarHBondContact O-N 2.91Å; R134-D138 WeakPolarHBondContact O-CB 3.47Å; R134-D138 PolarHBondContact O-N 2.92Å
135	S	87.9	Confident	84.3	Confident	5 Å²	5	62.3 Å²	62.3	4%	0.035	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-37.4	177.7	70.6	0	0	0	0	113.3	W116 L123 Q131 T132 R133 D138 A139	W116-S135 WeakPolarHBondContact CZ3-O 3.4Å; L123-S135 VanDerWaalsContact CD1-CB 3.49Å; L123-S135 WeakPolarHBondContact CD1-OG 3.48Å; Q131-S135 WeakPolarHBondContact O-CB 3.48Å; Q131-S135 PolarHBondContact O-N 3.5Å; Q131-S135 PolarHBondContact O-OG 3.45Å; T132-S135 WeakPolarHBondContact CA-OG 3.42Å; T132-S135 PolarHBondContact O-N 3.4Å; T132-S135 VanDerWaalsContact O-N 3.15Å; T132-S135 PolarHBondContact O-OG 3.21Å; R133-S135 VanDerWaalsContact C-N 3.33Å; R133-S135 PolarHBondContact O-N 3.02Å; S135-D138 PolarHBondContact O-N 3.3Å; S135-A139 VanDerWaalsContact O-CB 3.29Å; S135-A139 WeakPolarHBondContact O-CB 3.13Å; S135-A139 PolarHBondContact O-N 3.19Å
136	F	87.7	Confident	84.2	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66	-43	173.4	-79.9	-65.6	0	0	0	110.9	C120 V124 T132 R133 D138 A139 L140 I151 L154 Y155 F158	C120-F136 HydrophobicContact CB-CD1 4.27Å; C120-F136 HydrophobicContact CB-CE1 3.6Å; C120-F136 HydrophobicContact CB-CE2 4.5Å; C120-F136 HydrophobicContact CB-CZ 3.74Å; V124-F136 HydrophobicContact CG2-CE2 4.17Å; V124-F136 HydrophobicContact CG2-CZ 4.09Å; T132-F136 WeakPolarHBondContact O-CD2 3.41Å; T132-F136 PolarHBondContact O-N 3.4Å; R133-F136 PolarHBondContact O-N 3.12Å; F136-D138 PolarHBondContact O-N 3.22Å; F136-A139 WeakPolarHBondContact O-CB 3.35Å; F136-A139 PolarHBondContact O-N 2.91Å; F136-L140 WeakPolarHBondContact O-CG 3.27Å; F136-L140 PolarHBondContact O-N 3.38Å; F136-I151 HydrophobicContact CD1-CG2 3.71Å; F136-I151 HydrophobicContact CE1-CG2 4.13Å; F136-L154 HydrophobicContact CE1-CB 4.22Å; F136-L154 HydrophobicContact CZ-CB 4.5Å; F136-Y155 HydrophobicContact CB-CD1 4.37Å; F136-Y155 HydrophobicContact CB-CD2 3.88Å; F136-Y155 HydrophobicContact CB-CE1 4.15Å; F136-Y155 HydrophobicContact CB-CE2 3.68Å; F136-Y155 HydrophobicContact CB-CG 4.23Å; F136-Y155 AromaticContact CD1-CD2 3.93Å; F136-Y155 HydrophobicContact CD1-CD2 3.93Å; F136-Y155 HydrophobicContact CD1-CG 4.01Å; F136-Y155 AromaticContact CD2-CD2 3.34Å; F136-Y155 HydrophobicContact CD2-CD2 3.34Å; F136-Y155 AromaticContact CD2-CE2 3.5Å; F136-Y155 HydrophobicContact CD2-CE2 3.5Å; F136-Y155 HydrophobicContact CD2-CG 4.25Å; F136-Y155 HydrophobicContact CE1-CD2 4.25Å; F136-Y155 HydrophobicContact CE1-CG 4.39Å; F136-Y155 AromaticContact CE2-CD2 3.74Å; F136-Y155 HydrophobicContact CE2-CD2 3.74Å; F136-Y155 HydrophobicContact CE2-CE2 4.26Å; F136-Y155 AromaticContact CG-CD2 3.46Å; F136-Y155 HydrophobicContact CG-CD2 3.46Å; F136-Y155 VanDerWaalsContact CG-CD2 3.46Å; F136-Y155 AromaticContact CG-CE2 3.7Å; F136-Y155 HydrophobicContact CG-CE2 3.7Å; F136-Y155 AromaticContact CG-CG 3.93Å; F136-Y155 HydrophobicContact CG-CG 3.93Å; F136-Y155 HydrophobicContact CZ-CD2 4.17Å; F136-F158 HydrophobicContact CD2-CD1 4.35Å; F136-F158 HydrophobicContact CE2-CB 3.94Å; F136-F158 AromaticContact CE2-CD1 3.97Å; F136-F158 HydrophobicContact CE2-CD1 3.97Å; F136-F158 HydrophobicContact CE2-CD2 4.5Å; F136-F158 AromaticContact CE2-CG 3.86Å; F136-F158 HydrophobicContact CE2-CG 3.86Å; F136-F158 HydrophobicContact CZ-CB 4.19Å
137	D	87.2	Confident	84.3	Confident	19 Å²	19	63.3 Å²	63.3	10%	0.102	31%	0.311	C	S	.	.	H	α-helix	trans	-63.1	-40.2	175.6	-77	-1.6	0	0	0	111.7	R133 R134 L140 R141 Y155 R174	R133-D137 PolarHBondContact O-N 2.89Å; R134-D137 PolarHBondContact O-N 2.91Å; D137-L140 PolarHBondContact O-N 3.23Å; D137-R141 VanDerWaalsContact O-CG 3.32Å; D137-R141 WeakPolarHBondContact O-CG 3.42Å; D137-R141 PolarHBondContact O-N 3.48Å; D137-Y155 PolarHBondContact OD1-OH 3.04Å; D137-R174 IonicContact OD1-NH1 2.82Å; D137-R174 PolarHBondContact OD1-NH1 3.29Å; D137-R174 IonicContact OD2-CZ 3.94Å; D137-R174 IonicContact OD2-NH1 2.92Å; D137-R174 PolarHBondContact OD2-NH1 2.8Å
138	D	87.4	Confident	84.6	Confident	70 Å²	70	55.7 Å²	55.7	37%	0.374	28%	0.283	S	S	.	.	H	α-helix	trans	-70.4	-34.5	175.8	-66.8	-25.3	0	0	0	112.1	W116 R134 S135 F136 R141 S142	W116-D138 HydrophobicContact CH2-CB 3.81Å; W116-D138 HydrophobicContact CZ3-CB 4.31Å; R134-D138 WeakPolarHBondContact O-CB 3.47Å; R134-D138 PolarHBondContact O-N 2.92Å; S135-D138 PolarHBondContact O-N 3.3Å; F136-D138 PolarHBondContact O-N 3.22Å; D138-R141 PolarHBondContact O-N 2.86Å; D138-R141 IonicContact OD1-NH1 3.06Å; D138-R141 PolarHBondContact OD1-NH1 2.92Å; D138-S142 WeakPolarHBondContact O-CB 3.38Å; D138-S142 PolarHBondContact O-N 3.02Å; D138-S142 PolarHBondContact O-OG 3.45Å
139	A	88.4	Confident	84.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.7	-45.8	172.9	0	0	0	0	0	111.1	W116 S135 F136 R141 S142 L143 I151	W116-A139 HydrophobicContact CB-CB 4.34Å; W116-A139 HydrophobicContact CD2-CB 3.58Å; W116-A139 HydrophobicContact CE3-CB 3.42Å; W116-A139 VanDerWaalsContact CE3-CB 3.42Å; W116-A139 HydrophobicContact CG-CB 4.03Å; W116-A139 HydrophobicContact CH2-CB 4.41Å; W116-A139 HydrophobicContact CZ3-CB 3.86Å; S135-A139 VanDerWaalsContact O-CB 3.29Å; S135-A139 WeakPolarHBondContact O-CB 3.13Å; S135-A139 PolarHBondContact O-N 3.19Å; F136-A139 WeakPolarHBondContact O-CB 3.35Å; F136-A139 PolarHBondContact O-N 2.91Å; A139-R141 VanDerWaalsContact C-N 3.34Å; A139-R141 PolarHBondContact O-N 2.79Å; A139-S142 PolarHBondContact O-N 3.41Å; A139-S142 PolarHBondContact O-OG 3.31Å; A139-S142 VanDerWaalsContact O-OG 3.1Å; A139-L143 WeakPolarHBondContact O-CB 3.5Å; A139-L143 WeakPolarHBondContact O-CG 3.49Å; A139-L143 PolarHBondContact O-N 3.27Å; A139-I151 HydrophobicContact CB-CD1 3.99Å
140	L	85.4	Confident	84.8	Confident	24 Å²	24	63 Å²	63	13%	0.126	31%	0.31	C	S	.	.	H	α-helix	trans	-66.7	-33.3	177.5	-69.9	170.4	0	0	0	112.6	F136 D137 H148 I151 W152	F136-L140 WeakPolarHBondContact O-CG 3.27Å; F136-L140 PolarHBondContact O-N 3.38Å; D137-L140 PolarHBondContact O-N 3.23Å; L140-H148 HydrophobicContact CD2-CB 4.02Å; L140-H148 PolarHBondContact O-CE1 3.26Å; L140-H148 PolarHBondContact O-NE2 3.12Å; L140-I151 HydrophobicContact CD2-CB 4.48Å; L140-I151 HydrophobicContact CD2-CD1 4.09Å; L140-W152 HydrophobicContact CD1-CH2 3.9Å; L140-W152 HydrophobicContact CD1-CZ2 3.88Å; L140-W152 HydrophobicContact CD1-CZ3 4.45Å; L140-W152 HydrophobicContact CD2-CZ2 4.15Å
141	R	85.8	Confident	84.9	Confident	193 Å²	193	59 Å²	59	73%	0.728	29%	0.285	S	S	*	.	H	α-helix	trans	-70.7	-35.2	174.3	-74.7	172.8	-176.3	157	-5.4	113.4	D137 D138 A139	D137-R141 VanDerWaalsContact O-CG 3.32Å; D137-R141 WeakPolarHBondContact O-CG 3.42Å; D137-R141 PolarHBondContact O-N 3.48Å; D138-R141 PolarHBondContact O-N 2.86Å; D138-R141 IonicContact OD1-NH1 3.06Å; D138-R141 PolarHBondContact OD1-NH1 2.92Å; A139-R141 VanDerWaalsContact C-N 3.34Å; A139-R141 PolarHBondContact O-N 2.79Å
142	S	84.8	Confident	85	Confident	35 Å²	35	56.3 Å²	56.3	25%	0.245	27%	0.272	C	S	.	.	H	α-helix	trans	-87	-29.4	-173.9	57.5	0	0	0	0	113.5	W116 D138 A139	W116-S142 VanDerWaalsContact CE2-OG 3.26Å; W116-S142 WeakPolarHBondContact CZ2-OG 3.15Å; W116-S142 PolarHBondContact NE1-OG 3.15Å; D138-S142 WeakPolarHBondContact O-CB 3.38Å; D138-S142 PolarHBondContact O-N 3.02Å; D138-S142 PolarHBondContact O-OG 3.45Å; A139-S142 PolarHBondContact O-N 3.41Å; A139-S142 PolarHBondContact O-OG 3.31Å; A139-S142 VanDerWaalsContact O-OG 3.1Å
143	L	84.8	Confident	85	Confident	7 Å²	7	59.4 Å²	59.4	4%	0.037	29%	0.292	C	S	.	.	S	Bend	trans	-91.9	142.3	-177	-65.7	169.7	0	0	0	111.7	P113 W116 A139 Q147 H148 I151	P113-L143 HydrophobicContact CB-CD1 4.46Å; P113-L143 HydrophobicContact CG-CD2 4.03Å; W116-L143 HydrophobicContact CB-CD1 4.23Å; W116-L143 HydrophobicContact CG-CD1 4.01Å; A139-L143 WeakPolarHBondContact O-CB 3.5Å; A139-L143 WeakPolarHBondContact O-CG 3.49Å; A139-L143 PolarHBondContact O-N 3.27Å; L143-Q147 HydrophobicContact CB-CB 4.48Å; L143-H148 PolarHBondContact O-NE2 3.35Å; L143-I151 HydrophobicContact CB-CD1 4.43Å; L143-I151 HydrophobicContact CD1-CD1 3.3Å; L143-I151 HydrophobicContact CD1-CG1 4.11Å; L143-I151 HydrophobicContact CG-CD1 4.42Å
144	P	84.3	Confident	84.8	Confident	67 Å²	67	57.9 Å²	57.9	44%	0.435	29%	0.29	S	S	.	.			trans	-57.2	149	170.9	-23.3	33.2	0	0	0	112.2	T146 Q147 H148	P144-T146 PolarHBondContact O-N 2.86Å; P144-T146 VanDerWaalsContact O-N 3.09Å; P144-Q147 PolarHBondContact O-N 3.08Å; P144-H148 PolarHBondContact O-CD2 3.3Å; P144-H148 VanDerWaalsContact O-CD2 3.24Å
145	A	79.7	Confident	84.6	Confident	58 Å²	58	50.1 Å²	50.1	48%	0.479	26%	0.261	S	S	.	.	H	α-helix	trans	-53	-34.8	-179.2	0	0	0	0	0	113.2	Q147 H148 F178	A145-Q147 PolarHBondContact O-N 3.46Å; A145-Q147 VanDerWaalsContact O-N 3.08Å; A145-H148 WeakPolarHBondContact O-CB 3.32Å; A145-H148 PolarHBondContact O-N 3.47Å; A145-H148 VanDerWaalsContact O-N 3.09Å; A145-F178 HydrophobicContact CB-CE2 4.32Å; A145-F178 VanDerWaalsContact O-CE2 3.24Å; A145-F178 WeakPolarHBondContact O-CE2 3.23Å
146	T	83.2	Confident	84.3	Confident	115 Å²	115	51.6 Å²	51.6	71%	0.706	27%	0.268	S	S	*	.	H	α-helix	trans	-59.3	-22.8	177	58.3	0	0	0	0	113.9	P144	P144-T146 PolarHBondContact O-N 2.86Å; P144-T146 VanDerWaalsContact O-N 3.09Å
147	Q	82	Confident	84	Confident	49 Å²	49	58.6 Å²	58.6	23%	0.229	30%	0.298	C	S	.	.	H	α-helix	trans	-100.6	-7	-177.9	-61.8	179.6	-10.1	0	0	113	P113 L143 P144 A145 N149 R150	P113-Q147 HydrophobicContact CG-CB 4.17Å; P113-Q147 HydrophobicContact CG-CG 4.19Å; L143-Q147 HydrophobicContact CB-CB 4.48Å; P144-Q147 PolarHBondContact O-N 3.08Å; A145-Q147 PolarHBondContact O-N 3.46Å; A145-Q147 VanDerWaalsContact O-N 3.08Å; Q147-N149 PolarHBondContact O-N 3.16Å; Q147-R150 PolarHBondContact O-N 3.15Å
148	H	84.4	Confident	83.6	Confident	28 Å²	28	58 Å²	58	13%	0.13	30%	0.295	C	S	.	.	H	α-helix	trans	-59.9	-31.7	179.2	-69.6	-171.3	0	0	0	111.5	L140 L143 P144 A145 R150 I151 W152 F178	L140-H148 HydrophobicContact CD2-CB 4.02Å; L140-H148 PolarHBondContact O-CE1 3.26Å; L140-H148 PolarHBondContact O-NE2 3.12Å; L143-H148 PolarHBondContact O-NE2 3.35Å; P144-H148 PolarHBondContact O-CD2 3.3Å; P144-H148 VanDerWaalsContact O-CD2 3.24Å; A145-H148 WeakPolarHBondContact O-CB 3.32Å; A145-H148 PolarHBondContact O-N 3.47Å; A145-H148 VanDerWaalsContact O-N 3.09Å; H148-R150 PolarHBondContact O-N 2.9Å; H148-I151 PolarHBondContact O-N 3.4Å; H148-W152 VanDerWaalsContact C-CD1 3.46Å; H148-W152 PolarHBondContact O-N 2.84Å; H148-F178 HydrophobicContact CB-CD2 4.33Å; H148-F178 HydrophobicContact CB-CE2 4.02Å; H148-F178 HydrophobicContact CB-CZ 4.31Å
149	N	81.9	Confident	83	Confident	95 Å²	95	55 Å²	55	51%	0.508	28%	0.279	S	S	.	.	H	α-helix	trans	-51.5	-27.1	172.4	-73.4	-9.4	0	0	0	114.7	Q147 P153 F178	Q147-N149 PolarHBondContact O-N 3.16Å; N149-P153 WeakPolarHBondContact O-CD 3.47Å; N149-P153 VanDerWaalsContact O-CG 3.31Å; N149-P153 WeakPolarHBondContact O-CG 3.46Å; N149-F178 WeakPolarHBondContact OD1-CE1 3.46Å; N149-F178 VanDerWaalsContact OD1-CZ 3.27Å; N149-F178 WeakPolarHBondContact OD1-CZ 3.46Å
150	R	81.9	Confident	82.4	Confident	159 Å²	159	58.2 Å²	58.2	60%	0.6	31%	0.312	S	S	*	.	H	α-helix	trans	-84.1	-23	179.7	-61.7	-178.2	174.5	179.6	-1.8	112.8	I117 Q147 H148	I117-R150 HydrophobicContact CD1-CB 4.28Å; Q147-R150 PolarHBondContact O-N 3.15Å; H148-R150 PolarHBondContact O-N 2.9Å
151	I	85.4	Confident	81.9	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-93.3	-42.3	-176.2	-52.3	170	0	0	0	110	F136 A139 L140 L143 H148 L154 Y155	F136-I151 HydrophobicContact CD1-CG2 3.71Å; F136-I151 HydrophobicContact CE1-CG2 4.13Å; A139-I151 HydrophobicContact CB-CD1 3.99Å; L140-I151 HydrophobicContact CD2-CB 4.48Å; L140-I151 HydrophobicContact CD2-CD1 4.09Å; L143-I151 HydrophobicContact CB-CD1 4.43Å; L143-I151 HydrophobicContact CD1-CD1 3.3Å; L143-I151 HydrophobicContact CD1-CG1 4.11Å; L143-I151 HydrophobicContact CG-CD1 4.42Å; H148-I151 PolarHBondContact O-N 3.4Å; I151-L154 WeakPolarHBondContact O-CA 3.32Å; I151-L154 WeakPolarHBondContact O-CB 3.46Å; I151-L154 PolarHBondContact O-N 3.12Å; I151-Y155 PolarHBondContact O-N 3.21Å
152	W	85.4	Confident	81.1	Confident	8 Å²	8	55.3 Å²	55.3	3%	0.03	31%	0.309	C	S	.	.	H	α-helix	trans	-52.7	-44.4	-177.4	-73.8	125.5	0	0	0	114	L140 H148 L154 Y155 L156 V171 R174 Y175 F178	L140-W152 HydrophobicContact CD1-CH2 3.9Å; L140-W152 HydrophobicContact CD1-CZ2 3.88Å; L140-W152 HydrophobicContact CD1-CZ3 4.45Å; L140-W152 HydrophobicContact CD2-CZ2 4.15Å; H148-W152 VanDerWaalsContact C-CD1 3.46Å; H148-W152 PolarHBondContact O-N 2.84Å; W152-L154 VanDerWaalsContact C-N 3.28Å; W152-L154 PolarHBondContact O-N 3.35Å; W152-Y155 AromaticContact CE3-CD1 3.82Å; W152-Y155 HydrophobicContact CE3-CD1 3.82Å; W152-Y155 AromaticContact CZ3-CD1 3.61Å; W152-Y155 HydrophobicContact CZ3-CD1 3.61Å; W152-Y155 HydrophobicContact CZ3-CE1 4.1Å; W152-Y155 CarbonylContact O-C 3.58Å; W152-Y155 WeakPolarHBondContact O-CA 3.33Å; W152-Y155 PolarHBondContact O-N 3.42Å; W152-L156 WeakPolarHBondContact O-CG 3.03Å; W152-L156 PolarHBondContact O-N 3Å; W152-V171 HydrophobicContact CZ3-CG1 3.82Å; W152-R174 HydrophobicContact CH2-CB 3.96Å; W152-Y175 HydrophobicContact CB-CD2 4.01Å; W152-Y175 HydrophobicContact CB-CE2 3.62Å; W152-Y175 AromaticContact CD1-CD2 3.91Å; W152-Y175 AromaticContact CD1-CE2 3.83Å; W152-Y175 AromaticContact CD2-CD2 3.35Å; W152-Y175 HydrophobicContact CD2-CD2 3.35Å; W152-Y175 AromaticContact CD2-CE2 3.9Å; W152-Y175 HydrophobicContact CD2-CE2 3.9Å; W152-Y175 HydrophobicContact CD2-CG 4.37Å; W152-Y175 AromaticContact CE2-CD2 3.74Å; W152-Y175 AromaticContact CE3-CD2 3.54Å; W152-Y175 HydrophobicContact CE3-CD2 3.54Å; W152-Y175 HydrophobicContact CE3-CE2 4.33Å; W152-Y175 HydrophobicContact CE3-CG 4.17Å; W152-Y175 AromaticContact CG-CD2 3.54Å; W152-Y175 HydrophobicContact CG-CD2 3.54Å; W152-Y175 AromaticContact CG-CE2 3.54Å; W152-Y175 HydrophobicContact CG-CE2 3.54Å; W152-Y175 HydrophobicContact CH2-CD2 4.46Å; W152-Y175 HydrophobicContact CZ2-CD2 4.31Å; W152-Y175 HydrophobicContact CZ3-CD2 4.08Å; W152-Y175 HydrophobicContact CZ3-CG 4.38Å; W152-F178 AromaticContact NE1-CG 3.96Å
153	P	83.9	Confident	80.2	Confident	65 Å²	65	59.3 Å²	59.3	42%	0.422	34%	0.338	S	S	.	.	H	α-helix	trans	-61.7	-35.1	176.7	-25	34.7	0	0	0	113.3	N149 K157	N149-P153 WeakPolarHBondContact O-CD 3.47Å; N149-P153 VanDerWaalsContact O-CG 3.31Å; N149-P153 WeakPolarHBondContact O-CG 3.46Å; P153-K157 WeakPolarHBondContact O-CB 3.11Å; P153-K157 WeakPolarHBondContact O-CG 3.27Å; P153-K157 PolarHBondContact O-N 2.9Å; P153-K157 VanDerWaalsContact O-N 3.07Å
154	L	82.2	Confident	79.7	Confident	50 Å²	50	62.1 Å²	62.1	26%	0.262	35%	0.352	S	S	.	.	H	α-helix	trans	-73.3	-34.5	175.3	-63.7	174.3	0	0	0	111.2	I117 F136 I151 W152 F158	I117-L154 HydrophobicContact CB-CD1 4.06Å; I117-L154 HydrophobicContact CG1-CD1 3.82Å; I117-L154 HydrophobicContact CG2-CD1 3.66Å; F136-L154 HydrophobicContact CE1-CB 4.22Å; F136-L154 HydrophobicContact CZ-CB 4.5Å; I151-L154 WeakPolarHBondContact O-CA 3.32Å; I151-L154 WeakPolarHBondContact O-CB 3.46Å; I151-L154 PolarHBondContact O-N 3.12Å; W152-L154 VanDerWaalsContact C-N 3.28Å; W152-L154 PolarHBondContact O-N 3.35Å; L154-F158 WeakPolarHBondContact O-CB 2.87Å; L154-F158 PolarHBondContact O-N 2.9Å
155	Y	83.9	Confident	79.2	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.008	35%	0.346	C	S	.	.	H	α-helix	trans	-70.2	-44.8	177.6	-160.3	-162.2	0	0	0	111.1	F136 D137 I151 W152 K157 F158 L159 V171	F136-Y155 HydrophobicContact CB-CD1 4.37Å; F136-Y155 HydrophobicContact CB-CD2 3.88Å; F136-Y155 HydrophobicContact CB-CE1 4.15Å; F136-Y155 HydrophobicContact CB-CE2 3.68Å; F136-Y155 HydrophobicContact CB-CG 4.23Å; F136-Y155 AromaticContact CD1-CD2 3.93Å; F136-Y155 HydrophobicContact CD1-CD2 3.93Å; F136-Y155 HydrophobicContact CD1-CG 4.01Å; F136-Y155 AromaticContact CD2-CD2 3.34Å; F136-Y155 HydrophobicContact CD2-CD2 3.34Å; F136-Y155 AromaticContact CD2-CE2 3.5Å; F136-Y155 HydrophobicContact CD2-CE2 3.5Å; F136-Y155 HydrophobicContact CD2-CG 4.25Å; F136-Y155 HydrophobicContact CE1-CD2 4.25Å; F136-Y155 HydrophobicContact CE1-CG 4.39Å; F136-Y155 AromaticContact CE2-CD2 3.74Å; F136-Y155 HydrophobicContact CE2-CD2 3.74Å; F136-Y155 HydrophobicContact CE2-CE2 4.26Å; F136-Y155 AromaticContact CG-CD2 3.46Å; F136-Y155 HydrophobicContact CG-CD2 3.46Å; F136-Y155 VanDerWaalsContact CG-CD2 3.46Å; F136-Y155 AromaticContact CG-CE2 3.7Å; F136-Y155 HydrophobicContact CG-CE2 3.7Å; F136-Y155 AromaticContact CG-CG 3.93Å; F136-Y155 HydrophobicContact CG-CG 3.93Å; F136-Y155 HydrophobicContact CZ-CD2 4.17Å; D137-Y155 PolarHBondContact OD1-OH 3.04Å; I151-Y155 PolarHBondContact O-N 3.21Å; W152-Y155 AromaticContact CE3-CD1 3.82Å; W152-Y155 HydrophobicContact CE3-CD1 3.82Å; W152-Y155 AromaticContact CZ3-CD1 3.61Å; W152-Y155 HydrophobicContact CZ3-CD1 3.61Å; W152-Y155 HydrophobicContact CZ3-CE1 4.1Å; W152-Y155 CarbonylContact O-C 3.58Å; W152-Y155 WeakPolarHBondContact O-CA 3.33Å; W152-Y155 PolarHBondContact O-N 3.42Å; Y155-K157 PolarHBondContact O-N 2.87Å; Y155-F158 AromaticContact CD2-CD1 3.95Å; Y155-F158 HydrophobicContact CD2-CD1 3.95Å; Y155-F158 HydrophobicContact CE2-CD1 4.02Å; Y155-F158 HydrophobicContact CE2-CE1 4.42Å; Y155-F158 WeakPolarHBondContact O-CA 3.24Å; Y155-F158 VanDerWaalsContact O-CB 3.32Å; Y155-F158 WeakPolarHBondContact O-CB 3.36Å; Y155-F158 PolarHBondContact O-N 3.29Å; Y155-F158 VanDerWaalsContact O-N 3.08Å; Y155-L159 VanDerWaalsContact O-CG 3.29Å; Y155-L159 WeakPolarHBondContact O-CG 3.43Å; Y155-L159 PolarHBondContact O-N 3.25Å; Y155-V171 HydrophobicContact CD1-CG1 3.4Å; Y155-V171 VanDerWaalsContact CD1-CG1 3.4Å; Y155-V171 HydrophobicContact CE1-CB 4.04Å; Y155-V171 HydrophobicContact CE1-CG1 3.17Å; Y155-V171 HydrophobicContact CE1-CG2 3.59Å; Y155-V171 HydrophobicContact CE2-CG1 4.4Å; Y155-V171 HydrophobicContact CE2-CG2 4.23Å; Y155-V171 HydrophobicContact CG-CG1 4.15Å; Y155-V171 WeakPolarHBondContact OH-CG2 3.3Å
156	L	80.1	Confident	79.2	Confident	35 Å²	35	63.9 Å²	63.9	18%	0.183	35%	0.348	C	S	.	.	H	α-helix	trans	-61.3	-42.1	173.7	-66.8	177.6	0	0	0	111.9	W152 F158 L159 G160 Y172 Y175	W152-L156 WeakPolarHBondContact O-CG 3.03Å; W152-L156 PolarHBondContact O-N 3Å; L156-F158 VanDerWaalsContact C-N 3.29Å; L156-F158 PolarHBondContact O-N 2.99Å; L156-L159 HydrophobicContact CD2-CD1 4.07Å; L156-L159 WeakPolarHBondContact O-CB 3.48Å; L156-L159 PolarHBondContact O-N 3.29Å; L156-L159 VanDerWaalsContact O-N 3.15Å; L156-G160 PolarHBondContact O-N 2.97Å; L156-Y172 HydrophobicContact CD2-CD1 4.06Å; L156-Y172 HydrophobicContact CD2-CE1 3.44Å; L156-Y172 VanDerWaalsContact CD2-CE1 3.44Å; L156-Y172 HydrophobicContact CD2-CE2 4.36Å; L156-Y175 HydrophobicContact CD1-CE1 4.3Å
157	K	81.3	Confident	78.9	Confident	148 Å²	148	59.9 Å²	59.9	64%	0.643	32%	0.323	S	S	*	.	H	α-helix	trans	-59.4	-39.8	171.7	-77.3	175.4	-176.4	-175.7	0	112.2	P153 Y155 G160 L161	P153-K157 WeakPolarHBondContact O-CB 3.11Å; P153-K157 WeakPolarHBondContact O-CG 3.27Å; P153-K157 PolarHBondContact O-N 2.9Å; P153-K157 VanDerWaalsContact O-N 3.07Å; Y155-K157 PolarHBondContact O-N 2.87Å; K157-G160 PolarHBondContact O-N 3.32Å; K157-L161 WeakPolarHBondContact O-CG 3.33Å; K157-L161 PolarHBondContact O-N 2.89Å
158	F	80.3	Confident	78.8	Confident	6 Å²	6	57.6 Å²	57.6	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-65.1	-39.1	175.2	167.9	-102.4	0	0	0	112.2	V124 V129 T132 F136 L154 Y155 L156 G160 L161 H162	V124-F158 HydrophobicContact CB-CD2 4.45Å; V124-F158 HydrophobicContact CG1-CD2 4.38Å; V124-F158 HydrophobicContact CG2-CB 3.95Å; V124-F158 HydrophobicContact CG2-CD2 3.78Å; V124-F158 HydrophobicContact CG2-CG 4.17Å; V129-F158 HydrophobicContact CG1-CZ 4.25Å; T132-F158 HydrophobicContact CG2-CD2 4.38Å; T132-F158 HydrophobicContact CG2-CE2 3.82Å; T132-F158 HydrophobicContact CG2-CZ 4.31Å; T132-F158 WeakPolarHBondContact OG1-CE2 3.32Å; T132-F158 WeakPolarHBondContact OG1-CZ 3.25Å; F136-F158 HydrophobicContact CD2-CD1 4.35Å; F136-F158 HydrophobicContact CE2-CB 3.94Å; F136-F158 AromaticContact CE2-CD1 3.97Å; F136-F158 HydrophobicContact CE2-CD1 3.97Å; F136-F158 HydrophobicContact CE2-CD2 4.5Å; F136-F158 AromaticContact CE2-CG 3.86Å; F136-F158 HydrophobicContact CE2-CG 3.86Å; F136-F158 HydrophobicContact CZ-CB 4.19Å; L154-F158 WeakPolarHBondContact O-CB 2.87Å; L154-F158 PolarHBondContact O-N 2.9Å; Y155-F158 AromaticContact CD2-CD1 3.95Å; Y155-F158 HydrophobicContact CD2-CD1 3.95Å; Y155-F158 HydrophobicContact CE2-CD1 4.02Å; Y155-F158 HydrophobicContact CE2-CE1 4.42Å; Y155-F158 WeakPolarHBondContact O-CA 3.24Å; Y155-F158 VanDerWaalsContact O-CB 3.32Å; Y155-F158 WeakPolarHBondContact O-CB 3.36Å; Y155-F158 PolarHBondContact O-N 3.29Å; Y155-F158 VanDerWaalsContact O-N 3.08Å; L156-F158 VanDerWaalsContact C-N 3.29Å; L156-F158 PolarHBondContact O-N 2.99Å; F158-G160 VanDerWaalsContact C-N 3.35Å; F158-L161 PolarHBondContact O-N 3.26Å; F158-H162 AromaticContact CD2-CD2 3.79Å; F158-H162 AromaticContact CD2-NE2 3.97Å; F158-H162 AromaticContact CE2-CD2 3.25Å; F158-H162 WeakPolarHBondContact CE2-CD2 3.29Å; F158-H162 AromaticContact CE2-NE2 3.36Å; F158-H162 WeakPolarHBondContact CE2-NE2 3.5Å; F158-H162 AromaticContact CZ-CD2 3.64Å
159	L	74.9	Confident	78.7	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-66.3	-36	176.6	-63	170.4	0	0	0	112.2	Y155 L156 L161 H162 T168 V171 Y172	Y155-L159 VanDerWaalsContact O-CG 3.29Å; Y155-L159 WeakPolarHBondContact O-CG 3.43Å; Y155-L159 PolarHBondContact O-N 3.25Å; L156-L159 HydrophobicContact CD2-CD1 4.07Å; L156-L159 WeakPolarHBondContact O-CB 3.48Å; L156-L159 PolarHBondContact O-N 3.29Å; L156-L159 VanDerWaalsContact O-N 3.15Å; L159-L161 PolarHBondContact O-N 3.11Å; L159-H162 PolarHBondContact O-N 2.96Å; L159-T168 HydrophobicContact CB-CG2 3.69Å; L159-T168 HydrophobicContact CD1-CG2 3.77Å; L159-T168 HydrophobicContact CD2-CG2 4.16Å; L159-T168 HydrophobicContact CG-CG2 4.03Å; L159-V171 HydrophobicContact CD1-CB 3.81Å; L159-V171 HydrophobicContact CD1-CG1 3.4Å; L159-V171 HydrophobicContact CD2-CB 4.35Å; L159-V171 HydrophobicContact CD2-CG1 4.49Å; L159-V171 HydrophobicContact CD2-CG2 4.35Å; L159-V171 HydrophobicContact CG-CG1 4.41Å; L159-Y172 HydrophobicContact CD1-CE2 4.43Å
160	G	74.6	Confident	78.6	Confident	69 Å²	69	59 Å²	59	71%	0.711	31%	0.31	S	S	*	.	H	α-helix	trans	-66.6	-20.1	175.4	0	0	0	0	0	114.5	L156 K157 F158	L156-G160 PolarHBondContact O-N 2.97Å; K157-G160 PolarHBondContact O-N 3.32Å; F158-G160 VanDerWaalsContact C-N 3.35Å
161	L	76.1	Confident	78.6	Confident	116 Å²	116	51.6 Å²	51.6	61%	0.607	28%	0.283	S	S	*	.	H	α-helix	trans	-83.9	-18.9	180	-69.2	170.6	0	0	0	113.7	V124 K157 F158 L159	V124-L161 HydrophobicContact CG1-CD1 3.66Å; K157-L161 WeakPolarHBondContact O-CG 3.33Å; K157-L161 PolarHBondContact O-N 2.89Å; F158-L161 PolarHBondContact O-N 3.26Å; L159-L161 PolarHBondContact O-N 3.11Å
162	H	67.3	Low	78.3	Confident	39 Å²	39	52.8 Å²	52.8	18%	0.181	29%	0.287	C	S	.	.	S	Bend	trans	-126.7	130.6	-174.2	-62.3	-61.8	0	0	0	111.1	F158 L159 I164	F158-H162 AromaticContact CD2-CD2 3.79Å; F158-H162 AromaticContact CD2-NE2 3.97Å; F158-H162 AromaticContact CE2-CD2 3.25Å; F158-H162 WeakPolarHBondContact CE2-CD2 3.29Å; F158-H162 AromaticContact CE2-NE2 3.36Å; F158-H162 WeakPolarHBondContact CE2-NE2 3.5Å; F158-H162 AromaticContact CZ-CD2 3.64Å; L159-H162 PolarHBondContact O-N 2.96Å; H162-I164 HydrophobicContact CB-CD1 4.45Å; H162-I164 HydrophobicContact CB-CG1 4.41Å; H162-I164 PolarHBondContact O-N 3.13Å
163	S	66.2	Low	78.1	Confident	120 Å²	120	57.2 Å²	57.2	84%	0.839	30%	0.304	S	S	*	.			trans	-74.3	29.1	-179.4	53	0	0	0	0	114.6	T165	S163-T165 PolarHBondContact O-N 3.03Å
164	I	74.2	Confident	77.9	Confident	66 Å²	66	59.7 Å²	59.7	34%	0.338	31%	0.305	S	S	.	.			trans	-92.2	92.1	-176.2	-53	170.9	0	0	0	109.6	V129 H162 E166 T167 T168	V129-I164 HydrophobicContact CB-CD1 4.4Å; V129-I164 HydrophobicContact CG1-CD1 3.43Å; V129-I164 VanDerWaalsContact CG1-CD1 3.43Å; V129-I164 HydrophobicContact CG2-CD1 4.26Å; H162-I164 HydrophobicContact CB-CD1 4.45Å; H162-I164 HydrophobicContact CB-CG1 4.41Å; H162-I164 PolarHBondContact O-N 3.13Å; I164-E166 PolarHBondContact O-N 3.5Å; I164-T167 VanDerWaalsContact CB-OG1 3.29Å; I164-T167 WeakPolarHBondContact CB-OG1 3.11Å; I164-T167 HydrophobicContact CG2-CG2 3.88Å; I164-T167 WeakPolarHBondContact CG2-OG1 3.4Å; I164-T167 PolarHBondContact O-N 3.11Å; I164-T167 PolarHBondContact O-OG1 3.28Å; I164-T168 PolarHBondContact O-N 3.23Å; I164-T168 PolarHBondContact O-OG1 2.92Å
165	T	74.6	Confident	77.9	Confident	50 Å²	50	58.3 Å²	58.3	31%	0.307	30%	0.296	S	S	.	.	H	α-helix	trans	-58.3	-45.7	-174.1	57.5	0	0	0	0	113.1	S163 T168 V169 I193	S163-T165 PolarHBondContact O-N 3.03Å; T165-T168 PolarHBondContact O-N 3.03Å; T165-V169 WeakPolarHBondContact O-CB 3.11Å; T165-V169 VanDerWaalsContact O-CG2 3.26Å; T165-V169 WeakPolarHBondContact O-CG2 3.22Å; T165-V169 PolarHBondContact O-N 2.81Å; T165-I193 HydrophobicContact CG2-CD1 4.41Å; T165-I193 HydrophobicContact CG2-CG1 4.36Å; T165-I193 HydrophobicContact CG2-CG2 3.49Å; T165-I193 VanDerWaalsContact CG2-CG2 3.49Å
166	E	78.4	Confident	77.5	Confident	111 Å²	111	59.4 Å²	59.4	52%	0.519	30%	0.302	S	S	.	.	H	α-helix	trans	-67.9	-39.8	-176	-65.6	-166.3	168.2	0	0	114	I164 T168 R170	I164-E166 PolarHBondContact O-N 3.5Å; E166-T168 VanDerWaalsContact C-N 3.31Å; E166-R170 WeakPolarHBondContact O-CB 3.29Å; E166-R170 VanDerWaalsContact O-CG 3.28Å; E166-R170 WeakPolarHBondContact O-CG 3.34Å; E166-R170 PolarHBondContact O-N 3.43Å
167	T	77.9	Confident	77.5	Confident	32 Å²	32	66.7 Å²	66.7	20%	0.196	33%	0.332	C	S	.	.	H	α-helix	trans	-66.4	-42	177.1	47.5	0	0	0	0	109.9	I164 R170 V171	I164-T167 VanDerWaalsContact CB-OG1 3.29Å; I164-T167 WeakPolarHBondContact CB-OG1 3.11Å; I164-T167 HydrophobicContact CG2-CG2 3.88Å; I164-T167 WeakPolarHBondContact CG2-OG1 3.4Å; I164-T167 PolarHBondContact O-N 3.11Å; I164-T167 PolarHBondContact O-OG1 3.28Å; T167-R170 PolarHBondContact O-N 2.85Å; T167-V171 WeakPolarHBondContact O-CB 3.42Å; T167-V171 WeakPolarHBondContact O-CG2 3.29Å; T167-V171 PolarHBondContact O-N 3.28Å
168	T	79.8	Confident	77.2	Confident	1 Å²	1	63 Å²	63	1%	0.006	32%	0.316	C	S	.	.	H	α-helix	trans	-66	-45	-179.4	-51	0	0	0	0	111.4	L159 I164 T165 E166 R170 V171 Y172 Y189	L159-T168 HydrophobicContact CB-CG2 3.69Å; L159-T168 HydrophobicContact CD1-CG2 3.77Å; L159-T168 HydrophobicContact CD2-CG2 4.16Å; L159-T168 HydrophobicContact CG-CG2 4.03Å; I164-T168 PolarHBondContact O-N 3.23Å; I164-T168 PolarHBondContact O-OG1 2.92Å; T165-T168 PolarHBondContact O-N 3.03Å; E166-T168 VanDerWaalsContact C-N 3.31Å; T168-R170 PolarHBondContact O-N 2.69Å; T168-V171 PolarHBondContact O-N 2.86Å; T168-V171 VanDerWaalsContact O-N 3.17Å; T168-Y172 HydrophobicContact CG2-CD2 3.49Å; T168-Y172 VanDerWaalsContact CG2-CD2 3.49Å; T168-Y172 HydrophobicContact CG2-CE2 3.31Å; T168-Y172 VanDerWaalsContact O-CD2 3.25Å; T168-Y172 WeakPolarHBondContact O-CD2 3.25Å; T168-Y172 PolarHBondContact O-N 3.46Å; T168-Y189 WeakPolarHBondContact CB-OH 3.31Å; T168-Y189 HydrophobicContact CG2-CD1 4.05Å; T168-Y189 HydrophobicContact CG2-CE1 3.17Å; T168-Y189 HydrophobicContact CG2-CE2 4.03Å; T168-Y189 WeakPolarHBondContact CG2-OH 3.36Å; T168-Y189 PolarHBondContact OG1-OH 3.5Å
169	V	81.5	Confident	76.9	Confident	4 Å²	4	63.3 Å²	63.3	2%	0.024	32%	0.32	C	S	.	.	H	α-helix	trans	-56.2	-48.4	172.9	165.1	0	0	0	0	111.7	T165 V171 Y172 R173 L190	T165-V169 WeakPolarHBondContact O-CB 3.11Å; T165-V169 VanDerWaalsContact O-CG2 3.26Å; T165-V169 WeakPolarHBondContact O-CG2 3.22Å; T165-V169 PolarHBondContact O-N 2.81Å; V169-V171 VanDerWaalsContact C-N 3.27Å; V169-V171 PolarHBondContact O-N 2.98Å; V169-Y172 PolarHBondContact O-N 3.33Å; V169-R173 WeakPolarHBondContact O-CB 3.45Å; V169-R173 VanDerWaalsContact O-CG 3.28Å; V169-R173 WeakPolarHBondContact O-CG 3.49Å; V169-R173 PolarHBondContact O-N 3.43Å; V169-L190 HydrophobicContact CG2-CD2 4.19Å
170	R	81.2	Confident	76.9	Confident	148 Å²	148	66.7 Å²	66.7	56%	0.558	34%	0.343	S	S	*	.	H	α-helix	trans	-64	-33.9	179.1	-72.7	178	-171.6	-172.5	8	112.9	E166 T167 T168 R174	E166-R170 WeakPolarHBondContact O-CB 3.29Å; E166-R170 VanDerWaalsContact O-CG 3.28Å; E166-R170 WeakPolarHBondContact O-CG 3.34Å; E166-R170 PolarHBondContact O-N 3.43Å; T167-R170 PolarHBondContact O-N 2.85Å; T168-R170 PolarHBondContact O-N 2.69Å; R170-R174 WeakPolarHBondContact O-CG 3.34Å; R170-R174 PolarHBondContact O-N 2.77Å
171	V	81.3	Confident	76.8	Confident	4 Å²	4	69.1 Å²	69.1	2%	0.024	34%	0.336	C	S	.	.	H	α-helix	trans	-74.8	-45.3	179.6	171	0	0	0	0	110.9	W152 Y155 L159 T167 T168 V169 R173 R174 Y175	W152-V171 HydrophobicContact CZ3-CG1 3.82Å; Y155-V171 HydrophobicContact CD1-CG1 3.4Å; Y155-V171 VanDerWaalsContact CD1-CG1 3.4Å; Y155-V171 HydrophobicContact CE1-CB 4.04Å; Y155-V171 HydrophobicContact CE1-CG1 3.17Å; Y155-V171 HydrophobicContact CE1-CG2 3.59Å; Y155-V171 HydrophobicContact CE2-CG1 4.4Å; Y155-V171 HydrophobicContact CE2-CG2 4.23Å; Y155-V171 HydrophobicContact CG-CG1 4.15Å; Y155-V171 WeakPolarHBondContact OH-CG2 3.3Å; L159-V171 HydrophobicContact CD1-CB 3.81Å; L159-V171 HydrophobicContact CD1-CG1 3.4Å; L159-V171 HydrophobicContact CD2-CB 4.35Å; L159-V171 HydrophobicContact CD2-CG1 4.49Å; L159-V171 HydrophobicContact CD2-CG2 4.35Å; L159-V171 HydrophobicContact CG-CG1 4.41Å; T167-V171 WeakPolarHBondContact O-CB 3.42Å; T167-V171 WeakPolarHBondContact O-CG2 3.29Å; T167-V171 PolarHBondContact O-N 3.28Å; T168-V171 PolarHBondContact O-N 2.86Å; T168-V171 VanDerWaalsContact O-N 3.17Å; V169-V171 VanDerWaalsContact C-N 3.27Å; V169-V171 PolarHBondContact O-N 2.98Å; V171-R173 VanDerWaalsContact C-N 3.32Å; V171-R173 PolarHBondContact O-N 3Å; V171-R174 CarbonylContact O-C 3.36Å; V171-R174 WeakPolarHBondContact O-CA 3.23Å; V171-R174 WeakPolarHBondContact O-CB 3.42Å; V171-R174 PolarHBondContact O-N 3.18Å; V171-Y175 PolarHBondContact O-N 2.99Å
172	Y	79.5	Confident	76.8	Confident	28 Å²	28	64 Å²	64	11%	0.11	31%	0.309	C	S	.	.	H	α-helix	trans	-58.8	-43	172.2	-84.1	-72.3	0	0	0	111.6	L156 L159 T168 V169 R174 Y175 L176 Y186 Y189	L156-Y172 HydrophobicContact CD2-CD1 4.06Å; L156-Y172 HydrophobicContact CD2-CE1 3.44Å; L156-Y172 VanDerWaalsContact CD2-CE1 3.44Å; L156-Y172 HydrophobicContact CD2-CE2 4.36Å; L159-Y172 HydrophobicContact CD1-CE2 4.43Å; T168-Y172 HydrophobicContact CG2-CD2 3.49Å; T168-Y172 VanDerWaalsContact CG2-CD2 3.49Å; T168-Y172 HydrophobicContact CG2-CE2 3.31Å; T168-Y172 VanDerWaalsContact O-CD2 3.25Å; T168-Y172 WeakPolarHBondContact O-CD2 3.25Å; T168-Y172 PolarHBondContact O-N 3.46Å; V169-Y172 PolarHBondContact O-N 3.33Å; Y172-R174 PolarHBondContact O-N 3.29Å; Y172-R174 VanDerWaalsContact O-N 3.13Å; Y172-Y175 HydrophobicContact CD1-CD1 4.48Å; Y172-Y175 CarbonylContact O-C 3.6Å; Y172-Y175 WeakPolarHBondContact O-CA 3.19Å; Y172-Y175 WeakPolarHBondContact O-CB 3.27Å; Y172-Y175 PolarHBondContact O-N 3.02Å; Y172-L176 WeakPolarHBondContact O-CG 3.39Å; Y172-L176 PolarHBondContact O-N 3.08Å; Y172-Y186 VanDerWaalsContact CB-CE2 3.41Å; Y172-Y186 AromaticContact CD1-CD2 3.9Å; Y172-Y186 HydrophobicContact CD1-CD2 3.9Å; Y172-Y186 HydrophobicContact CD1-CG 4.3Å; Y172-Y186 AromaticContact CD2-CD2 3.77Å; Y172-Y186 HydrophobicContact CD2-CD2 3.77Å; Y172-Y186 HydrophobicContact CD2-CE2 4.16Å; Y172-Y186 AromaticContact CG-CD2 3.38Å; Y172-Y186 HydrophobicContact CG-CD2 3.38Å; Y172-Y186 AromaticContact CG-CE2 3.96Å; Y172-Y186 HydrophobicContact CG-CE2 3.96Å; Y172-Y186 HydrophobicContact CG-CG 4.16Å; Y172-Y189 AromaticContact CD2-CD1 3.73Å; Y172-Y189 HydrophobicContact CD2-CD1 3.73Å; Y172-Y189 HydrophobicContact CD2-CE1 4.04Å; Y172-Y189 HydrophobicContact CD2-CG 4.37Å; Y172-Y189 AromaticContact CE2-CD1 3.5Å; Y172-Y189 HydrophobicContact CE2-CD1 3.5Å; Y172-Y189 HydrophobicContact CE2-CD2 4.27Å; Y172-Y189 AromaticContact CE2-CE1 3.87Å; Y172-Y189 HydrophobicContact CE2-CE1 3.87Å; Y172-Y189 AromaticContact CE2-CG 3.73Å; Y172-Y189 HydrophobicContact CE2-CG 3.73Å
173	R	80.5	Confident	77.3	Confident	101 Å²	101	62.6 Å²	62.6	38%	0.381	30%	0.304	S	S	.	.	H	α-helix	trans	-58.5	-28.1	173.7	-71.7	-179.7	-169.6	-176.5	5.5	113.9	V169 V171 E198	V169-R173 WeakPolarHBondContact O-CB 3.45Å; V169-R173 VanDerWaalsContact O-CG 3.28Å; V169-R173 WeakPolarHBondContact O-CG 3.49Å; V169-R173 PolarHBondContact O-N 3.43Å; V171-R173 VanDerWaalsContact C-N 3.32Å; V171-R173 PolarHBondContact O-N 3Å; R173-E198 IonicContact CZ-OE2 2.7Å; R173-E198 IonicContact NH2-OE1 3.9Å; R173-E198 PolarHBondContact NH2-OE1 3.38Å; R173-E198 IonicContact NH2-OE2 3.94Å; R173-E198 PolarHBondContact NH2-OE2 3.4Å
174	R	80.9	Confident	77.8	Confident	117 Å²	117	57.1 Å²	57.1	44%	0.442	27%	0.265	S	S	.	.	H	α-helix	trans	-79.9	-37.6	172	-70.1	174.6	-178.4	178.6	0	111.3	D137 W152 R170 V171 Y172 K177	D137-R174 IonicContact OD1-NH1 2.82Å; D137-R174 PolarHBondContact OD1-NH1 3.29Å; D137-R174 IonicContact OD2-CZ 3.94Å; D137-R174 IonicContact OD2-NH1 2.92Å; D137-R174 PolarHBondContact OD2-NH1 2.8Å; W152-R174 HydrophobicContact CH2-CB 3.96Å; R170-R174 WeakPolarHBondContact O-CG 3.34Å; R170-R174 PolarHBondContact O-N 2.77Å; V171-R174 CarbonylContact O-C 3.36Å; V171-R174 WeakPolarHBondContact O-CA 3.23Å; V171-R174 WeakPolarHBondContact O-CB 3.42Å; V171-R174 PolarHBondContact O-N 3.18Å; Y172-R174 PolarHBondContact O-N 3.29Å; Y172-R174 VanDerWaalsContact O-N 3.13Å; R174-K177 WeakPolarHBondContact O-CB 3.34Å; R174-K177 PolarHBondContact O-N 3.09Å
175	Y	80.7	Confident	78.1	Confident	21 Å²	21	57 Å²	57	8%	0.082	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-44.3	177.8	-175.7	-119.9	0	0	0	112.1	W152 L156 V171 Y172 K177 F178 A179 D182	W152-Y175 HydrophobicContact CB-CD2 4.01Å; W152-Y175 HydrophobicContact CB-CE2 3.62Å; W152-Y175 AromaticContact CD1-CD2 3.91Å; W152-Y175 AromaticContact CD1-CE2 3.83Å; W152-Y175 AromaticContact CD2-CD2 3.35Å; W152-Y175 HydrophobicContact CD2-CD2 3.35Å; W152-Y175 AromaticContact CD2-CE2 3.9Å; W152-Y175 HydrophobicContact CD2-CE2 3.9Å; W152-Y175 HydrophobicContact CD2-CG 4.37Å; W152-Y175 AromaticContact CE2-CD2 3.74Å; W152-Y175 AromaticContact CE3-CD2 3.54Å; W152-Y175 HydrophobicContact CE3-CD2 3.54Å; W152-Y175 HydrophobicContact CE3-CE2 4.33Å; W152-Y175 HydrophobicContact CE3-CG 4.17Å; W152-Y175 AromaticContact CG-CD2 3.54Å; W152-Y175 HydrophobicContact CG-CD2 3.54Å; W152-Y175 AromaticContact CG-CE2 3.54Å; W152-Y175 HydrophobicContact CG-CE2 3.54Å; W152-Y175 HydrophobicContact CH2-CD2 4.46Å; W152-Y175 HydrophobicContact CZ2-CD2 4.31Å; W152-Y175 HydrophobicContact CZ3-CD2 4.08Å; W152-Y175 HydrophobicContact CZ3-CG 4.38Å; L156-Y175 HydrophobicContact CD1-CE1 4.3Å; V171-Y175 PolarHBondContact O-N 2.99Å; Y172-Y175 HydrophobicContact CD1-CD1 4.48Å; Y172-Y175 CarbonylContact O-C 3.6Å; Y172-Y175 WeakPolarHBondContact O-CA 3.19Å; Y172-Y175 WeakPolarHBondContact O-CB 3.27Å; Y172-Y175 PolarHBondContact O-N 3.02Å; Y175-K177 PolarHBondContact O-N 3.42Å; Y175-F178 WeakPolarHBondContact O-CA 3.44Å; Y175-F178 WeakPolarHBondContact O-CB 3.45Å; Y175-F178 PolarHBondContact O-N 3.34Å; Y175-A179 HydrophobicContact CE1-CB 4.37Å; Y175-A179 HydrophobicContact CE2-CB 4.26Å; Y175-A179 PolarHBondContact O-N 2.86Å; Y175-D182 HydrophobicContact CD1-CB 4.43Å; Y175-D182 HydrophobicContact CE1-CB 3.55Å; Y175-D182 WeakPolarHBondContact CE1-OD2 3.38Å; Y175-D182 VanDerWaalsContact CZ-OD2 3.25Å; Y175-D182 PolarHBondContact OH-OD2 3.44Å
176	L	75.9	Confident	78.5	Confident	26 Å²	26	54.6 Å²	54.6	14%	0.136	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-26.5	178.9	-65.2	175.1	0	0	0	113.7	Y172 F178 A179 A183 Y186 Y202	Y172-L176 WeakPolarHBondContact O-CG 3.39Å; Y172-L176 PolarHBondContact O-N 3.08Å; L176-F178 PolarHBondContact O-N 2.92Å; L176-A179 CarbonylContact O-C 3.55Å; L176-A183 VanDerWaalsContact CD2-CA 3.44Å; L176-A183 HydrophobicContact CD2-CB 3.87Å; L176-Y186 HydrophobicContact CD1-CD1 3.44Å; L176-Y186 VanDerWaalsContact CD1-CD1 3.44Å; L176-Y186 HydrophobicContact CD1-CE1 3.86Å; L176-Y186 HydrophobicContact CD1-CG 4.09Å; L176-Y202 HydrophobicContact CD1-CD1 4.33Å; L176-Y202 HydrophobicContact CD1-CE1 4.07Å
177	K	79.7	Confident	78.6	Confident	187 Å²	187	49.4 Å²	49.4	81%	0.813	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-23.9	172.5	-65.3	-175	178.8	-165.6	0	112.8	R174 Y175	R174-K177 WeakPolarHBondContact O-CB 3.34Å; R174-K177 PolarHBondContact O-N 3.09Å; Y175-K177 PolarHBondContact O-N 3.42Å
178	F	74.7	Confident	78.9	Confident	70 Å²	70	52 Å²	52	31%	0.307	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-48	-179.9	179.8	-84	0	0	0	111	A145 H148 N149 W152 Y175 L176	A145-F178 HydrophobicContact CB-CE2 4.32Å; A145-F178 VanDerWaalsContact O-CE2 3.24Å; A145-F178 WeakPolarHBondContact O-CE2 3.23Å; H148-F178 HydrophobicContact CB-CD2 4.33Å; H148-F178 HydrophobicContact CB-CE2 4.02Å; H148-F178 HydrophobicContact CB-CZ 4.31Å; N149-F178 WeakPolarHBondContact OD1-CE1 3.46Å; N149-F178 VanDerWaalsContact OD1-CZ 3.27Å; N149-F178 WeakPolarHBondContact OD1-CZ 3.46Å; W152-F178 AromaticContact NE1-CG 3.96Å; Y175-F178 WeakPolarHBondContact O-CA 3.44Å; Y175-F178 WeakPolarHBondContact O-CB 3.45Å; Y175-F178 PolarHBondContact O-N 3.34Å; L176-F178 PolarHBondContact O-N 2.92Å
179	A	73.9	Confident	79	Confident	14 Å²	14	54 Å²	54	12%	0.116	24%	0.243	C	C	.	.			trans	-123.9	90.9	178.2	0	0	0	0	0	109.1	Y175 L176 E181	Y175-A179 HydrophobicContact CE1-CB 4.37Å; Y175-A179 HydrophobicContact CE2-CB 4.26Å; Y175-A179 PolarHBondContact O-N 2.86Å; L176-A179 CarbonylContact O-C 3.55Å; A179-E181 PolarHBondContact O-N 3.45Å
180	P	76.4	Confident	79.1	Confident	77 Å²	77	53.8 Å²	53.8	50%	0.5	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-63.7	-30.9	174.4	25.8	-32.7	0	0	0	111.3	D182 A183 F212	P180-D182 PolarHBondContact O-N 2.82Å; P180-D182 VanDerWaalsContact O-N 3.15Å; P180-A183 VanDerWaalsContact O-CB 3.25Å; P180-A183 WeakPolarHBondContact O-CB 3.48Å; P180-A183 PolarHBondContact O-N 2.85Å; P180-F212 WeakPolarHBondContact O-CE2 3.45Å
181	E	72.5	Confident	79.1	Confident	120 Å²	120	49.8 Å²	49.8	56%	0.561	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-54.1	-33.1	-179.3	-61.6	171.2	-171.1	0	0	114	A179 A183	A179-E181 PolarHBondContact O-N 3.45Å; E181-A183 PolarHBondContact O-N 2.94Å
182	D	74.9	Confident	79.3	Confident	9 Å²	9	53.7 Å²	53.7	5%	0.048	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-88.8	21.3	-178.8	-73.5	-27.2	0	0	0	112.6	Y175 P180 E184 L185 R215	Y175-D182 HydrophobicContact CD1-CB 4.43Å; Y175-D182 HydrophobicContact CE1-CB 3.55Å; Y175-D182 WeakPolarHBondContact CE1-OD2 3.38Å; Y175-D182 VanDerWaalsContact CZ-OD2 3.25Å; Y175-D182 PolarHBondContact OH-OD2 3.44Å; P180-D182 PolarHBondContact O-N 2.82Å; P180-D182 VanDerWaalsContact O-N 3.15Å; D182-E184 PolarHBondContact O-N 2.78Å; D182-L185 HydrophobicContact CB-CD1 4.21Å; D182-L185 PolarHBondContact O-N 3.1Å; D182-R215 WeakPolarHBondContact OD1-CD 3.46Å; D182-R215 IonicContact OD1-CZ 3.71Å; D182-R215 IonicContact OD1-NE 2.72Å; D182-R215 IonicContact OD1-NH1 3.44Å; D182-R215 PolarHBondContact OD1-NH1 3.35Å; D182-R215 IonicContact OD2-NH1 3.73Å; D182-R215 PolarHBondContact OD2-NH1 3.24Å
183	A	78.5	Confident	79.3	Confident	8 Å²	8	54.1 Å²	54.1	7%	0.066	26%	0.26	C	S	.	.	H	α-helix	trans	-60.5	-30.2	178	0	0	0	0	0	113.5	L176 P180 E181 Y186 V187 I206 F212	L176-A183 VanDerWaalsContact CD2-CA 3.44Å; L176-A183 HydrophobicContact CD2-CB 3.87Å; P180-A183 VanDerWaalsContact O-CB 3.25Å; P180-A183 WeakPolarHBondContact O-CB 3.48Å; P180-A183 PolarHBondContact O-N 2.85Å; E181-A183 PolarHBondContact O-N 2.94Å; A183-Y186 WeakPolarHBondContact O-CB 3.28Å; A183-Y186 PolarHBondContact O-N 2.94Å; A183-Y186 VanDerWaalsContact O-N 3.16Å; A183-V187 WeakPolarHBondContact O-CG2 3.21Å; A183-V187 PolarHBondContact O-N 2.85Å; A183-I206 HydrophobicContact CB-CD1 3.59Å; A183-I206 HydrophobicContact CB-CG1 4.07Å; A183-F212 HydrophobicContact CB-CE2 4.08Å; A183-F212 HydrophobicContact CB-CZ 4.23Å
184	E	77.7	Confident	79.2	Confident	6 Å²	6	54.2 Å²	54.2	3%	0.028	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-45.4	177.9	-65.3	172.5	160.8	0	0	112.2	D182 Y186 V187 E188 F212 S214 E216 L223	D182-E184 PolarHBondContact O-N 2.78Å; E184-Y186 PolarHBondContact O-N 3.5Å; E184-Y186 VanDerWaalsContact O-N 3.16Å; E184-V187 CarbonylContact O-C 3.23Å; E184-V187 WeakPolarHBondContact O-CA 3.47Å; E184-V187 WeakPolarHBondContact O-CB 3.42Å; E184-V187 PolarHBondContact O-N 3.32Å; E184-E188 WeakPolarHBondContact O-CG 3.34Å; E184-E188 PolarHBondContact O-N 3.47Å; E184-F212 HydrophobicContact CG-CZ 4.44Å; E184-S214 WeakPolarHBondContact OE1-CB 3.46Å; E184-S214 PolarHBondContact OE1-OG 3.35Å; E184-S214 PolarHBondContact OE2-OG 2.92Å; E184-E216 VanDerWaalsContact OE2-CB 3.3Å; E184-E216 WeakPolarHBondContact OE2-CB 3.32Å; E184-E216 VanDerWaalsContact OE2-CG 3.26Å; E184-E216 WeakPolarHBondContact OE2-CG 3.34Å; E184-E216 PolarHBondContact OE2-N 2.98Å; E184-L223 HydrophobicContact CG-CD2 4.3Å; E184-L223 WeakPolarHBondContact OE1-CD2 3.39Å
185	L	80.5	Confident	79.2	Confident	63 Å²	63	52 Å²	52	33%	0.33	26%	0.26	S	S	.	.	H	α-helix	trans	-58.2	-33.1	176	-65.6	176.8	0	0	0	111.8	D182 Y189	D182-L185 HydrophobicContact CB-CD1 4.21Å; D182-L185 PolarHBondContact O-N 3.1Å; L185-Y189 VanDerWaalsContact O-CB 3.31Å; L185-Y189 WeakPolarHBondContact O-CB 3.41Å; L185-Y189 PolarHBondContact O-N 2.88Å
186	Y	81.1	Confident	79.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-75	-39.6	174.9	179.4	-125.8	0	0	0	112.3	Y172 L176 A183 E184 E188 Y189 L190 E198 Y202	Y172-Y186 VanDerWaalsContact CB-CE2 3.41Å; Y172-Y186 AromaticContact CD1-CD2 3.9Å; Y172-Y186 HydrophobicContact CD1-CD2 3.9Å; Y172-Y186 HydrophobicContact CD1-CG 4.3Å; Y172-Y186 AromaticContact CD2-CD2 3.77Å; Y172-Y186 HydrophobicContact CD2-CD2 3.77Å; Y172-Y186 HydrophobicContact CD2-CE2 4.16Å; Y172-Y186 AromaticContact CG-CD2 3.38Å; Y172-Y186 HydrophobicContact CG-CD2 3.38Å; Y172-Y186 AromaticContact CG-CE2 3.96Å; Y172-Y186 HydrophobicContact CG-CE2 3.96Å; Y172-Y186 HydrophobicContact CG-CG 4.16Å; L176-Y186 HydrophobicContact CD1-CD1 3.44Å; L176-Y186 VanDerWaalsContact CD1-CD1 3.44Å; L176-Y186 HydrophobicContact CD1-CE1 3.86Å; L176-Y186 HydrophobicContact CD1-CG 4.09Å; A183-Y186 WeakPolarHBondContact O-CB 3.28Å; A183-Y186 PolarHBondContact O-N 2.94Å; A183-Y186 VanDerWaalsContact O-N 3.16Å; E184-Y186 PolarHBondContact O-N 3.5Å; E184-Y186 VanDerWaalsContact O-N 3.16Å; Y186-E188 VanDerWaalsContact C-N 3.34Å; Y186-Y189 HydrophobicContact CD2-CD1 4.36Å; Y186-Y189 PolarHBondContact O-N 3.25Å; Y186-L190 HydrophobicContact CD1-CD1 3.83Å; Y186-L190 HydrophobicContact CD1-CG 4.45Å; Y186-L190 HydrophobicContact CD2-CD1 4.33Å; Y186-L190 HydrophobicContact CD2-CG 4.08Å; Y186-L190 HydrophobicContact CE1-CD1 3.51Å; Y186-L190 HydrophobicContact CE1-CG 4.22Å; Y186-L190 HydrophobicContact CE2-CD1 3.96Å; Y186-L190 HydrophobicContact CE2-CD2 3.84Å; Y186-L190 HydrophobicContact CE2-CG 3.72Å; Y186-L190 HydrophobicContact CG-CD1 4.29Å; Y186-L190 HydrophobicContact CG-CG 4.45Å; Y186-L190 WeakPolarHBondContact O-CB 3.43Å; Y186-L190 VanDerWaalsContact O-CG 3.27Å; Y186-L190 WeakPolarHBondContact O-CG 3.28Å; Y186-L190 PolarHBondContact O-N 3.47Å; Y186-E198 PolarHBondContact OH-OE2 2.93Å; Y186-Y202 HydrophobicContact CD1-CD2 4.06Å; Y186-Y202 HydrophobicContact CD1-CE2 4.31Å; Y186-Y202 HydrophobicContact CD1-CG 4.26Å; Y186-Y202 HydrophobicContact CE1-CD1 4.49Å; Y186-Y202 AromaticContact CE1-CD2 3.52Å; Y186-Y202 HydrophobicContact CE1-CD2 3.52Å; Y186-Y202 HydrophobicContact CE1-CE1 4.33Å; Y186-Y202 AromaticContact CE1-CE2 3.39Å; Y186-Y202 HydrophobicContact CE1-CE2 3.39Å; Y186-Y202 HydrophobicContact CE1-CG 4.11Å; Y186-Y202 AromaticContact CE1-CZ 3.8Å
187	V	81.7	Confident	79.6	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.012	26%	0.262	C	S	.	.	H	α-helix	trans	-59.7	-45.3	172.8	170	0	0	0	0	110.5	A183 E184 Y189 L190 K191 A199 L203 I206	A183-V187 WeakPolarHBondContact O-CG2 3.21Å; A183-V187 PolarHBondContact O-N 2.85Å; E184-V187 CarbonylContact O-C 3.23Å; E184-V187 WeakPolarHBondContact O-CA 3.47Å; E184-V187 WeakPolarHBondContact O-CB 3.42Å; E184-V187 PolarHBondContact O-N 3.32Å; V187-Y189 VanDerWaalsContact C-N 3.34Å; V187-Y189 PolarHBondContact O-N 3.38Å; V187-L190 PolarHBondContact O-N 2.93Å; V187-K191 HydrophobicContact CG1-CD 4.4Å; V187-K191 WeakPolarHBondContact O-CG 3.27Å; V187-K191 PolarHBondContact O-N 3.47Å; V187-A199 HydrophobicContact CG1-CB 4.37Å; V187-L203 HydrophobicContact CB-CG 4.43Å; V187-L203 HydrophobicContact CG1-CD1 3.69Å; V187-L203 HydrophobicContact CG1-CD2 3.94Å; V187-L203 HydrophobicContact CG1-CG 3.68Å; V187-L203 HydrophobicContact CG2-CD2 4.06Å; V187-L203 HydrophobicContact CG2-CG 3.87Å; V187-I206 HydrophobicContact CG2-CD1 4.26Å
188	E	83.4	Confident	79.7	Confident	86 Å²	86	44.7 Å²	44.7	40%	0.402	23%	0.23	S	C	.	.	H	α-helix	trans	-61.6	-42.5	175	-68.2	-167.9	156.3	0	0	112.2	E184 Y186 L190 K191 S192	E184-E188 WeakPolarHBondContact O-CG 3.34Å; E184-E188 PolarHBondContact O-N 3.47Å; Y186-E188 VanDerWaalsContact C-N 3.34Å; E188-L190 VanDerWaalsContact C-N 3.33Å; E188-L190 PolarHBondContact O-N 3.49Å; E188-K191 WeakPolarHBondContact O-CB 3.46Å; E188-K191 PolarHBondContact O-N 2.96Å; E188-S192 PolarHBondContact O-N 3.38Å
189	Y	82.5	Confident	80.1	Confident	42 Å²	42	41.4 Å²	41.4	17%	0.165	22%	0.215	C	C	.	.	H	α-helix	trans	-61.9	-41.3	174.4	-177.4	-109.3	0	0	0	111.8	T168 Y172 L185 Y186 V187 S192 I193	T168-Y189 WeakPolarHBondContact CB-OH 3.31Å; T168-Y189 HydrophobicContact CG2-CD1 4.05Å; T168-Y189 HydrophobicContact CG2-CE1 3.17Å; T168-Y189 HydrophobicContact CG2-CE2 4.03Å; T168-Y189 WeakPolarHBondContact CG2-OH 3.36Å; T168-Y189 PolarHBondContact OG1-OH 3.5Å; Y172-Y189 AromaticContact CD2-CD1 3.73Å; Y172-Y189 HydrophobicContact CD2-CD1 3.73Å; Y172-Y189 HydrophobicContact CD2-CE1 4.04Å; Y172-Y189 HydrophobicContact CD2-CG 4.37Å; Y172-Y189 AromaticContact CE2-CD1 3.5Å; Y172-Y189 HydrophobicContact CE2-CD1 3.5Å; Y172-Y189 HydrophobicContact CE2-CD2 4.27Å; Y172-Y189 AromaticContact CE2-CE1 3.87Å; Y172-Y189 HydrophobicContact CE2-CE1 3.87Å; Y172-Y189 AromaticContact CE2-CG 3.73Å; Y172-Y189 HydrophobicContact CE2-CG 3.73Å; L185-Y189 VanDerWaalsContact O-CB 3.31Å; L185-Y189 WeakPolarHBondContact O-CB 3.41Å; L185-Y189 PolarHBondContact O-N 2.88Å; Y186-Y189 HydrophobicContact CD2-CD1 4.36Å; Y186-Y189 PolarHBondContact O-N 3.25Å; V187-Y189 VanDerWaalsContact C-N 3.34Å; V187-Y189 PolarHBondContact O-N 3.38Å; Y189-S192 WeakPolarHBondContact O-CB 3.42Å; Y189-S192 PolarHBondContact O-N 2.95Å; Y189-S192 VanDerWaalsContact O-N 3.15Å; Y189-S192 PolarHBondContact O-OG 3.47Å; Y189-I193 HydrophobicContact CD1-CD1 3.56Å; Y189-I193 HydrophobicContact CD2-CD1 4.43Å; Y189-I193 HydrophobicContact CE1-CD1 2.98Å; Y189-I193 HydrophobicContact CE1-CG1 4.11Å; Y189-I193 HydrophobicContact CE2-CD1 3.97Å; Y189-I193 HydrophobicContact CE2-CG1 4.28Å; Y189-I193 HydrophobicContact CG-CD1 4.24Å; Y189-I193 WeakPolarHBondContact O-CG1 3.28Å; Y189-I193 PolarHBondContact O-N 3.4Å; Y189-I193 WeakPolarHBondContact OH-CD1 3.41Å
190	L	82.6	Confident	80.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67	-38.5	176.2	-72.1	173.2	0	0	0	112.3	V169 Y186 V187 E188 S192 I193 D194 R195 E198 A199 Y202	V169-L190 HydrophobicContact CG2-CD2 4.19Å; Y186-L190 HydrophobicContact CD1-CD1 3.83Å; Y186-L190 HydrophobicContact CD1-CG 4.45Å; Y186-L190 HydrophobicContact CD2-CD1 4.33Å; Y186-L190 HydrophobicContact CD2-CG 4.08Å; Y186-L190 HydrophobicContact CE1-CD1 3.51Å; Y186-L190 HydrophobicContact CE1-CG 4.22Å; Y186-L190 HydrophobicContact CE2-CD1 3.96Å; Y186-L190 HydrophobicContact CE2-CD2 3.84Å; Y186-L190 HydrophobicContact CE2-CG 3.72Å; Y186-L190 HydrophobicContact CG-CD1 4.29Å; Y186-L190 HydrophobicContact CG-CG 4.45Å; Y186-L190 WeakPolarHBondContact O-CB 3.43Å; Y186-L190 VanDerWaalsContact O-CG 3.27Å; Y186-L190 WeakPolarHBondContact O-CG 3.28Å; Y186-L190 PolarHBondContact O-N 3.47Å; V187-L190 PolarHBondContact O-N 2.93Å; E188-L190 VanDerWaalsContact C-N 3.33Å; E188-L190 PolarHBondContact O-N 3.49Å; L190-S192 PolarHBondContact O-N 3.29Å; L190-I193 PolarHBondContact O-N 2.97Å; L190-D194 PolarHBondContact O-N 3.17Å; L190-R195 HydrophobicContact CD2-CB 3.91Å; L190-R195 PolarHBondContact O-N 3.26Å; L190-R195 VanDerWaalsContact O-N 3.08Å; L190-E198 HydrophobicContact CD1-CB 3.84Å; L190-E198 HydrophobicContact CD2-CB 4.14Å; L190-A199 HydrophobicContact CB-CB 3.81Å; L190-A199 HydrophobicContact CD1-CB 4.29Å; L190-Y202 HydrophobicContact CD1-CD2 3.98Å
191	K	82.5	Confident	80.8	Confident	64 Å²	64	40.4 Å²	40.4	28%	0.278	20%	0.202	S	C	.	.	H	α-helix	trans	-56.4	-40.6	169.9	-71.1	174.3	-177.9	170.3	0	110.3	V187 E188 I193 D194 E226 L230	V187-K191 HydrophobicContact CG1-CD 4.4Å; V187-K191 WeakPolarHBondContact O-CG 3.27Å; V187-K191 PolarHBondContact O-N 3.47Å; E188-K191 WeakPolarHBondContact O-CB 3.46Å; E188-K191 PolarHBondContact O-N 2.96Å; K191-I193 PolarHBondContact O-N 3.36Å; K191-D194 PolarHBondContact O-N 3.16Å; K191-E226 IonicContact NZ-OE2 3.58Å; K191-E226 PolarHBondContact NZ-OE2 2.63Å; K191-L230 HydrophobicContact CD-CD1 4.23Å; K191-L230 HydrophobicContact CD-CD2 4.16Å; K191-L230 HydrophobicContact CG-CD1 4.28Å; K191-L230 HydrophobicContact CG-CD2 4Å
192	S	84.8	Confident	81.2	Confident	86 Å²	86	37 Å²	37	60%	0.601	18%	0.184	S	C	*	.	H	α-helix	trans	-69.6	-26.6	178.7	82.4	0	0	0	0	115	E188 Y189 L190	E188-S192 PolarHBondContact O-N 3.38Å; Y189-S192 WeakPolarHBondContact O-CB 3.42Å; Y189-S192 PolarHBondContact O-N 2.95Å; Y189-S192 VanDerWaalsContact O-N 3.15Å; Y189-S192 PolarHBondContact O-OG 3.47Å; L190-S192 PolarHBondContact O-N 3.29Å
193	I	80.1	Confident	81.5	Confident	38 Å²	38	36.6 Å²	36.6	20%	0.195	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	6.4	178.8	-55.6	160.5	0	0	0	111.9	T165 Y189 L190 K191 R195	T165-I193 HydrophobicContact CG2-CD1 4.41Å; T165-I193 HydrophobicContact CG2-CG1 4.36Å; T165-I193 HydrophobicContact CG2-CG2 3.49Å; T165-I193 VanDerWaalsContact CG2-CG2 3.49Å; Y189-I193 HydrophobicContact CD1-CD1 3.56Å; Y189-I193 HydrophobicContact CD2-CD1 4.43Å; Y189-I193 HydrophobicContact CE1-CD1 2.98Å; Y189-I193 HydrophobicContact CE1-CG1 4.11Å; Y189-I193 HydrophobicContact CE2-CD1 3.97Å; Y189-I193 HydrophobicContact CE2-CG1 4.28Å; Y189-I193 HydrophobicContact CG-CD1 4.24Å; Y189-I193 WeakPolarHBondContact O-CG1 3.28Å; Y189-I193 PolarHBondContact O-N 3.4Å; Y189-I193 WeakPolarHBondContact OH-CD1 3.41Å; L190-I193 PolarHBondContact O-N 2.97Å; K191-I193 PolarHBondContact O-N 3.36Å; I193-R195 HydrophobicContact CG2-CG 4.16Å; I193-R195 PolarHBondContact O-N 3.48Å; I193-R195 VanDerWaalsContact O-N 3.12Å
194	D	78.9	Confident	81.7	Confident	102 Å²	102	36.8 Å²	36.8	55%	0.545	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	16.8	-173	-80.5	-54.4	0	0	0	114.4	L190 K191 L196 K237	L190-D194 PolarHBondContact O-N 3.17Å; K191-D194 PolarHBondContact O-N 3.16Å; D194-L196 PolarHBondContact O-N 3.42Å; D194-K237 IonicContact OD1-NZ 3.2Å; D194-K237 PolarHBondContact OD1-NZ 3.29Å
195	R	80.7	Confident	81.9	Confident	72 Å²	72	41.5 Å²	41.5	27%	0.272	21%	0.206	S	C	.	.			trans	-86.4	62.8	173.1	-73.1	-171.1	-175.4	-150.9	3.9	110.7	L190 I193 D197 E198 A199	L190-R195 HydrophobicContact CD2-CB 3.91Å; L190-R195 PolarHBondContact O-N 3.26Å; L190-R195 VanDerWaalsContact O-N 3.08Å; I193-R195 HydrophobicContact CG2-CG 4.16Å; I193-R195 PolarHBondContact O-N 3.48Å; I193-R195 VanDerWaalsContact O-N 3.12Å; R195-D197 VanDerWaalsContact C-N 3.33Å; R195-D197 PolarHBondContact O-N 3.17Å; R195-E198 IonicContact CZ-OE1 3.78Å; R195-E198 IonicContact NH1-OE1 3.59Å; R195-E198 PolarHBondContact NH1-OE1 3.1Å; R195-E198 PolarHBondContact O-N 3.49Å; R195-A199 PolarHBondContact O-N 3.47Å; R195-A199 VanDerWaalsContact O-N 3.14Å
196	L	82.2	Confident	81.8	Confident	11 Å²	11	38.9 Å²	38.9	6%	0.058	19%	0.192	C	C	.	.	H	α-helix	trans	-68	-32.7	-174.4	-54.4	-174.6	0	0	0	112.9	D194 A199 A200 L230 N234 K237	D194-L196 PolarHBondContact O-N 3.42Å; L196-A199 WeakPolarHBondContact O-CB 3.16Å; L196-A199 PolarHBondContact O-N 3Å; L196-A200 WeakPolarHBondContact O-CB 3.46Å; L196-A200 PolarHBondContact O-N 3.25Å; L196-L230 HydrophobicContact CD2-CD2 4.36Å; L196-N234 HydrophobicContact CD1-CB 3.5Å; L196-N234 VanDerWaalsContact CD1-ND2 3.27Å; L196-N234 WeakPolarHBondContact CD1-ND2 3.07Å; L196-K237 HydrophobicContact CB-CB 4.23Å; L196-K237 HydrophobicContact CD1-CB 4.11Å; L196-K237 HydrophobicContact CD1-CD 3.46Å; L196-K237 VanDerWaalsContact CD1-CD 3.46Å; L196-K237 HydrophobicContact CD1-CG 4.44Å; L196-K237 HydrophobicContact CG-CD 4.06Å
197	D	82.3	Confident	81.6	Confident	37 Å²	37	39.2 Å²	39.2	20%	0.198	19%	0.194	C	C	.	.	H	α-helix	trans	-57.4	-48.9	174.8	-111.8	-36	0	0	0	111.7	R195 A200 Q201 K237 V238 T239 S240	R195-D197 VanDerWaalsContact C-N 3.33Å; R195-D197 PolarHBondContact O-N 3.17Å; D197-A200 PolarHBondContact O-N 3.2Å; D197-Q201 WeakPolarHBondContact O-CG 3.37Å; D197-Q201 PolarHBondContact O-N 3.02Å; D197-Q201 VanDerWaalsContact O-N 3.12Å; D197-K237 WeakPolarHBondContact CB-O 3.41Å; D197-V238 WeakPolarHBondContact OD1-CA 3.22Å; D197-T239 PolarHBondContact OD1-N 2.97Å; D197-T239 PolarHBondContact OD2-N 3.07Å; D197-T239 PolarHBondContact OD2-OG1 3.32Å; D197-S240 PolarHBondContact OD1-N 2.94Å; D197-S240 VanDerWaalsContact OD1-N 3.13Å; D197-S240 PolarHBondContact OD1-OG 2.48Å
198	E	81.1	Confident	81.3	Confident	32 Å²	32	43.3 Å²	43.3	15%	0.15	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-41.3	176	-65.7	-173.9	-150.8	0	0	110.3	R173 Y186 L190 R195 A200 Q201 Y202	R173-E198 IonicContact CZ-OE2 2.7Å; R173-E198 IonicContact NH2-OE1 3.9Å; R173-E198 PolarHBondContact NH2-OE1 3.38Å; R173-E198 IonicContact NH2-OE2 3.94Å; R173-E198 PolarHBondContact NH2-OE2 3.4Å; Y186-E198 PolarHBondContact OH-OE2 2.93Å; L190-E198 HydrophobicContact CD1-CB 3.84Å; L190-E198 HydrophobicContact CD2-CB 4.14Å; R195-E198 IonicContact CZ-OE1 3.78Å; R195-E198 IonicContact NH1-OE1 3.59Å; R195-E198 PolarHBondContact NH1-OE1 3.1Å; R195-E198 PolarHBondContact O-N 3.49Å; E198-A200 VanDerWaalsContact C-N 3.33Å; E198-A200 PolarHBondContact O-N 3.19Å; E198-Q201 PolarHBondContact O-N 3.04Å; E198-Y202 WeakPolarHBondContact O-CD2 3.4Å; E198-Y202 PolarHBondContact O-N 3.48Å
199	A	83.7	Confident	81	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-43.4	179.3	0	0	0	0	0	111.8	V187 L190 R195 L196 Y202 L203	V187-A199 HydrophobicContact CG1-CB 4.37Å; L190-A199 HydrophobicContact CB-CB 3.81Å; L190-A199 HydrophobicContact CD1-CB 4.29Å; R195-A199 PolarHBondContact O-N 3.47Å; R195-A199 VanDerWaalsContact O-N 3.14Å; L196-A199 WeakPolarHBondContact O-CB 3.16Å; L196-A199 PolarHBondContact O-N 3Å; A199-Y202 PolarHBondContact O-N 3.27Å; A199-L203 WeakPolarHBondContact O-CB 3.29Å; A199-L203 WeakPolarHBondContact O-CG 3.47Å; A199-L203 PolarHBondContact O-N 3.19Å
200	A	82.8	Confident	80.2	Confident	2 Å²	2	48.1 Å²	48.1	2%	0.017	25%	0.248	C	C	.	.	H	α-helix	trans	-65	-38.1	176.9	0	0	0	0	0	111.9	L196 D197 E198 L203 A204 V238	L196-A200 WeakPolarHBondContact O-CB 3.46Å; L196-A200 PolarHBondContact O-N 3.25Å; D197-A200 PolarHBondContact O-N 3.2Å; E198-A200 VanDerWaalsContact C-N 3.33Å; E198-A200 PolarHBondContact O-N 3.19Å; A200-L203 PolarHBondContact O-N 3.11Å; A200-A204 VanDerWaalsContact O-CB 3.26Å; A200-A204 WeakPolarHBondContact O-CB 3.44Å; A200-A204 PolarHBondContact O-N 3.37Å; A200-V238 HydrophobicContact CB-CG1 4.26Å; A200-V238 HydrophobicContact CB-CG2 4.45Å
201	Q	83.3	Confident	79.6	Confident	69 Å²	69	55.6 Å²	55.6	32%	0.322	29%	0.288	S	S	.	.	H	α-helix	trans	-63.1	-45.3	175.2	-72.5	173.9	15.8	0	0	112.4	D197 E198 A204 Q205 S240 F241	D197-Q201 WeakPolarHBondContact O-CG 3.37Å; D197-Q201 PolarHBondContact O-N 3.02Å; D197-Q201 VanDerWaalsContact O-N 3.12Å; E198-Q201 PolarHBondContact O-N 3.04Å; Q201-A204 PolarHBondContact O-N 3.38Å; Q201-Q205 WeakPolarHBondContact O-CG 3.45Å; Q201-Q205 PolarHBondContact O-N 2.86Å; Q201-S240 PolarHBondContact NE2-OG 3.48Å; Q201-F241 HydrophobicContact CB-CE2 3.97Å; Q201-F241 HydrophobicContact CB-CZ 4.06Å; Q201-F241 HydrophobicContact CG-CD2 4.39Å; Q201-F241 HydrophobicContact CG-CE2 3.29Å; Q201-F241 HydrophobicContact CG-CZ 3.5Å
202	Y	79.8	Confident	78.8	Confident	47 Å²	47	53.8 Å²	53.8	18%	0.184	28%	0.28	C	S	.	.	H	α-helix	trans	-68.5	-41.6	178.4	-78	-70.8	0	0	0	111.6	L176 Y186 L190 E198 A199 A204 Q205 I206	L176-Y202 HydrophobicContact CD1-CD1 4.33Å; L176-Y202 HydrophobicContact CD1-CE1 4.07Å; Y186-Y202 HydrophobicContact CD1-CD2 4.06Å; Y186-Y202 HydrophobicContact CD1-CE2 4.31Å; Y186-Y202 HydrophobicContact CD1-CG 4.26Å; Y186-Y202 HydrophobicContact CE1-CD1 4.49Å; Y186-Y202 AromaticContact CE1-CD2 3.52Å; Y186-Y202 HydrophobicContact CE1-CD2 3.52Å; Y186-Y202 HydrophobicContact CE1-CE1 4.33Å; Y186-Y202 AromaticContact CE1-CE2 3.39Å; Y186-Y202 HydrophobicContact CE1-CE2 3.39Å; Y186-Y202 HydrophobicContact CE1-CG 4.11Å; Y186-Y202 AromaticContact CE1-CZ 3.8Å; L190-Y202 HydrophobicContact CD1-CD2 3.98Å; E198-Y202 WeakPolarHBondContact O-CD2 3.4Å; E198-Y202 PolarHBondContact O-N 3.48Å; A199-Y202 PolarHBondContact O-N 3.27Å; Y202-A204 VanDerWaalsContact C-N 3.32Å; Y202-A204 PolarHBondContact O-N 3.27Å; Y202-Q205 PolarHBondContact O-N 3.43Å; Y202-I206 WeakPolarHBondContact O-CD1 3.35Å; Y202-I206 WeakPolarHBondContact O-CG1 3.48Å; Y202-I206 PolarHBondContact O-N 3.03Å
203	L	82.3	Confident	78	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-61.3	-39.9	172.8	-77.3	172.3	0	0	0	112.5	V187 A199 A200 Q205 I206 V207 L223 L227 L230	V187-L203 HydrophobicContact CB-CG 4.43Å; V187-L203 HydrophobicContact CG1-CD1 3.69Å; V187-L203 HydrophobicContact CG1-CD2 3.94Å; V187-L203 HydrophobicContact CG1-CG 3.68Å; V187-L203 HydrophobicContact CG2-CD2 4.06Å; V187-L203 HydrophobicContact CG2-CG 3.87Å; A199-L203 WeakPolarHBondContact O-CB 3.29Å; A199-L203 WeakPolarHBondContact O-CG 3.47Å; A199-L203 PolarHBondContact O-N 3.19Å; A200-L203 PolarHBondContact O-N 3.11Å; L203-Q205 VanDerWaalsContact C-N 3.31Å; L203-Q205 PolarHBondContact O-N 3.35Å; L203-I206 HydrophobicContact CD2-CD1 4.4Å; L203-I206 PolarHBondContact O-N 3.34Å; L203-V207 WeakPolarHBondContact O-CB 3.44Å; L203-V207 VanDerWaalsContact O-CG2 3.24Å; L203-V207 WeakPolarHBondContact O-CG2 3.24Å; L203-V207 PolarHBondContact O-N 2.79Å; L203-L223 HydrophobicContact CD2-CD2 4.38Å; L203-L227 HydrophobicContact CB-CB 4.2Å; L203-L227 HydrophobicContact CB-CD1 3.76Å; L203-L227 HydrophobicContact CB-CG 4.43Å; L203-L227 HydrophobicContact CD1-CB 4.38Å; L203-L230 HydrophobicContact CD1-CD1 3.35Å
204	A	81.3	Confident	77.3	Confident	12 Å²	12	53.8 Å²	53.8	10%	0.099	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-34.4	176.9	0	0	0	0	0	112.3	A200 Q201 Y202 N208 L227 F241	A200-A204 VanDerWaalsContact O-CB 3.26Å; A200-A204 WeakPolarHBondContact O-CB 3.44Å; A200-A204 PolarHBondContact O-N 3.37Å; Q201-A204 PolarHBondContact O-N 3.38Å; Y202-A204 VanDerWaalsContact C-N 3.32Å; Y202-A204 PolarHBondContact O-N 3.27Å; A204-N208 WeakPolarHBondContact O-CB 3.45Å; A204-N208 VanDerWaalsContact O-CG 3.31Å; A204-N208 PolarHBondContact O-N 3.06Å; A204-N208 PolarHBondContact O-ND2 3.48Å; A204-L227 HydrophobicContact CB-CD1 3.85Å; A204-F241 HydrophobicContact CB-CE2 4.42Å; A204-F241 HydrophobicContact CB-CZ 4.14Å
205	Q	81.4	Confident	76.7	Confident	105 Å²	105	57.1 Å²	57.1	49%	0.491	28%	0.283	S	S	.	.	H	α-helix	trans	-66.6	-48.2	172.6	-73	170.9	9.6	0	0	110.7	Q201 Y202 L203 V207 N208 D209	Q201-Q205 WeakPolarHBondContact O-CG 3.45Å; Q201-Q205 PolarHBondContact O-N 2.86Å; Y202-Q205 PolarHBondContact O-N 3.43Å; L203-Q205 VanDerWaalsContact C-N 3.31Å; L203-Q205 PolarHBondContact O-N 3.35Å; Q205-V207 VanDerWaalsContact C-N 3.33Å; Q205-V207 PolarHBondContact O-N 3.3Å; Q205-N208 PolarHBondContact O-N 3.3Å; Q205-N208 VanDerWaalsContact O-N 3.12Å; Q205-D209 PolarHBondContact O-N 2.77Å; Q205-D209 VanDerWaalsContact O-N 3.12Å
206	I	79.5	Confident	75.8	Confident	8 Å²	8	57.3 Å²	57.3	4%	0.041	29%	0.287	C	S	.	.	H	α-helix	trans	-57.4	-45.6	178.3	-67.1	162.7	0	0	0	111.4	A183 V187 Y202 L203 N208 D209 F212 L223	A183-I206 HydrophobicContact CB-CD1 3.59Å; A183-I206 HydrophobicContact CB-CG1 4.07Å; V187-I206 HydrophobicContact CG2-CD1 4.26Å; Y202-I206 WeakPolarHBondContact O-CD1 3.35Å; Y202-I206 WeakPolarHBondContact O-CG1 3.48Å; Y202-I206 PolarHBondContact O-N 3.03Å; L203-I206 HydrophobicContact CD2-CD1 4.4Å; L203-I206 PolarHBondContact O-N 3.34Å; I206-N208 VanDerWaalsContact C-N 3.29Å; I206-N208 PolarHBondContact O-N 3.49Å; I206-D209 PolarHBondContact O-N 3.1Å; I206-F212 HydrophobicContact CG1-CE2 4.35Å; I206-F212 HydrophobicContact CG1-CZ 4.48Å; I206-F212 HydrophobicContact CG2-CB 4.37Å; I206-F212 HydrophobicContact CG2-CD1 3.41Å; I206-F212 VanDerWaalsContact CG2-CD1 3.41Å; I206-F212 HydrophobicContact CG2-CD2 4.17Å; I206-F212 HydrophobicContact CG2-CE1 3.59Å; I206-F212 HydrophobicContact CG2-CE2 4.32Å; I206-F212 HydrophobicContact CG2-CG 3.72Å; I206-F212 HydrophobicContact CG2-CZ 4.06Å; I206-L223 HydrophobicContact CG2-CD1 3.75Å
207	V	75.8	Confident	75.3	Confident	8 Å²	8	65.1 Å²	65.1	5%	0.048	32%	0.323	C	S	.	.	H	α-helix	trans	-64.6	-33.4	179.2	164.8	0	0	0	0	112.4	L203 Q205 D209 L223 W224	L203-V207 WeakPolarHBondContact O-CB 3.44Å; L203-V207 VanDerWaalsContact O-CG2 3.24Å; L203-V207 WeakPolarHBondContact O-CG2 3.24Å; L203-V207 PolarHBondContact O-N 2.79Å; Q205-V207 VanDerWaalsContact C-N 3.33Å; Q205-V207 PolarHBondContact O-N 3.3Å; V207-D209 VanDerWaalsContact C-N 3.32Å; V207-L223 HydrophobicContact CG2-CB 4.37Å; V207-W224 HydrophobicContact CG1-CB 4.44Å; V207-W224 VanDerWaalsContact CG1-CD1 3.46Å; V207-W224 HydrophobicContact CG1-CG 4.27Å; V207-W224 HydrophobicContact CG2-CB 4.12Å
208	N	75.9	Confident	74.8	Confident	88 Å²	88	65.3 Å²	65.3	47%	0.471	32%	0.322	S	S	.	.	H	α-helix	trans	-80.8	-15.7	-179.9	-75.7	-39	0	0	0	112.9	A204 Q205 I206 D210	A204-N208 WeakPolarHBondContact O-CB 3.45Å; A204-N208 VanDerWaalsContact O-CG 3.31Å; A204-N208 PolarHBondContact O-N 3.06Å; A204-N208 PolarHBondContact O-ND2 3.48Å; Q205-N208 PolarHBondContact O-N 3.3Å; Q205-N208 VanDerWaalsContact O-N 3.12Å; I206-N208 VanDerWaalsContact C-N 3.29Å; I206-N208 PolarHBondContact O-N 3.49Å; N208-D210 PolarHBondContact O-N 3.21Å
209	D	77.4	Confident	74.6	Confident	98 Å²	98	67 Å²	67	52%	0.524	34%	0.335	S	S	.	.			trans	-90.4	98.7	176.8	-72.5	-21	0	0	0	110.1	Q205 I206 V207 N211 F212	Q205-D209 PolarHBondContact O-N 2.77Å; Q205-D209 VanDerWaalsContact O-N 3.12Å; I206-D209 PolarHBondContact O-N 3.1Å; V207-D209 VanDerWaalsContact C-N 3.32Å; D209-N211 PolarHBondContact O-N 3.31Å; D209-F212 HydrophobicContact CB-CB 4.4Å; D209-F212 WeakPolarHBondContact O-CB 3.41Å; D209-F212 PolarHBondContact O-N 3.46Å; D209-F212 VanDerWaalsContact O-N 3.13Å
210	D	66.6	Low	74.3	Confident	131 Å²	131	69.2 Å²	69.2	70%	0.701	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-19.1	179.6	-65.2	-32.4	0	0	0	113.6	N208	N208-D210 PolarHBondContact O-N 3.21Å
211	N	68.7	Low	73.8	Confident	157 Å²	157	73 Å²	73	84%	0.84	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	0	-179	-64.7	-37.7	0	0	0	113.9	D209 V213	D209-N211 PolarHBondContact O-N 3.31Å; N211-V213 PolarHBondContact O-N 3.44Å
212	F	67.1	Low	73.7	Confident	25 Å²	25	74.4 Å²	74.4	11%	0.11	37%	0.371	C	S	.	.			trans	-73.1	119.2	-176.8	-175.5	-96.1	0	0	0	111.1	P180 A183 E184 I206 D209 L223	P180-F212 WeakPolarHBondContact O-CE2 3.45Å; A183-F212 HydrophobicContact CB-CE2 4.08Å; A183-F212 HydrophobicContact CB-CZ 4.23Å; E184-F212 HydrophobicContact CG-CZ 4.44Å; I206-F212 HydrophobicContact CG1-CE2 4.35Å; I206-F212 HydrophobicContact CG1-CZ 4.48Å; I206-F212 HydrophobicContact CG2-CB 4.37Å; I206-F212 HydrophobicContact CG2-CD1 3.41Å; I206-F212 VanDerWaalsContact CG2-CD1 3.41Å; I206-F212 HydrophobicContact CG2-CD2 4.17Å; I206-F212 HydrophobicContact CG2-CE1 3.59Å; I206-F212 HydrophobicContact CG2-CE2 4.32Å; I206-F212 HydrophobicContact CG2-CG 3.72Å; I206-F212 HydrophobicContact CG2-CZ 4.06Å; D209-F212 HydrophobicContact CB-CB 4.4Å; D209-F212 WeakPolarHBondContact O-CB 3.41Å; D209-F212 PolarHBondContact O-N 3.46Å; D209-F212 VanDerWaalsContact O-N 3.13Å; F212-L223 HydrophobicContact CD1-CD1 4.1Å; F212-L223 HydrophobicContact CE1-CD1 4.05Å
213	V	67.4	Low	73.6	Confident	114 Å²	114	72.2 Å²	72.2	69%	0.691	36%	0.362	S	S	*	.			trans	-105.2	112.2	170.4	-177.2	0	0	0	0	108.1	N211	N211-V213 PolarHBondContact O-N 3.44Å
214	S	65.9	Low	73.5	Confident	11 Å²	11	72.5 Å²	72.5	8%	0.077	36%	0.363	C	S	.	.			trans	-61.9	135.9	172.9	169.3	0	0	0	0	110.8	E184 E216 E217 K218	E184-S214 WeakPolarHBondContact OE1-CB 3.46Å; E184-S214 PolarHBondContact OE1-OG 3.35Å; E184-S214 PolarHBondContact OE2-OG 2.92Å; S214-E216 VanDerWaalsContact C-N 3.29Å; S214-E216 PolarHBondContact OG-N 2.88Å; S214-E217 PolarHBondContact O-N 3.44Å; S214-E217 PolarHBondContact OG-N 3.15Å; S214-E217 VanDerWaalsContact OG-N 3.17Å; S214-K218 WeakPolarHBondContact CB-O 3.31Å; S214-K218 PolarHBondContact OG-N 3.27Å; S214-K218 VanDerWaalsContact OG-N 3.1Å
215	R	65.9	Low	73.5	Confident	172 Å²	172	74.2 Å²	74.2	65%	0.649	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-23.5	169.2	-173.7	177.8	173.5	-175.9	-0.9	112.2	D182	D182-R215 WeakPolarHBondContact OD1-CD 3.46Å; D182-R215 IonicContact OD1-CZ 3.71Å; D182-R215 IonicContact OD1-NE 2.72Å; D182-R215 IonicContact OD1-NH1 3.44Å; D182-R215 PolarHBondContact OD1-NH1 3.35Å; D182-R215 IonicContact OD2-NH1 3.73Å; D182-R215 PolarHBondContact OD2-NH1 3.24Å
216	E	61.9	Low	73.5	Confident	75 Å²	75	71 Å²	71	35%	0.35	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	7.3	174.7	-60.7	-178	168.5	0	0	112.6	E184 S214 K218	E184-E216 VanDerWaalsContact OE2-CB 3.3Å; E184-E216 WeakPolarHBondContact OE2-CB 3.32Å; E184-E216 VanDerWaalsContact OE2-CG 3.26Å; E184-E216 WeakPolarHBondContact OE2-CG 3.34Å; E184-E216 PolarHBondContact OE2-N 2.98Å; S214-E216 VanDerWaalsContact C-N 3.29Å; S214-E216 PolarHBondContact OG-N 2.88Å; E216-K218 HydrophobicContact CB-CD 4.41Å; E216-K218 HydrophobicContact CB-CG 4.2Å; E216-K218 PolarHBondContact O-N 3.48Å; E216-K218 WeakPolarHBondContact OE2-CE 3.41Å; E216-K218 IonicContact OE2-NZ 2.94Å; E216-K218 PolarHBondContact OE2-NZ 3Å
217	E	70.8	Confident	73.7	Confident	175 Å²	175	71 Å²	71	82%	0.818	35%	0.354	S	S	*	.			trans	57.1	26.4	-178.1	-58.7	177.6	177.6	0	0	113.2	S214	S214-E217 PolarHBondContact O-N 3.44Å; S214-E217 PolarHBondContact OG-N 3.15Å; S214-E217 VanDerWaalsContact OG-N 3.17Å
218	K	71.8	Confident	73.9	Confident	41 Å²	41	70.7 Å²	70.7	18%	0.178	35%	0.352	C	S	.	.			trans	-72.4	132.1	174.6	-69.3	177.3	-179.9	169.5	0	110	S214 E216 Q222 L223 E226	S214-K218 WeakPolarHBondContact CB-O 3.31Å; S214-K218 PolarHBondContact OG-N 3.27Å; S214-K218 VanDerWaalsContact OG-N 3.1Å; E216-K218 HydrophobicContact CB-CD 4.41Å; E216-K218 HydrophobicContact CB-CG 4.2Å; E216-K218 PolarHBondContact O-N 3.48Å; E216-K218 WeakPolarHBondContact OE2-CE 3.41Å; E216-K218 IonicContact OE2-NZ 2.94Å; E216-K218 PolarHBondContact OE2-NZ 3Å; K218-Q222 HydrophobicContact CB-CB 4.48Å; K218-L223 HydrophobicContact CB-CD2 4.14Å; K218-L223 HydrophobicContact CB-CG 4.09Å; K218-L223 HydrophobicContact CD-CD2 4.06Å; K218-E226 WeakPolarHBondContact CD-OE1 3.34Å; K218-E226 VanDerWaalsContact CE-OE1 3.28Å; K218-E226 WeakPolarHBondContact CE-OE1 2.95Å; K218-E226 IonicContact NZ-OE1 3.93Å; K218-E226 PolarHBondContact NZ-OE1 3.48Å
219	T	77.7	Confident	74.2	Confident	69 Å²	69	71.2 Å²	71.2	42%	0.423	35%	0.352	S	S	.	.			trans	-71.7	152.6	174.5	60.2	0	0	0	0	110.5	H221 Q222 L223	T219-H221 PolarHBondContact O-N 3.32Å; T219-H221 VanDerWaalsContact O-N 3.11Å; T219-Q222 WeakPolarHBondContact O-CA 3.46Å; T219-Q222 WeakPolarHBondContact O-CB 3.33Å; T219-Q222 PolarHBondContact O-N 3.44Å; T219-Q222 VanDerWaalsContact OG1-CG 3.31Å; T219-Q222 WeakPolarHBondContact OG1-CG 3.2Å; T219-Q222 PolarHBondContact OG1-N 3.47Å; T219-L223 PolarHBondContact O-N 3.17Å
220	N	76	Confident	74.3	Confident	45 Å²	45	67.6 Å²	67.6	24%	0.241	33%	0.332	C	S	.	.	H	α-helix	trans	-53.9	-34	174.6	-69.8	-2.7	0	0	0	111.9	L223 W224	N220-L223 PolarHBondContact O-N 3.36Å; N220-W224 VanDerWaalsContact O-CB 3.27Å; N220-W224 WeakPolarHBondContact O-CB 3.32Å; N220-W224 PolarHBondContact O-N 3.36Å
221	H	73.3	Confident	75	Confident	81 Å²	81	61.8 Å²	61.8	38%	0.375	30%	0.301	S	S	.	.	H	α-helix	trans	-61.7	-45.8	172.3	-67.3	-98.1	0	0	0	112.6	T219 W224 H225 Y254	T219-H221 PolarHBondContact O-N 3.32Å; T219-H221 VanDerWaalsContact O-N 3.11Å; H221-W224 PolarHBondContact O-N 3.39Å; H221-H225 WeakPolarHBondContact O-CB 3.13Å; H221-H225 PolarHBondContact O-CD2 3.02Å; H221-H225 PolarHBondContact O-N 2.63Å; H221-Y254 AromaticContact CE1-CD1 2.95Å; H221-Y254 WeakPolarHBondContact CE1-CD1 3.41Å; H221-Y254 AromaticContact CE1-CE1 3.08Å; H221-Y254 WeakPolarHBondContact CE1-CE1 3.47Å; H221-Y254 AromaticContact CE1-CG 3.89Å; H221-Y254 AromaticContact CG-CE1 3.82Å; H221-Y254 AromaticContact ND1-CD1 3.11Å; H221-Y254 WeakPolarHBondContact ND1-CD1 3.18Å; H221-Y254 AromaticContact ND1-CE1 3.2Å; H221-Y254 WeakPolarHBondContact ND1-CE1 3.4Å; H221-Y254 AromaticContact ND1-CG 3.64Å; H221-Y254 AromaticContact ND1-CZ 3.84Å; H221-Y254 AromaticContact NE2-CD1 3.88Å; H221-Y254 AromaticContact NE2-CE1 3.56Å
222	Q	81.6	Confident	75.5	Confident	100 Å²	100	54.6 Å²	54.6	47%	0.467	26%	0.264	S	S	.	.	H	α-helix	trans	-64.4	-42.6	177.9	-75.2	167.6	-4.2	0	0	111.5	K218 T219 W224 H225 E226	K218-Q222 HydrophobicContact CB-CB 4.48Å; T219-Q222 WeakPolarHBondContact O-CA 3.46Å; T219-Q222 WeakPolarHBondContact O-CB 3.33Å; T219-Q222 PolarHBondContact O-N 3.44Å; T219-Q222 VanDerWaalsContact OG1-CG 3.31Å; T219-Q222 WeakPolarHBondContact OG1-CG 3.2Å; T219-Q222 PolarHBondContact OG1-N 3.47Å; Q222-W224 PolarHBondContact O-N 3.21Å; Q222-H225 PolarHBondContact O-N 3.03Å; Q222-E226 WeakPolarHBondContact O-CB 3.25Å; Q222-E226 WeakPolarHBondContact O-CG 3.37Å; Q222-E226 PolarHBondContact O-N 3.29Å
223	L	76.9	Confident	76.1	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-37.5	174.8	-67.3	171.2	0	0	0	111.7	E184 L203 I206 V207 F212 K218 T219 N220 E226 L227	E184-L223 HydrophobicContact CG-CD2 4.3Å; E184-L223 WeakPolarHBondContact OE1-CD2 3.39Å; L203-L223 HydrophobicContact CD2-CD2 4.38Å; I206-L223 HydrophobicContact CG2-CD1 3.75Å; V207-L223 HydrophobicContact CG2-CB 4.37Å; F212-L223 HydrophobicContact CD1-CD1 4.1Å; F212-L223 HydrophobicContact CE1-CD1 4.05Å; K218-L223 HydrophobicContact CB-CD2 4.14Å; K218-L223 HydrophobicContact CB-CG 4.09Å; K218-L223 HydrophobicContact CD-CD2 4.06Å; T219-L223 PolarHBondContact O-N 3.17Å; N220-L223 PolarHBondContact O-N 3.36Å; L223-E226 PolarHBondContact O-N 3.2Å; L223-L227 WeakPolarHBondContact O-CB 3.31Å; L223-L227 PolarHBondContact O-N 3.15Å
224	W	81.3	Confident	76.5	Confident	6 Å²	6	54.7 Å²	54.7	2%	0.023	26%	0.257	C	S	.	.	H	α-helix	trans	-71.4	-38.5	176	-168.2	71.6	0	0	0	113	V207 N220 H221 Q222 L227 C228 G250 Y254 L261	V207-W224 HydrophobicContact CG1-CB 4.44Å; V207-W224 VanDerWaalsContact CG1-CD1 3.46Å; V207-W224 HydrophobicContact CG1-CG 4.27Å; V207-W224 HydrophobicContact CG2-CB 4.12Å; N220-W224 VanDerWaalsContact O-CB 3.27Å; N220-W224 WeakPolarHBondContact O-CB 3.32Å; N220-W224 PolarHBondContact O-N 3.36Å; H221-W224 PolarHBondContact O-N 3.39Å; Q222-W224 PolarHBondContact O-N 3.21Å; W224-L227 WeakPolarHBondContact O-CB 3.06Å; W224-L227 PolarHBondContact O-N 2.97Å; W224-C228 VanDerWaalsContact CE2-SG 3.53Å; W224-C228 WeakPolarHBondContact CH2-SG 3.32Å; W224-C228 WeakPolarHBondContact CZ2-SG 3.38Å; W224-C228 PolarHBondContact O-N 3.26Å; W224-C228 PolarHBondContact O-SG 3.12Å; W224-G250 VanDerWaalsContact CH2-CA 3.47Å; W224-Y254 HydrophobicContact CB-CE2 3.92Å; W224-Y254 AromaticContact CD2-CD2 3.81Å; W224-Y254 HydrophobicContact CD2-CD2 3.81Å; W224-Y254 AromaticContact CD2-CE2 3.64Å; W224-Y254 HydrophobicContact CD2-CE2 3.64Å; W224-Y254 AromaticContact CE3-CD2 3.45Å; W224-Y254 HydrophobicContact CE3-CD2 3.45Å; W224-Y254 VanDerWaalsContact CE3-CD2 3.45Å; W224-Y254 AromaticContact CE3-CE2 3.72Å; W224-Y254 HydrophobicContact CE3-CE2 3.72Å; W224-Y254 HydrophobicContact CG-CD2 4.33Å; W224-Y254 AromaticContact CG-CE2 3.67Å; W224-Y254 HydrophobicContact CG-CE2 3.67Å; W224-Y254 AromaticContact CZ3-CD2 3.84Å; W224-Y254 HydrophobicContact CZ3-CD2 3.84Å; W224-Y254 HydrophobicContact CZ3-CE2 4.5Å; W224-L261 HydrophobicContact CE3-CD2 4.12Å; W224-L261 HydrophobicContact CH2-CB 4.41Å; W224-L261 HydrophobicContact CH2-CD1 3.5Å; W224-L261 HydrophobicContact CH2-CD2 3.38Å; W224-L261 HydrophobicContact CH2-CG 3.84Å; W224-L261 HydrophobicContact CZ3-CD1 3.3Å; W224-L261 HydrophobicContact CZ3-CD2 3.07Å; W224-L261 HydrophobicContact CZ3-CG 3.67Å
225	H	81.5	Confident	76.9	Confident	49 Å²	49	54.7 Å²	54.7	23%	0.227	26%	0.257	C	S	.	.	H	α-helix	trans	-64.5	-41.3	170.7	-82	-68.4	0	0	0	111.8	H221 Q222 L227 C228 E229 Q257	H221-H225 WeakPolarHBondContact O-CB 3.13Å; H221-H225 PolarHBondContact O-CD2 3.02Å; H221-H225 PolarHBondContact O-N 2.63Å; Q222-H225 PolarHBondContact O-N 3.03Å; H225-L227 VanDerWaalsContact C-N 3.29Å; H225-L227 PolarHBondContact O-N 3.45Å; H225-C228 PolarHBondContact O-N 3.39Å; H225-E229 VanDerWaalsContact O-CB 3.27Å; H225-E229 WeakPolarHBondContact O-CB 3.28Å; H225-E229 PolarHBondContact O-N 2.89Å; H225-Q257 PolarHBondContact CE1-OE1 3.21Å; H225-Q257 PolarHBondContact NE2-OE1 2.84Å; H225-Q257 VanDerWaalsContact NE2-OE1 3.14Å
226	E	81.5	Confident	77.1	Confident	37 Å²	37	51.3 Å²	51.3	17%	0.173	26%	0.259	C	S	.	.	H	α-helix	trans	-60.7	-40.1	173.7	-78.6	-164.2	-156.1	0	0	111.5	K191 K218 Q222 L223 L230	K191-E226 IonicContact NZ-OE2 3.58Å; K191-E226 PolarHBondContact NZ-OE2 2.63Å; K218-E226 WeakPolarHBondContact CD-OE1 3.34Å; K218-E226 VanDerWaalsContact CE-OE1 3.28Å; K218-E226 WeakPolarHBondContact CE-OE1 2.95Å; K218-E226 IonicContact NZ-OE1 3.93Å; K218-E226 PolarHBondContact NZ-OE1 3.48Å; Q222-E226 WeakPolarHBondContact O-CB 3.25Å; Q222-E226 WeakPolarHBondContact O-CG 3.37Å; Q222-E226 PolarHBondContact O-N 3.29Å; L223-E226 PolarHBondContact O-N 3.2Å; E226-L230 VanDerWaalsContact O-CB 3.29Å; E226-L230 WeakPolarHBondContact O-CB 3.25Å; E226-L230 WeakPolarHBondContact O-CG 3.29Å; E226-L230 PolarHBondContact O-N 3.38Å
227	L	82.2	Confident	77.6	Confident	7 Å²	7	51.4 Å²	51.4	4%	0.037	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-49.4	173.2	177.7	142.5	0	0	0	110.7	L203 A204 L223 W224 H225 E229 L230 V231 I246	L203-L227 HydrophobicContact CB-CB 4.2Å; L203-L227 HydrophobicContact CB-CD1 3.76Å; L203-L227 HydrophobicContact CB-CG 4.43Å; L203-L227 HydrophobicContact CD1-CB 4.38Å; A204-L227 HydrophobicContact CB-CD1 3.85Å; L223-L227 WeakPolarHBondContact O-CB 3.31Å; L223-L227 PolarHBondContact O-N 3.15Å; W224-L227 WeakPolarHBondContact O-CB 3.06Å; W224-L227 PolarHBondContact O-N 2.97Å; H225-L227 VanDerWaalsContact C-N 3.29Å; H225-L227 PolarHBondContact O-N 3.45Å; L227-E229 VanDerWaalsContact C-N 3.33Å; L227-E229 PolarHBondContact O-N 2.82Å; L227-L230 PolarHBondContact O-N 3.02Å; L227-V231 WeakPolarHBondContact O-CB 3.24Å; L227-V231 WeakPolarHBondContact O-CG2 3.41Å; L227-V231 PolarHBondContact O-N 2.98Å; L227-I246 HydrophobicContact CD2-CG2 3.86Å
228	C	79.5	Confident	77.7	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.014	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-41.6	179.1	-68.6	0	0	0	0	111.9	W224 H225 V231 A232	W224-C228 VanDerWaalsContact CE2-SG 3.53Å; W224-C228 WeakPolarHBondContact CH2-SG 3.32Å; W224-C228 WeakPolarHBondContact CZ2-SG 3.38Å; W224-C228 PolarHBondContact O-N 3.26Å; W224-C228 PolarHBondContact O-SG 3.12Å; H225-C228 PolarHBondContact O-N 3.39Å; C228-V231 PolarHBondContact O-N 2.96Å; C228-A232 WeakPolarHBondContact O-CB 3.48Å; C228-A232 PolarHBondContact O-N 3.45Å
229	E	82.5	Confident	77.6	Confident	100 Å²	100	46.8 Å²	46.8	47%	0.467	25%	0.246	S	C	.	.	H	α-helix	trans	-68.1	-41.5	179	-169.9	-174.9	178.1	0	0	111.6	H225 L227 V231 K233	H225-E229 VanDerWaalsContact O-CB 3.27Å; H225-E229 WeakPolarHBondContact O-CB 3.28Å; H225-E229 PolarHBondContact O-N 2.89Å; L227-E229 VanDerWaalsContact C-N 3.33Å; L227-E229 PolarHBondContact O-N 2.82Å; E229-V231 VanDerWaalsContact C-N 3.32Å; E229-V231 PolarHBondContact O-N 3.16Å; E229-K233 HydrophobicContact CG-CD 3.99Å; E229-K233 HydrophobicContact CG-CG 4.43Å; E229-K233 WeakPolarHBondContact O-CB 3.39Å; E229-K233 VanDerWaalsContact O-CG 3.22Å; E229-K233 WeakPolarHBondContact O-CG 3.45Å; E229-K233 PolarHBondContact O-N 3.42Å; E229-K233 WeakPolarHBondContact OE1-CE 3.46Å; E229-K233 IonicContact OE1-NZ 3.95Å; E229-K233 PolarHBondContact OE1-NZ 2.99Å
230	L	81.3	Confident	77	Confident	21 Å²	21	45.8 Å²	45.8	11%	0.11	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-44.7	174.9	-89.6	174.8	0	0	0	112	K191 L196 L203 E226 L227 K233 N234	K191-L230 HydrophobicContact CD-CD1 4.23Å; K191-L230 HydrophobicContact CD-CD2 4.16Å; K191-L230 HydrophobicContact CG-CD1 4.28Å; K191-L230 HydrophobicContact CG-CD2 4Å; L196-L230 HydrophobicContact CD2-CD2 4.36Å; L203-L230 HydrophobicContact CD1-CD1 3.35Å; E226-L230 VanDerWaalsContact O-CB 3.29Å; E226-L230 WeakPolarHBondContact O-CB 3.25Å; E226-L230 WeakPolarHBondContact O-CG 3.29Å; E226-L230 PolarHBondContact O-N 3.38Å; L227-L230 PolarHBondContact O-N 3.02Å; L230-K233 PolarHBondContact O-N 2.82Å; L230-N234 PolarHBondContact O-N 3.06Å; L230-N234 PolarHBondContact O-ND2 3.13Å
231	V	81.2	Confident	76.7	Confident	9 Å²	9	47 Å²	47	6%	0.055	25%	0.245	C	C	.	.	H	α-helix	trans	-69.5	-48.4	-178.9	173.4	0	0	0	0	110.4	L227 C228 E229 K233 N234 V243 Y268	L227-V231 WeakPolarHBondContact O-CB 3.24Å; L227-V231 WeakPolarHBondContact O-CG2 3.41Å; L227-V231 PolarHBondContact O-N 2.98Å; C228-V231 PolarHBondContact O-N 2.96Å; E229-V231 VanDerWaalsContact C-N 3.32Å; E229-V231 PolarHBondContact O-N 3.16Å; V231-K233 PolarHBondContact O-N 3.16Å; V231-N234 CarbonylContact O-C 3.59Å; V231-N234 PolarHBondContact O-N 3.34Å; V231-V243 HydrophobicContact CG1-CB 3.85Å; V231-V243 HydrophobicContact CG1-CG1 3.24Å; V231-V243 HydrophobicContact CG1-CG2 3.29Å; V231-Y268 HydrophobicContact CG1-CD2 4Å; V231-Y268 HydrophobicContact CG1-CE2 4.16Å; V231-Y268 WeakPolarHBondContact O-CD2 3.21Å
232	A	78.7	Confident	76.7	Confident	6 Å²	6	51.5 Å²	51.5	5%	0.05	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-34.7	176.2	0	0	0	0	0	111.7	C228 A264 R271	C228-A232 WeakPolarHBondContact O-CB 3.48Å; C228-A232 PolarHBondContact O-N 3.45Å; A232-A264 HydrophobicContact CB-CB 4.18Å; A232-A264 WeakPolarHBondContact CB-O 3.18Å; A232-R271 WeakPolarHBondContact O-CD 3.25Å; A232-R271 PolarHBondContact O-NE 3Å
233	K	80.4	Confident	76.4	Confident	95 Å²	95	47 Å²	47	41%	0.413	24%	0.243	S	C	.	.	H	α-helix	trans	-73.3	-34.2	-179.4	-78.7	177.2	174.8	175	0	114.1	E229 L230 V231 R271	E229-K233 HydrophobicContact CG-CD 3.99Å; E229-K233 HydrophobicContact CG-CG 4.43Å; E229-K233 WeakPolarHBondContact O-CB 3.39Å; E229-K233 VanDerWaalsContact O-CG 3.22Å; E229-K233 WeakPolarHBondContact O-CG 3.45Å; E229-K233 PolarHBondContact O-N 3.42Å; E229-K233 WeakPolarHBondContact OE1-CE 3.46Å; E229-K233 IonicContact OE1-NZ 3.95Å; E229-K233 PolarHBondContact OE1-NZ 2.99Å; L230-K233 PolarHBondContact O-N 2.82Å; V231-K233 PolarHBondContact O-N 3.16Å; K233-R271 PolarHBondContact O-NH1 3.41Å
234	N	75.6	Confident	76.6	Confident	46 Å²	46	50 Å²	50	25%	0.246	26%	0.257	C	S	.	.			trans	-132.7	71.8	-170.1	-58.3	-76.8	0	0	0	113.4	L196 L230 V231 S236 K237	L196-N234 HydrophobicContact CD1-CB 3.5Å; L196-N234 VanDerWaalsContact CD1-ND2 3.27Å; L196-N234 WeakPolarHBondContact CD1-ND2 3.07Å; L230-N234 PolarHBondContact O-N 3.06Å; L230-N234 PolarHBondContact O-ND2 3.13Å; V231-N234 CarbonylContact O-C 3.59Å; V231-N234 PolarHBondContact O-N 3.34Å; N234-S236 VanDerWaalsContact C-N 3.35Å; N234-S236 PolarHBondContact O-N 3.3Å; N234-K237 HydrophobicContact CB-CB 4.31Å; N234-K237 HydrophobicContact CB-CD 4.47Å; N234-K237 PolarHBondContact O-N 3.15Å
235	P	72.9	Confident	76.6	Confident	12 Å²	12	53 Å²	53	8%	0.078	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-60.6	-40	180	-22.8	32.1	0	0	0	114.1	K237 V238 Y268 R271 D272	P235-K237 VanDerWaalsContact C-N 3.27Å; P235-K237 PolarHBondContact O-N 3.05Å; P235-V238 PolarHBondContact O-N 3.39Å; P235-Y268 HydrophobicContact CB-CD2 3.74Å; P235-Y268 HydrophobicContact CB-CE2 3.5Å; P235-Y268 HydrophobicContact CG-CD2 3.74Å; P235-Y268 HydrophobicContact CG-CE2 4.05Å; P235-Y268 HydrophobicContact CG-CG 4.39Å; P235-Y268 VanDerWaalsContact CG-O 3.28Å; P235-Y268 WeakPolarHBondContact CG-O 3.15Å; P235-R271 HydrophobicContact CG-CB 3.59Å; P235-D272 HydrophobicContact CB-CB 4.17Å
236	S	71.2	Confident	76.4	Confident	100 Å²	100	52.5 Å²	52.5	70%	0.699	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-70.3	-21.6	-174.9	58.8	0	0	0	0	114.4	N234	N234-S236 VanDerWaalsContact C-N 3.35Å; N234-S236 PolarHBondContact O-N 3.3Å
237	K	72.9	Confident	76.4	Confident	77 Å²	77	50.8 Å²	50.8	34%	0.335	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-98	-7.2	-176.6	-69.3	178.4	172.5	176	0	113.1	D194 L196 D197 N234 P235	D194-K237 IonicContact OD1-NZ 3.2Å; D194-K237 PolarHBondContact OD1-NZ 3.29Å; L196-K237 HydrophobicContact CB-CB 4.23Å; L196-K237 HydrophobicContact CD1-CB 4.11Å; L196-K237 HydrophobicContact CD1-CD 3.46Å; L196-K237 VanDerWaalsContact CD1-CD 3.46Å; L196-K237 HydrophobicContact CD1-CG 4.44Å; L196-K237 HydrophobicContact CG-CD 4.06Å; D197-K237 WeakPolarHBondContact CB-O 3.41Å; N234-K237 HydrophobicContact CB-CB 4.31Å; N234-K237 HydrophobicContact CB-CD 4.47Å; N234-K237 PolarHBondContact O-N 3.15Å; P235-K237 VanDerWaalsContact C-N 3.27Å; P235-K237 PolarHBondContact O-N 3.05Å
238	V	71.9	Confident	76.4	Confident	6 Å²	6	53.3 Å²	53.3	4%	0.036	28%	0.281	C	S	.	.			trans	-110.8	89.4	178.7	-175.7	0	0	0	0	108.8	D197 A200 P235	D197-V238 WeakPolarHBondContact OD1-CA 3.22Å; A200-V238 HydrophobicContact CB-CG1 4.26Å; A200-V238 HydrophobicContact CB-CG2 4.45Å; P235-V238 PolarHBondContact O-N 3.39Å
239	T	70.5	Confident	76.4	Confident	114 Å²	114	57.1 Å²	57.1	70%	0.699	30%	0.299	S	S	*	.			trans	-93.3	-21.6	179.9	58.6	0	0	0	0	112.7	D197 F241	D197-T239 PolarHBondContact OD1-N 2.97Å; D197-T239 PolarHBondContact OD2-N 3.07Å; D197-T239 PolarHBondContact OD2-OG1 3.32Å; T239-F241 PolarHBondContact O-N 3.43Å
240	S	65.4	Low	76.1	Confident	47 Å²	47	52.4 Å²	52.4	33%	0.329	28%	0.277	S	S	.	.	S	Bend	trans	-77.9	-19.2	-165.5	50.5	0	0	0	0	115.4	D197 Q201	D197-S240 PolarHBondContact OD1-N 2.94Å; D197-S240 VanDerWaalsContact OD1-N 3.13Å; D197-S240 PolarHBondContact OD1-OG 2.48Å; Q201-S240 PolarHBondContact NE2-OG 3.48Å
241	F	68.2	Low	75.9	Confident	70 Å²	70	52.7 Å²	52.7	31%	0.307	28%	0.278	S	S	.	.	S	Bend	trans	-125.7	145.5	179.8	-61.4	-73.9	0	0	0	112.2	Q201 A204 T239 V243 I246	Q201-F241 HydrophobicContact CB-CE2 3.97Å; Q201-F241 HydrophobicContact CB-CZ 4.06Å; Q201-F241 HydrophobicContact CG-CD2 4.39Å; Q201-F241 HydrophobicContact CG-CE2 3.29Å; Q201-F241 HydrophobicContact CG-CZ 3.5Å; A204-F241 HydrophobicContact CB-CE2 4.42Å; A204-F241 HydrophobicContact CB-CZ 4.14Å; T239-F241 PolarHBondContact O-N 3.43Å; F241-V243 PolarHBondContact O-N 2.85Å; F241-I246 HydrophobicContact CB-CD1 3.67Å; F241-I246 HydrophobicContact CD1-CD1 4.04Å; F241-I246 HydrophobicContact CG-CD1 3.86Å
242	K	73.1	Confident	75.6	Confident	176 Å²	176	56.9 Å²	56.9	77%	0.765	31%	0.308	S	S	*	.			trans	-71.4	110.8	156.9	-65.1	-176.5	-178.8	-179.4	0	106.5	P245	K242-P245 HydrophobicContact CB-CG 3.77Å; K242-P245 VanDerWaalsContact O-CD 3.23Å; K242-P245 WeakPolarHBondContact O-CD 2.93Å; K242-P245 VanDerWaalsContact O-CG 3.23Å; K242-P245 WeakPolarHBondContact O-CG 3.43Å
243	V	76.5	Confident	75.6	Confident	6 Å²	6	62 Å²	62	4%	0.036	33%	0.326	C	S	.	.	H	α-helix	trans	-66.5	-41.9	-174.8	167.3	0	0	0	0	112.1	V231 F241 I246 I247 Y268	V231-V243 HydrophobicContact CG1-CB 3.85Å; V231-V243 HydrophobicContact CG1-CG1 3.24Å; V231-V243 HydrophobicContact CG1-CG2 3.29Å; F241-V243 PolarHBondContact O-N 2.85Å; V243-I246 PolarHBondContact O-N 2.65Å; V243-I246 VanDerWaalsContact O-N 3.11Å; V243-I247 HydrophobicContact CG1-CD1 3.56Å; V243-I247 HydrophobicContact CG1-CG1 4.14Å; V243-I247 PolarHBondContact O-N 3.39Å; V243-I247 VanDerWaalsContact O-N 3.11Å; V243-Y268 HydrophobicContact CB-CD1 4.39Å; V243-Y268 HydrophobicContact CB-CD2 4.4Å; V243-Y268 HydrophobicContact CB-CE1 3.98Å; V243-Y268 HydrophobicContact CB-CE2 3.98Å; V243-Y268 HydrophobicContact CG1-CD1 4.08Å; V243-Y268 HydrophobicContact CG1-CD2 3.96Å; V243-Y268 HydrophobicContact CG1-CE1 4.18Å; V243-Y268 HydrophobicContact CG1-CE2 4.05Å; V243-Y268 HydrophobicContact CG1-CG 3.97Å; V243-Y268 HydrophobicContact CG2-CD2 4.26Å; V243-Y268 HydrophobicContact CG2-CE1 4.31Å; V243-Y268 HydrophobicContact CG2-CE2 3.53Å
244	E	80.4	Confident	75.2	Confident	64 Å²	64	59 Å²	59	30%	0.299	31%	0.312	S	S	.	.	H	α-helix	trans	-52.7	-53.1	-176.7	-173.5	178	159	0	0	114.4	I246 I247 L248 L265 Y269	E244-I246 PolarHBondContact O-N 3.26Å; E244-I247 PolarHBondContact O-N 3.27Å; E244-L248 HydrophobicContact CG-CD1 3.83Å; E244-L248 HydrophobicContact CG-CG 4.33Å; E244-L248 WeakPolarHBondContact O-CB 3.46Å; E244-L248 VanDerWaalsContact O-CG 3.28Å; E244-L248 WeakPolarHBondContact O-CG 3.27Å; E244-L248 PolarHBondContact O-N 2.95Å; E244-L265 HydrophobicContact CB-CD1 4.32Å; E244-L265 HydrophobicContact CG-CD1 4.43Å; E244-Y269 PolarHBondContact OE2-OH 3.22Å
245	P	82	Confident	75.2	Confident	70 Å²	70	60.8 Å²	60.8	46%	0.455	33%	0.328	S	S	.	.	H	α-helix	trans	-63.4	-28.7	179.4	24.7	-35.8	0	0	0	113.4	K242 Q249	K242-P245 HydrophobicContact CB-CG 3.77Å; K242-P245 VanDerWaalsContact O-CD 3.23Å; K242-P245 WeakPolarHBondContact O-CD 2.93Å; K242-P245 VanDerWaalsContact O-CG 3.23Å; K242-P245 WeakPolarHBondContact O-CG 3.43Å; P245-Q249 WeakPolarHBondContact O-CB 3.04Å; P245-Q249 PolarHBondContact O-N 3.02Å
246	I	77.4	Confident	75.2	Confident	38 Å²	38	66.4 Å²	66.4	20%	0.195	36%	0.357	C	S	.	.	H	α-helix	trans	-71.5	-44.6	178.8	-61.3	173.4	0	0	0	110.2	L227 F241 V243 E244 Q249 G250	L227-I246 HydrophobicContact CD2-CG2 3.86Å; F241-I246 HydrophobicContact CB-CD1 3.67Å; F241-I246 HydrophobicContact CD1-CD1 4.04Å; F241-I246 HydrophobicContact CG-CD1 3.86Å; V243-I246 PolarHBondContact O-N 2.65Å; V243-I246 VanDerWaalsContact O-N 3.11Å; E244-I246 PolarHBondContact O-N 3.26Å; I246-Q249 PolarHBondContact O-N 3.18Å; I246-G250 PolarHBondContact O-N 3.24Å
247	I	80.7	Confident	75.3	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-68.7	-41.5	178.4	-59	178.5	0	0	0	110.3	V243 E244 Q249 G250 I251 L261 L265	V243-I247 HydrophobicContact CG1-CD1 3.56Å; V243-I247 HydrophobicContact CG1-CG1 4.14Å; V243-I247 PolarHBondContact O-N 3.39Å; V243-I247 VanDerWaalsContact O-N 3.11Å; E244-I247 PolarHBondContact O-N 3.27Å; I247-Q249 VanDerWaalsContact C-N 3.32Å; I247-Q249 PolarHBondContact O-N 3.48Å; I247-G250 PolarHBondContact O-N 2.89Å; I247-G250 VanDerWaalsContact O-N 3.15Å; I247-I251 HydrophobicContact CG2-CD1 4.14Å; I247-I251 WeakPolarHBondContact O-CG1 3.18Å; I247-I251 PolarHBondContact O-N 3.25Å; I247-L261 HydrophobicContact CG2-CB 4.26Å; I247-L265 HydrophobicContact CB-CB 4.47Å; I247-L265 HydrophobicContact CB-CD1 4.25Å; I247-L265 HydrophobicContact CD1-CB 4.1Å; I247-L265 HydrophobicContact CD1-CD1 3.85Å; I247-L265 HydrophobicContact CG2-CB 3.97Å
248	L	81.8	Confident	75.8	Confident	59 Å²	59	63.7 Å²	63.7	31%	0.309	34%	0.336	S	S	.	.	H	α-helix	trans	-62.2	-38.6	173.5	-68.4	176.6	0	0	0	112.3	E244 G250 I251 S252 W262 L265	E244-L248 HydrophobicContact CG-CD1 3.83Å; E244-L248 HydrophobicContact CG-CG 4.33Å; E244-L248 WeakPolarHBondContact O-CB 3.46Å; E244-L248 VanDerWaalsContact O-CG 3.28Å; E244-L248 WeakPolarHBondContact O-CG 3.27Å; E244-L248 PolarHBondContact O-N 2.95Å; L248-G250 VanDerWaalsContact C-N 3.32Å; L248-G250 PolarHBondContact O-N 3.14Å; L248-I251 HydrophobicContact CD2-CD1 4.06Å; L248-I251 PolarHBondContact O-N 2.87Å; L248-S252 PolarHBondContact O-N 3.05Å; L248-S252 VanDerWaalsContact O-N 3.1Å; L248-W262 HydrophobicContact CD2-CH2 3.46Å; L248-W262 VanDerWaalsContact CD2-CH2 3.46Å; L248-W262 HydrophobicContact CD2-CZ2 3.99Å; L248-W262 HydrophobicContact CD2-CZ3 3.95Å; L248-L265 HydrophobicContact CD2-CD2 4.42Å
249	Q	80.9	Confident	76.4	Confident	83 Å²	83	63.4 Å²	63.4	39%	0.388	33%	0.334	S	S	.	.	H	α-helix	trans	-61.9	-41.4	174	-176.4	176.2	19.6	0	0	111	P245 I246 I247 S252 R253	P245-Q249 WeakPolarHBondContact O-CB 3.04Å; P245-Q249 PolarHBondContact O-N 3.02Å; I246-Q249 PolarHBondContact O-N 3.18Å; I247-Q249 VanDerWaalsContact C-N 3.32Å; I247-Q249 PolarHBondContact O-N 3.48Å; Q249-S252 PolarHBondContact O-N 2.84Å; Q249-S252 PolarHBondContact O-OG 3.31Å; Q249-R253 VanDerWaalsContact NE2-NH2 3.17Å; Q249-R253 WeakPolarHBondContact O-CG 3.19Å; Q249-R253 PolarHBondContact O-N 3.22Å
250	G	75.1	Confident	77	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-76.3	-25.6	176.7	0	0	0	0	0	114.8	W224 I246 I247 L248 S252 R253 Y254	W224-G250 VanDerWaalsContact CH2-CA 3.47Å; I246-G250 PolarHBondContact O-N 3.24Å; I247-G250 PolarHBondContact O-N 2.89Å; I247-G250 VanDerWaalsContact O-N 3.15Å; L248-G250 VanDerWaalsContact C-N 3.32Å; L248-G250 PolarHBondContact O-N 3.14Å; G250-S252 PolarHBondContact O-N 2.9Å; G250-R253 PolarHBondContact O-N 3.32Å; G250-Y254 WeakPolarHBondContact O-CB 3.43Å; G250-Y254 PolarHBondContact O-N 2.97Å
251	I	77.7	Confident	77.9	Confident	27 Å²	27	57.8 Å²	57.8	14%	0.138	30%	0.302	C	S	.	.	H	α-helix	trans	-59.3	-36.4	165.8	-71.1	158.6	0	0	0	110.3	I247 L248 V258 L261 W262	I247-I251 HydrophobicContact CG2-CD1 4.14Å; I247-I251 WeakPolarHBondContact O-CG1 3.18Å; I247-I251 PolarHBondContact O-N 3.25Å; L248-I251 HydrophobicContact CD2-CD1 4.06Å; L248-I251 PolarHBondContact O-N 2.87Å; I251-V258 HydrophobicContact CG2-CG1 3.83Å; I251-V258 HydrophobicContact CG2-CG2 4.27Å; I251-L261 HydrophobicContact CD1-CB 4.28Å; I251-L261 HydrophobicContact CG1-CB 3.72Å; I251-L261 HydrophobicContact CG1-CD1 4.04Å; I251-W262 HydrophobicContact CD1-CD2 3.73Å; I251-W262 HydrophobicContact CD1-CE3 4.27Å; I251-W262 HydrophobicContact CD1-CG 4.06Å; I251-W262 HydrophobicContact CD1-CH2 4.49Å; I251-W262 HydrophobicContact CD1-CZ2 3.96Å
252	S	75.3	Confident	79	Confident	97 Å²	97	54.7 Å²	54.7	68%	0.678	29%	0.289	S	S	*	.	H	α-helix	trans	-75.7	-32	176.4	77.1	0	0	0	0	114.1	L248 Q249 G250	L248-S252 PolarHBondContact O-N 3.05Å; L248-S252 VanDerWaalsContact O-N 3.1Å; Q249-S252 PolarHBondContact O-N 2.84Å; Q249-S252 PolarHBondContact O-OG 3.31Å; G250-S252 PolarHBondContact O-N 2.9Å
253	R	77.1	Confident	79.6	Confident	115 Å²	115	47.4 Å²	47.4	43%	0.434	26%	0.259	S	S	.	.	H	α-helix	trans	-81.4	-34.7	179.9	-72.1	-178.2	175	-175.3	-1.4	112.5	Q249 G250	Q249-R253 VanDerWaalsContact NE2-NH2 3.17Å; Q249-R253 WeakPolarHBondContact O-CG 3.19Å; Q249-R253 PolarHBondContact O-N 3.22Å; G250-R253 PolarHBondContact O-N 3.32Å
254	Y	72.6	Confident	80	Confident	32 Å²	32	47.9 Å²	47.9	13%	0.125	26%	0.264	C	S	.	.			trans	-122.1	93	-171.1	-55.3	-50.9	0	0	0	110.5	H221 W224 G250 D256	H221-Y254 AromaticContact CE1-CD1 2.95Å; H221-Y254 WeakPolarHBondContact CE1-CD1 3.41Å; H221-Y254 AromaticContact CE1-CE1 3.08Å; H221-Y254 WeakPolarHBondContact CE1-CE1 3.47Å; H221-Y254 AromaticContact CE1-CG 3.89Å; H221-Y254 AromaticContact CG-CE1 3.82Å; H221-Y254 AromaticContact ND1-CD1 3.11Å; H221-Y254 WeakPolarHBondContact ND1-CD1 3.18Å; H221-Y254 AromaticContact ND1-CE1 3.2Å; H221-Y254 WeakPolarHBondContact ND1-CE1 3.4Å; H221-Y254 AromaticContact ND1-CG 3.64Å; H221-Y254 AromaticContact ND1-CZ 3.84Å; H221-Y254 AromaticContact NE2-CD1 3.88Å; H221-Y254 AromaticContact NE2-CE1 3.56Å; W224-Y254 HydrophobicContact CB-CE2 3.92Å; W224-Y254 AromaticContact CD2-CD2 3.81Å; W224-Y254 HydrophobicContact CD2-CD2 3.81Å; W224-Y254 AromaticContact CD2-CE2 3.64Å; W224-Y254 HydrophobicContact CD2-CE2 3.64Å; W224-Y254 AromaticContact CE3-CD2 3.45Å; W224-Y254 HydrophobicContact CE3-CD2 3.45Å; W224-Y254 VanDerWaalsContact CE3-CD2 3.45Å; W224-Y254 AromaticContact CE3-CE2 3.72Å; W224-Y254 HydrophobicContact CE3-CE2 3.72Å; W224-Y254 HydrophobicContact CG-CD2 4.33Å; W224-Y254 AromaticContact CG-CE2 3.67Å; W224-Y254 HydrophobicContact CG-CE2 3.67Å; W224-Y254 AromaticContact CZ3-CD2 3.84Å; W224-Y254 HydrophobicContact CZ3-CD2 3.84Å; W224-Y254 HydrophobicContact CZ3-CE2 4.5Å; G250-Y254 WeakPolarHBondContact O-CB 3.43Å; G250-Y254 PolarHBondContact O-N 2.97Å; Y254-D256 PolarHBondContact O-N 3.45Å
255	S	76.1	Confident	80.3	Confident	83 Å²	83	44.9 Å²	44.9	58%	0.58	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-67.4	-17.8	178	48.6	0	0	0	0	114.1	V258	S255-V258 WeakPolarHBondContact O-CG2 3.38Å
256	D	71.6	Confident	80.6	Confident	129 Å²	129	41.5 Å²	41.5	69%	0.69	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-85.5	-17.1	-160.9	-59.6	-10.6	0	0	0	113.4	Y254	Y254-D256 PolarHBondContact O-N 3.45Å
257	Q	74.8	Confident	81	Confident	100 Å²	100	42.7 Å²	42.7	47%	0.467	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-137.9	37.1	179.9	-60.5	-170	14.3	0	0	112.5	H225 G259 A260 L261	H225-Q257 PolarHBondContact CE1-OE1 3.21Å; H225-Q257 PolarHBondContact NE2-OE1 2.84Å; H225-Q257 VanDerWaalsContact NE2-OE1 3.14Å; Q257-G259 PolarHBondContact O-N 3.12Å; Q257-A260 HydrophobicContact CB-CB 4.38Å; Q257-A260 PolarHBondContact O-N 2.72Å; Q257-A260 VanDerWaalsContact O-N 3.12Å; Q257-L261 WeakPolarHBondContact O-CG 3.42Å; Q257-L261 PolarHBondContact O-N 3.06Å
258	V	82.7	Confident	81.3	Confident	20 Å²	20	44.1 Å²	44.1	12%	0.121	24%	0.24	C	C	.	.	H	α-helix	trans	-54.5	-39.4	-178.6	174.6	0	0	0	0	111.4	I251 S255 A260 L261 W262	I251-V258 HydrophobicContact CG2-CG1 3.83Å; I251-V258 HydrophobicContact CG2-CG2 4.27Å; S255-V258 WeakPolarHBondContact O-CG2 3.38Å; V258-A260 PolarHBondContact O-N 3.26Å; V258-L261 PolarHBondContact O-N 2.86Å; V258-W262 VanDerWaalsContact CG1-CD1 3.41Å; V258-W262 PolarHBondContact O-N 3.31Å; V258-W262 VanDerWaalsContact O-N 3.1Å
259	G	83.4	Confident	81.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-55.5	-49.9	176.2	0	0	0	0	0	113.8	Q257 L261 W262 C263 D294	Q257-G259 PolarHBondContact O-N 3.12Å; G259-L261 VanDerWaalsContact C-N 3.28Å; G259-L261 PolarHBondContact O-N 3.18Å; G259-W262 PolarHBondContact O-N 3.06Å; G259-C263 PolarHBondContact O-N 3.03Å; G259-C263 VanDerWaalsContact O-N 3.07Å; G259-C263 PolarHBondContact O-SG 2.91Å; G259-D294 WeakPolarHBondContact CA-OD1 3.37Å; G259-D294 PolarHBondContact N-OD1 3.04Å
260	A	84.8	Confident	81.9	Confident	41 Å²	41	40.1 Å²	40.1	34%	0.339	22%	0.22	S	C	.	.	H	α-helix	trans	-64.5	-32.8	-178.8	0	0	0	0	0	112.6	Q257 V258 C263 A264	Q257-A260 HydrophobicContact CB-CB 4.38Å; Q257-A260 PolarHBondContact O-N 2.72Å; Q257-A260 VanDerWaalsContact O-N 3.12Å; V258-A260 PolarHBondContact O-N 3.26Å; A260-C263 PolarHBondContact O-N 2.89Å; A260-A264 WeakPolarHBondContact O-CB 3.49Å; A260-A264 PolarHBondContact O-N 2.87Å
261	L	84.5	Confident	82.4	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-76.8	-39.6	-177.8	-58.2	168.7	0	0	0	112.5	W224 I247 I251 Q257 V258 G259 C263 A264 L265	W224-L261 HydrophobicContact CE3-CD2 4.12Å; W224-L261 HydrophobicContact CH2-CB 4.41Å; W224-L261 HydrophobicContact CH2-CD1 3.5Å; W224-L261 HydrophobicContact CH2-CD2 3.38Å; W224-L261 HydrophobicContact CH2-CG 3.84Å; W224-L261 HydrophobicContact CZ3-CD1 3.3Å; W224-L261 HydrophobicContact CZ3-CD2 3.07Å; W224-L261 HydrophobicContact CZ3-CG 3.67Å; I247-L261 HydrophobicContact CG2-CB 4.26Å; I251-L261 HydrophobicContact CD1-CB 4.28Å; I251-L261 HydrophobicContact CG1-CB 3.72Å; I251-L261 HydrophobicContact CG1-CD1 4.04Å; Q257-L261 WeakPolarHBondContact O-CG 3.42Å; Q257-L261 PolarHBondContact O-N 3.06Å; V258-L261 PolarHBondContact O-N 2.86Å; G259-L261 VanDerWaalsContact C-N 3.28Å; G259-L261 PolarHBondContact O-N 3.18Å; L261-C263 VanDerWaalsContact C-N 3.3Å; L261-A264 PolarHBondContact O-N 3.34Å; L261-L265 WeakPolarHBondContact O-CB 3.42Å; L261-L265 PolarHBondContact O-N 3.26Å
262	W	89.6	Confident	82.8	Confident	6 Å²	6	48.5 Å²	48.5	2%	0.023	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-40.9	169.4	-77.9	113	0	0	0	111.4	L248 I251 V258 G259 L265 A266 I281 Q284 A285 N288 I298	L248-W262 HydrophobicContact CD2-CH2 3.46Å; L248-W262 VanDerWaalsContact CD2-CH2 3.46Å; L248-W262 HydrophobicContact CD2-CZ2 3.99Å; L248-W262 HydrophobicContact CD2-CZ3 3.95Å; I251-W262 HydrophobicContact CD1-CD2 3.73Å; I251-W262 HydrophobicContact CD1-CE3 4.27Å; I251-W262 HydrophobicContact CD1-CG 4.06Å; I251-W262 HydrophobicContact CD1-CH2 4.49Å; I251-W262 HydrophobicContact CD1-CZ2 3.96Å; V258-W262 VanDerWaalsContact CG1-CD1 3.41Å; V258-W262 PolarHBondContact O-N 3.31Å; V258-W262 VanDerWaalsContact O-N 3.1Å; G259-W262 PolarHBondContact O-N 3.06Å; W262-L265 HydrophobicContact CE3-CD2 4.03Å; W262-L265 HydrophobicContact CZ3-CD2 3.94Å; W262-L265 PolarHBondContact O-N 3.33Å; W262-A266 WeakPolarHBondContact O-CB 3.4Å; W262-A266 PolarHBondContact O-N 3.14Å; W262-I281 HydrophobicContact CE3-CG2 3.73Å; W262-I281 HydrophobicContact CZ3-CG2 3.93Å; W262-Q284 HydrophobicContact CH2-CB 4.23Å; W262-Q284 HydrophobicContact CZ3-CB 4.28Å; W262-A285 HydrophobicContact CB-CB 3.8Å; W262-A285 HydrophobicContact CD2-CB 3.37Å; W262-A285 HydrophobicContact CE3-CB 3.6Å; W262-A285 HydrophobicContact CG-CB 3.46Å; W262-A285 VanDerWaalsContact CG-CB 3.46Å; W262-A285 HydrophobicContact CZ3-CB 4.29Å; W262-N288 HydrophobicContact CZ2-CB 4.38Å; W262-I298 HydrophobicContact CB-CD1 3.91Å; W262-I298 HydrophobicContact CB-CG1 4.15Å; W262-I298 HydrophobicContact CG-CD1 4.16Å
263	C	87.2	Confident	83.2	Confident	23 Å²	23	45.9 Å²	45.9	16%	0.155	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-42	173.1	-68.3	0	0	0	0	111.9	G259 A260 L261 L265 A266 D267	G259-C263 PolarHBondContact O-N 3.03Å; G259-C263 VanDerWaalsContact O-N 3.07Å; G259-C263 PolarHBondContact O-SG 2.91Å; A260-C263 PolarHBondContact O-N 2.89Å; L261-C263 VanDerWaalsContact C-N 3.3Å; C263-L265 PolarHBondContact O-N 3.34Å; C263-A266 PolarHBondContact O-N 2.93Å; C263-D267 WeakPolarHBondContact O-CB 3.4Å; C263-D267 VanDerWaalsContact O-CG 3.32Å; C263-D267 PolarHBondContact O-N 3.45Å
264	A	84.3	Confident	83.7	Confident	16 Å²	16	43.5 Å²	43.5	13%	0.132	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-38.3	176.7	0	0	0	0	0	112.7	A232 A260 L261 Y268	A232-A264 HydrophobicContact CB-CB 4.18Å; A232-A264 WeakPolarHBondContact CB-O 3.18Å; A260-A264 WeakPolarHBondContact O-CB 3.49Å; A260-A264 PolarHBondContact O-N 2.87Å; L261-A264 PolarHBondContact O-N 3.34Å; A264-Y268 PolarHBondContact O-N 3.13Å
265	L	86.5	Confident	84.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-66.4	-43.2	174.1	-177.4	62.6	0	0	0	111.2	E244 I247 L248 L261 W262 C263 Y268 Y269 I281	E244-L265 HydrophobicContact CB-CD1 4.32Å; E244-L265 HydrophobicContact CG-CD1 4.43Å; I247-L265 HydrophobicContact CB-CB 4.47Å; I247-L265 HydrophobicContact CB-CD1 4.25Å; I247-L265 HydrophobicContact CD1-CB 4.1Å; I247-L265 HydrophobicContact CD1-CD1 3.85Å; I247-L265 HydrophobicContact CG2-CB 3.97Å; L248-L265 HydrophobicContact CD2-CD2 4.42Å; L261-L265 WeakPolarHBondContact O-CB 3.42Å; L261-L265 PolarHBondContact O-N 3.26Å; W262-L265 HydrophobicContact CE3-CD2 4.03Å; W262-L265 HydrophobicContact CZ3-CD2 3.94Å; W262-L265 PolarHBondContact O-N 3.33Å; C263-L265 PolarHBondContact O-N 3.34Å; L265-Y268 WeakPolarHBondContact O-CB 3.37Å; L265-Y268 PolarHBondContact O-N 2.67Å; L265-Y269 HydrophobicContact CD1-CD2 4.3Å; L265-Y269 HydrophobicContact CD1-CE2 3.86Å; L265-Y269 HydrophobicContact CG-CD2 4.48Å; L265-Y269 HydrophobicContact CG-CE2 4.33Å; L265-Y269 VanDerWaalsContact O-CD2 3.31Å; L265-Y269 WeakPolarHBondContact O-CD2 3.33Å; L265-Y269 PolarHBondContact O-N 2.63Å; L265-I281 HydrophobicContact CB-CG2 4.31Å; L265-I281 HydrophobicContact CD2-CD1 4.36Å; L265-I281 HydrophobicContact CD2-CG1 4.43Å; L265-I281 HydrophobicContact CD2-CG2 3.75Å; L265-I281 HydrophobicContact CG-CD1 4.13Å; L265-I281 HydrophobicContact CG-CG2 3.89Å
266	A	87.6	Confident	84.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.3	-44.7	175.5	0	0	0	0	0	111.2	W262 C263 Y268 Y269 I270 I281 Y282	W262-A266 WeakPolarHBondContact O-CB 3.4Å; W262-A266 PolarHBondContact O-N 3.14Å; C263-A266 PolarHBondContact O-N 2.93Å; A266-Y268 VanDerWaalsContact C-N 3.25Å; A266-Y268 PolarHBondContact O-N 3.08Å; A266-Y269 PolarHBondContact O-N 3.38Å; A266-I270 WeakPolarHBondContact O-CG1 3.09Å; A266-I270 PolarHBondContact O-N 2.99Å; A266-I281 HydrophobicContact CB-CG2 4.35Å; A266-Y282 HydrophobicContact CB-CD1 4.09Å; A266-Y282 HydrophobicContact CB-CD2 4.12Å; A266-Y282 HydrophobicContact CB-CE1 3.51Å; A266-Y282 HydrophobicContact CB-CE2 3.56Å; A266-Y282 HydrophobicContact CB-CG 4.37Å; A266-Y282 WeakPolarHBondContact CB-OH 3.33Å
267	D	87.3	Confident	85.7	Confident	63 Å²	63	48.3 Å²	48.3	34%	0.337	24%	0.241	S	C	.	.	H	α-helix	trans	-57.2	-37.1	175.5	-81.8	-15.7	0	0	0	112.4	C263 I270 R271	C263-D267 WeakPolarHBondContact O-CB 3.4Å; C263-D267 VanDerWaalsContact O-CG 3.32Å; C263-D267 PolarHBondContact O-N 3.45Å; D267-I270 PolarHBondContact O-N 3.39Å; D267-R271 WeakPolarHBondContact O-CB 3.41Å; D267-R271 VanDerWaalsContact O-CG 3.31Å; D267-R271 WeakPolarHBondContact O-CG 3.41Å; D267-R271 PolarHBondContact O-N 2.84Å
268	Y	86	Confident	86.4	Confident	30 Å²	30	43.6 Å²	43.6	12%	0.118	22%	0.219	C	C	.	.	H	α-helix	trans	-57.7	-49.1	173	171.8	-96.8	0	0	0	111.5	V231 P235 V243 A264 L265 A266 R271 D272	V231-Y268 HydrophobicContact CG1-CD2 4Å; V231-Y268 HydrophobicContact CG1-CE2 4.16Å; V231-Y268 WeakPolarHBondContact O-CD2 3.21Å; P235-Y268 HydrophobicContact CB-CD2 3.74Å; P235-Y268 HydrophobicContact CB-CE2 3.5Å; P235-Y268 HydrophobicContact CG-CD2 3.74Å; P235-Y268 HydrophobicContact CG-CE2 4.05Å; P235-Y268 HydrophobicContact CG-CG 4.39Å; P235-Y268 VanDerWaalsContact CG-O 3.28Å; P235-Y268 WeakPolarHBondContact CG-O 3.15Å; V243-Y268 HydrophobicContact CB-CD1 4.39Å; V243-Y268 HydrophobicContact CB-CD2 4.4Å; V243-Y268 HydrophobicContact CB-CE1 3.98Å; V243-Y268 HydrophobicContact CB-CE2 3.98Å; V243-Y268 HydrophobicContact CG1-CD1 4.08Å; V243-Y268 HydrophobicContact CG1-CD2 3.96Å; V243-Y268 HydrophobicContact CG1-CE1 4.18Å; V243-Y268 HydrophobicContact CG1-CE2 4.05Å; V243-Y268 HydrophobicContact CG1-CG 3.97Å; V243-Y268 HydrophobicContact CG2-CD2 4.26Å; V243-Y268 HydrophobicContact CG2-CE1 4.31Å; V243-Y268 HydrophobicContact CG2-CE2 3.53Å; A264-Y268 PolarHBondContact O-N 3.13Å; L265-Y268 WeakPolarHBondContact O-CB 3.37Å; L265-Y268 PolarHBondContact O-N 2.67Å; A266-Y268 VanDerWaalsContact C-N 3.25Å; A266-Y268 PolarHBondContact O-N 3.08Å; Y268-R271 PolarHBondContact O-N 3.46Å; Y268-D272 PolarHBondContact O-N 3.01Å
269	Y	88	Confident	86.7	Confident	17 Å²	17	43.7 Å²	43.7	7%	0.067	22%	0.217	C	C	.	.	H	α-helix	trans	-73.7	-32.4	179.9	-76.6	-73.9	0	0	0	113.6	E244 L265 A266 R271 D272 G273 Q274 R277 I281	E244-Y269 PolarHBondContact OE2-OH 3.22Å; L265-Y269 HydrophobicContact CD1-CD2 4.3Å; L265-Y269 HydrophobicContact CD1-CE2 3.86Å; L265-Y269 HydrophobicContact CG-CD2 4.48Å; L265-Y269 HydrophobicContact CG-CE2 4.33Å; L265-Y269 VanDerWaalsContact O-CD2 3.31Å; L265-Y269 WeakPolarHBondContact O-CD2 3.33Å; L265-Y269 PolarHBondContact O-N 2.63Å; A266-Y269 PolarHBondContact O-N 3.38Å; Y269-R271 VanDerWaalsContact C-N 3.29Å; Y269-R271 PolarHBondContact O-N 2.88Å; Y269-D272 PolarHBondContact O-N 2.85Å; Y269-G273 PolarHBondContact O-N 3.12Å; Y269-Q274 HydrophobicContact CD1-CB 4.21Å; Y269-Q274 PolarHBondContact O-N 3.48Å; Y269-R277 HydrophobicContact CD1-CB 3.88Å; Y269-R277 HydrophobicContact CE1-CB 4.22Å; Y269-R277 HydrophobicContact CG-CB 4.2Å; Y269-I281 HydrophobicContact CD2-CD1 2.95Å; Y269-I281 HydrophobicContact CD2-CG1 4.45Å; Y269-I281 HydrophobicContact CE2-CD1 3.01Å; Y269-I281 HydrophobicContact CE2-CG1 4.43Å; Y269-I281 HydrophobicContact CG-CD1 3.85Å
270	I	87.8	Confident	87	Confident	41 Å²	41	48 Å²	48	21%	0.21	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-43.2	172.8	-67.4	167.9	0	0	0	109.8	A266 D267 G273 F275 A278 Y282 F305	A266-I270 WeakPolarHBondContact O-CG1 3.09Å; A266-I270 PolarHBondContact O-N 2.99Å; D267-I270 PolarHBondContact O-N 3.39Å; I270-G273 PolarHBondContact O-N 3.39Å; I270-F275 HydrophobicContact CG2-CE1 4.35Å; I270-A278 HydrophobicContact CG1-CB 3.7Å; I270-Y282 HydrophobicContact CD1-CE2 4.25Å; I270-F305 HydrophobicContact CB-CE2 4.48Å; I270-F305 HydrophobicContact CD1-CD2 3.48Å; I270-F305 VanDerWaalsContact CD1-CD2 3.48Å; I270-F305 HydrophobicContact CD1-CE2 3.86Å; I270-F305 HydrophobicContact CD1-CG 4.1Å; I270-F305 HydrophobicContact CG1-CD2 3.75Å; I270-F305 HydrophobicContact CG1-CE2 3.56Å; I270-F305 HydrophobicContact CG1-CZ 4.28Å; I270-F305 HydrophobicContact CG2-CD2 4.49Å; I270-F305 HydrophobicContact CG2-CE2 4.26Å
271	R	86.2	Confident	87.3	Confident	134 Å²	134	46.3 Å²	46.3	51%	0.506	23%	0.226	S	C	.	.	H	α-helix	trans	-75.1	-28.2	179.3	-71.7	-176.3	-155.4	-142.7	-0.2	114	A232 K233 P235 D267 Y268 Y269 G273	A232-R271 WeakPolarHBondContact O-CD 3.25Å; A232-R271 PolarHBondContact O-NE 3Å; K233-R271 PolarHBondContact O-NH1 3.41Å; P235-R271 HydrophobicContact CG-CB 3.59Å; D267-R271 WeakPolarHBondContact O-CB 3.41Å; D267-R271 VanDerWaalsContact O-CG 3.31Å; D267-R271 WeakPolarHBondContact O-CG 3.41Å; D267-R271 PolarHBondContact O-N 2.84Å; Y268-R271 PolarHBondContact O-N 3.46Å; Y269-R271 VanDerWaalsContact C-N 3.29Å; Y269-R271 PolarHBondContact O-N 2.88Å; R271-G273 PolarHBondContact O-N 3.22Å
272	D	85.5	Confident	87.6	Confident	69 Å²	69	46.5 Å²	46.5	37%	0.369	23%	0.226	S	C	.	.	H	α-helix	trans	-72.5	-9.8	171.6	-162.4	56.3	0	0	0	112.6	P235 Y268 Y269 Q274	P235-D272 HydrophobicContact CB-CB 4.17Å; Y268-D272 PolarHBondContact O-N 3.01Å; Y269-D272 PolarHBondContact O-N 2.85Å; D272-Q274 VanDerWaalsContact C-N 3.31Å; D272-Q274 WeakPolarHBondContact OD2-CG 3.4Å; D272-Q274 PolarHBondContact OD2-NE2 3.36Å
273	G	84.5	Confident	87.6	Confident	42 Å²	42	48.3 Å²	48.3	43%	0.433	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	7.4	-177.9	0	0	0	0	0	113.8	Y269 I270 R271 F275	Y269-G273 PolarHBondContact O-N 3.12Å; I270-G273 PolarHBondContact O-N 3.39Å; R271-G273 PolarHBondContact O-N 3.22Å; G273-F275 VanDerWaalsContact C-N 3.33Å; G273-F275 PolarHBondContact O-N 2.8Å
274	Q	87.4	Confident	87.6	Confident	65 Å²	65	50.9 Å²	50.9	30%	0.304	25%	0.245	S	C	.	.			trans	-90.6	68.4	178.5	-62.1	-176.6	15.3	0	0	110.4	Y269 D272 E276 R277 A278	Y269-Q274 HydrophobicContact CD1-CB 4.21Å; Y269-Q274 PolarHBondContact O-N 3.48Å; D272-Q274 VanDerWaalsContact C-N 3.31Å; D272-Q274 WeakPolarHBondContact OD2-CG 3.4Å; D272-Q274 PolarHBondContact OD2-NE2 3.36Å; Q274-E276 PolarHBondContact O-N 3.27Å; Q274-R277 HydrophobicContact CB-CB 4.26Å; Q274-R277 HydrophobicContact CB-CG 4.41Å; Q274-R277 PolarHBondContact O-N 2.8Å; Q274-A278 PolarHBondContact O-N 3.23Å; Q274-A278 VanDerWaalsContact O-N 3.1Å
275	F	87.8	Confident	87.9	Confident	89 Å²	89	50.1 Å²	50.1	39%	0.39	24%	0.238	S	C	.	.	H	α-helix	trans	-60	-33.1	-177.3	-59.1	-52.6	0	0	0	113.5	I270 G273 A278 R279 F305 L309	I270-F275 HydrophobicContact CG2-CE1 4.35Å; G273-F275 VanDerWaalsContact C-N 3.33Å; G273-F275 PolarHBondContact O-N 2.8Å; F275-A278 PolarHBondContact O-N 2.99Å; F275-R279 WeakPolarHBondContact O-CG 3.43Å; F275-R279 PolarHBondContact O-N 2.86Å; F275-R279 VanDerWaalsContact O-N 3.11Å; F275-F305 HydrophobicContact CB-CZ 3.99Å; F275-F305 AromaticContact CD1-CE2 3.76Å; F275-F305 HydrophobicContact CD1-CE2 3.76Å; F275-F305 AromaticContact CD1-CZ 3.84Å; F275-F305 HydrophobicContact CD1-CZ 3.84Å; F275-F305 HydrophobicContact CE1-CE2 4.41Å; F275-F305 HydrophobicContact CG-CZ 4.31Å; F275-L309 HydrophobicContact CB-CD1 3.59Å; F275-L309 HydrophobicContact CD1-CD1 4.16Å; F275-L309 HydrophobicContact CD2-CD1 4.25Å; F275-L309 HydrophobicContact CG-CD1 3.74Å
276	E	86.2	Confident	87.8	Confident	128 Å²	128	50.2 Å²	50.2	60%	0.598	24%	0.239	S	C	*	.	H	α-helix	trans	-64.9	-44.1	178.3	-48.2	-149.6	119.3	0	0	111.6	Q274 A278 R279 D280	Q274-E276 PolarHBondContact O-N 3.27Å; E276-A278 VanDerWaalsContact C-N 3.35Å; E276-A278 PolarHBondContact O-N 2.77Å; E276-R279 VanDerWaalsContact CG-NH2 3.33Å; E276-R279 WeakPolarHBondContact O-CB 3.41Å; E276-R279 PolarHBondContact O-N 3.01Å; E276-R279 IonicContact OE1-NH2 2.68Å; E276-R279 PolarHBondContact OE1-NH2 3.1Å; E276-D280 PolarHBondContact O-N 2.88Å
277	R	87.9	Confident	87.7	Confident	129 Å²	129	55 Å²	55	49%	0.487	26%	0.261	S	S	.	.	H	α-helix	trans	-66.7	-36.8	176.4	-67.2	-157.4	-177.2	155	-11.8	112.4	Y269 Q274 R279 D280 I281	Y269-R277 HydrophobicContact CD1-CB 3.88Å; Y269-R277 HydrophobicContact CE1-CB 4.22Å; Y269-R277 HydrophobicContact CG-CB 4.2Å; Q274-R277 HydrophobicContact CB-CB 4.26Å; Q274-R277 HydrophobicContact CB-CG 4.41Å; Q274-R277 PolarHBondContact O-N 2.8Å; R277-R279 VanDerWaalsContact C-N 3.26Å; R277-R279 PolarHBondContact O-N 3.31Å; R277-D280 PolarHBondContact O-N 3.26Å; R277-I281 WeakPolarHBondContact O-CB 3.31Å; R277-I281 WeakPolarHBondContact O-CD1 3.18Å; R277-I281 VanDerWaalsContact O-CG1 3.28Å; R277-I281 WeakPolarHBondContact O-CG1 3.32Å; R277-I281 PolarHBondContact O-N 2.87Å
278	A	89.7	Confident	87.6	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.7	-41	173.8	0	0	0	0	0	111.4	I270 Q274 F275 E276 I281 Y282 F305	I270-A278 HydrophobicContact CG1-CB 3.7Å; Q274-A278 PolarHBondContact O-N 3.23Å; Q274-A278 VanDerWaalsContact O-N 3.1Å; F275-A278 PolarHBondContact O-N 2.99Å; E276-A278 VanDerWaalsContact C-N 3.35Å; E276-A278 PolarHBondContact O-N 2.77Å; A278-I281 PolarHBondContact O-N 3.21Å; A278-Y282 WeakPolarHBondContact O-CD2 3.2Å; A278-Y282 PolarHBondContact O-N 2.9Å; A278-F305 HydrophobicContact CB-CE1 4.45Å; A278-F305 HydrophobicContact CB-CZ 4.17Å
279	R	88.3	Confident	87.4	Confident	22 Å²	22	55.2 Å²	55.2	8%	0.083	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-47.1	173.1	-63.2	-177.5	-64	-159.8	-3	111.9	F275 E276 R277 I281 Y282 E283 Y302 F305 M306 R336	F275-R279 WeakPolarHBondContact O-CG 3.43Å; F275-R279 PolarHBondContact O-N 2.86Å; F275-R279 VanDerWaalsContact O-N 3.11Å; E276-R279 VanDerWaalsContact CG-NH2 3.33Å; E276-R279 WeakPolarHBondContact O-CB 3.41Å; E276-R279 PolarHBondContact O-N 3.01Å; E276-R279 IonicContact OE1-NH2 2.68Å; E276-R279 PolarHBondContact OE1-NH2 3.1Å; R277-R279 VanDerWaalsContact C-N 3.26Å; R277-R279 PolarHBondContact O-N 3.31Å; R279-I281 PolarHBondContact O-N 3.02Å; R279-Y282 PolarHBondContact O-N 3.35Å; R279-Y282 VanDerWaalsContact O-N 3.12Å; R279-E283 WeakPolarHBondContact O-CG 3.34Å; R279-E283 PolarHBondContact O-N 3.47Å; R279-Y302 HydrophobicContact CB-CE2 4.28Å; R279-Y302 HydrophobicContact CG-CE2 4.09Å; R279-F305 HydrophobicContact CG-CD1 4.45Å; R279-F305 HydrophobicContact CG-CE1 3.66Å; R279-M306 HydrophobicContact CG-SD 4.06Å; R279-R336 VanDerWaalsContact NH2-NH1 3.13Å
280	D	89.7	Confident	87.2	Confident	92 Å²	92	59.5 Å²	59.5	49%	0.492	29%	0.287	S	S	.	.	H	α-helix	trans	-57.5	-37	178.8	-64.7	-21.8	0	0	0	111.3	E276 R277 E283 Q284	E276-D280 PolarHBondContact O-N 2.88Å; R277-D280 PolarHBondContact O-N 3.26Å; D280-E283 PolarHBondContact O-N 3.49Å; D280-Q284 WeakPolarHBondContact O-CB 3.47Å; D280-Q284 WeakPolarHBondContact O-CG 3.44Å; D280-Q284 PolarHBondContact O-N 2.87Å
281	I	91.2	Very high	87.1	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-71.8	-41.5	177.8	-72.9	161	0	0	0	111.8	W262 L265 A266 Y269 R277 A278 R279 E283 Q284 A285	W262-I281 HydrophobicContact CE3-CG2 3.73Å; W262-I281 HydrophobicContact CZ3-CG2 3.93Å; L265-I281 HydrophobicContact CB-CG2 4.31Å; L265-I281 HydrophobicContact CD2-CD1 4.36Å; L265-I281 HydrophobicContact CD2-CG1 4.43Å; L265-I281 HydrophobicContact CD2-CG2 3.75Å; L265-I281 HydrophobicContact CG-CD1 4.13Å; L265-I281 HydrophobicContact CG-CG2 3.89Å; A266-I281 HydrophobicContact CB-CG2 4.35Å; Y269-I281 HydrophobicContact CD2-CD1 2.95Å; Y269-I281 HydrophobicContact CD2-CG1 4.45Å; Y269-I281 HydrophobicContact CE2-CD1 3.01Å; Y269-I281 HydrophobicContact CE2-CG1 4.43Å; Y269-I281 HydrophobicContact CG-CD1 3.85Å; R277-I281 WeakPolarHBondContact O-CB 3.31Å; R277-I281 WeakPolarHBondContact O-CD1 3.18Å; R277-I281 VanDerWaalsContact O-CG1 3.28Å; R277-I281 WeakPolarHBondContact O-CG1 3.32Å; R277-I281 PolarHBondContact O-N 2.87Å; A278-I281 PolarHBondContact O-N 3.21Å; R279-I281 PolarHBondContact O-N 3.02Å; I281-E283 VanDerWaalsContact C-N 3.33Å; I281-Q284 PolarHBondContact O-N 3.21Å; I281-A285 VanDerWaalsContact O-CB 3.25Å; I281-A285 WeakPolarHBondContact O-CB 3.37Å; I281-A285 PolarHBondContact O-N 2.9Å
282	Y	91.4	Very high	87	Confident	5 Å²	5	56.3 Å²	56.3	2%	0.02	29%	0.285	C	S	.	.	H	α-helix	trans	-61	-43.4	171.2	-76.2	-55.4	0	0	0	111.2	A266 I270 A278 R279 Q284 A285 M286 I298 A301 Y302 F305	A266-Y282 HydrophobicContact CB-CD1 4.09Å; A266-Y282 HydrophobicContact CB-CD2 4.12Å; A266-Y282 HydrophobicContact CB-CE1 3.51Å; A266-Y282 HydrophobicContact CB-CE2 3.56Å; A266-Y282 HydrophobicContact CB-CG 4.37Å; A266-Y282 WeakPolarHBondContact CB-OH 3.33Å; I270-Y282 HydrophobicContact CD1-CE2 4.25Å; A278-Y282 WeakPolarHBondContact O-CD2 3.2Å; A278-Y282 PolarHBondContact O-N 2.9Å; R279-Y282 PolarHBondContact O-N 3.35Å; R279-Y282 VanDerWaalsContact O-N 3.12Å; Y282-Q284 PolarHBondContact O-N 2.89Å; Y282-A285 WeakPolarHBondContact O-CB 3.43Å; Y282-A285 PolarHBondContact O-N 3.24Å; Y282-M286 WeakPolarHBondContact O-CB 3.14Å; Y282-M286 WeakPolarHBondContact O-CG 3.22Å; Y282-M286 PolarHBondContact O-N 2.86Å; Y282-I298 HydrophobicContact CD1-CG2 3.95Å; Y282-A301 HydrophobicContact CE1-CB 4.2Å; Y282-Y302 HydrophobicContact CD1-CG 4.46Å; Y282-Y302 AromaticContact CD2-CD2 3.42Å; Y282-Y302 HydrophobicContact CD2-CD2 3.42Å; Y282-Y302 VanDerWaalsContact CD2-CD2 3.42Å; Y282-Y302 HydrophobicContact CD2-CE2 4.12Å; Y282-Y302 HydrophobicContact CD2-CG 4.04Å; Y282-Y302 HydrophobicContact CE2-CD2 4.22Å; Y282-Y302 AromaticContact CG-CD2 3.66Å; Y282-Y302 HydrophobicContact CG-CD2 3.66Å; Y282-Y302 HydrophobicContact CG-CE2 4.41Å; Y282-Y302 AromaticContact CG-CG 3.83Å; Y282-Y302 HydrophobicContact CG-CG 3.83Å; Y282-F305 HydrophobicContact CD2-CD1 4.25Å; Y282-F305 HydrophobicContact CE2-CB 4.04Å; Y282-F305 HydrophobicContact CE2-CD1 4.01Å; Y282-F305 HydrophobicContact CE2-CG 4.02Å
283	E	88.3	Confident	87	Confident	45 Å²	45	62.6 Å²	62.6	21%	0.21	30%	0.303	C	S	.	.	H	α-helix	trans	-62.5	-42.8	175.9	-69.5	-68.4	160.8	0	0	112	R279 D280 I281 A285 M286 Q287 Y302	R279-E283 WeakPolarHBondContact O-CG 3.34Å; R279-E283 PolarHBondContact O-N 3.47Å; D280-E283 PolarHBondContact O-N 3.49Å; I281-E283 VanDerWaalsContact C-N 3.33Å; E283-A285 VanDerWaalsContact C-N 3.34Å; E283-M286 PolarHBondContact O-N 3.24Å; E283-Q287 WeakPolarHBondContact O-CG 3.27Å; E283-Q287 PolarHBondContact O-N 2.78Å; E283-Y302 WeakPolarHBondContact OE1-CE1 3.25Å; E283-Y302 PolarHBondContact OE1-OH 3.09Å
284	Q	88.9	Confident	87.1	Confident	77 Å²	77	61.3 Å²	61.3	36%	0.36	29%	0.287	S	S	.	.	H	α-helix	trans	-62.1	-42.2	173.5	-75.1	174.6	23.4	0	0	111.8	W262 D280 I281 Y282 Q287 N288	W262-Q284 HydrophobicContact CH2-CB 4.23Å; W262-Q284 HydrophobicContact CZ3-CB 4.28Å; D280-Q284 WeakPolarHBondContact O-CB 3.47Å; D280-Q284 WeakPolarHBondContact O-CG 3.44Å; D280-Q284 PolarHBondContact O-N 2.87Å; I281-Q284 PolarHBondContact O-N 3.21Å; Y282-Q284 PolarHBondContact O-N 2.89Å; Q284-Q287 PolarHBondContact O-N 3.36Å; Q284-N288 WeakPolarHBondContact O-CB 3.41Å; Q284-N288 VanDerWaalsContact O-CG 3.27Å; Q284-N288 PolarHBondContact O-N 3.43Å; Q284-N288 PolarHBondContact O-ND2 2.96Å
285	A	88.8	Confident	87.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-48.8	177	0	0	0	0	0	110.4	W262 I281 Y282 E283 Q287 N288 V289 I298	W262-A285 HydrophobicContact CB-CB 3.8Å; W262-A285 HydrophobicContact CD2-CB 3.37Å; W262-A285 HydrophobicContact CE3-CB 3.6Å; W262-A285 HydrophobicContact CG-CB 3.46Å; W262-A285 VanDerWaalsContact CG-CB 3.46Å; W262-A285 HydrophobicContact CZ3-CB 4.29Å; I281-A285 VanDerWaalsContact O-CB 3.25Å; I281-A285 WeakPolarHBondContact O-CB 3.37Å; I281-A285 PolarHBondContact O-N 2.9Å; Y282-A285 WeakPolarHBondContact O-CB 3.43Å; Y282-A285 PolarHBondContact O-N 3.24Å; E283-A285 VanDerWaalsContact C-N 3.34Å; A285-Q287 PolarHBondContact O-N 2.83Å; A285-N288 PolarHBondContact O-N 3.32Å; A285-V289 WeakPolarHBondContact O-CB 3.27Å; A285-V289 WeakPolarHBondContact O-CG2 3.49Å; A285-V289 PolarHBondContact O-N 3.47Å; A285-I298 HydrophobicContact CB-CD1 4.02Å; A285-I298 HydrophobicContact CB-CG2 3.84Å
286	M	84.8	Confident	87.2	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-61.7	-32.1	179.2	-67.8	-66.6	-75.3	0	0	112.8	Y282 E283 F295 I298 F299 L347	Y282-M286 WeakPolarHBondContact O-CB 3.14Å; Y282-M286 WeakPolarHBondContact O-CG 3.22Å; Y282-M286 PolarHBondContact O-N 2.86Å; E283-M286 PolarHBondContact O-N 3.24Å; M286-F295 HydrophobicContact CE-CD2 3.64Å; M286-F295 HydrophobicContact CE-CE1 4.14Å; M286-F295 HydrophobicContact CE-CE2 3Å; M286-F295 HydrophobicContact CE-CG 4.47Å; M286-F295 HydrophobicContact CE-CZ 3.28Å; M286-F295 HydrophobicContact SD-CD2 3.76Å; M286-F295 HydrophobicContact SD-CE2 3.77Å; M286-F295 HydrophobicContact SD-CZ 4.42Å; M286-I298 HydrophobicContact CG-CG2 4.01Å; M286-I298 HydrophobicContact SD-CB 4.18Å; M286-I298 HydrophobicContact SD-CG2 3.69Å; M286-F299 HydrophobicContact CE-CB 3.93Å; M286-F299 HydrophobicContact CE-CD2 3.5Å; M286-F299 VanDerWaalsContact CE-CD2 3.5Å; M286-F299 HydrophobicContact CE-CE2 4.48Å; M286-F299 HydrophobicContact CE-CG 4.18Å; M286-F299 HydrophobicContact SD-CB 4.17Å; M286-L347 HydrophobicContact CE-CD1 3.88Å
287	Q	85	Confident	87.4	Confident	102 Å²	102	55.5 Å²	55.5	48%	0.477	26%	0.264	S	S	.	.	H	α-helix	trans	-73.6	-41.5	171	-69	174.5	20.9	0	0	111.7	E283 Q284 A285 R354	E283-Q287 WeakPolarHBondContact O-CG 3.27Å; E283-Q287 PolarHBondContact O-N 2.78Å; Q284-Q287 PolarHBondContact O-N 3.36Å; A285-Q287 PolarHBondContact O-N 2.83Å; Q287-R354 PolarHBondContact O-NE 3.3Å; Q287-R354 VanDerWaalsContact O-NE 3.13Å; Q287-R354 PolarHBondContact O-NH1 3.14Å; Q287-R354 PolarHBondContact O-NH2 3.01Å
288	N	85.3	Confident	87.5	Confident	94 Å²	94	49.3 Å²	49.3	50%	0.503	24%	0.241	S	C	.	.	H	α-helix	trans	-83.9	-20.9	-171.1	-68.1	-28.1	0	0	0	114.5	W262 Q284 A285 I290	W262-N288 HydrophobicContact CZ2-CB 4.38Å; Q284-N288 WeakPolarHBondContact O-CB 3.41Å; Q284-N288 VanDerWaalsContact O-CG 3.27Å; Q284-N288 PolarHBondContact O-N 3.43Å; Q284-N288 PolarHBondContact O-ND2 2.96Å; A285-N288 PolarHBondContact O-N 3.32Å; N288-I290 PolarHBondContact O-N 2.79Å
289	V	83.7	Confident	87.6	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	24%	0.242	C	C	.	.			trans	-65.3	131.8	-173.2	169	0	0	0	0	112.8	A285 T291 D294 F295 I298	A285-V289 WeakPolarHBondContact O-CB 3.27Å; A285-V289 WeakPolarHBondContact O-CG2 3.49Å; A285-V289 PolarHBondContact O-N 3.47Å; V289-T291 WeakPolarHBondContact CG1-O 3.43Å; V289-D294 HydrophobicContact CG1-CB 3.7Å; V289-D294 HydrophobicContact CG2-CB 4.36Å; V289-F295 HydrophobicContact CG1-CB 3.91Å; V289-I298 HydrophobicContact CG2-CD1 3.34Å
290	I	82.4	Confident	87.8	Confident	107 Å²	107	52.3 Å²	52.3	55%	0.549	26%	0.258	S	S	.	.			trans	-95.8	-36.7	178.1	-55.6	168.8	0	0	0	110.5	N288 V351 Q355	N288-I290 PolarHBondContact O-N 2.79Å; I290-V351 VanDerWaalsContact O-CG1 3.23Å; I290-V351 WeakPolarHBondContact O-CG1 3.42Å; I290-Q355 HydrophobicContact CG2-CG 4.08Å; I290-Q355 WeakPolarHBondContact O-CG 3.05Å; I290-Q355 PolarHBondContact O-NE2 3.1Å
291	T	85.5	Confident	87.8	Confident	54 Å²	54	49 Å²	49	33%	0.331	24%	0.244	S	C	.	.	S	Bend	trans	-91	142.8	-174.6	89.4	0	0	0	0	112.1	V289 R293 D294 F295	V289-T291 WeakPolarHBondContact CG1-O 3.43Å; T291-R293 PolarHBondContact O-N 3.24Å; T291-D294 WeakPolarHBondContact CG2-OD2 3.2Å; T291-D294 WeakPolarHBondContact OG1-CB 3.11Å; T291-D294 PolarHBondContact OG1-N 3.11Å; T291-D294 PolarHBondContact OG1-OD2 3.47Å; T291-F295 WeakPolarHBondContact O-CB 3.08Å; T291-F295 PolarHBondContact O-N 2.8Å; T291-F295 VanDerWaalsContact O-N 3.13Å
292	V	84.5	Confident	87.8	Confident	55 Å²	55	49.3 Å²	49.3	33%	0.333	25%	0.245	S	C	.	.	H	α-helix	trans	-66.2	-29.5	175.9	178.6	0	0	0	0	111.2	F295 T296 V351 L352	V292-F295 WeakPolarHBondContact O-CB 3.43Å; V292-F295 PolarHBondContact O-N 3.25Å; V292-T296 HydrophobicContact CG1-CG2 4.49Å; V292-T296 WeakPolarHBondContact O-CG2 3.28Å; V292-T296 PolarHBondContact O-N 2.88Å; V292-T296 PolarHBondContact O-OG1 2.56Å; V292-V351 HydrophobicContact CG2-CG1 4.24Å; V292-L352 HydrophobicContact CG2-CD2 3.83Å
293	R	86.3	Confident	87.8	Confident	201 Å²	201	49.7 Å²	49.7	76%	0.758	25%	0.248	S	C	*	.	H	α-helix	trans	-69.4	-49.2	-179.5	-66.3	-177.6	-176.6	173	1.6	111.7	T291 F295 T296 Q297	T291-R293 PolarHBondContact O-N 3.24Å; R293-F295 PolarHBondContact O-N 3.01Å; R293-T296 WeakPolarHBondContact CA-OG1 3.45Å; R293-T296 PolarHBondContact O-N 2.79Å; R293-T296 PolarHBondContact O-OG1 3.38Å; R293-Q297 WeakPolarHBondContact O-CG 2.95Å; R293-Q297 PolarHBondContact O-N 2.76Å
294	D	86.5	Confident	87.9	Confident	15 Å²	15	52.2 Å²	52.2	8%	0.08	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-39.5	175.3	-63.3	-46.8	0	0	0	110.2	G259 V289 T291 T296 Q297 I298	G259-D294 WeakPolarHBondContact CA-OD1 3.37Å; G259-D294 PolarHBondContact N-OD1 3.04Å; V289-D294 HydrophobicContact CG1-CB 3.7Å; V289-D294 HydrophobicContact CG2-CB 4.36Å; T291-D294 WeakPolarHBondContact CG2-OD2 3.2Å; T291-D294 WeakPolarHBondContact OG1-CB 3.11Å; T291-D294 PolarHBondContact OG1-N 3.11Å; T291-D294 PolarHBondContact OG1-OD2 3.47Å; D294-T296 PolarHBondContact O-N 2.84Å; D294-Q297 PolarHBondContact O-N 2.92Å; D294-I298 HydrophobicContact CB-CD1 4.47Å; D294-I298 WeakPolarHBondContact O-CB 3.48Å; D294-I298 WeakPolarHBondContact O-CD1 3.03Å; D294-I298 VanDerWaalsContact O-CG1 3.26Å; D294-I298 WeakPolarHBondContact O-CG1 3.06Å; D294-I298 PolarHBondContact O-N 3.1Å
295	F	87.9	Confident	87.9	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-46	177.2	177.4	-90	0	0	0	111.5	M286 V289 T291 V292 R293 I298 F299 L347 V348 V351	M286-F295 HydrophobicContact CE-CD2 3.64Å; M286-F295 HydrophobicContact CE-CE1 4.14Å; M286-F295 HydrophobicContact CE-CE2 3Å; M286-F295 HydrophobicContact CE-CG 4.47Å; M286-F295 HydrophobicContact CE-CZ 3.28Å; M286-F295 HydrophobicContact SD-CD2 3.76Å; M286-F295 HydrophobicContact SD-CE2 3.77Å; M286-F295 HydrophobicContact SD-CZ 4.42Å; V289-F295 HydrophobicContact CG1-CB 3.91Å; T291-F295 WeakPolarHBondContact O-CB 3.08Å; T291-F295 PolarHBondContact O-N 2.8Å; T291-F295 VanDerWaalsContact O-N 3.13Å; V292-F295 WeakPolarHBondContact O-CB 3.43Å; V292-F295 PolarHBondContact O-N 3.25Å; R293-F295 PolarHBondContact O-N 3.01Å; F295-I298 PolarHBondContact O-N 2.88Å; F295-F299 HydrophobicContact CE1-CB 4.39Å; F295-F299 WeakPolarHBondContact O-CB 3.49Å; F295-F299 PolarHBondContact O-N 3.02Å; F295-L347 HydrophobicContact CE2-CB 3.66Å; F295-L347 HydrophobicContact CZ-CB 3.56Å; F295-V348 HydrophobicContact CD1-CG2 4.06Å; F295-V348 HydrophobicContact CE1-CB 4.42Å; F295-V348 HydrophobicContact CE1-CG2 3.32Å; F295-V348 HydrophobicContact CZ-CG2 3.83Å; F295-V351 HydrophobicContact CB-CG2 4.23Å; F295-V351 HydrophobicContact CD2-CG2 3.42Å; F295-V351 VanDerWaalsContact CD2-CG2 3.42Å; F295-V351 HydrophobicContact CE2-CG2 3.89Å; F295-V351 HydrophobicContact CG-CG2 3.96Å
296	T	89	Confident	87.9	Confident	54 Å²	54	49.4 Å²	49.4	33%	0.331	25%	0.247	S	C	.	.	H	α-helix	trans	-63.3	-42.8	177.3	48.3	0	0	0	0	112.1	V292 R293 D294 F299 D300	V292-T296 HydrophobicContact CG1-CG2 4.49Å; V292-T296 WeakPolarHBondContact O-CG2 3.28Å; V292-T296 PolarHBondContact O-N 2.88Å; V292-T296 PolarHBondContact O-OG1 2.56Å; R293-T296 WeakPolarHBondContact CA-OG1 3.45Å; R293-T296 PolarHBondContact O-N 2.79Å; R293-T296 PolarHBondContact O-OG1 3.38Å; D294-T296 PolarHBondContact O-N 2.84Å; T296-F299 PolarHBondContact O-N 3.48Å; T296-D300 VanDerWaalsContact O-CB 3.31Å; T296-D300 WeakPolarHBondContact O-CB 3.48Å; T296-D300 PolarHBondContact O-N 3.07Å
297	Q	89.9	Confident	88.1	Confident	101 Å²	101	54.5 Å²	54.5	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-63.2	-45.7	179	-69.9	175.8	2.8	0	0	111.9	R293 D294 A301	R293-Q297 WeakPolarHBondContact O-CG 2.95Å; R293-Q297 PolarHBondContact O-N 2.76Å; D294-Q297 PolarHBondContact O-N 2.92Å; Q297-A301 VanDerWaalsContact O-CB 3.31Å; Q297-A301 WeakPolarHBondContact O-CB 3.4Å; Q297-A301 PolarHBondContact O-N 3.35Å
298	I	90.7	Very high	88.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-67.9	-42.5	179	-67.8	162.2	0	0	0	110.4	W262 Y282 A285 M286 V289 D294 F295 A301 Y302	W262-I298 HydrophobicContact CB-CD1 3.91Å; W262-I298 HydrophobicContact CB-CG1 4.15Å; W262-I298 HydrophobicContact CG-CD1 4.16Å; Y282-I298 HydrophobicContact CD1-CG2 3.95Å; A285-I298 HydrophobicContact CB-CD1 4.02Å; A285-I298 HydrophobicContact CB-CG2 3.84Å; M286-I298 HydrophobicContact CG-CG2 4.01Å; M286-I298 HydrophobicContact SD-CB 4.18Å; M286-I298 HydrophobicContact SD-CG2 3.69Å; V289-I298 HydrophobicContact CG2-CD1 3.34Å; D294-I298 HydrophobicContact CB-CD1 4.47Å; D294-I298 WeakPolarHBondContact O-CB 3.48Å; D294-I298 WeakPolarHBondContact O-CD1 3.03Å; D294-I298 VanDerWaalsContact O-CG1 3.26Å; D294-I298 WeakPolarHBondContact O-CG1 3.06Å; D294-I298 PolarHBondContact O-N 3.1Å; F295-I298 PolarHBondContact O-N 2.88Å; I298-A301 PolarHBondContact O-N 3.17Å; I298-Y302 VanDerWaalsContact O-CB 3.26Å; I298-Y302 WeakPolarHBondContact O-CB 3.31Å; I298-Y302 PolarHBondContact O-N 3.46Å
299	F	91.1	Very high	88.5	Confident	6 Å²	6	54.1 Å²	54.1	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-64.3	-45.1	178.8	-175.7	-95.2	0	0	0	111.6	M286 F295 T296 A301 Y302 A303 L340 M341 R344	M286-F299 HydrophobicContact CE-CB 3.93Å; M286-F299 HydrophobicContact CE-CD2 3.5Å; M286-F299 VanDerWaalsContact CE-CD2 3.5Å; M286-F299 HydrophobicContact CE-CE2 4.48Å; M286-F299 HydrophobicContact CE-CG 4.18Å; M286-F299 HydrophobicContact SD-CB 4.17Å; F295-F299 HydrophobicContact CE1-CB 4.39Å; F295-F299 WeakPolarHBondContact O-CB 3.49Å; F295-F299 PolarHBondContact O-N 3.02Å; T296-F299 PolarHBondContact O-N 3.48Å; F299-A301 VanDerWaalsContact C-N 3.33Å; F299-A301 PolarHBondContact O-N 3.12Å; F299-Y302 PolarHBondContact O-N 3.49Å; F299-A303 VanDerWaalsContact O-CB 3.31Å; F299-A303 WeakPolarHBondContact O-CB 3.31Å; F299-A303 PolarHBondContact O-N 3.2Å; F299-L340 HydrophobicContact CD2-CD1 4.44Å; F299-L340 HydrophobicContact CE2-CD1 3.94Å; F299-L340 HydrophobicContact CE2-CD2 4.44Å; F299-L340 HydrophobicContact CE2-CG 3.91Å; F299-M341 HydrophobicContact CE1-SD 4.33Å; F299-M341 HydrophobicContact CZ-SD 3.9Å; F299-R344 HydrophobicContact CE1-CG 4.1Å; F299-R344 HydrophobicContact CE2-CB 4.02Å; F299-R344 HydrophobicContact CE2-CG 4.05Å; F299-R344 HydrophobicContact CZ-CB 3.83Å; F299-R344 HydrophobicContact CZ-CG 3.74Å
300	D	92.4	Very high	88.7	Confident	79 Å²	79	54.9 Å²	54.9	42%	0.422	26%	0.263	S	S	.	.	H	α-helix	trans	-65.1	-39.5	178.3	-67.7	-14.7	0	0	0	110.7	T296 Q304	T296-D300 VanDerWaalsContact O-CB 3.31Å; T296-D300 WeakPolarHBondContact O-CB 3.48Å; T296-D300 PolarHBondContact O-N 3.07Å; D300-Q304 WeakPolarHBondContact O-CB 3.26Å; D300-Q304 WeakPolarHBondContact O-CG 3.3Å; D300-Q304 PolarHBondContact O-N 3.4Å
301	A	90.6	Very high	89.1	Confident	22 Å²	22	52 Å²	52	18%	0.182	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-42	173.7	0	0	0	0	0	112.3	Y282 Q297 I298 F299 Q304 F305	Y282-A301 HydrophobicContact CE1-CB 4.2Å; Q297-A301 VanDerWaalsContact O-CB 3.31Å; Q297-A301 WeakPolarHBondContact O-CB 3.4Å; Q297-A301 PolarHBondContact O-N 3.35Å; I298-A301 PolarHBondContact O-N 3.17Å; F299-A301 VanDerWaalsContact C-N 3.33Å; F299-A301 PolarHBondContact O-N 3.12Å; A301-Q304 PolarHBondContact O-N 2.89Å; A301-F305 VanDerWaalsContact O-CB 3.31Å; A301-F305 WeakPolarHBondContact O-CB 3.5Å; A301-F305 PolarHBondContact O-N 2.91Å
302	Y	90.9	Very high	89.2	Confident	12 Å²	12	53.2 Å²	53.2	5%	0.047	26%	0.262	C	S	.	.	H	α-helix	trans	-67.6	-41.7	178.7	-176.8	-149.9	0	0	0	111.8	R279 Y282 E283 I298 F299 F305 M306 L340	R279-Y302 HydrophobicContact CB-CE2 4.28Å; R279-Y302 HydrophobicContact CG-CE2 4.09Å; Y282-Y302 HydrophobicContact CD1-CG 4.46Å; Y282-Y302 AromaticContact CD2-CD2 3.42Å; Y282-Y302 HydrophobicContact CD2-CD2 3.42Å; Y282-Y302 VanDerWaalsContact CD2-CD2 3.42Å; Y282-Y302 HydrophobicContact CD2-CE2 4.12Å; Y282-Y302 HydrophobicContact CD2-CG 4.04Å; Y282-Y302 HydrophobicContact CE2-CD2 4.22Å; Y282-Y302 AromaticContact CG-CD2 3.66Å; Y282-Y302 HydrophobicContact CG-CD2 3.66Å; Y282-Y302 HydrophobicContact CG-CE2 4.41Å; Y282-Y302 AromaticContact CG-CG 3.83Å; Y282-Y302 HydrophobicContact CG-CG 3.83Å; E283-Y302 WeakPolarHBondContact OE1-CE1 3.25Å; E283-Y302 PolarHBondContact OE1-OH 3.09Å; I298-Y302 VanDerWaalsContact O-CB 3.26Å; I298-Y302 WeakPolarHBondContact O-CB 3.31Å; I298-Y302 PolarHBondContact O-N 3.46Å; F299-Y302 PolarHBondContact O-N 3.49Å; Y302-F305 HydrophobicContact CD2-CD1 4.24Å; Y302-F305 HydrophobicContact CE2-CD1 4.49Å; Y302-F305 PolarHBondContact O-N 2.8Å; Y302-M306 HydrophobicContact CD2-CG 3.9Å; Y302-M306 HydrophobicContact CE2-CG 3.62Å; Y302-M306 HydrophobicContact CE2-SD 3.93Å; Y302-M306 WeakPolarHBondContact O-CB 3.38Å; Y302-M306 WeakPolarHBondContact O-CG 3.42Å; Y302-M306 PolarHBondContact O-N 3.33Å; Y302-L340 HydrophobicContact CD1-CD1 3.74Å; Y302-L340 HydrophobicContact CD1-CD2 3.38Å; Y302-L340 HydrophobicContact CD1-CG 4.19Å; Y302-L340 HydrophobicContact CE1-CD1 3.46Å; Y302-L340 VanDerWaalsContact CE1-CD1 3.46Å; Y302-L340 HydrophobicContact CE1-CD2 3.42Å; Y302-L340 VanDerWaalsContact CE1-CD2 3.42Å; Y302-L340 HydrophobicContact CE1-CG 4.03Å; Y302-L340 HydrophobicContact CG-CD2 4.07Å
303	A	91.1	Very high	89.1	Confident	12 Å²	12	52.6 Å²	52.6	10%	0.099	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-48.5	174.4	0	0	0	0	0	111.1	F299 F305 M306 E307 F337	F299-A303 VanDerWaalsContact O-CB 3.31Å; F299-A303 WeakPolarHBondContact O-CB 3.31Å; F299-A303 PolarHBondContact O-N 3.2Å; A303-F305 VanDerWaalsContact C-N 3.3Å; A303-F305 PolarHBondContact O-N 2.99Å; A303-M306 PolarHBondContact O-N 3.48Å; A303-E307 WeakPolarHBondContact O-CB 3.45Å; A303-E307 WeakPolarHBondContact O-CG 3.28Å; A303-E307 PolarHBondContact O-N 3.44Å; A303-F337 HydrophobicContact CB-CE2 4.36Å
304	Q	91.2	Very high	89	Confident	98 Å²	98	46.1 Å²	46.1	46%	0.458	24%	0.235	S	C	.	.	H	α-helix	trans	-61.1	-38.4	175.5	-73.3	174.3	29.5	0	0	112.5	D300 A301 R308	D300-Q304 WeakPolarHBondContact O-CB 3.26Å; D300-Q304 WeakPolarHBondContact O-CG 3.3Å; D300-Q304 PolarHBondContact O-N 3.4Å; A301-Q304 PolarHBondContact O-N 2.89Å; Q304-R308 WeakPolarHBondContact O-CB 3.45Å; Q304-R308 WeakPolarHBondContact O-CG 3.42Å; Q304-R308 PolarHBondContact O-N 3.08Å
305	F	89.1	Confident	89	Confident	16 Å²	16	51.6 Å²	51.6	7%	0.07	26%	0.261	C	S	.	.	H	α-helix	trans	-63.5	-47	175.8	168.9	-105.4	0	0	0	111.5	I270 F275 A278 R279 Y282 A301 Y302 A303 R308 L309	I270-F305 HydrophobicContact CB-CE2 4.48Å; I270-F305 HydrophobicContact CD1-CD2 3.48Å; I270-F305 VanDerWaalsContact CD1-CD2 3.48Å; I270-F305 HydrophobicContact CD1-CE2 3.86Å; I270-F305 HydrophobicContact CD1-CG 4.1Å; I270-F305 HydrophobicContact CG1-CD2 3.75Å; I270-F305 HydrophobicContact CG1-CE2 3.56Å; I270-F305 HydrophobicContact CG1-CZ 4.28Å; I270-F305 HydrophobicContact CG2-CD2 4.49Å; I270-F305 HydrophobicContact CG2-CE2 4.26Å; F275-F305 HydrophobicContact CB-CZ 3.99Å; F275-F305 AromaticContact CD1-CE2 3.76Å; F275-F305 HydrophobicContact CD1-CE2 3.76Å; F275-F305 AromaticContact CD1-CZ 3.84Å; F275-F305 HydrophobicContact CD1-CZ 3.84Å; F275-F305 HydrophobicContact CE1-CE2 4.41Å; F275-F305 HydrophobicContact CG-CZ 4.31Å; A278-F305 HydrophobicContact CB-CE1 4.45Å; A278-F305 HydrophobicContact CB-CZ 4.17Å; R279-F305 HydrophobicContact CG-CD1 4.45Å; R279-F305 HydrophobicContact CG-CE1 3.66Å; Y282-F305 HydrophobicContact CD2-CD1 4.25Å; Y282-F305 HydrophobicContact CE2-CB 4.04Å; Y282-F305 HydrophobicContact CE2-CD1 4.01Å; Y282-F305 HydrophobicContact CE2-CG 4.02Å; A301-F305 VanDerWaalsContact O-CB 3.31Å; A301-F305 WeakPolarHBondContact O-CB 3.5Å; A301-F305 PolarHBondContact O-N 2.91Å; Y302-F305 HydrophobicContact CD2-CD1 4.24Å; Y302-F305 HydrophobicContact CE2-CD1 4.49Å; Y302-F305 PolarHBondContact O-N 2.8Å; A303-F305 VanDerWaalsContact C-N 3.3Å; A303-F305 PolarHBondContact O-N 2.99Å; F305-R308 PolarHBondContact O-N 2.89Å; F305-L309 HydrophobicContact CE1-CD1 4.11Å; F305-L309 HydrophobicContact CE2-CD1 4.19Å; F305-L309 HydrophobicContact CZ-CD1 3.6Å; F305-L309 WeakPolarHBondContact O-CB 3.27Å; F305-L309 PolarHBondContact O-N 3.31Å
306	M	88.5	Confident	88.7	Confident	2 Å²	2	54 Å²	54	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-43.2	178.1	-72.6	-64	-65.8	0	0	111.9	R279 Y302 A303 R308 L309 I310 L333 R336 F337	R279-M306 HydrophobicContact CG-SD 4.06Å; Y302-M306 HydrophobicContact CD2-CG 3.9Å; Y302-M306 HydrophobicContact CE2-CG 3.62Å; Y302-M306 HydrophobicContact CE2-SD 3.93Å; Y302-M306 WeakPolarHBondContact O-CB 3.38Å; Y302-M306 WeakPolarHBondContact O-CG 3.42Å; Y302-M306 PolarHBondContact O-N 3.33Å; A303-M306 PolarHBondContact O-N 3.48Å; M306-R308 PolarHBondContact O-N 3.31Å; M306-L309 PolarHBondContact O-N 2.87Å; M306-I310 WeakPolarHBondContact O-CB 3.49Å; M306-I310 VanDerWaalsContact O-CG1 3.27Å; M306-I310 WeakPolarHBondContact O-CG1 3.29Å; M306-I310 PolarHBondContact O-N 3.24Å; M306-L333 HydrophobicContact CE-CD2 4.2Å; M306-R336 HydrophobicContact CE-CB 4.15Å; M306-F337 HydrophobicContact CB-CD2 3.8Å; M306-F337 HydrophobicContact CB-CE2 4.41Å
307	E	89.6	Confident	87.9	Confident	109 Å²	109	53.1 Å²	53.1	51%	0.509	27%	0.268	S	S	.	.	H	α-helix	trans	-59.6	-45.9	174.7	-75.4	178.2	-177.5	0	0	111.8	A303 L309 I310 A311 F337	A303-E307 WeakPolarHBondContact O-CB 3.45Å; A303-E307 WeakPolarHBondContact O-CG 3.28Å; A303-E307 PolarHBondContact O-N 3.44Å; E307-L309 VanDerWaalsContact C-N 3.34Å; E307-L309 PolarHBondContact O-N 3.01Å; E307-I310 PolarHBondContact O-N 3.42Å; E307-A311 WeakPolarHBondContact O-CB 3.49Å; E307-A311 PolarHBondContact O-N 3Å; E307-F337 HydrophobicContact CG-CE2 3.92Å; E307-F337 HydrophobicContact CG-CZ 3.89Å
308	R	89.6	Confident	87.3	Confident	170 Å²	170	54.6 Å²	54.6	64%	0.642	28%	0.279	S	S	*	.	H	α-helix	trans	-63.3	-41.1	176.9	-74.9	175.9	-173.1	176.5	7.3	111.9	Q304 F305 M306 A311 V312	Q304-R308 WeakPolarHBondContact O-CB 3.45Å; Q304-R308 WeakPolarHBondContact O-CG 3.42Å; Q304-R308 PolarHBondContact O-N 3.08Å; F305-R308 PolarHBondContact O-N 2.89Å; M306-R308 PolarHBondContact O-N 3.31Å; R308-A311 PolarHBondContact O-N 3.43Å; R308-V312 VanDerWaalsContact O-CG2 3.29Å; R308-V312 WeakPolarHBondContact O-CG2 3.36Å; R308-V312 PolarHBondContact O-N 2.95Å
309	L	88.9	Confident	86.6	Confident	17 Å²	17	60.4 Å²	60.4	9%	0.089	31%	0.314	C	S	.	.	H	α-helix	trans	-66.9	-41.8	179.7	-170.4	150.5	0	0	0	111	F275 F305 M306 E307 V312 E313 L333	F275-L309 HydrophobicContact CB-CD1 3.59Å; F275-L309 HydrophobicContact CD1-CD1 4.16Å; F275-L309 HydrophobicContact CD2-CD1 4.25Å; F275-L309 HydrophobicContact CG-CD1 3.74Å; F305-L309 HydrophobicContact CE1-CD1 4.11Å; F305-L309 HydrophobicContact CE2-CD1 4.19Å; F305-L309 HydrophobicContact CZ-CD1 3.6Å; F305-L309 WeakPolarHBondContact O-CB 3.27Å; F305-L309 PolarHBondContact O-N 3.31Å; M306-L309 PolarHBondContact O-N 2.87Å; E307-L309 VanDerWaalsContact C-N 3.34Å; E307-L309 PolarHBondContact O-N 3.01Å; L309-V312 PolarHBondContact O-N 2.89Å; L309-E313 HydrophobicContact CD2-CG 4.29Å; L309-E313 WeakPolarHBondContact O-CG 3.34Å; L309-E313 PolarHBondContact O-N 3.35Å; L309-L333 HydrophobicContact CD2-CD1 3.22Å; L309-L333 HydrophobicContact CD2-CD2 3.44Å; L309-L333 VanDerWaalsContact CD2-CD2 3.44Å; L309-L333 HydrophobicContact CD2-CG 3.9Å
310	I	87.9	Confident	85.4	Confident	19 Å²	19	62.4 Å²	62.4	10%	0.097	33%	0.329	C	S	.	.	H	α-helix	trans	-61.2	-46.3	172.6	-69.1	163.8	0	0	0	110.6	M306 E307 V312 E313 I314 L333 M334 F337	M306-I310 WeakPolarHBondContact O-CB 3.49Å; M306-I310 VanDerWaalsContact O-CG1 3.27Å; M306-I310 WeakPolarHBondContact O-CG1 3.29Å; M306-I310 PolarHBondContact O-N 3.24Å; E307-I310 PolarHBondContact O-N 3.42Å; I310-V312 VanDerWaalsContact C-N 3.34Å; I310-V312 PolarHBondContact O-N 3.4Å; I310-E313 PolarHBondContact O-N 2.89Å; I310-I314 HydrophobicContact CG2-CD1 3.62Å; I310-I314 HydrophobicContact CG2-CG1 4.3Å; I310-I314 VanDerWaalsContact O-CG1 3.28Å; I310-I314 WeakPolarHBondContact O-CG1 3.26Å; I310-I314 PolarHBondContact O-N 3.42Å; I310-L333 HydrophobicContact CD1-CB 4.43Å; I310-L333 HydrophobicContact CG1-CB 3.77Å; I310-M334 HydrophobicContact CD1-CG 4.43Å; I310-M334 HydrophobicContact CG2-CG 4.27Å; I310-F337 HydrophobicContact CD1-CB 3.88Å; I310-F337 HydrophobicContact CD1-CG 4.23Å
311	A	90.3	Very high	83.8	Confident	46 Å²	46	64.6 Å²	64.6	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-59.8	-43.6	179	0	0	0	0	0	112.2	E307 R308 I314 E315	E307-A311 WeakPolarHBondContact O-CB 3.49Å; E307-A311 PolarHBondContact O-N 3Å; R308-A311 PolarHBondContact O-N 3.43Å; A311-I314 PolarHBondContact O-N 2.7Å; A311-E315 WeakPolarHBondContact O-CG 3.46Å; A311-E315 PolarHBondContact O-N 3.27Å
312	V	86.8	Confident	82.4	Confident	80 Å²	80	65.8 Å²	65.8	49%	0.485	37%	0.365	S	S	.	.	H	α-helix	trans	-62.9	-45.8	175.9	170.8	0	0	0	0	110.9	R308 L309 I310 I314 E315 T316	R308-V312 VanDerWaalsContact O-CG2 3.29Å; R308-V312 WeakPolarHBondContact O-CG2 3.36Å; R308-V312 PolarHBondContact O-N 2.95Å; L309-V312 PolarHBondContact O-N 2.89Å; I310-V312 VanDerWaalsContact C-N 3.34Å; I310-V312 PolarHBondContact O-N 3.4Å; V312-I314 VanDerWaalsContact C-N 3.34Å; V312-I314 PolarHBondContact O-N 3.1Å; V312-E315 PolarHBondContact O-N 3.43Å; V312-T316 WeakPolarHBondContact O-CG2 3.1Å; V312-T316 PolarHBondContact O-N 3.47Å
313	E	82.7	Confident	80.8	Confident	41 Å²	41	71.9 Å²	71.9	19%	0.192	39%	0.392	C	S	.	.	H	α-helix	trans	-64.4	-38.6	179.4	-68.7	-73.5	156.4	0	0	111.5	L309 I310 E315 T316 E317 V330 L333	L309-E313 HydrophobicContact CD2-CG 4.29Å; L309-E313 WeakPolarHBondContact O-CG 3.34Å; L309-E313 PolarHBondContact O-N 3.35Å; I310-E313 PolarHBondContact O-N 2.89Å; E313-E315 PolarHBondContact O-N 3.35Å; E313-T316 WeakPolarHBondContact CA-OG1 3.28Å; E313-T316 CarbonylContact O-C 3.59Å; E313-T316 PolarHBondContact O-N 2.99Å; E313-T316 VanDerWaalsContact O-N 3.14Å; E313-T316 PolarHBondContact O-OG1 3.31Å; E313-E317 WeakPolarHBondContact O-CG 3.45Å; E313-E317 PolarHBondContact O-N 3.32Å; E313-V330 HydrophobicContact CB-CG2 3.58Å; E313-L333 HydrophobicContact CB-CD1 4.33Å; E313-L333 HydrophobicContact CG-CD1 3.81Å
314	I	85	Confident	79.6	Confident	65 Å²	65	77.7 Å²	77.7	33%	0.333	42%	0.422	S	S	.	.	H	α-helix	trans	-63.4	-38.8	173.3	-67.5	167.5	0	0	0	111.8	I310 A311 V312 T316 E317 N318 V330	I310-I314 HydrophobicContact CG2-CD1 3.62Å; I310-I314 HydrophobicContact CG2-CG1 4.3Å; I310-I314 VanDerWaalsContact O-CG1 3.28Å; I310-I314 WeakPolarHBondContact O-CG1 3.26Å; I310-I314 PolarHBondContact O-N 3.42Å; A311-I314 PolarHBondContact O-N 2.7Å; V312-I314 VanDerWaalsContact C-N 3.34Å; V312-I314 PolarHBondContact O-N 3.1Å; I314-T316 VanDerWaalsContact C-N 3.33Å; I314-E317 WeakPolarHBondContact O-CB 3.5Å; I314-E317 PolarHBondContact O-N 2.72Å; I314-N318 PolarHBondContact O-N 2.96Å; I314-N318 VanDerWaalsContact O-N 3.07Å; I314-N318 PolarHBondContact O-ND2 3.48Å; I314-N318 VanDerWaalsContact O-ND2 3.12Å; I314-V330 HydrophobicContact CD1-CG1 4.39Å; I314-V330 HydrophobicContact CG1-CG1 3.87Å; I314-V330 HydrophobicContact CG1-CG2 4.11Å
315	E	85.3	Confident	78.6	Confident	131 Å²	131	76.3 Å²	76.3	61%	0.612	43%	0.426	S	S	*	.	H	α-helix	trans	-65.8	-37	173.6	-73.4	179.3	-176.2	0	0	111.9	A311 V312 E313 N318 T319	A311-E315 WeakPolarHBondContact O-CG 3.46Å; A311-E315 PolarHBondContact O-N 3.27Å; V312-E315 PolarHBondContact O-N 3.43Å; E313-E315 PolarHBondContact O-N 3.35Å; E315-N318 PolarHBondContact O-N 2.96Å; E315-T319 PolarHBondContact O-N 3.28Å; E315-T319 PolarHBondContact O-OG1 2.92Å; E315-T319 VanDerWaalsContact O-OG1 3.13Å
316	T	81.9	Confident	77.3	Confident	55 Å²	55	76 Å²	76	34%	0.337	43%	0.427	S	S	.	.	H	α-helix	trans	-68.7	-32.9	174.1	66.4	0	0	0	0	112.6	V312 E313 I314 T319 S320	V312-T316 WeakPolarHBondContact O-CG2 3.1Å; V312-T316 PolarHBondContact O-N 3.47Å; E313-T316 WeakPolarHBondContact CA-OG1 3.28Å; E313-T316 CarbonylContact O-C 3.59Å; E313-T316 PolarHBondContact O-N 2.99Å; E313-T316 VanDerWaalsContact O-N 3.14Å; E313-T316 PolarHBondContact O-OG1 3.31Å; I314-T316 VanDerWaalsContact C-N 3.33Å; T316-T319 WeakPolarHBondContact CA-OG1 3.41Å; T316-T319 PolarHBondContact O-N 3.25Å; T316-T319 PolarHBondContact O-OG1 3.01Å; T316-T319 VanDerWaalsContact O-OG1 3.06Å; T316-S320 VanDerWaalsContact O-CB 3.27Å; T316-S320 WeakPolarHBondContact O-CB 3.33Å; T316-S320 PolarHBondContact O-N 3.25Å; T316-S320 PolarHBondContact O-OG 3.5Å
317	E	72.7	Confident	76.7	Confident	34 Å²	34	79 Å²	79	16%	0.159	44%	0.442	C	S	.	.	H	α-helix	trans	-62.2	-44.1	171.1	-78.4	180	172.7	0	0	112.1	E313 I314 T319 S326 N327 V330	E313-E317 WeakPolarHBondContact O-CG 3.45Å; E313-E317 PolarHBondContact O-N 3.32Å; I314-E317 WeakPolarHBondContact O-CB 3.5Å; I314-E317 PolarHBondContact O-N 2.72Å; E317-T319 PolarHBondContact O-N 3.26Å; E317-S326 VanDerWaalsContact CG-CB 3.42Å; E317-S326 WeakPolarHBondContact CG-OG 3.38Å; E317-N327 WeakPolarHBondContact OE1-CA 3.44Å; E317-N327 PolarHBondContact OE1-N 2.86Å; E317-N327 PolarHBondContact OE1-OD1 3.39Å; E317-V330 VanDerWaalsContact CD-CG2 3.4Å; E317-V330 HydrophobicContact CG-CG2 4.25Å; E317-V330 WeakPolarHBondContact OE1-CB 3.34Å; E317-V330 WeakPolarHBondContact OE1-CG2 3.49Å
318	N	76.8	Confident	76.4	Confident	133 Å²	133	78.3 Å²	78.3	71%	0.711	45%	0.446	S	S	*	.	H	α-helix	trans	-65.6	-25.4	-179.8	-73.2	-39.6	0	0	0	112.6	I314 E315	I314-N318 PolarHBondContact O-N 2.96Å; I314-N318 VanDerWaalsContact O-N 3.07Å; I314-N318 PolarHBondContact O-ND2 3.48Å; I314-N318 VanDerWaalsContact O-ND2 3.12Å; E315-N318 PolarHBondContact O-N 2.96Å
319	T	76.5	Confident	75.9	Confident	121 Å²	121	77.5 Å²	77.5	74%	0.742	44%	0.442	S	S	*	.	H	α-helix	trans	-96.5	-29.9	-179.4	52	0	0	0	0	113.6	E315 T316 E317	E315-T319 PolarHBondContact O-N 3.28Å; E315-T319 PolarHBondContact O-OG1 2.92Å; E315-T319 VanDerWaalsContact O-OG1 3.13Å; T316-T319 WeakPolarHBondContact CA-OG1 3.41Å; T316-T319 PolarHBondContact O-N 3.25Å; T316-T319 PolarHBondContact O-OG1 3.01Å; T316-T319 VanDerWaalsContact O-OG1 3.06Å; E317-T319 PolarHBondContact O-N 3.26Å
320	S	64.8	Low	75.7	Confident	48 Å²	48	77 Å²	77	34%	0.336	44%	0.44	S	S	.	.			trans	-90.2	124.1	-177.7	63.4	0	0	0	0	111.5	T316 G322	T316-S320 VanDerWaalsContact O-CB 3.27Å; T316-S320 WeakPolarHBondContact O-CB 3.33Å; T316-S320 PolarHBondContact O-N 3.25Å; T316-S320 PolarHBondContact O-OG 3.5Å; S320-G322 PolarHBondContact O-N 2.98Å; S320-G322 VanDerWaalsContact O-N 3.16Å
321	S	59.8	Low	75.7	Confident	125 Å²	125	81 Å²	81	87%	0.874	46%	0.462	S	S	*	.	S	Bend	trans	-68.8	-7.8	176.9	49	0	0	0	0	113.8	K323	S321-K323 PolarHBondContact O-N 3.37Å
322	G	60.1	Low	75.5	Confident	47 Å²	47	82.7 Å²	82.7	49%	0.485	46%	0.464	S	S	.	.			trans	-90.2	65.1	179.6	0	0	0	0	0	113	S320 D324 S326	S320-G322 PolarHBondContact O-N 2.98Å; S320-G322 VanDerWaalsContact O-N 3.16Å; G322-D324 VanDerWaalsContact C-N 3.3Å; G322-D324 PolarHBondContact O-N 2.9Å; G322-D324 VanDerWaalsContact O-N 3.17Å; G322-S326 PolarHBondContact O-OG 3.24Å
323	K	57.5	Low	75.4	Confident	140 Å²	140	79.2 Å²	79.2	61%	0.609	44%	0.443	S	S	*	.	H	α-helix	trans	-53.3	-36.4	-169.9	-63.7	-179.6	178.4	-178.5	0	115	S321 A325 S326 N327	S321-K323 PolarHBondContact O-N 3.37Å; K323-A325 PolarHBondContact O-N 3.1Å; K323-S326 PolarHBondContact O-OG 3.28Å; K323-N327 WeakPolarHBondContact O-CB 3.48Å; K323-N327 PolarHBondContact O-N 3.47Å; K323-N327 VanDerWaalsContact O-N 3.12Å; K323-N327 PolarHBondContact O-ND2 2.97Å; K323-N327 PolarHBondContact O-OD1 3.4Å
324	D	66.2	Low	75.6	Confident	135 Å²	135	81.2 Å²	81.2	72%	0.722	45%	0.453	S	S	*	.	H	α-helix	trans	-73.3	-35.5	-166	-59	-24.2	0	0	0	114.1	G322 V328	G322-D324 VanDerWaalsContact C-N 3.3Å; G322-D324 PolarHBondContact O-N 2.9Å; G322-D324 VanDerWaalsContact O-N 3.17Å; D324-V328 WeakPolarHBondContact O-CG2 3.35Å; D324-V328 PolarHBondContact O-N 3.04Å
325	A	69.6	Low	75.8	Confident	68 Å²	68	80.7 Å²	80.7	56%	0.562	46%	0.458	S	S	*	.	H	α-helix	trans	-81.2	-33.7	-175.6	0	0	0	0	0	112.8	K323	K323-A325 PolarHBondContact O-N 3.1Å
326	S	63.1	Low	75.8	Confident	11 Å²	11	79.6 Å²	79.6	8%	0.077	45%	0.449	C	S	.	.	H	α-helix	trans	-71.8	-43.9	176	52.1	0	0	0	0	110.4	E317 G322 K323 V328 R329 V330	E317-S326 VanDerWaalsContact CG-CB 3.42Å; E317-S326 WeakPolarHBondContact CG-OG 3.38Å; G322-S326 PolarHBondContact O-OG 3.24Å; K323-S326 PolarHBondContact O-OG 3.28Å; S326-V328 VanDerWaalsContact C-N 3.3Å; S326-V328 PolarHBondContact O-N 2.87Å; S326-R329 WeakPolarHBondContact O-CA 3.41Å; S326-R329 WeakPolarHBondContact O-CB 3.44Å; S326-R329 PolarHBondContact O-N 3.41Å; S326-V330 PolarHBondContact O-N 2.88Å
327	N	76.1	Confident	76.1	Confident	63 Å²	63	79 Å²	79	34%	0.337	44%	0.442	S	S	.	.	H	α-helix	trans	-54.3	-44.9	177.3	-70.2	5	0	0	0	112.3	E317 K323 R329 V330 D331	E317-N327 WeakPolarHBondContact OE1-CA 3.44Å; E317-N327 PolarHBondContact OE1-N 2.86Å; E317-N327 PolarHBondContact OE1-OD1 3.39Å; K323-N327 WeakPolarHBondContact O-CB 3.48Å; K323-N327 PolarHBondContact O-N 3.47Å; K323-N327 VanDerWaalsContact O-N 3.12Å; K323-N327 PolarHBondContact O-ND2 2.97Å; K323-N327 PolarHBondContact O-OD1 3.4Å; N327-R329 VanDerWaalsContact C-N 3.27Å; N327-R329 PolarHBondContact O-N 3.3Å; N327-V330 PolarHBondContact O-N 3.07Å; N327-D331 WeakPolarHBondContact O-CB 3.43Å; N327-D331 VanDerWaalsContact O-CG 3.22Å; N327-D331 PolarHBondContact O-N 3.16Å
328	V	82.3	Confident	76.8	Confident	95 Å²	95	83 Å²	83	58%	0.576	46%	0.46	S	S	*	.	H	α-helix	trans	-63.4	-33.6	178.7	173.3	0	0	0	0	112.1	D324 S326 L332	D324-V328 WeakPolarHBondContact O-CG2 3.35Å; D324-V328 PolarHBondContact O-N 3.04Å; S326-V328 VanDerWaalsContact C-N 3.3Å; S326-V328 PolarHBondContact O-N 2.87Å; V328-L332 WeakPolarHBondContact O-CB 3.26Å; V328-L332 PolarHBondContact O-N 3.47Å
329	R	80.6	Confident	77.3	Confident	153 Å²	153	79.9 Å²	79.9	58%	0.577	44%	0.444	S	S	*	.	H	α-helix	trans	-72	-44.8	177.3	-69.7	179.6	-175.5	170.5	2.1	111.1	S326 N327 L332 L333	S326-R329 WeakPolarHBondContact O-CA 3.41Å; S326-R329 WeakPolarHBondContact O-CB 3.44Å; S326-R329 PolarHBondContact O-N 3.41Å; N327-R329 VanDerWaalsContact C-N 3.27Å; N327-R329 PolarHBondContact O-N 3.3Å; R329-L332 PolarHBondContact O-N 2.97Å; R329-L333 WeakPolarHBondContact O-CB 3.19Å; R329-L333 WeakPolarHBondContact O-CD1 3.39Å; R329-L333 WeakPolarHBondContact O-CG 3.41Å; R329-L333 PolarHBondContact O-N 3.43Å
330	V	83.1	Confident	77.8	Confident	7 Å²	7	74.4 Å²	74.4	4%	0.042	41%	0.41	C	S	.	.	H	α-helix	trans	-61.6	-46.9	176.7	169.9	0	0	0	0	110.4	E313 I314 E317 S326 N327 L332 L333 M334	E313-V330 HydrophobicContact CB-CG2 3.58Å; I314-V330 HydrophobicContact CD1-CG1 4.39Å; I314-V330 HydrophobicContact CG1-CG1 3.87Å; I314-V330 HydrophobicContact CG1-CG2 4.11Å; E317-V330 VanDerWaalsContact CD-CG2 3.4Å; E317-V330 HydrophobicContact CG-CG2 4.25Å; E317-V330 WeakPolarHBondContact OE1-CB 3.34Å; E317-V330 WeakPolarHBondContact OE1-CG2 3.49Å; S326-V330 PolarHBondContact O-N 2.88Å; N327-V330 PolarHBondContact O-N 3.07Å; V330-L332 VanDerWaalsContact C-N 3.3Å; V330-L332 PolarHBondContact O-N 2.81Å; V330-L333 PolarHBondContact O-N 3.35Å; V330-L333 VanDerWaalsContact O-N 3.09Å; V330-M334 HydrophobicContact CG1-CG 4.18Å; V330-M334 HydrophobicContact CG1-SD 3.81Å; V330-M334 WeakPolarHBondContact O-CB 3.39Å; V330-M334 VanDerWaalsContact O-CG 3.31Å; V330-M334 WeakPolarHBondContact O-CG 3.24Å; V330-M334 PolarHBondContact O-N 3.3Å
331	D	88.1	Confident	78.8	Confident	104 Å²	104	75.9 Å²	75.9	56%	0.556	41%	0.412	S	S	*	.	H	α-helix	trans	-58.1	-43.3	176.9	-71.3	-20.2	0	0	0	111.7	N327 L333 M334 A335	N327-D331 WeakPolarHBondContact O-CB 3.43Å; N327-D331 VanDerWaalsContact O-CG 3.22Å; N327-D331 PolarHBondContact O-N 3.16Å; D331-L333 PolarHBondContact O-N 3.27Å; D331-M334 PolarHBondContact O-N 2.81Å; D331-A335 VanDerWaalsContact O-CB 3.31Å; D331-A335 WeakPolarHBondContact O-CB 3.49Å; D331-A335 PolarHBondContact O-N 2.87Å
332	L	86.9	Confident	80	Confident	81 Å²	81	75.9 Å²	75.9	42%	0.424	40%	0.403	S	S	.	.	H	α-helix	trans	-67.3	-34.8	177.7	175.6	142.4	0	0	0	112.5	V328 R329 V330 R336	V328-L332 WeakPolarHBondContact O-CB 3.26Å; V328-L332 PolarHBondContact O-N 3.47Å; R329-L332 PolarHBondContact O-N 2.97Å; V330-L332 VanDerWaalsContact C-N 3.3Å; V330-L332 PolarHBondContact O-N 2.81Å; L332-R336 WeakPolarHBondContact O-CB 3.31Å; L332-R336 WeakPolarHBondContact O-CD 3.33Å; L332-R336 WeakPolarHBondContact O-CG 3.5Å; L332-R336 PolarHBondContact O-N 3.47Å; L332-R336 VanDerWaalsContact O-N 3.08Å
333	L	85.3	Confident	81.1	Confident	7 Å²	7	78.6 Å²	78.6	4%	0.037	40%	0.398	C	S	.	.	H	α-helix	trans	-73.3	-40.1	176.1	-71.8	165.3	0	0	0	112.1	M306 L309 I310 E313 R329 V330 D331 R336 F337	M306-L333 HydrophobicContact CE-CD2 4.2Å; L309-L333 HydrophobicContact CD2-CD1 3.22Å; L309-L333 HydrophobicContact CD2-CD2 3.44Å; L309-L333 VanDerWaalsContact CD2-CD2 3.44Å; L309-L333 HydrophobicContact CD2-CG 3.9Å; I310-L333 HydrophobicContact CD1-CB 4.43Å; I310-L333 HydrophobicContact CG1-CB 3.77Å; E313-L333 HydrophobicContact CB-CD1 4.33Å; E313-L333 HydrophobicContact CG-CD1 3.81Å; R329-L333 WeakPolarHBondContact O-CB 3.19Å; R329-L333 WeakPolarHBondContact O-CD1 3.39Å; R329-L333 WeakPolarHBondContact O-CG 3.41Å; R329-L333 PolarHBondContact O-N 3.43Å; V330-L333 PolarHBondContact O-N 3.35Å; V330-L333 VanDerWaalsContact O-N 3.09Å; D331-L333 PolarHBondContact O-N 3.27Å; L333-R336 PolarHBondContact O-N 3.09Å; L333-F337 WeakPolarHBondContact O-CB 3.23Å; L333-F337 PolarHBondContact O-N 2.82Å
334	M	86.8	Confident	82.4	Confident	82 Å²	82	77.3 Å²	77.3	40%	0.404	39%	0.389	S	S	.	.	H	α-helix	trans	-62.2	-47.6	173.5	-71.7	-178.2	67.3	0	0	110.7	I310 V330 D331 R336 F337 E338	I310-M334 HydrophobicContact CD1-CG 4.43Å; I310-M334 HydrophobicContact CG2-CG 4.27Å; V330-M334 HydrophobicContact CG1-CG 4.18Å; V330-M334 HydrophobicContact CG1-SD 3.81Å; V330-M334 WeakPolarHBondContact O-CB 3.39Å; V330-M334 VanDerWaalsContact O-CG 3.31Å; V330-M334 WeakPolarHBondContact O-CG 3.24Å; V330-M334 PolarHBondContact O-N 3.3Å; D331-M334 PolarHBondContact O-N 2.81Å; M334-R336 VanDerWaalsContact C-N 3.28Å; M334-R336 PolarHBondContact O-N 3.5Å; M334-F337 WeakPolarHBondContact O-CB 3.3Å; M334-F337 PolarHBondContact O-N 3.01Å; M334-F337 VanDerWaalsContact O-N 3.08Å; M334-E338 WeakPolarHBondContact O-CG 3.48Å; M334-E338 PolarHBondContact O-N 3.37Å
335	A	89.1	Confident	83.1	Confident	54 Å²	54	73.4 Å²	73.4	45%	0.446	37%	0.372	S	S	.	.	H	α-helix	trans	-59.9	-37.8	175.8	0	0	0	0	0	112.4	D331 D339	D331-A335 VanDerWaalsContact O-CB 3.31Å; D331-A335 WeakPolarHBondContact O-CB 3.49Å; D331-A335 PolarHBondContact O-N 2.87Å; A335-D339 WeakPolarHBondContact O-CB 3.43Å; A335-D339 PolarHBondContact O-N 3.31Å
336	R	84.7	Confident	83.7	Confident	108 Å²	108	72.8 Å²	72.8	41%	0.408	36%	0.36	S	S	.	.	H	α-helix	trans	-68	-38.3	174.5	-76.7	172.2	-178.1	-168.1	0.1	112.5	R279 M306 L332 L333 M334 D339 L340	R279-R336 VanDerWaalsContact NH2-NH1 3.13Å; M306-R336 HydrophobicContact CE-CB 4.15Å; L332-R336 WeakPolarHBondContact O-CB 3.31Å; L332-R336 WeakPolarHBondContact O-CD 3.33Å; L332-R336 WeakPolarHBondContact O-CG 3.5Å; L332-R336 PolarHBondContact O-N 3.47Å; L332-R336 VanDerWaalsContact O-N 3.08Å; L333-R336 PolarHBondContact O-N 3.09Å; M334-R336 VanDerWaalsContact C-N 3.28Å; M334-R336 PolarHBondContact O-N 3.5Å; R336-D339 PolarHBondContact O-N 2.88Å; R336-L340 WeakPolarHBondContact O-CB 3.4Å; R336-L340 PolarHBondContact O-N 3.26Å
337	F	87.7	Confident	84.6	Confident	43 Å²	43	73.5 Å²	73.5	19%	0.189	36%	0.362	C	S	.	.	H	α-helix	trans	-67.6	-41.8	176.7	-179.3	-104	0	0	0	111.4	A303 M306 E307 I310 L333 M334 L340 M341	A303-F337 HydrophobicContact CB-CE2 4.36Å; M306-F337 HydrophobicContact CB-CD2 3.8Å; M306-F337 HydrophobicContact CB-CE2 4.41Å; E307-F337 HydrophobicContact CG-CE2 3.92Å; E307-F337 HydrophobicContact CG-CZ 3.89Å; I310-F337 HydrophobicContact CD1-CB 3.88Å; I310-F337 HydrophobicContact CD1-CG 4.23Å; L333-F337 WeakPolarHBondContact O-CB 3.23Å; L333-F337 PolarHBondContact O-N 2.82Å; M334-F337 WeakPolarHBondContact O-CB 3.3Å; M334-F337 PolarHBondContact O-N 3.01Å; M334-F337 VanDerWaalsContact O-N 3.08Å; F337-L340 WeakPolarHBondContact O-CB 3.43Å; F337-L340 PolarHBondContact O-N 3.39Å; F337-M341 HydrophobicContact CD1-CG 4.4Å; F337-M341 HydrophobicContact CE1-CG 4.08Å; F337-M341 HydrophobicContact CZ-CG 4.15Å; F337-M341 HydrophobicContact CZ-SD 4.34Å; F337-M341 WeakPolarHBondContact O-CG 3.18Å; F337-M341 PolarHBondContact O-N 3.33Å
338	E	88.8	Confident	85	Confident	118 Å²	118	72.7 Å²	72.7	55%	0.551	36%	0.36	S	S	*	.	H	α-helix	trans	-59.8	-46.8	172.8	-71.2	177.8	174.5	0	0	111.3	M334 L340 M341 D342	M334-E338 WeakPolarHBondContact O-CG 3.48Å; M334-E338 PolarHBondContact O-N 3.37Å; E338-L340 VanDerWaalsContact C-N 3.32Å; E338-L340 PolarHBondContact O-N 3.45Å; E338-M341 PolarHBondContact O-N 3.26Å; E338-M341 VanDerWaalsContact O-N 3.1Å; E338-D342 PolarHBondContact O-N 2.92Å
339	D	86.7	Confident	85.1	Confident	68 Å²	68	68.4 Å²	68.4	36%	0.364	33%	0.334	S	S	.	.	H	α-helix	trans	-60.6	-39.2	176.1	-170.9	15.3	0	0	0	112.1	A335 R336 D342 R343	A335-D339 WeakPolarHBondContact O-CB 3.43Å; A335-D339 PolarHBondContact O-N 3.31Å; R336-D339 PolarHBondContact O-N 2.88Å; D339-D342 PolarHBondContact O-N 2.67Å; D339-R343 VanDerWaalsContact CG-NE 3.25Å; D339-R343 VanDerWaalsContact O-CB 3.28Å; D339-R343 WeakPolarHBondContact O-CB 3.42Å; D339-R343 WeakPolarHBondContact O-CD 3.2Å; D339-R343 WeakPolarHBondContact O-CG 3.17Å; D339-R343 PolarHBondContact O-N 3.31Å; D339-R343 IonicContact OD1-CZ 2.55Å; D339-R343 IonicContact OD1-NE 3.28Å; D339-R343 PolarHBondContact OD1-NE 2.92Å; D339-R343 IonicContact OD1-NH2 2.84Å; D339-R343 PolarHBondContact OD1-NH2 3.26Å; D339-R343 IonicContact OD2-CZ 2.78Å; D339-R343 IonicContact OD2-NE 3.97Å; D339-R343 PolarHBondContact OD2-NE 3.48Å; D339-R343 IonicContact OD2-NH2 3Å; D339-R343 PolarHBondContact OD2-NH2 3.43Å
340	L	87	Confident	85.2	Confident	5 Å²	5	62 Å²	62	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-62.3	-42.8	173.7	179.2	63.1	0	0	0	112.1	F299 Y302 R336 F337 E338 R343 R344	F299-L340 HydrophobicContact CD2-CD1 4.44Å; F299-L340 HydrophobicContact CE2-CD1 3.94Å; F299-L340 HydrophobicContact CE2-CD2 4.44Å; F299-L340 HydrophobicContact CE2-CG 3.91Å; Y302-L340 HydrophobicContact CD1-CD1 3.74Å; Y302-L340 HydrophobicContact CD1-CD2 3.38Å; Y302-L340 HydrophobicContact CD1-CG 4.19Å; Y302-L340 HydrophobicContact CE1-CD1 3.46Å; Y302-L340 VanDerWaalsContact CE1-CD1 3.46Å; Y302-L340 HydrophobicContact CE1-CD2 3.42Å; Y302-L340 VanDerWaalsContact CE1-CD2 3.42Å; Y302-L340 HydrophobicContact CE1-CG 4.03Å; Y302-L340 HydrophobicContact CG-CD2 4.07Å; R336-L340 WeakPolarHBondContact O-CB 3.4Å; R336-L340 PolarHBondContact O-N 3.26Å; F337-L340 WeakPolarHBondContact O-CB 3.43Å; F337-L340 PolarHBondContact O-N 3.39Å; E338-L340 VanDerWaalsContact C-N 3.32Å; E338-L340 PolarHBondContact O-N 3.45Å; L340-R343 PolarHBondContact O-N 3.34Å; L340-R344 PolarHBondContact O-N 3.37Å; L340-R344 VanDerWaalsContact O-N 3.14Å
341	M	85.2	Confident	85	Confident	80 Å²	80	61.7 Å²	61.7	39%	0.394	31%	0.31	S	S	.	.	H	α-helix	trans	-67	-40.7	179.8	-71.1	-59.5	-67.1	0	0	111.9	F299 F337 E338 R344	F299-M341 HydrophobicContact CE1-SD 4.33Å; F299-M341 HydrophobicContact CZ-SD 3.9Å; F337-M341 HydrophobicContact CD1-CG 4.4Å; F337-M341 HydrophobicContact CE1-CG 4.08Å; F337-M341 HydrophobicContact CZ-CG 4.15Å; F337-M341 HydrophobicContact CZ-SD 4.34Å; F337-M341 WeakPolarHBondContact O-CG 3.18Å; F337-M341 PolarHBondContact O-N 3.33Å; E338-M341 PolarHBondContact O-N 3.26Å; E338-M341 VanDerWaalsContact O-N 3.1Å; M341-R344 VanDerWaalsContact O-CB 3.3Å; M341-R344 WeakPolarHBondContact O-CB 3.45Å; M341-R344 PolarHBondContact O-N 3.04Å
342	D	85.9	Confident	84.7	Confident	125 Å²	125	58.9 Å²	58.9	67%	0.668	30%	0.295	S	S	*	.	H	α-helix	trans	-66.1	-40.6	175.4	-72.5	-16.9	0	0	0	111.6	E338 D339 R344 S345	E338-D342 PolarHBondContact O-N 2.92Å; D339-D342 PolarHBondContact O-N 2.67Å; D342-R344 VanDerWaalsContact C-N 3.26Å; D342-R344 PolarHBondContact O-N 3.47Å; D342-S345 PolarHBondContact O-OG 3.31Å
343	R	82.8	Confident	84.5	Confident	103 Å²	103	55.5 Å²	55.5	39%	0.389	28%	0.277	S	S	.	.	H	α-helix	trans	-68.2	-19.8	177.7	-74.1	171.9	-171.2	-163.1	5.1	114	D339 L340 S345 L346 L347	D339-R343 VanDerWaalsContact CG-NE 3.25Å; D339-R343 VanDerWaalsContact O-CB 3.28Å; D339-R343 WeakPolarHBondContact O-CB 3.42Å; D339-R343 WeakPolarHBondContact O-CD 3.2Å; D339-R343 WeakPolarHBondContact O-CG 3.17Å; D339-R343 PolarHBondContact O-N 3.31Å; D339-R343 IonicContact OD1-CZ 2.55Å; D339-R343 IonicContact OD1-NE 3.28Å; D339-R343 PolarHBondContact OD1-NE 2.92Å; D339-R343 IonicContact OD1-NH2 2.84Å; D339-R343 PolarHBondContact OD1-NH2 3.26Å; D339-R343 IonicContact OD2-CZ 2.78Å; D339-R343 IonicContact OD2-NE 3.97Å; D339-R343 PolarHBondContact OD2-NE 3.48Å; D339-R343 IonicContact OD2-NH2 3Å; D339-R343 PolarHBondContact OD2-NH2 3.43Å; L340-R343 PolarHBondContact O-N 3.34Å; R343-S345 PolarHBondContact O-N 3.46Å; R343-S345 VanDerWaalsContact O-N 3.12Å; R343-L346 WeakPolarHBondContact O-CB 3.47Å; R343-L346 PolarHBondContact O-N 2.75Å; R343-L347 HydrophobicContact CB-CD1 4.03Å; R343-L347 HydrophobicContact CB-CG 4.25Å; R343-L347 WeakPolarHBondContact O-CB 3.35Å; R343-L347 WeakPolarHBondContact O-CG 3.42Å; R343-L347 PolarHBondContact O-N 2.91Å
344	R	84.9	Confident	84.2	Confident	114 Å²	114	60.7 Å²	60.7	43%	0.43	30%	0.296	S	S	.	.	H	α-helix	trans	-48.6	-45.7	-176.7	-177.1	-175.3	175.4	172.7	2.8	112.2	F299 L340 M341 D342 L347 V348	F299-R344 HydrophobicContact CE1-CG 4.1Å; F299-R344 HydrophobicContact CE2-CB 4.02Å; F299-R344 HydrophobicContact CE2-CG 4.05Å; F299-R344 HydrophobicContact CZ-CB 3.83Å; F299-R344 HydrophobicContact CZ-CG 3.74Å; L340-R344 PolarHBondContact O-N 3.37Å; L340-R344 VanDerWaalsContact O-N 3.14Å; M341-R344 VanDerWaalsContact O-CB 3.3Å; M341-R344 WeakPolarHBondContact O-CB 3.45Å; M341-R344 PolarHBondContact O-N 3.04Å; D342-R344 VanDerWaalsContact C-N 3.26Å; D342-R344 PolarHBondContact O-N 3.47Å; R344-L347 PolarHBondContact O-N 3.13Å; R344-V348 HydrophobicContact CG-CG2 4.44Å; R344-V348 VanDerWaalsContact O-CG2 3.25Å; R344-V348 WeakPolarHBondContact O-CG2 3.35Å; R344-V348 PolarHBondContact O-N 3.04Å
345	S	81.2	Confident	83.7	Confident	52 Å²	52	60.3 Å²	60.3	36%	0.364	29%	0.294	S	S	.	.	H	α-helix	trans	-63.4	-43.2	-179.6	65.1	0	0	0	0	112.6	D342 R343 N349	D342-S345 PolarHBondContact O-OG 3.31Å; R343-S345 PolarHBondContact O-N 3.46Å; R343-S345 VanDerWaalsContact O-N 3.12Å; S345-N349 WeakPolarHBondContact O-CB 3.28Å; S345-N349 PolarHBondContact O-N 3.28Å; S345-N349 VanDerWaalsContact O-N 3.1Å
346	L	82.8	Confident	83.2	Confident	56 Å²	56	62.1 Å²	62.1	29%	0.293	30%	0.296	S	S	.	.	H	α-helix	trans	-66.6	-40.2	176.6	-64.1	174.4	0	0	0	111.6	R343 N349 S350 L369 T370	R343-L346 WeakPolarHBondContact O-CB 3.47Å; R343-L346 PolarHBondContact O-N 2.75Å; L346-N349 PolarHBondContact O-N 3.47Å; L346-S350 WeakPolarHBondContact O-CB 3.26Å; L346-S350 PolarHBondContact O-N 2.57Å; L346-L369 HydrophobicContact CD2-CB 3.77Å; L346-L369 HydrophobicContact CD2-CD1 4.4Å; L346-T370 HydrophobicContact CD2-CG2 3.76Å
347	L	81.5	Confident	83	Confident	26 Å²	26	59.5 Å²	59.5	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-68.7	-45	-180	-71.6	174	0	0	0	111.3	M286 F295 R343 R344 N349 S350 V351	M286-L347 HydrophobicContact CE-CD1 3.88Å; F295-L347 HydrophobicContact CE2-CB 3.66Å; F295-L347 HydrophobicContact CZ-CB 3.56Å; R343-L347 HydrophobicContact CB-CD1 4.03Å; R343-L347 HydrophobicContact CB-CG 4.25Å; R343-L347 WeakPolarHBondContact O-CB 3.35Å; R343-L347 WeakPolarHBondContact O-CG 3.42Å; R343-L347 PolarHBondContact O-N 2.91Å; R344-L347 PolarHBondContact O-N 3.13Å; L347-N349 VanDerWaalsContact C-N 3.31Å; L347-N349 PolarHBondContact O-N 3.33Å; L347-S350 WeakPolarHBondContact O-CA 3.06Å; L347-S350 WeakPolarHBondContact O-CB 3.49Å; L347-S350 PolarHBondContact O-N 2.74Å; L347-S350 PolarHBondContact O-OG 3.21Å; L347-V351 WeakPolarHBondContact O-CG2 3.44Å; L347-V351 PolarHBondContact O-N 2.95Å
348	V	84.9	Confident	82.6	Confident	46 Å²	46	59.6 Å²	59.6	28%	0.279	29%	0.293	S	S	.	.	H	α-helix	trans	-58	-46.4	173.4	171.9	0	0	0	0	110.5	F295 R344 S350 V351 L352	F295-V348 HydrophobicContact CD1-CG2 4.06Å; F295-V348 HydrophobicContact CE1-CB 4.42Å; F295-V348 HydrophobicContact CE1-CG2 3.32Å; F295-V348 HydrophobicContact CZ-CG2 3.83Å; R344-V348 HydrophobicContact CG-CG2 4.44Å; R344-V348 VanDerWaalsContact O-CG2 3.25Å; R344-V348 WeakPolarHBondContact O-CG2 3.35Å; R344-V348 PolarHBondContact O-N 3.04Å; V348-S350 VanDerWaalsContact C-N 3.29Å; V348-S350 PolarHBondContact O-N 3.1Å; V348-V351 PolarHBondContact O-N 3.27Å; V348-L352 HydrophobicContact CG1-CD1 4.34Å; V348-L352 WeakPolarHBondContact O-CG 2.98Å; V348-L352 PolarHBondContact O-N 3.07Å; V348-L352 VanDerWaalsContact O-N 3.08Å
349	N	83.1	Confident	82.3	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.027	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-38	176.1	-179.2	-86.8	0	0	0	111.8	S345 L346 L347 V351 L352 L353 E362 R366 L369	S345-N349 WeakPolarHBondContact O-CB 3.28Å; S345-N349 PolarHBondContact O-N 3.28Å; S345-N349 VanDerWaalsContact O-N 3.1Å; L346-N349 PolarHBondContact O-N 3.47Å; L347-N349 VanDerWaalsContact C-N 3.31Å; L347-N349 PolarHBondContact O-N 3.33Å; N349-V351 VanDerWaalsContact C-N 3.35Å; N349-V351 PolarHBondContact O-N 3.41Å; N349-L352 PolarHBondContact O-N 3.42Å; N349-L353 WeakPolarHBondContact O-CG 3.39Å; N349-L353 PolarHBondContact O-N 3.32Å; N349-L353 VanDerWaalsContact OD1-CD1 3.26Å; N349-L353 WeakPolarHBondContact OD1-CD1 3.42Å; N349-E362 PolarHBondContact ND2-O 2.89Å; N349-R366 VanDerWaalsContact OD1-CB 3.23Å; N349-R366 WeakPolarHBondContact OD1-CB 3.41Å; N349-R366 WeakPolarHBondContact OD1-CD 3.24Å; N349-R366 WeakPolarHBondContact OD1-CG 3.47Å; N349-L369 HydrophobicContact CB-CD1 4.18Å
350	S	83.5	Confident	82	Confident	17 Å²	17	52.1 Å²	52.1	12%	0.119	26%	0.257	C	S	.	.	H	α-helix	trans	-63.8	-37.4	175.7	83.4	0	0	0	0	112.9	L346 L347 V348 L353 R354	L346-S350 WeakPolarHBondContact O-CB 3.26Å; L346-S350 PolarHBondContact O-N 2.57Å; L347-S350 WeakPolarHBondContact O-CA 3.06Å; L347-S350 WeakPolarHBondContact O-CB 3.49Å; L347-S350 PolarHBondContact O-N 2.74Å; L347-S350 PolarHBondContact O-OG 3.21Å; V348-S350 VanDerWaalsContact C-N 3.29Å; V348-S350 PolarHBondContact O-N 3.1Å; S350-L353 PolarHBondContact O-N 3.47Å; S350-R354 VanDerWaalsContact O-CG 3.28Å; S350-R354 WeakPolarHBondContact O-CG 3.42Å; S350-R354 PolarHBondContact O-N 3.19Å
351	V	79.1	Confident	81.8	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-64.9	-42.8	174.5	175.5	0	0	0	0	110.4	I290 V292 F295 L347 V348 N349 L353 R354 Q355	I290-V351 VanDerWaalsContact O-CG1 3.23Å; I290-V351 WeakPolarHBondContact O-CG1 3.42Å; V292-V351 HydrophobicContact CG2-CG1 4.24Å; F295-V351 HydrophobicContact CB-CG2 4.23Å; F295-V351 HydrophobicContact CD2-CG2 3.42Å; F295-V351 VanDerWaalsContact CD2-CG2 3.42Å; F295-V351 HydrophobicContact CE2-CG2 3.89Å; F295-V351 HydrophobicContact CG-CG2 3.96Å; L347-V351 WeakPolarHBondContact O-CG2 3.44Å; L347-V351 PolarHBondContact O-N 2.95Å; V348-V351 PolarHBondContact O-N 3.27Å; N349-V351 VanDerWaalsContact C-N 3.35Å; N349-V351 PolarHBondContact O-N 3.41Å; V351-L353 VanDerWaalsContact C-N 3.34Å; V351-L353 PolarHBondContact O-N 3.12Å; V351-R354 WeakPolarHBondContact O-CB 3.31Å; V351-R354 PolarHBondContact O-N 2.97Å; V351-R354 VanDerWaalsContact O-N 3.15Å; V351-Q355 WeakPolarHBondContact O-CG 3.18Å; V351-Q355 PolarHBondContact O-N 3.23Å
352	L	81.7	Confident	81.7	Confident	45 Å²	45	53.9 Å²	53.9	24%	0.236	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-38.1	176.5	-65.1	173.2	0	0	0	112.3	V292 V348 N349 R354 Q355 N356 E362	V292-L352 HydrophobicContact CG2-CD2 3.83Å; V348-L352 HydrophobicContact CG1-CD1 4.34Å; V348-L352 WeakPolarHBondContact O-CG 2.98Å; V348-L352 PolarHBondContact O-N 3.07Å; V348-L352 VanDerWaalsContact O-N 3.08Å; N349-L352 PolarHBondContact O-N 3.42Å; L352-R354 VanDerWaalsContact C-N 3.33Å; L352-Q355 WeakPolarHBondContact O-CB 3.46Å; L352-Q355 PolarHBondContact O-N 3.45Å; L352-N356 PolarHBondContact O-N 3.28Å; L352-E362 HydrophobicContact CB-CG 4.25Å; L352-E362 WeakPolarHBondContact CD1-OE2 3.34Å
353	L	81.7	Confident	81.7	Confident	11 Å²	11	48.6 Å²	48.6	6%	0.058	24%	0.235	C	C	.	.	H	α-helix	trans	-68.7	-30.2	173.8	-70.9	175.4	0	0	0	112.6	N349 S350 V351 N356 P357 E362 W363	N349-L353 WeakPolarHBondContact O-CG 3.39Å; N349-L353 PolarHBondContact O-N 3.32Å; N349-L353 VanDerWaalsContact OD1-CD1 3.26Å; N349-L353 WeakPolarHBondContact OD1-CD1 3.42Å; S350-L353 PolarHBondContact O-N 3.47Å; V351-L353 VanDerWaalsContact C-N 3.34Å; V351-L353 PolarHBondContact O-N 3.12Å; L353-N356 CarbonylContact O-C 3.57Å; L353-N356 VanDerWaalsContact O-C 3.23Å; L353-P357 WeakPolarHBondContact O-CA 3.49Å; L353-P357 WeakPolarHBondContact O-CD 3.46Å; L353-P357 WeakPolarHBondContact O-CG 3.31Å; L353-E362 HydrophobicContact CD2-CB 3.74Å; L353-E362 HydrophobicContact CG-CB 4.32Å; L353-W363 HydrophobicContact CD1-CD2 4.02Å; L353-W363 HydrophobicContact CD1-CE3 3.91Å; L353-W363 HydrophobicContact CD1-CH2 4.05Å; L353-W363 HydrophobicContact CD1-CZ2 4.12Å; L353-W363 HydrophobicContact CD1-CZ3 3.95Å; L353-W363 HydrophobicContact CD2-CD2 3.74Å; L353-W363 HydrophobicContact CD2-CE3 4.47Å; L353-W363 HydrophobicContact CD2-CG 3.83Å; L353-W363 HydrophobicContact CD2-CZ2 4.15Å
354	R	78.6	Confident	81.8	Confident	116 Å²	116	45.6 Å²	45.6	44%	0.438	23%	0.227	S	C	.	.	H	α-helix	trans	-70.5	-36.7	172.2	-71.9	168.5	-164.1	-97.5	4.3	112	Q287 S350 V351 L352	Q287-R354 PolarHBondContact O-NE 3.3Å; Q287-R354 VanDerWaalsContact O-NE 3.13Å; Q287-R354 PolarHBondContact O-NH1 3.14Å; Q287-R354 PolarHBondContact O-NH2 3.01Å; S350-R354 VanDerWaalsContact O-CG 3.28Å; S350-R354 WeakPolarHBondContact O-CG 3.42Å; S350-R354 PolarHBondContact O-N 3.19Å; V351-R354 WeakPolarHBondContact O-CB 3.31Å; V351-R354 PolarHBondContact O-N 2.97Å; V351-R354 VanDerWaalsContact O-N 3.15Å; L352-R354 VanDerWaalsContact C-N 3.33Å
355	Q	76.4	Confident	81.6	Confident	74 Å²	74	45 Å²	45	35%	0.346	23%	0.227	S	C	.	.	H	α-helix	trans	-63.9	-48.5	173	-69	177.9	0.7	0	0	111.1	I290 V351 L352	I290-Q355 HydrophobicContact CG2-CG 4.08Å; I290-Q355 WeakPolarHBondContact O-CG 3.05Å; I290-Q355 PolarHBondContact O-NE2 3.1Å; V351-Q355 WeakPolarHBondContact O-CG 3.18Å; V351-Q355 PolarHBondContact O-N 3.23Å; L352-Q355 WeakPolarHBondContact O-CB 3.46Å; L352-Q355 PolarHBondContact O-N 3.45Å
356	N	78.8	Confident	81.7	Confident	92 Å²	92	45.7 Å²	45.7	49%	0.492	22%	0.222	S	C	.	.			trans	-136.9	88.6	-177	-69.7	-51.5	0	0	0	111.2	L352 L353 H358 N359	L352-N356 PolarHBondContact O-N 3.28Å; L353-N356 CarbonylContact O-C 3.57Å; L353-N356 VanDerWaalsContact O-C 3.23Å; N356-H358 PolarHBondContact O-N 3.26Å; N356-H358 VanDerWaalsContact O-N 3.15Å; N356-N359 HydrophobicContact CB-CB 4.15Å; N356-N359 PolarHBondContact O-N 3.43Å
357	P	80.6	Confident	81.4	Confident	53 Å²	53	43.8 Å²	43.8	34%	0.344	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-25.8	178.5	-24.9	34.1	0	0	0	113.3	L353 W363	L353-P357 WeakPolarHBondContact O-CA 3.49Å; L353-P357 WeakPolarHBondContact O-CD 3.46Å; L353-P357 WeakPolarHBondContact O-CG 3.31Å; P357-W363 PolarHBondContact O-NE1 2.81Å
358	H	78.9	Confident	81.5	Confident	44 Å²	44	48 Å²	48	20%	0.204	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	5.6	-175.7	-52.6	-41.7	0	0	0	114.1	N356 V360 T387 N389 L392 V394	N356-H358 PolarHBondContact O-N 3.26Å; N356-H358 VanDerWaalsContact O-N 3.15Å; H358-V360 PolarHBondContact O-N 3.21Å; H358-T387 PolarHBondContact CE1-O 2.93Å; H358-T387 PolarHBondContact ND1-O 3.15Å; H358-N389 PolarHBondContact CE1-ND2 3.18Å; H358-L392 HydrophobicContact CB-CB 4.49Å; H358-L392 WeakPolarHBondContact CB-O 3.49Å; H358-V394 PolarHBondContact O-N 3.13Å; H358-V394 VanDerWaalsContact O-N 3.12Å
359	N	84	Confident	81.1	Confident	28 Å²	28	49.4 Å²	49.4	15%	0.15	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-83	109.2	177.7	-172.7	-10.7	0	0	0	111.3	N356 H361 E362 W363 V394	N356-N359 HydrophobicContact CB-CB 4.15Å; N356-N359 PolarHBondContact O-N 3.43Å; N359-H361 VanDerWaalsContact C-N 3.33Å; N359-H361 PolarHBondContact O-N 3.23Å; N359-H361 PolarHBondContact OD1-N 3.22Å; N359-H361 PolarHBondContact OD1-ND1 2.99Å; N359-E362 HydrophobicContact CB-CG 4.36Å; N359-E362 PolarHBondContact O-N 3.45Å; N359-W363 PolarHBondContact O-N 3.36Å; N359-V394 PolarHBondContact OD1-O 3.1Å
360	V	79.1	Confident	80.9	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-63.6	-36.8	-179	170	0	0	0	0	112.4	H358 E362 W363 L364 V388 V394 K396 I400	H358-V360 PolarHBondContact O-N 3.21Å; V360-E362 VanDerWaalsContact C-N 3.33Å; V360-E362 PolarHBondContact O-N 2.97Å; V360-W363 PolarHBondContact O-N 3.1Å; V360-L364 HydrophobicContact CG1-CD1 4.13Å; V360-L364 HydrophobicContact CG1-CG 4.33Å; V360-L364 WeakPolarHBondContact O-CG 3.48Å; V360-L364 PolarHBondContact O-N 3.48Å; V360-V388 HydrophobicContact CG2-CG1 4.41Å; V360-V394 PolarHBondContact N-O 3.1Å; V360-K396 WeakPolarHBondContact CG1-O 3.42Å; V360-I400 HydrophobicContact CB-CD1 4.11Å; V360-I400 HydrophobicContact CB-CG1 4.24Å; V360-I400 HydrophobicContact CG1-CD1 3.8Å; V360-I400 HydrophobicContact CG1-CG1 3.38Å; V360-I400 HydrophobicContact CG2-CD1 3.85Å; V360-I400 HydrophobicContact CG2-CG1 4.26Å
361	H	83.6	Confident	80.3	Confident	99 Å²	99	54 Å²	54	46%	0.458	26%	0.256	S	S	.	.	H	α-helix	trans	-68	-35.6	-175.2	-61	85.7	0	0	0	111.9	N359 L364 K365	N359-H361 VanDerWaalsContact C-N 3.33Å; N359-H361 PolarHBondContact O-N 3.23Å; N359-H361 PolarHBondContact OD1-N 3.22Å; N359-H361 PolarHBondContact OD1-ND1 2.99Å; H361-L364 PolarHBondContact O-N 2.75Å; H361-K365 WeakPolarHBondContact O-CG 3.3Å; H361-K365 PolarHBondContact O-N 2.94Å
362	E	82.5	Confident	80	Confident	23 Å²	23	61.7 Å²	61.7	11%	0.107	30%	0.297	C	S	.	.	H	α-helix	trans	-71.5	-35.3	177	-63.7	-54.1	139.7	0	0	111.4	N349 L352 L353 N359 V360 K365 R366	N349-E362 PolarHBondContact ND2-O 2.89Å; L352-E362 HydrophobicContact CB-CG 4.25Å; L352-E362 WeakPolarHBondContact CD1-OE2 3.34Å; L353-E362 HydrophobicContact CD2-CB 3.74Å; L353-E362 HydrophobicContact CG-CB 4.32Å; N359-E362 HydrophobicContact CB-CG 4.36Å; N359-E362 PolarHBondContact O-N 3.45Å; V360-E362 VanDerWaalsContact C-N 3.33Å; V360-E362 PolarHBondContact O-N 2.97Å; E362-K365 PolarHBondContact O-N 3.15Å; E362-K365 IonicContact OE1-NZ 2.68Å; E362-K365 PolarHBondContact OE1-NZ 2.92Å; E362-K365 WeakPolarHBondContact OE2-CD 3.22Å; E362-K365 IonicContact OE2-NZ 4Å; E362-R366 PolarHBondContact O-N 3.12Å
363	W	86	Confident	79.8	Confident	14 Å²	14	62.9 Å²	62.9	5%	0.053	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-42.8	169.9	-76	111.6	0	0	0	112.1	L353 P357 N359 V360 K365 R366 V367 V380 D383 A384 T387 I400	L353-W363 HydrophobicContact CD1-CD2 4.02Å; L353-W363 HydrophobicContact CD1-CE3 3.91Å; L353-W363 HydrophobicContact CD1-CH2 4.05Å; L353-W363 HydrophobicContact CD1-CZ2 4.12Å; L353-W363 HydrophobicContact CD1-CZ3 3.95Å; L353-W363 HydrophobicContact CD2-CD2 3.74Å; L353-W363 HydrophobicContact CD2-CE3 4.47Å; L353-W363 HydrophobicContact CD2-CG 3.83Å; L353-W363 HydrophobicContact CD2-CZ2 4.15Å; P357-W363 PolarHBondContact O-NE1 2.81Å; N359-W363 PolarHBondContact O-N 3.36Å; V360-W363 PolarHBondContact O-N 3.1Å; W363-K365 PolarHBondContact O-N 3.07Å; W363-R366 VanDerWaalsContact O-CB 3.31Å; W363-R366 WeakPolarHBondContact O-CB 3.22Å; W363-R366 PolarHBondContact O-N 3.48Å; W363-R366 VanDerWaalsContact O-N 3.14Å; W363-V367 WeakPolarHBondContact O-CG2 3.03Å; W363-V367 PolarHBondContact O-N 3.02Å; W363-V380 HydrophobicContact CE3-CG1 3.99Å; W363-V380 HydrophobicContact CZ3-CG1 4.22Å; W363-D383 HydrophobicContact CH2-CB 4Å; W363-D383 HydrophobicContact CZ3-CB 4.1Å; W363-A384 HydrophobicContact CB-CB 4.07Å; W363-A384 HydrophobicContact CD2-CB 3.57Å; W363-A384 HydrophobicContact CE3-CB 3.63Å; W363-A384 HydrophobicContact CG-CB 3.77Å; W363-A384 HydrophobicContact CZ3-CB 4.25Å; W363-T387 HydrophobicContact CZ2-CG2 4.16Å; W363-T387 WeakPolarHBondContact CZ2-OG1 3.4Å; W363-I400 HydrophobicContact CB-CD1 4.35Å
364	L	83.8	Confident	79.6	Confident	41 Å²	41	67.1 Å²	67.1	22%	0.215	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-44.1	174.5	-68.2	176.4	0	0	0	111.3	V360 H361 R366 V367 E368 D399 S403	V360-L364 HydrophobicContact CG1-CD1 4.13Å; V360-L364 HydrophobicContact CG1-CG 4.33Å; V360-L364 WeakPolarHBondContact O-CG 3.48Å; V360-L364 PolarHBondContact O-N 3.48Å; H361-L364 PolarHBondContact O-N 2.75Å; L364-R366 VanDerWaalsContact C-N 3.28Å; L364-R366 PolarHBondContact O-N 3.41Å; L364-V367 WeakPolarHBondContact O-CB 3.47Å; L364-V367 PolarHBondContact O-N 3.31Å; L364-E368 VanDerWaalsContact O-CG 3.29Å; L364-E368 WeakPolarHBondContact O-CG 3.37Å; L364-E368 PolarHBondContact O-N 3.32Å; L364-D399 HydrophobicContact CD1-CB 4.15Å; L364-S403 WeakPolarHBondContact CD2-OG 3.08Å
365	K	81.6	Confident	79.8	Confident	102 Å²	102	64.3 Å²	64.3	44%	0.443	33%	0.325	S	S	.	.	H	α-helix	trans	-59.6	-38.1	173.3	-72.1	172.3	-173.7	171.1	0	111.9	H361 E362 W363 E368 L369	H361-K365 WeakPolarHBondContact O-CG 3.3Å; H361-K365 PolarHBondContact O-N 2.94Å; E362-K365 PolarHBondContact O-N 3.15Å; E362-K365 IonicContact OE1-NZ 2.68Å; E362-K365 PolarHBondContact OE1-NZ 2.92Å; E362-K365 WeakPolarHBondContact OE2-CD 3.22Å; E362-K365 IonicContact OE2-NZ 4Å; W363-K365 PolarHBondContact O-N 3.07Å; K365-E368 CarbonylContact O-C 3.54Å; K365-E368 WeakPolarHBondContact O-CA 3.42Å; K365-E368 WeakPolarHBondContact O-CB 3.38Å; K365-E368 PolarHBondContact O-N 3.41Å; K365-L369 VanDerWaalsContact O-CG 3.31Å; K365-L369 WeakPolarHBondContact O-CG 3.46Å; K365-L369 PolarHBondContact O-N 3.34Å
366	R	82.5	Confident	79.8	Confident	66 Å²	66	66 Å²	66	25%	0.249	33%	0.331	C	S	.	.	H	α-helix	trans	-62.1	-44.2	175.2	-165	170	170.8	153.7	-5.2	112.2	N349 E362 W363 L364 E368 L369 T370 V380	N349-R366 VanDerWaalsContact OD1-CB 3.23Å; N349-R366 WeakPolarHBondContact OD1-CB 3.41Å; N349-R366 WeakPolarHBondContact OD1-CD 3.24Å; N349-R366 WeakPolarHBondContact OD1-CG 3.47Å; E362-R366 PolarHBondContact O-N 3.12Å; W363-R366 VanDerWaalsContact O-CB 3.31Å; W363-R366 WeakPolarHBondContact O-CB 3.22Å; W363-R366 PolarHBondContact O-N 3.48Å; W363-R366 VanDerWaalsContact O-N 3.14Å; L364-R366 VanDerWaalsContact C-N 3.28Å; L364-R366 PolarHBondContact O-N 3.41Å; R366-E368 PolarHBondContact O-N 3.28Å; R366-L369 PolarHBondContact O-N 3.03Å; R366-T370 WeakPolarHBondContact O-CB 3.25Å; R366-T370 WeakPolarHBondContact O-CG2 3.49Å; R366-T370 PolarHBondContact O-N 3.14Å; R366-T370 PolarHBondContact O-OG1 3.37Å; R366-V380 HydrophobicContact CB-CG1 3.96Å; R366-V380 HydrophobicContact CG-CG1 3.77Å; R366-V380 HydrophobicContact CG-CG2 4.06Å
367	V	78	Confident	80	Confident	16 Å²	16	61.7 Å²	61.7	10%	0.097	31%	0.308	C	S	.	.	H	α-helix	trans	-59.4	-39.4	172.2	171.1	0	0	0	0	109.6	W363 L364 L369 T370 K371 V380 F381	W363-V367 WeakPolarHBondContact O-CG2 3.03Å; W363-V367 PolarHBondContact O-N 3.02Å; L364-V367 WeakPolarHBondContact O-CB 3.47Å; L364-V367 PolarHBondContact O-N 3.31Å; V367-L369 PolarHBondContact O-N 3.47Å; V367-T370 WeakPolarHBondContact CA-OG1 3.31Å; V367-T370 PolarHBondContact O-N 2.98Å; V367-T370 PolarHBondContact O-OG1 2.87Å; V367-K371 PolarHBondContact O-N 2.86Å; V367-V380 HydrophobicContact CG2-CG1 3.73Å; V367-F381 HydrophobicContact CB-CE1 4.39Å; V367-F381 HydrophobicContact CB-CE2 4.42Å; V367-F381 HydrophobicContact CB-CZ 4.06Å; V367-F381 HydrophobicContact CG1-CE1 4.09Å; V367-F381 HydrophobicContact CG1-CE2 3.57Å; V367-F381 HydrophobicContact CG1-CZ 3.3Å; V367-F381 HydrophobicContact CG2-CD1 3.87Å; V367-F381 HydrophobicContact CG2-CD2 4.23Å; V367-F381 HydrophobicContact CG2-CE1 3.54Å; V367-F381 HydrophobicContact CG2-CE2 3.91Å; V367-F381 HydrophobicContact CG2-CG 4.23Å; V367-F381 HydrophobicContact CG2-CZ 3.58Å
368	E	82.1	Confident	80	Confident	113 Å²	113	60.5 Å²	60.5	53%	0.528	30%	0.298	S	S	.	.	H	α-helix	trans	-68.6	-35.3	-179.4	-66.5	-152.8	117.5	0	0	114.2	L364 K365 R366 T370 K371	L364-E368 VanDerWaalsContact O-CG 3.29Å; L364-E368 WeakPolarHBondContact O-CG 3.37Å; L364-E368 PolarHBondContact O-N 3.32Å; K365-E368 CarbonylContact O-C 3.54Å; K365-E368 WeakPolarHBondContact O-CA 3.42Å; K365-E368 WeakPolarHBondContact O-CB 3.38Å; K365-E368 PolarHBondContact O-N 3.41Å; R366-E368 PolarHBondContact O-N 3.28Å; E368-T370 VanDerWaalsContact C-N 3.34Å; E368-K371 VanDerWaalsContact O-CD 3.27Å; E368-K371 WeakPolarHBondContact O-CD 3.4Å; E368-K371 WeakPolarHBondContact O-CE 3.46Å; E368-K371 WeakPolarHBondContact O-CG 3.21Å; E368-K371 IonicContact OE1-NZ 3.87Å; E368-K371 PolarHBondContact OE1-NZ 3.19Å
369	L	78.3	Confident	80.4	Confident	77 Å²	77	63.9 Å²	63.9	40%	0.403	31%	0.314	S	S	.	.	H	α-helix	trans	-73.4	-28	175.4	-67	171.4	0	0	0	112.2	L346 N349 K365 R366 V367	L346-L369 HydrophobicContact CD2-CB 3.77Å; L346-L369 HydrophobicContact CD2-CD1 4.4Å; N349-L369 HydrophobicContact CB-CD1 4.18Å; K365-L369 VanDerWaalsContact O-CG 3.31Å; K365-L369 WeakPolarHBondContact O-CG 3.46Å; K365-L369 PolarHBondContact O-N 3.34Å; R366-L369 PolarHBondContact O-N 3.03Å; V367-L369 PolarHBondContact O-N 3.47Å
370	T	77	Confident	80.4	Confident	15 Å²	15	62.8 Å²	62.8	9%	0.092	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	4.9	-178.1	49.2	0	0	0	0	113.9	L346 R366 V367 E368 D372 N373 T377 V380	L346-T370 HydrophobicContact CD2-CG2 3.76Å; R366-T370 WeakPolarHBondContact O-CB 3.25Å; R366-T370 WeakPolarHBondContact O-CG2 3.49Å; R366-T370 PolarHBondContact O-N 3.14Å; R366-T370 PolarHBondContact O-OG1 3.37Å; V367-T370 WeakPolarHBondContact CA-OG1 3.31Å; V367-T370 PolarHBondContact O-N 2.98Å; V367-T370 PolarHBondContact O-OG1 2.87Å; E368-T370 VanDerWaalsContact C-N 3.34Å; T370-D372 PolarHBondContact O-N 3.09Å; T370-N373 PolarHBondContact O-N 3.27Å; T370-T377 VanDerWaalsContact C-CG2 3.46Å; T370-T377 WeakPolarHBondContact O-CG2 3.31Å; T370-V380 HydrophobicContact CG2-CG2 4.4Å
371	K	71.5	Confident	80.6	Confident	102 Å²	102	62.9 Å²	62.9	44%	0.443	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.7	-33.1	-173.7	-78.9	173.8	-165.3	176.4	0	114.5	V367 E368	V367-K371 PolarHBondContact O-N 2.86Å; E368-K371 VanDerWaalsContact O-CD 3.27Å; E368-K371 WeakPolarHBondContact O-CD 3.4Å; E368-K371 WeakPolarHBondContact O-CE 3.46Å; E368-K371 WeakPolarHBondContact O-CG 3.21Å; E368-K371 IonicContact OE1-NZ 3.87Å; E368-K371 PolarHBondContact OE1-NZ 3.19Å
372	D	72.8	Confident	80.8	Confident	163 Å²	163	62.4 Å²	62.4	87%	0.872	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-22.4	-175.2	-58.7	-28.4	0	0	0	113.9	T370	T370-D372 PolarHBondContact O-N 3.09Å
373	N	78.1	Confident	80.9	Confident	70 Å²	70	64.5 Å²	64.5	37%	0.374	32%	0.319	S	S	.	.			trans	-116.9	103.7	-177.2	-167.9	-25	0	0	0	111.7	T370 A375 K376 T377	T370-N373 PolarHBondContact O-N 3.27Å; N373-A375 VanDerWaalsContact C-N 3.34Å; N373-A375 PolarHBondContact O-N 2.84Å; N373-A375 PolarHBondContact OD1-N 3.29Å; N373-K376 HydrophobicContact CB-CB 4.17Å; N373-K376 HydrophobicContact CB-CD 4.22Å; N373-K376 HydrophobicContact CB-CG 4.27Å; N373-K376 PolarHBondContact O-N 3.12Å; N373-T377 WeakPolarHBondContact O-CG2 3.26Å; N373-T377 PolarHBondContact O-N 3Å
374	E	76.4	Confident	80.8	Confident	100 Å²	100	63.9 Å²	63.9	47%	0.467	32%	0.317	S	S	.	.	H	α-helix	trans	-55.8	-45.7	-176.5	-55.4	-168.4	161.8	0	0	112.9	K376 T377 L378 Y407	E374-K376 PolarHBondContact O-N 2.75Å; E374-T377 PolarHBondContact O-N 3.32Å; E374-T377 PolarHBondContact O-OG1 3.4Å; E374-L378 WeakPolarHBondContact O-CG 3.48Å; E374-L378 PolarHBondContact O-N 3.36Å; E374-L378 VanDerWaalsContact O-N 3.1Å; E374-Y407 VanDerWaalsContact CA-OH 3.26Å; E374-Y407 WeakPolarHBondContact CA-OH 3.28Å; E374-Y407 WeakPolarHBondContact CB-OH 3.32Å; E374-Y407 WeakPolarHBondContact CG-OH 3.45Å
375	A	82.9	Confident	80.8	Confident	57 Å²	57	64 Å²	64	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-62	-45.5	-177.7	0	0	0	0	0	111.5	N373 T377 L378 E379	N373-A375 VanDerWaalsContact C-N 3.34Å; N373-A375 PolarHBondContact O-N 2.84Å; N373-A375 PolarHBondContact OD1-N 3.29Å; A375-T377 PolarHBondContact O-N 2.82Å; A375-L378 PolarHBondContact O-N 2.99Å; A375-E379 WeakPolarHBondContact O-CG 3.44Å; A375-E379 PolarHBondContact O-N 2.91Å
376	K	77.9	Confident	80.9	Confident	111 Å²	111	66 Å²	66	48%	0.483	33%	0.328	S	S	.	.	H	α-helix	trans	-66.1	-38	178.4	-66.8	-175.6	-178.9	-179.1	0	111.9	N373 E374 L378 E379 V380	N373-K376 HydrophobicContact CB-CB 4.17Å; N373-K376 HydrophobicContact CB-CD 4.22Å; N373-K376 HydrophobicContact CB-CG 4.27Å; N373-K376 PolarHBondContact O-N 3.12Å; E374-K376 PolarHBondContact O-N 2.75Å; K376-L378 VanDerWaalsContact C-N 3.29Å; K376-L378 PolarHBondContact O-N 3.48Å; K376-E379 PolarHBondContact O-N 2.85Å; K376-V380 WeakPolarHBondContact O-CB 3.23Å; K376-V380 WeakPolarHBondContact O-CG2 3.14Å; K376-V380 PolarHBondContact O-N 3.4Å
377	T	81.2	Confident	80.9	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.2	-40	176.2	59.7	0	0	0	0	111.6	T370 N373 E374 A375 V380 F381 Y407	T370-T377 VanDerWaalsContact C-CG2 3.46Å; T370-T377 WeakPolarHBondContact O-CG2 3.31Å; N373-T377 WeakPolarHBondContact O-CG2 3.26Å; N373-T377 PolarHBondContact O-N 3Å; E374-T377 PolarHBondContact O-N 3.32Å; E374-T377 PolarHBondContact O-OG1 3.4Å; A375-T377 PolarHBondContact O-N 2.82Å; T377-V380 PolarHBondContact O-N 3.06Å; T377-F381 WeakPolarHBondContact O-CD2 3.31Å; T377-F381 PolarHBondContact O-N 2.85Å; T377-Y407 HydrophobicContact CG2-CE2 4.26Å; T377-Y407 VanDerWaalsContact OG1-CE1 3.31Å; T377-Y407 WeakPolarHBondContact OG1-CE1 3.33Å; T377-Y407 PolarHBondContact OG1-OH 2.69Å
378	L	82.4	Confident	81	Confident	28 Å²	28	64.8 Å²	64.8	15%	0.147	33%	0.328	C	S	.	.	H	α-helix	trans	-66.4	-45.3	177.9	-65.4	178.6	0	0	0	111.4	E374 A375 K376 V380 F381 E382 Y404 Y407 Y408	E374-L378 WeakPolarHBondContact O-CG 3.48Å; E374-L378 PolarHBondContact O-N 3.36Å; E374-L378 VanDerWaalsContact O-N 3.1Å; A375-L378 PolarHBondContact O-N 2.99Å; K376-L378 VanDerWaalsContact C-N 3.29Å; K376-L378 PolarHBondContact O-N 3.48Å; L378-V380 VanDerWaalsContact C-N 3.3Å; L378-V380 PolarHBondContact O-N 2.97Å; L378-F381 PolarHBondContact O-N 3.41Å; L378-F381 VanDerWaalsContact O-N 3.16Å; L378-E382 WeakPolarHBondContact O-CG 3.35Å; L378-E382 PolarHBondContact O-N 3.4Å; L378-Y404 HydrophobicContact CD2-CE2 3.82Å; L378-Y407 HydrophobicContact CD2-CD1 4.07Å; L378-Y407 HydrophobicContact CD2-CE1 3.99Å; L378-Y407 HydrophobicContact CG-CE1 4.44Å; L378-Y408 HydrophobicContact CD2-CE1 3.83Å; L378-Y408 HydrophobicContact CD2-CE2 4.16Å; L378-Y408 WeakPolarHBondContact CD2-OH 3.41Å
379	E	86.2	Confident	80.7	Confident	115 Å²	115	63.3 Å²	63.3	54%	0.537	32%	0.324	S	S	.	.	H	α-helix	trans	-58.2	-43.6	173.6	-71.6	172.3	-177.6	0	0	111.3	A375 K376 F381 E382 D383	A375-E379 WeakPolarHBondContact O-CG 3.44Å; A375-E379 PolarHBondContact O-N 2.91Å; K376-E379 PolarHBondContact O-N 2.85Å; E379-F381 VanDerWaalsContact C-N 3.32Å; E379-F381 PolarHBondContact O-N 3.44Å; E379-E382 PolarHBondContact O-N 2.95Å; E379-D383 WeakPolarHBondContact O-CB 3.38Å; E379-D383 VanDerWaalsContact O-CG 3.24Å; E379-D383 PolarHBondContact O-N 3.49Å
380	V	84.3	Confident	80.5	Confident	6 Å²	6	61 Å²	61	4%	0.036	31%	0.313	C	S	.	.	H	α-helix	trans	-62	-39.3	176.8	169.6	0	0	0	0	111.7	W363 R366 V367 T370 K376 T377 L378 A384	W363-V380 HydrophobicContact CE3-CG1 3.99Å; W363-V380 HydrophobicContact CZ3-CG1 4.22Å; R366-V380 HydrophobicContact CB-CG1 3.96Å; R366-V380 HydrophobicContact CG-CG1 3.77Å; R366-V380 HydrophobicContact CG-CG2 4.06Å; V367-V380 HydrophobicContact CG2-CG1 3.73Å; T370-V380 HydrophobicContact CG2-CG2 4.4Å; K376-V380 WeakPolarHBondContact O-CB 3.23Å; K376-V380 WeakPolarHBondContact O-CG2 3.14Å; K376-V380 PolarHBondContact O-N 3.4Å; T377-V380 PolarHBondContact O-N 3.06Å; L378-V380 VanDerWaalsContact C-N 3.3Å; L378-V380 PolarHBondContact O-N 2.97Å; V380-A384 VanDerWaalsContact O-CB 3.23Å; V380-A384 WeakPolarHBondContact O-CB 3.45Å; V380-A384 PolarHBondContact O-N 2.89Å
381	F	83.4	Confident	80.3	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.009	35%	0.348	C	S	.	.	H	α-helix	trans	-68.9	-43.1	175.3	-79.4	-63.5	0	0	0	112.4	V367 T377 L378 E379 D383 A384 V385 I400 S403 Y404 Y407	V367-F381 HydrophobicContact CB-CE1 4.39Å; V367-F381 HydrophobicContact CB-CE2 4.42Å; V367-F381 HydrophobicContact CB-CZ 4.06Å; V367-F381 HydrophobicContact CG1-CE1 4.09Å; V367-F381 HydrophobicContact CG1-CE2 3.57Å; V367-F381 HydrophobicContact CG1-CZ 3.3Å; V367-F381 HydrophobicContact CG2-CD1 3.87Å; V367-F381 HydrophobicContact CG2-CD2 4.23Å; V367-F381 HydrophobicContact CG2-CE1 3.54Å; V367-F381 HydrophobicContact CG2-CE2 3.91Å; V367-F381 HydrophobicContact CG2-CG 4.23Å; V367-F381 HydrophobicContact CG2-CZ 3.58Å; T377-F381 WeakPolarHBondContact O-CD2 3.31Å; T377-F381 PolarHBondContact O-N 2.85Å; L378-F381 PolarHBondContact O-N 3.41Å; L378-F381 VanDerWaalsContact O-N 3.16Å; E379-F381 VanDerWaalsContact C-N 3.32Å; E379-F381 PolarHBondContact O-N 3.44Å; F381-D383 VanDerWaalsContact C-N 3.33Å; F381-D383 PolarHBondContact O-N 3.02Å; F381-A384 PolarHBondContact O-N 3.08Å; F381-V385 WeakPolarHBondContact O-CB 3.31Å; F381-V385 VanDerWaalsContact O-CG2 3.3Å; F381-V385 WeakPolarHBondContact O-CG2 3.5Å; F381-V385 PolarHBondContact O-N 3.22Å; F381-I400 HydrophobicContact CD1-CG2 4.18Å; F381-S403 WeakPolarHBondContact CE1-OG 3.24Å; F381-Y404 HydrophobicContact CB-CD2 3.43Å; F381-Y404 VanDerWaalsContact CB-CD2 3.43Å; F381-Y404 HydrophobicContact CB-CE2 3.57Å; F381-Y404 HydrophobicContact CB-CG 3.96Å; F381-Y404 AromaticContact CD1-CD2 3.9Å; F381-Y404 HydrophobicContact CD1-CD2 3.9Å; F381-Y404 HydrophobicContact CD1-CG 4.01Å; F381-Y404 AromaticContact CD2-CD2 3.41Å; F381-Y404 HydrophobicContact CD2-CD2 3.41Å; F381-Y404 VanDerWaalsContact CD2-CD2 3.41Å; F381-Y404 AromaticContact CD2-CE2 3.97Å; F381-Y404 HydrophobicContact CD2-CE2 3.97Å; F381-Y404 HydrophobicContact CD2-CG 4.32Å; F381-Y404 HydrophobicContact CE1-CD2 4.44Å; F381-Y404 HydrophobicContact CE2-CD2 4.03Å; F381-Y404 AromaticContact CG-CD2 3.33Å; F381-Y404 HydrophobicContact CG-CD2 3.33Å; F381-Y404 AromaticContact CG-CE2 3.94Å; F381-Y404 HydrophobicContact CG-CE2 3.94Å; F381-Y404 AromaticContact CG-CG 3.88Å; F381-Y404 HydrophobicContact CG-CG 3.88Å; F381-Y404 HydrophobicContact CZ-CD2 4.47Å; F381-Y407 HydrophobicContact CE2-CD1 4.35Å; F381-Y407 HydrophobicContact CE2-CD2 4.45Å; F381-Y407 AromaticContact CE2-CG 3.98Å; F381-Y407 HydrophobicContact CE2-CG 3.98Å
382	E	86.9	Confident	80.5	Confident	90 Å²	90	69.7 Å²	69.7	42%	0.421	35%	0.354	S	S	.	.	H	α-helix	trans	-62.3	-41.4	176.1	-73	-175.1	-165.6	0	0	111.8	L378 E379 V385 K386	L378-E382 WeakPolarHBondContact O-CG 3.35Å; L378-E382 PolarHBondContact O-N 3.4Å; E379-E382 PolarHBondContact O-N 2.95Å; E382-V385 PolarHBondContact O-N 2.83Å; E382-K386 WeakPolarHBondContact O-CB 3.35Å; E382-K386 WeakPolarHBondContact O-CD 3.2Å; E382-K386 VanDerWaalsContact O-CG 3.24Å; E382-K386 WeakPolarHBondContact O-CG 3.1Å; E382-K386 PolarHBondContact O-N 3.42Å; E382-K386 IonicContact OE2-NZ 3.95Å
383	D	85	Confident	80.5	Confident	67 Å²	67	63.4 Å²	63.4	36%	0.358	32%	0.319	S	S	.	.	H	α-helix	trans	-66.4	-42.6	175.1	-73	-13.5	0	0	0	111.3	W363 E379 F381 V385 K386 T387	W363-D383 HydrophobicContact CH2-CB 4Å; W363-D383 HydrophobicContact CZ3-CB 4.1Å; E379-D383 WeakPolarHBondContact O-CB 3.38Å; E379-D383 VanDerWaalsContact O-CG 3.24Å; E379-D383 PolarHBondContact O-N 3.49Å; F381-D383 VanDerWaalsContact C-N 3.33Å; F381-D383 PolarHBondContact O-N 3.02Å; D383-V385 VanDerWaalsContact C-N 3.33Å; D383-V385 PolarHBondContact O-N 3.18Å; D383-K386 PolarHBondContact O-N 2.87Å; D383-T387 WeakPolarHBondContact O-CB 3.46Å; D383-T387 WeakPolarHBondContact O-CG2 3.23Å; D383-T387 PolarHBondContact O-N 3.36Å; D383-T387 PolarHBondContact O-OG1 3.34Å
384	A	85.5	Confident	80	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.008	33%	0.327	C	S	.	.	H	α-helix	trans	-59.3	-45.1	175.4	0	0	0	0	0	111.3	W363 V380 F381 K386 T387 V388 I400	W363-A384 HydrophobicContact CB-CB 4.07Å; W363-A384 HydrophobicContact CD2-CB 3.57Å; W363-A384 HydrophobicContact CE3-CB 3.63Å; W363-A384 HydrophobicContact CG-CB 3.77Å; W363-A384 HydrophobicContact CZ3-CB 4.25Å; V380-A384 VanDerWaalsContact O-CB 3.23Å; V380-A384 WeakPolarHBondContact O-CB 3.45Å; V380-A384 PolarHBondContact O-N 2.89Å; F381-A384 PolarHBondContact O-N 3.08Å; A384-K386 PolarHBondContact O-N 3.45Å; A384-T387 PolarHBondContact O-N 2.91Å; A384-T387 PolarHBondContact O-OG1 2.9Å; A384-V388 WeakPolarHBondContact O-CB 3.2Å; A384-V388 WeakPolarHBondContact O-CG2 3.42Å; A384-V388 PolarHBondContact O-N 3.49Å; A384-I400 HydrophobicContact CB-CD1 4.32Å; A384-I400 HydrophobicContact CB-CG2 4.22Å
385	V	82.2	Confident	79.8	Confident	43 Å²	43	60.8 Å²	60.8	26%	0.261	32%	0.318	S	S	.	.	H	α-helix	trans	-64.3	-38.7	177.8	168.6	0	0	0	0	112.1	F381 E382 D383 W401	F381-V385 WeakPolarHBondContact O-CB 3.31Å; F381-V385 VanDerWaalsContact O-CG2 3.3Å; F381-V385 WeakPolarHBondContact O-CG2 3.5Å; F381-V385 PolarHBondContact O-N 3.22Å; E382-V385 PolarHBondContact O-N 2.83Å; D383-V385 VanDerWaalsContact C-N 3.33Å; D383-V385 PolarHBondContact O-N 3.18Å; V385-W401 HydrophobicContact CB-CH2 4.29Å; V385-W401 HydrophobicContact CB-CZ2 4.15Å; V385-W401 HydrophobicContact CG1-CH2 3.57Å; V385-W401 HydrophobicContact CG1-CZ2 3.41Å; V385-W401 VanDerWaalsContact CG1-CZ2 3.41Å; V385-W401 HydrophobicContact CG2-CD2 4.45Å; V385-W401 HydrophobicContact CG2-CE3 4.49Å; V385-W401 HydrophobicContact CG2-CH2 3.68Å; V385-W401 HydrophobicContact CG2-CZ2 3.58Å; V385-W401 HydrophobicContact CG2-CZ3 4.14Å
386	K	84.2	Confident	79.4	Confident	144 Å²	144	64 Å²	64	63%	0.626	32%	0.321	S	S	*	.	H	α-helix	trans	-72.9	-34.9	179.2	-71.8	166.4	-169	160	0	113	E382 D383 A384	E382-K386 WeakPolarHBondContact O-CB 3.35Å; E382-K386 WeakPolarHBondContact O-CD 3.2Å; E382-K386 VanDerWaalsContact O-CG 3.24Å; E382-K386 WeakPolarHBondContact O-CG 3.1Å; E382-K386 PolarHBondContact O-N 3.42Å; E382-K386 IonicContact OE2-NZ 3.95Å; D383-K386 PolarHBondContact O-N 2.87Å; A384-K386 PolarHBondContact O-N 3.45Å
387	T	82.2	Confident	79.6	Confident	51 Å²	51	58.9 Å²	58.9	31%	0.313	30%	0.299	S	S	.	.	H	α-helix	trans	-87.5	-31.2	-173.8	54.6	0	0	0	0	113.8	H358 W363 D383 A384 N389	H358-T387 PolarHBondContact CE1-O 2.93Å; H358-T387 PolarHBondContact ND1-O 3.15Å; W363-T387 HydrophobicContact CZ2-CG2 4.16Å; W363-T387 WeakPolarHBondContact CZ2-OG1 3.4Å; D383-T387 WeakPolarHBondContact O-CB 3.46Å; D383-T387 WeakPolarHBondContact O-CG2 3.23Å; D383-T387 PolarHBondContact O-N 3.36Å; D383-T387 PolarHBondContact O-OG1 3.34Å; A384-T387 PolarHBondContact O-N 2.91Å; A384-T387 PolarHBondContact O-OG1 2.9Å; T387-N389 PolarHBondContact O-N 2.98Å
388	V	79.7	Confident	79.4	Confident	6 Å²	6	58.9 Å²	58.9	4%	0.036	30%	0.3	C	S	.	.			trans	-81.6	105.8	-174.1	179.8	0	0	0	0	110.4	V360 A384 P390 Q393 L397 I400	V360-V388 HydrophobicContact CG2-CG1 4.41Å; A384-V388 WeakPolarHBondContact O-CB 3.2Å; A384-V388 WeakPolarHBondContact O-CG2 3.42Å; A384-V388 PolarHBondContact O-N 3.49Å; V388-P390 WeakPolarHBondContact O-CD 3.47Å; V388-Q393 HydrophobicContact CG1-CB 4.38Å; V388-L397 HydrophobicContact CB-CD1 4.2Å; V388-L397 HydrophobicContact CG1-CD1 3.86Å; V388-I400 HydrophobicContact CG2-CD1 4.1Å
389	N	75.7	Confident	79.5	Confident	82 Å²	82	59.9 Å²	59.9	44%	0.439	31%	0.305	S	S	.	.			trans	-72.8	123.3	170.7	-75	-34.4	0	0	0	110.1	H358 T387 K391 L392 Q393	H358-N389 PolarHBondContact CE1-ND2 3.18Å; T387-N389 PolarHBondContact O-N 2.98Å; N389-K391 PolarHBondContact O-N 3.25Å; N389-L392 PolarHBondContact O-N 2.99Å; N389-L392 VanDerWaalsContact O-N 3.17Å; N389-Q393 PolarHBondContact O-N 3.45Å
390	P	74.5	Confident	79.4	Confident	27 Å²	27	54.5 Å²	54.5	18%	0.175	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.7	-178.1	-25.8	33.6	0	0	0	115	V388 Q393 L397 V427 Q428 A430	V388-P390 WeakPolarHBondContact O-CD 3.47Å; P390-Q393 WeakPolarHBondContact O-CG 3.11Å; P390-Q393 PolarHBondContact O-NE2 3.37Å; P390-Q393 VanDerWaalsContact O-NE2 3.12Å; P390-L397 HydrophobicContact CB-CD2 4.12Å; P390-L397 HydrophobicContact CG-CD2 3.87Å; P390-V427 HydrophobicContact CG-CG1 3.99Å; P390-Q428 WeakPolarHBondContact CB-O 3.4Å; P390-Q428 WeakPolarHBondContact CG-O 3.32Å; P390-A430 WeakPolarHBondContact O-CB 3.37Å
391	K	74	Confident	79.6	Confident	192 Å²	192	54.4 Å²	54.4	84%	0.835	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-31.8	179.9	-64.5	-173.6	178.6	-176	0	114.1	N389	N389-K391 PolarHBondContact O-N 3.25Å
392	L	75.7	Confident	79.7	Confident	108 Å²	108	54.8 Å²	54.8	57%	0.565	28%	0.282	S	S	*	.	S	Bend	trans	-103.8	9.9	-174.1	-62.1	175.3	0	0	0	112.7	H358 N389 V394	H358-L392 HydrophobicContact CB-CB 4.49Å; H358-L392 WeakPolarHBondContact CB-O 3.49Å; N389-L392 PolarHBondContact O-N 2.99Å; N389-L392 VanDerWaalsContact O-N 3.17Å; L392-V394 PolarHBondContact O-N 3.45Å
393	Q	71	Confident	79.6	Confident	31 Å²	31	51.8 Å²	51.8	15%	0.145	27%	0.27	C	S	.	.			trans	-62.5	133.5	-172.9	62	179.6	-30	0	0	112.3	V388 N389 P390 G395 E434	V388-Q393 HydrophobicContact CG1-CB 4.38Å; N389-Q393 PolarHBondContact O-N 3.45Å; P390-Q393 WeakPolarHBondContact O-CG 3.11Å; P390-Q393 PolarHBondContact O-NE2 3.37Å; P390-Q393 VanDerWaalsContact O-NE2 3.12Å; Q393-G395 PolarHBondContact OE1-O 3.23Å; Q393-E434 VanDerWaalsContact NE2-CD 3.27Å; Q393-E434 PolarHBondContact NE2-OE1 2.92Å; Q393-E434 PolarHBondContact NE2-OE2 3.45Å
394	V	69	Low	79.7	Confident	89 Å²	89	49.2 Å²	49.2	54%	0.539	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-106.3	103.3	163.8	-178.3	0	0	0	0	106.9	H358 N359 V360 L392	H358-V394 PolarHBondContact O-N 3.13Å; H358-V394 VanDerWaalsContact O-N 3.12Å; N359-V394 PolarHBondContact OD1-O 3.1Å; V360-V394 PolarHBondContact N-O 3.1Å; L392-V394 PolarHBondContact O-N 3.45Å
395	G	71.2	Confident	79.6	Confident	27 Å²	27	49.1 Å²	49.1	28%	0.278	26%	0.255	S	S	.	.	S	Bend	trans	110.5	179.1	-169.2	0	0	0	0	0	112	Q393	Q393-G395 PolarHBondContact OE1-O 3.23Å
396	K	75.7	Confident	79.7	Confident	123 Å²	123	52.6 Å²	52.6	54%	0.535	26%	0.264	S	S	.	.			trans	-97	112.5	-176.5	-60.5	175.5	-179.3	175.2	0	109.8	V360 S398 D399	V360-K396 WeakPolarHBondContact CG1-O 3.42Å; K396-S398 PolarHBondContact O-N 2.95Å; K396-S398 VanDerWaalsContact O-N 3.11Å; K396-D399 WeakPolarHBondContact O-CB 3.07Å; K396-D399 PolarHBondContact O-N 3.38Å
397	L	81.1	Confident	79.6	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-57.1	-27	174.7	-179.4	62.1	0	0	0	112	V388 P390 D399 I400 W401 V427 F429	V388-L397 HydrophobicContact CB-CD1 4.2Å; V388-L397 HydrophobicContact CG1-CD1 3.86Å; P390-L397 HydrophobicContact CB-CD2 4.12Å; P390-L397 HydrophobicContact CG-CD2 3.87Å; L397-D399 PolarHBondContact O-N 3.45Å; L397-I400 HydrophobicContact CD1-CB 4.48Å; L397-I400 HydrophobicContact CD1-CD1 4.09Å; L397-I400 PolarHBondContact O-N 3.06Å; L397-W401 VanDerWaalsContact O-CD1 3.3Å; L397-W401 PolarHBondContact O-N 3.04Å; L397-V427 HydrophobicContact CD2-CG1 4.24Å; L397-F429 HydrophobicContact CB-CD1 4.12Å; L397-F429 HydrophobicContact CB-CE1 3.9Å; L397-F429 HydrophobicContact CD2-CD1 3.8Å; L397-F429 HydrophobicContact CD2-CE1 3.61Å; L397-F429 HydrophobicContact CG-CD1 4.15Å; L397-F429 HydrophobicContact CG-CE1 3.63Å
398	S	77.8	Confident	79.7	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.007	23%	0.227	C	C	.	.	H	α-helix	trans	-54.4	-32.5	171.2	61.2	0	0	0	0	112.5	K396 W401 T402	K396-S398 PolarHBondContact O-N 2.95Å; K396-S398 VanDerWaalsContact O-N 3.11Å; S398-W401 PolarHBondContact O-N 3.44Å; S398-T402 WeakPolarHBondContact O-CB 3.48Å; S398-T402 WeakPolarHBondContact O-CG2 3.49Å; S398-T402 PolarHBondContact O-N 3.08Å; S398-T402 PolarHBondContact O-OG1 3.17Å; S398-T402 VanDerWaalsContact O-OG1 3.08Å
399	D	84.2	Confident	79.7	Confident	49 Å²	49	47.7 Å²	47.7	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-74.1	-31.1	-175.8	-62	-9.2	0	0	0	111.4	L364 K396 L397 T402 S403	L364-D399 HydrophobicContact CD1-CB 4.15Å; K396-D399 WeakPolarHBondContact O-CB 3.07Å; K396-D399 PolarHBondContact O-N 3.38Å; L397-D399 PolarHBondContact O-N 3.45Å; D399-T402 WeakPolarHBondContact CA-OG1 3.01Å; D399-T402 PolarHBondContact O-OG1 3.26Å; D399-S403 WeakPolarHBondContact O-CB 3.45Å; D399-S403 PolarHBondContact O-N 3.03Å; D399-S403 PolarHBondContact O-OG 3.15Å
400	I	84.7	Confident	80	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-50.3	169.7	-55.9	-174.6	0	0	0	109.7	V360 W363 F381 A384 V388 L397 T402 S403 Y404	V360-I400 HydrophobicContact CB-CD1 4.11Å; V360-I400 HydrophobicContact CB-CG1 4.24Å; V360-I400 HydrophobicContact CG1-CD1 3.8Å; V360-I400 HydrophobicContact CG1-CG1 3.38Å; V360-I400 HydrophobicContact CG2-CD1 3.85Å; V360-I400 HydrophobicContact CG2-CG1 4.26Å; W363-I400 HydrophobicContact CB-CD1 4.35Å; F381-I400 HydrophobicContact CD1-CG2 4.18Å; A384-I400 HydrophobicContact CB-CD1 4.32Å; A384-I400 HydrophobicContact CB-CG2 4.22Å; V388-I400 HydrophobicContact CG2-CD1 4.1Å; L397-I400 HydrophobicContact CD1-CB 4.48Å; L397-I400 HydrophobicContact CD1-CD1 4.09Å; L397-I400 PolarHBondContact O-N 3.06Å; I400-T402 PolarHBondContact O-N 3.4Å; I400-S403 WeakPolarHBondContact CA-OG 3.17Å; I400-S403 PolarHBondContact O-N 3.23Å; I400-S403 PolarHBondContact O-OG 2.7Å; I400-Y404 VanDerWaalsContact O-CB 3.24Å; I400-Y404 WeakPolarHBondContact O-CB 3.35Å; I400-Y404 PolarHBondContact O-N 2.8Å
401	W	88.5	Confident	80.2	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-64.8	-41.2	-179.1	-72.4	109	0	0	0	112.7	V385 L397 S398 Y404 A405 V420 E423 A424 V427 F429 V438	V385-W401 HydrophobicContact CB-CH2 4.29Å; V385-W401 HydrophobicContact CB-CZ2 4.15Å; V385-W401 HydrophobicContact CG1-CH2 3.57Å; V385-W401 HydrophobicContact CG1-CZ2 3.41Å; V385-W401 VanDerWaalsContact CG1-CZ2 3.41Å; V385-W401 HydrophobicContact CG2-CD2 4.45Å; V385-W401 HydrophobicContact CG2-CE3 4.49Å; V385-W401 HydrophobicContact CG2-CH2 3.68Å; V385-W401 HydrophobicContact CG2-CZ2 3.58Å; V385-W401 HydrophobicContact CG2-CZ3 4.14Å; L397-W401 VanDerWaalsContact O-CD1 3.3Å; L397-W401 PolarHBondContact O-N 3.04Å; S398-W401 PolarHBondContact O-N 3.44Å; W401-Y404 HydrophobicContact CE3-CD1 4.11Å; W401-Y404 HydrophobicContact CZ3-CD1 4.07Å; W401-Y404 HydrophobicContact CZ3-CE1 4.37Å; W401-Y404 PolarHBondContact O-N 2.59Å; W401-A405 WeakPolarHBondContact O-CB 3.23Å; W401-A405 PolarHBondContact O-N 3.13Å; W401-V420 HydrophobicContact CE3-CG1 3.71Å; W401-V420 HydrophobicContact CZ3-CG1 3.94Å; W401-E423 HydrophobicContact CH2-CB 4.16Å; W401-E423 HydrophobicContact CZ3-CB 4.2Å; W401-A424 HydrophobicContact CB-CB 4.01Å; W401-A424 HydrophobicContact CD2-CB 3.48Å; W401-A424 VanDerWaalsContact CD2-CB 3.48Å; W401-A424 HydrophobicContact CE3-CB 3.59Å; W401-A424 HydrophobicContact CG-CB 3.67Å; W401-A424 HydrophobicContact CZ3-CB 4.19Å; W401-V427 HydrophobicContact CZ2-CG2 3.8Å; W401-F429 AromaticContact CD1-CE1 3.91Å; W401-F429 AromaticContact CD1-CZ 3.71Å; W401-V438 HydrophobicContact CB-CG2 4.37Å
402	T	85.9	Confident	80.2	Confident	11 Å²	11	50.3 Å²	50.3	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-67.7	-37.6	176.5	63.3	0	0	0	0	111.8	S398 D399 I400 R406 V437 S441	S398-T402 WeakPolarHBondContact O-CB 3.48Å; S398-T402 WeakPolarHBondContact O-CG2 3.49Å; S398-T402 PolarHBondContact O-N 3.08Å; S398-T402 PolarHBondContact O-OG1 3.17Å; S398-T402 VanDerWaalsContact O-OG1 3.08Å; D399-T402 WeakPolarHBondContact CA-OG1 3.01Å; D399-T402 PolarHBondContact O-OG1 3.26Å; I400-T402 PolarHBondContact O-N 3.4Å; T402-R406 VanDerWaalsContact O-CB 3.24Å; T402-R406 WeakPolarHBondContact O-CB 3.43Å; T402-R406 WeakPolarHBondContact O-CG 3.36Å; T402-R406 PolarHBondContact O-N 2.91Å; T402-V437 HydrophobicContact CG2-CG1 4.4Å; T402-S441 VanDerWaalsContact CG2-OG 3.27Å; T402-S441 WeakPolarHBondContact CG2-OG 3.17Å
403	S	84.4	Confident	80.5	Confident	27 Å²	27	50.2 Å²	50.2	19%	0.189	24%	0.239	C	C	.	.	H	α-helix	trans	-71.6	-37.2	175.4	60.4	0	0	0	0	112.2	L364 F381 D399 I400 R406 Y407	L364-S403 WeakPolarHBondContact CD2-OG 3.08Å; F381-S403 WeakPolarHBondContact CE1-OG 3.24Å; D399-S403 WeakPolarHBondContact O-CB 3.45Å; D399-S403 PolarHBondContact O-N 3.03Å; D399-S403 PolarHBondContact O-OG 3.15Å; I400-S403 WeakPolarHBondContact CA-OG 3.17Å; I400-S403 PolarHBondContact O-N 3.23Å; I400-S403 PolarHBondContact O-OG 2.7Å; S403-R406 PolarHBondContact O-N 3.03Å; S403-Y407 WeakPolarHBondContact O-CB 2.95Å; S403-Y407 PolarHBondContact O-N 3.47Å
404	Y	86.1	Confident	80.9	Confident	12 Å²	12	51.3 Å²	51.3	5%	0.047	25%	0.245	C	C	.	.	H	α-helix	trans	-63.1	-45	174.5	-173.3	-147.7	0	0	0	111.1	L378 F381 I400 W401 Y407 Y408 V420	L378-Y404 HydrophobicContact CD2-CE2 3.82Å; F381-Y404 HydrophobicContact CB-CD2 3.43Å; F381-Y404 VanDerWaalsContact CB-CD2 3.43Å; F381-Y404 HydrophobicContact CB-CE2 3.57Å; F381-Y404 HydrophobicContact CB-CG 3.96Å; F381-Y404 AromaticContact CD1-CD2 3.9Å; F381-Y404 HydrophobicContact CD1-CD2 3.9Å; F381-Y404 HydrophobicContact CD1-CG 4.01Å; F381-Y404 AromaticContact CD2-CD2 3.41Å; F381-Y404 HydrophobicContact CD2-CD2 3.41Å; F381-Y404 VanDerWaalsContact CD2-CD2 3.41Å; F381-Y404 AromaticContact CD2-CE2 3.97Å; F381-Y404 HydrophobicContact CD2-CE2 3.97Å; F381-Y404 HydrophobicContact CD2-CG 4.32Å; F381-Y404 HydrophobicContact CE1-CD2 4.44Å; F381-Y404 HydrophobicContact CE2-CD2 4.03Å; F381-Y404 AromaticContact CG-CD2 3.33Å; F381-Y404 HydrophobicContact CG-CD2 3.33Å; F381-Y404 AromaticContact CG-CE2 3.94Å; F381-Y404 HydrophobicContact CG-CE2 3.94Å; F381-Y404 AromaticContact CG-CG 3.88Å; F381-Y404 HydrophobicContact CG-CG 3.88Å; F381-Y404 HydrophobicContact CZ-CD2 4.47Å; I400-Y404 VanDerWaalsContact O-CB 3.24Å; I400-Y404 WeakPolarHBondContact O-CB 3.35Å; I400-Y404 PolarHBondContact O-N 2.8Å; W401-Y404 HydrophobicContact CE3-CD1 4.11Å; W401-Y404 HydrophobicContact CZ3-CD1 4.07Å; W401-Y404 HydrophobicContact CZ3-CE1 4.37Å; W401-Y404 PolarHBondContact O-N 2.59Å; Y404-Y407 WeakPolarHBondContact O-CB 3.47Å; Y404-Y407 PolarHBondContact O-N 3.42Å; Y404-Y408 HydrophobicContact CD2-CD2 4.19Å; Y404-Y408 AromaticContact CD2-CE2 3.89Å; Y404-Y408 HydrophobicContact CD2-CE2 3.89Å; Y404-Y408 HydrophobicContact CE1-CE2 4.09Å; Y404-Y408 HydrophobicContact CE2-CD2 4Å; Y404-Y408 AromaticContact CE2-CE2 3.25Å; Y404-Y408 HydrophobicContact CE2-CE2 3.25Å; Y404-Y408 AromaticContact CE2-CZ 3.91Å; Y404-Y408 AromaticContact CZ-CE2 3.35Å; Y404-Y408 WeakPolarHBondContact O-CD2 3.44Å; Y404-Y408 PolarHBondContact O-N 3.4Å; Y404-Y408 VanDerWaalsContact O-N 3.12Å; Y404-Y408 WeakPolarHBondContact OH-CE2 3.34Å; Y404-Y408 PolarHBondContact OH-OH 2.6Å; Y404-Y408 VanDerWaalsContact OH-OH 3.07Å; Y404-V420 HydrophobicContact CD1-CB 4.09Å; Y404-V420 HydrophobicContact CD1-CG1 3.22Å; Y404-V420 HydrophobicContact CD1-CG2 3.64Å; Y404-V420 HydrophobicContact CE1-CB 4.14Å; Y404-V420 HydrophobicContact CE1-CG1 3.76Å; Y404-V420 HydrophobicContact CE1-CG2 3.27Å; Y404-V420 HydrophobicContact CG-CG1 3.94Å; Y404-V420 HydrophobicContact CG-CG2 4.39Å
405	A	83.5	Confident	81.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.4	-40.1	175.1	0	0	0	0	0	112.9	W401 Y407 Y408 E409 V420 F421	W401-A405 WeakPolarHBondContact O-CB 3.23Å; W401-A405 PolarHBondContact O-N 3.13Å; A405-Y407 PolarHBondContact O-N 3.24Å; A405-Y408 PolarHBondContact O-N 3.47Å; A405-E409 PolarHBondContact O-N 3.05Å; A405-V420 HydrophobicContact CB-CG1 4.23Å; A405-F421 HydrophobicContact CB-CD1 4.27Å; A405-F421 HydrophobicContact CB-CD2 3.83Å; A405-F421 HydrophobicContact CB-CE1 3.7Å; A405-F421 HydrophobicContact CB-CE2 3.22Å; A405-F421 HydrophobicContact CB-CG 4.34Å; A405-F421 HydrophobicContact CB-CZ 3.15Å
406	R	83.6	Confident	82.2	Confident	116 Å²	116	56.9 Å²	56.9	44%	0.438	26%	0.257	S	S	.	.	H	α-helix	trans	-63.8	-30.8	172.9	-77.6	171.9	-179.7	176.9	3	112	T402 S403 E409 R410	T402-R406 VanDerWaalsContact O-CB 3.24Å; T402-R406 WeakPolarHBondContact O-CB 3.43Å; T402-R406 WeakPolarHBondContact O-CG 3.36Å; T402-R406 PolarHBondContact O-N 2.91Å; S403-R406 PolarHBondContact O-N 3.03Å; R406-E409 WeakPolarHBondContact O-CB 3.4Å; R406-E409 PolarHBondContact O-N 3.39Å; R406-R410 WeakPolarHBondContact O-CG 3.17Å; R406-R410 PolarHBondContact O-N 3.02Å
407	Y	83.2	Confident	82.7	Confident	28 Å²	28	51 Å²	51	11%	0.11	23%	0.232	C	C	.	.	H	α-helix	trans	-65.7	-48.4	174	-175	-96.8	0	0	0	110.5	E374 T377 L378 F381 S403 Y404 A405 E409 R410 C411	E374-Y407 VanDerWaalsContact CA-OH 3.26Å; E374-Y407 WeakPolarHBondContact CA-OH 3.28Å; E374-Y407 WeakPolarHBondContact CB-OH 3.32Å; E374-Y407 WeakPolarHBondContact CG-OH 3.45Å; T377-Y407 HydrophobicContact CG2-CE2 4.26Å; T377-Y407 VanDerWaalsContact OG1-CE1 3.31Å; T377-Y407 WeakPolarHBondContact OG1-CE1 3.33Å; T377-Y407 PolarHBondContact OG1-OH 2.69Å; L378-Y407 HydrophobicContact CD2-CD1 4.07Å; L378-Y407 HydrophobicContact CD2-CE1 3.99Å; L378-Y407 HydrophobicContact CG-CE1 4.44Å; F381-Y407 HydrophobicContact CE2-CD1 4.35Å; F381-Y407 HydrophobicContact CE2-CD2 4.45Å; F381-Y407 AromaticContact CE2-CG 3.98Å; F381-Y407 HydrophobicContact CE2-CG 3.98Å; S403-Y407 WeakPolarHBondContact O-CB 2.95Å; S403-Y407 PolarHBondContact O-N 3.47Å; Y404-Y407 WeakPolarHBondContact O-CB 3.47Å; Y404-Y407 PolarHBondContact O-N 3.42Å; A405-Y407 PolarHBondContact O-N 3.24Å; Y407-E409 VanDerWaalsContact C-N 3.3Å; Y407-E409 PolarHBondContact O-N 2.71Å; Y407-R410 WeakPolarHBondContact O-CB 3.27Å; Y407-R410 PolarHBondContact O-N 3.31Å; Y407-R410 VanDerWaalsContact O-N 3.11Å; Y407-C411 PolarHBondContact O-N 3.19Å; Y407-C411 PolarHBondContact O-SG 2.86Å
408	Y	83.4	Confident	82.8	Confident	17 Å²	17	54.1 Å²	54.1	7%	0.067	24%	0.243	C	C	.	.	H	α-helix	trans	-63.4	-32.9	172.5	-78.9	-61.9	0	0	0	113.9	L378 Y404 A405 R410 C411 N412 R413 K416 V420	L378-Y408 HydrophobicContact CD2-CE1 3.83Å; L378-Y408 HydrophobicContact CD2-CE2 4.16Å; L378-Y408 WeakPolarHBondContact CD2-OH 3.41Å; Y404-Y408 HydrophobicContact CD2-CD2 4.19Å; Y404-Y408 AromaticContact CD2-CE2 3.89Å; Y404-Y408 HydrophobicContact CD2-CE2 3.89Å; Y404-Y408 HydrophobicContact CE1-CE2 4.09Å; Y404-Y408 HydrophobicContact CE2-CD2 4Å; Y404-Y408 AromaticContact CE2-CE2 3.25Å; Y404-Y408 HydrophobicContact CE2-CE2 3.25Å; Y404-Y408 AromaticContact CE2-CZ 3.91Å; Y404-Y408 AromaticContact CZ-CE2 3.35Å; Y404-Y408 WeakPolarHBondContact O-CD2 3.44Å; Y404-Y408 PolarHBondContact O-N 3.4Å; Y404-Y408 VanDerWaalsContact O-N 3.12Å; Y404-Y408 WeakPolarHBondContact OH-CE2 3.34Å; Y404-Y408 PolarHBondContact OH-OH 2.6Å; Y404-Y408 VanDerWaalsContact OH-OH 3.07Å; A405-Y408 PolarHBondContact O-N 3.47Å; Y408-R410 VanDerWaalsContact C-N 3.34Å; Y408-C411 CarbonylContact O-C 3.53Å; Y408-C411 PolarHBondContact O-N 2.99Å; Y408-N412 PolarHBondContact O-N 3.36Å; Y408-R413 HydrophobicContact CD1-CB 4.18Å; Y408-R413 PolarHBondContact O-N 3.28Å; Y408-K416 HydrophobicContact CD1-CB 3.87Å; Y408-K416 HydrophobicContact CD1-CD 4.31Å; Y408-K416 HydrophobicContact CD2-CB 4.5Å; Y408-K416 HydrophobicContact CE1-CB 3.91Å; Y408-K416 HydrophobicContact CE1-CD 3.77Å; Y408-K416 HydrophobicContact CE2-CB 4.5Å; Y408-K416 HydrophobicContact CG-CB 4.17Å; Y408-V420 HydrophobicContact CD2-CG2 3.63Å; Y408-V420 HydrophobicContact CE2-CG2 3.43Å; Y408-V420 VanDerWaalsContact CE2-CG2 3.43Å
409	E	80	Confident	83.3	Confident	53 Å²	53	59.3 Å²	59.3	25%	0.248	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-42.5	172.3	-168.8	-171.9	167.7	0	0	110.8	A405 R406 Y407 N412 M445	A405-E409 PolarHBondContact O-N 3.05Å; R406-E409 WeakPolarHBondContact O-CB 3.4Å; R406-E409 PolarHBondContact O-N 3.39Å; Y407-E409 VanDerWaalsContact C-N 3.3Å; Y407-E409 PolarHBondContact O-N 2.71Å; E409-N412 PolarHBondContact O-N 3.41Å; E409-N412 VanDerWaalsContact O-N 3.1Å; E409-M445 HydrophobicContact CG-CG 4.49Å
410	R	82.2	Confident	83.4	Confident	191 Å²	191	57.1 Å²	57.1	72%	0.721	26%	0.256	S	S	*	.	H	α-helix	trans	-65.1	-37.8	175.2	-71.8	173.1	-176	178.1	2.1	112.3	R406 Y407 Y408 N412	R406-R410 WeakPolarHBondContact O-CG 3.17Å; R406-R410 PolarHBondContact O-N 3.02Å; Y407-R410 WeakPolarHBondContact O-CB 3.27Å; Y407-R410 PolarHBondContact O-N 3.31Å; Y407-R410 VanDerWaalsContact O-N 3.11Å; Y408-R410 VanDerWaalsContact C-N 3.34Å; R410-N412 PolarHBondContact O-N 3.11Å
411	C	79.4	Confident	83.4	Confident	33 Å²	33	57.2 Å²	57.2	22%	0.223	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	4	174.1	-61.3	0	0	0	0	113.7	Y407 Y408 R413	Y407-C411 PolarHBondContact O-N 3.19Å; Y407-C411 PolarHBondContact O-SG 2.86Å; Y408-C411 CarbonylContact O-C 3.53Å; Y408-C411 PolarHBondContact O-N 2.99Å; C411-R413 HydrophobicContact CB-CG 4.49Å; C411-R413 PolarHBondContact O-N 3.41Å; C411-R413 VanDerWaalsContact O-N 3.1Å
412	N	74.6	Confident	83.3	Confident	132 Å²	132	60.9 Å²	60.9	71%	0.706	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	15.8	-174.8	-63.2	-47.2	0	0	0	115	Y408 E409 R410 I414	Y408-N412 PolarHBondContact O-N 3.36Å; E409-N412 PolarHBondContact O-N 3.41Å; E409-N412 VanDerWaalsContact O-N 3.1Å; R410-N412 PolarHBondContact O-N 3.11Å; N412-I414 PolarHBondContact O-N 2.97Å
413	R	80.9	Confident	83.4	Confident	106 Å²	106	65.1 Å²	65.1	40%	0.4	29%	0.292	S	S	.	.			trans	-93.1	73.7	178.7	-65.4	-176	-171.2	156.6	3.1	110.3	Y408 C411 E415 K416 A417	Y408-R413 HydrophobicContact CD1-CB 4.18Å; Y408-R413 PolarHBondContact O-N 3.28Å; C411-R413 HydrophobicContact CB-CG 4.49Å; C411-R413 PolarHBondContact O-N 3.41Å; C411-R413 VanDerWaalsContact O-N 3.1Å; R413-E415 PolarHBondContact O-N 3.32Å; R413-K416 HydrophobicContact CB-CB 4.3Å; R413-K416 HydrophobicContact CB-CD 4.43Å; R413-K416 HydrophobicContact CB-CG 4.4Å; R413-K416 PolarHBondContact O-N 2.88Å; R413-A417 PolarHBondContact O-N 3.25Å
414	I	80.6	Confident	83.4	Confident	53 Å²	53	63.8 Å²	63.8	27%	0.272	28%	0.283	S	S	.	.	H	α-helix	trans	-59.6	-42.5	-176.8	-73	162	0	0	0	112.8	N412 K416 A417 R418 Q449	N412-I414 PolarHBondContact O-N 2.97Å; I414-K416 VanDerWaalsContact C-N 3.3Å; I414-K416 PolarHBondContact O-N 3.25Å; I414-A417 WeakPolarHBondContact O-CB 3.43Å; I414-A417 PolarHBondContact O-N 3.04Å; I414-A417 VanDerWaalsContact O-N 3.15Å; I414-R418 PolarHBondContact O-N 2.89Å; I414-Q449 VanDerWaalsContact CG2-OE1 3.25Å
415	E	83.2	Confident	83.1	Confident	148 Å²	148	64.3 Å²	64.3	69%	0.692	29%	0.287	S	S	*	.	H	α-helix	trans	-63.8	-40.2	-176.8	-65.1	178.6	173.4	0	0	111.2	R413 R418 Q419	R413-E415 PolarHBondContact O-N 3.32Å; E415-R418 WeakPolarHBondContact O-CB 3.39Å; E415-R418 PolarHBondContact O-N 3.05Å; E415-Q419 WeakPolarHBondContact O-CG 3.41Å; E415-Q419 PolarHBondContact O-N 2.87Å
416	K	84	Confident	83	Confident	86 Å²	86	71.1 Å²	71.1	37%	0.374	32%	0.319	S	S	.	.	H	α-helix	trans	-66.7	-40.3	173.1	-62.7	-167.4	179	-170.5	0	111.5	Y408 R413 I414 R418 Q419 V420	Y408-K416 HydrophobicContact CD1-CB 3.87Å; Y408-K416 HydrophobicContact CD1-CD 4.31Å; Y408-K416 HydrophobicContact CD2-CB 4.5Å; Y408-K416 HydrophobicContact CE1-CB 3.91Å; Y408-K416 HydrophobicContact CE1-CD 3.77Å; Y408-K416 HydrophobicContact CE2-CB 4.5Å; Y408-K416 HydrophobicContact CG-CB 4.17Å; R413-K416 HydrophobicContact CB-CB 4.3Å; R413-K416 HydrophobicContact CB-CD 4.43Å; R413-K416 HydrophobicContact CB-CG 4.4Å; R413-K416 PolarHBondContact O-N 2.88Å; I414-K416 VanDerWaalsContact C-N 3.3Å; I414-K416 PolarHBondContact O-N 3.25Å; K416-R418 PolarHBondContact O-N 2.93Å; K416-Q419 WeakPolarHBondContact O-CB 3.25Å; K416-Q419 PolarHBondContact O-N 2.92Å; K416-Q419 VanDerWaalsContact O-N 3.1Å; K416-V420 WeakPolarHBondContact O-CG2 3.48Å; K416-V420 PolarHBondContact O-N 2.85Å
417	A	84.4	Confident	82.8	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-59.8	-35.9	174.8	0	0	0	0	0	112.3	R413 I414 F421 M445	R413-A417 PolarHBondContact O-N 3.25Å; I414-A417 WeakPolarHBondContact O-CB 3.43Å; I414-A417 PolarHBondContact O-N 3.04Å; I414-A417 VanDerWaalsContact O-N 3.15Å; A417-F421 VanDerWaalsContact O-CD2 3.22Å; A417-F421 WeakPolarHBondContact O-CD2 3.43Å; A417-F421 PolarHBondContact O-N 2.94Å; A417-F421 VanDerWaalsContact O-N 3.09Å; A417-M445 HydrophobicContact CB-CE 3.56Å; A417-M445 HydrophobicContact CB-SD 4.1Å
418	R	84.8	Confident	82.4	Confident	69 Å²	69	72.5 Å²	72.5	26%	0.26	33%	0.334	S	S	.	.	H	α-helix	trans	-67.5	-43	172.5	-70.5	177.1	177.5	146.8	6.1	112.1	I414 E415 K416 V420 F421 E422 M445 E446	I414-R418 PolarHBondContact O-N 2.89Å; E415-R418 WeakPolarHBondContact O-CB 3.39Å; E415-R418 PolarHBondContact O-N 3.05Å; K416-R418 PolarHBondContact O-N 2.93Å; R418-V420 VanDerWaalsContact C-N 3.32Å; R418-V420 PolarHBondContact O-N 3.04Å; R418-F421 PolarHBondContact O-N 3.15Å; R418-E422 WeakPolarHBondContact O-CG 3.46Å; R418-E422 PolarHBondContact O-N 3.47Å; R418-M445 HydrophobicContact CG-CE 4.48Å; R418-E446 IonicContact CZ-OE1 3.66Å; R418-E446 IonicContact CZ-OE2 3.64Å; R418-E446 IonicContact NE-OE1 3.95Å; R418-E446 PolarHBondContact NE-OE1 3.39Å; R418-E446 IonicContact NE-OE2 2.77Å; R418-E446 IonicContact NH2-OE1 3Å; R418-E446 PolarHBondContact NH2-OE1 2.79Å; R418-E446 IonicContact NH2-OE2 3.65Å; R418-E446 PolarHBondContact NH2-OE2 3.36Å
419	Q	87.4	Confident	82	Confident	109 Å²	109	72 Å²	72	51%	0.509	33%	0.332	S	S	.	.	H	α-helix	trans	-58.8	-45.2	175	-70.8	169.7	-14.4	0	0	111	E415 K416 F421 E422 E423	E415-Q419 WeakPolarHBondContact O-CG 3.41Å; E415-Q419 PolarHBondContact O-N 2.87Å; K416-Q419 WeakPolarHBondContact O-CB 3.25Å; K416-Q419 PolarHBondContact O-N 2.92Å; K416-Q419 VanDerWaalsContact O-N 3.1Å; Q419-F421 VanDerWaalsContact C-N 3.32Å; Q419-F421 PolarHBondContact O-N 3.44Å; Q419-E422 CarbonylContact O-C 3.59Å; Q419-E422 PolarHBondContact O-N 2.8Å; Q419-E422 VanDerWaalsContact O-N 3.09Å; Q419-E423 WeakPolarHBondContact O-CG 3.35Å; Q419-E423 PolarHBondContact O-N 3.1Å
420	V	86.5	Confident	81.7	Confident	4 Å²	4	72 Å²	72	2%	0.024	34%	0.342	C	S	.	.	H	α-helix	trans	-57.6	-43.2	174.9	168	0	0	0	0	112.2	W401 Y404 A405 Y408 K416 R418 E423 A424	W401-V420 HydrophobicContact CE3-CG1 3.71Å; W401-V420 HydrophobicContact CZ3-CG1 3.94Å; Y404-V420 HydrophobicContact CD1-CB 4.09Å; Y404-V420 HydrophobicContact CD1-CG1 3.22Å; Y404-V420 HydrophobicContact CD1-CG2 3.64Å; Y404-V420 HydrophobicContact CE1-CB 4.14Å; Y404-V420 HydrophobicContact CE1-CG1 3.76Å; Y404-V420 HydrophobicContact CE1-CG2 3.27Å; Y404-V420 HydrophobicContact CG-CG1 3.94Å; Y404-V420 HydrophobicContact CG-CG2 4.39Å; A405-V420 HydrophobicContact CB-CG1 4.23Å; Y408-V420 HydrophobicContact CD2-CG2 3.63Å; Y408-V420 HydrophobicContact CE2-CG2 3.43Å; Y408-V420 VanDerWaalsContact CE2-CG2 3.43Å; K416-V420 WeakPolarHBondContact O-CG2 3.48Å; K416-V420 PolarHBondContact O-N 2.85Å; R418-V420 VanDerWaalsContact C-N 3.32Å; R418-V420 PolarHBondContact O-N 3.04Å; V420-E423 PolarHBondContact O-N 3.01Å; V420-A424 VanDerWaalsContact O-CB 3.32Å; V420-A424 WeakPolarHBondContact O-CB 3.44Å; V420-A424 PolarHBondContact O-N 3.49Å
421	F	85.3	Confident	81.4	Confident	3 Å²	3	69 Å²	69	1%	0.013	33%	0.334	C	S	.	.	H	α-helix	trans	-70.4	-33.9	176	-79.1	-55	0	0	0	113	A405 A417 R418 Q419 A424 V425 V438 S441 W442 M445	A405-F421 HydrophobicContact CB-CD1 4.27Å; A405-F421 HydrophobicContact CB-CD2 3.83Å; A405-F421 HydrophobicContact CB-CE1 3.7Å; A405-F421 HydrophobicContact CB-CE2 3.22Å; A405-F421 HydrophobicContact CB-CG 4.34Å; A405-F421 HydrophobicContact CB-CZ 3.15Å; A417-F421 VanDerWaalsContact O-CD2 3.22Å; A417-F421 WeakPolarHBondContact O-CD2 3.43Å; A417-F421 PolarHBondContact O-N 2.94Å; A417-F421 VanDerWaalsContact O-N 3.09Å; R418-F421 PolarHBondContact O-N 3.15Å; Q419-F421 VanDerWaalsContact C-N 3.32Å; Q419-F421 PolarHBondContact O-N 3.44Å; F421-A424 PolarHBondContact O-N 3.19Å; F421-V425 VanDerWaalsContact O-CG2 3.28Å; F421-V425 WeakPolarHBondContact O-CG2 3.26Å; F421-V425 PolarHBondContact O-N 2.95Å; F421-V438 HydrophobicContact CD1-CG1 3.74Å; F421-V438 HydrophobicContact CE1-CG1 4.17Å; F421-S441 WeakPolarHBondContact CE1-OG 3.47Å; F421-S441 WeakPolarHBondContact CZ-OG 3.27Å; F421-W442 HydrophobicContact CB-CB 4.27Å; F421-W442 HydrophobicContact CB-CD2 3.76Å; F421-W442 HydrophobicContact CB-CE3 4Å; F421-W442 HydrophobicContact CB-CG 3.88Å; F421-W442 HydrophobicContact CD1-CB 4.09Å; F421-W442 HydrophobicContact CD2-CB 3.89Å; F421-W442 AromaticContact CD2-CD1 3.76Å; F421-W442 AromaticContact CD2-CG 3.8Å; F421-W442 HydrophobicContact CD2-CG 3.8Å; F421-W442 HydrophobicContact CE1-CB 4.36Å; F421-W442 HydrophobicContact CE2-CB 4.13Å; F421-W442 HydrophobicContact CE2-CG 4.41Å; F421-W442 HydrophobicContact CG-CB 3.85Å; F421-W442 HydrophobicContact CG-CD2 4.28Å; F421-W442 AromaticContact CG-CG 3.87Å; F421-W442 HydrophobicContact CG-CG 3.87Å; F421-W442 HydrophobicContact CZ-CB 4.36Å; F421-M445 HydrophobicContact CD2-CE 3.15Å; F421-M445 HydrophobicContact CE2-CB 4.05Å; F421-M445 HydrophobicContact CE2-CE 3.16Å; F421-M445 HydrophobicContact CE2-CG 4.22Å; F421-M445 HydrophobicContact CE2-SD 4.5Å
422	E	86.9	Confident	81.4	Confident	81 Å²	81	67.8 Å²	67.8	38%	0.379	33%	0.325	S	S	.	.	H	α-helix	trans	-66.9	-38.9	173.8	-73.5	-175.5	162	0	0	111.6	R418 Q419 V425 Q426 W442 R477	R418-E422 WeakPolarHBondContact O-CG 3.46Å; R418-E422 PolarHBondContact O-N 3.47Å; Q419-E422 CarbonylContact O-C 3.59Å; Q419-E422 PolarHBondContact O-N 2.8Å; Q419-E422 VanDerWaalsContact O-N 3.09Å; E422-V425 PolarHBondContact O-N 3.36Å; E422-Q426 WeakPolarHBondContact O-CG 3.43Å; E422-Q426 PolarHBondContact O-N 2.86Å; E422-W442 HydrophobicContact CG-CH2 3.57Å; E422-W442 HydrophobicContact CG-CZ2 4.12Å; E422-W442 HydrophobicContact CG-CZ3 4.32Å; E422-R477 IonicContact OE1-CZ 3.67Å; E422-R477 IonicContact OE1-NH1 3.77Å; E422-R477 PolarHBondContact OE1-NH1 2.89Å
423	E	86.8	Confident	81.6	Confident	99 Å²	99	67.5 Å²	67.5	46%	0.463	32%	0.32	S	S	.	.	H	α-helix	trans	-64.2	-46	170.9	-72.2	172.5	-173.1	0	0	111.1	W401 Q419 V420 V425 Q426 V427	W401-E423 HydrophobicContact CH2-CB 4.16Å; W401-E423 HydrophobicContact CZ3-CB 4.2Å; Q419-E423 WeakPolarHBondContact O-CG 3.35Å; Q419-E423 PolarHBondContact O-N 3.1Å; V420-E423 PolarHBondContact O-N 3.01Å; E423-V425 VanDerWaalsContact C-N 3.28Å; E423-V425 PolarHBondContact O-N 3.46Å; E423-Q426 WeakPolarHBondContact O-CB 3.14Å; E423-Q426 PolarHBondContact O-N 3.23Å; E423-V427 PolarHBondContact O-N 2.73Å
424	A	84.6	Confident	81.6	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-57.5	-41.9	177.4	0	0	0	0	0	111.7	W401 V420 F421 Q426 V427 F429 V438	W401-A424 HydrophobicContact CB-CB 4.01Å; W401-A424 HydrophobicContact CD2-CB 3.48Å; W401-A424 VanDerWaalsContact CD2-CB 3.48Å; W401-A424 HydrophobicContact CE3-CB 3.59Å; W401-A424 HydrophobicContact CG-CB 3.67Å; W401-A424 HydrophobicContact CZ3-CB 4.19Å; V420-A424 VanDerWaalsContact O-CB 3.32Å; V420-A424 WeakPolarHBondContact O-CB 3.44Å; V420-A424 PolarHBondContact O-N 3.49Å; F421-A424 PolarHBondContact O-N 3.19Å; A424-Q426 PolarHBondContact O-N 2.83Å; A424-V427 PolarHBondContact O-N 3.47Å; A424-F429 WeakPolarHBondContact O-CE2 3.24Å; A424-V438 HydrophobicContact CB-CG1 3.79Å
425	V	79.9	Confident	81.7	Confident	22 Å²	22	60.4 Å²	60.4	13%	0.133	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-32	178.6	166	0	0	0	0	112	F421 E422 E423 V427 L435 Y439 W442 Q496	F421-V425 VanDerWaalsContact O-CG2 3.28Å; F421-V425 WeakPolarHBondContact O-CG2 3.26Å; F421-V425 PolarHBondContact O-N 2.95Å; E422-V425 PolarHBondContact O-N 3.36Å; E423-V425 VanDerWaalsContact C-N 3.28Å; E423-V425 PolarHBondContact O-N 3.46Å; V425-V427 VanDerWaalsContact C-N 3.32Å; V425-L435 HydrophobicContact CG2-CD1 4.25Å; V425-Y439 HydrophobicContact CG1-CE2 4.46Å; V425-Y439 WeakPolarHBondContact CG1-OH 3.46Å; V425-Y439 HydrophobicContact CG2-CD1 4.36Å; V425-Y439 HydrophobicContact CG2-CE1 3.71Å; V425-Y439 HydrophobicContact CG2-CE2 4.07Å; V425-W442 HydrophobicContact CG2-CE3 4.46Å; V425-W442 HydrophobicContact CG2-CZ3 4.27Å; V425-Q496 PolarHBondContact O-NE2 3.07Å
426	Q	81.6	Confident	81.6	Confident	143 Å²	143	53.6 Å²	53.6	67%	0.668	26%	0.259	S	S	*	.	H	α-helix	trans	-73	-23.8	178.3	-67.6	175.7	16.7	0	0	112.9	E422 E423 A424 Q496	E422-Q426 WeakPolarHBondContact O-CG 3.43Å; E422-Q426 PolarHBondContact O-N 2.86Å; E423-Q426 WeakPolarHBondContact O-CB 3.14Å; E423-Q426 PolarHBondContact O-N 3.23Å; A424-Q426 PolarHBondContact O-N 2.83Å; Q426-Q496 PolarHBondContact O-NE2 2.84Å; Q426-Q496 VanDerWaalsContact O-NE2 3.1Å
427	V	78.3	Confident	81.8	Confident	39 Å²	39	51 Å²	51	24%	0.236	25%	0.25	C	S	.	.	S	Bend	trans	-70.2	133.4	179.5	179.7	0	0	0	0	111.1	P390 L397 W401 E423 A424 V425 F429	P390-V427 HydrophobicContact CG-CG1 3.99Å; L397-V427 HydrophobicContact CD2-CG1 4.24Å; W401-V427 HydrophobicContact CZ2-CG2 3.8Å; E423-V427 PolarHBondContact O-N 2.73Å; A424-V427 PolarHBondContact O-N 3.47Å; V425-V427 VanDerWaalsContact C-N 3.32Å; V427-F429 HydrophobicContact CB-CE2 4.48Å; V427-F429 WeakPolarHBondContact O-CD2 3.36Å; V427-F429 PolarHBondContact O-N 3.3Å; V427-F429 VanDerWaalsContact O-N 3.08Å
428	Q	74.8	Confident	81.8	Confident	134 Å²	134	51 Å²	51	63%	0.626	25%	0.25	S	S	*	.			trans	-78.3	90.4	176.2	-64	-179.1	1.9	0	0	110.3	P390	P390-Q428 WeakPolarHBondContact CB-O 3.4Å; P390-Q428 WeakPolarHBondContact CG-O 3.32Å
429	F	75.4	Confident	81.9	Confident	6 Å²	6	48.6 Å²	48.6	3%	0.026	24%	0.241	C	C	.	.			trans	-63.7	154	168.7	-63.6	-81.7	0	0	0	111.2	L397 W401 A424 V427 E434 L435 V438 V495	L397-F429 HydrophobicContact CB-CD1 4.12Å; L397-F429 HydrophobicContact CB-CE1 3.9Å; L397-F429 HydrophobicContact CD2-CD1 3.8Å; L397-F429 HydrophobicContact CD2-CE1 3.61Å; L397-F429 HydrophobicContact CG-CD1 4.15Å; L397-F429 HydrophobicContact CG-CE1 3.63Å; W401-F429 AromaticContact CD1-CE1 3.91Å; W401-F429 AromaticContact CD1-CZ 3.71Å; A424-F429 WeakPolarHBondContact O-CE2 3.24Å; V427-F429 HydrophobicContact CB-CE2 4.48Å; V427-F429 WeakPolarHBondContact O-CD2 3.36Å; V427-F429 PolarHBondContact O-N 3.3Å; V427-F429 VanDerWaalsContact O-N 3.08Å; F429-E434 HydrophobicContact CB-CB 4.25Å; F429-E434 HydrophobicContact CD1-CB 3.85Å; F429-E434 WeakPolarHBondContact CD1-OE2 3.29Å; F429-E434 HydrophobicContact CE1-CB 4.48Å; F429-E434 HydrophobicContact CG-CB 4.12Å; F429-L435 HydrophobicContact CD2-CB 3.85Å; F429-L435 HydrophobicContact CD2-CD1 4.03Å; F429-L435 HydrophobicContact CD2-CG 4.36Å; F429-L435 HydrophobicContact CE2-CB 4.4Å; F429-L435 HydrophobicContact CE2-CD1 3.88Å; F429-V438 HydrophobicContact CE2-CG2 4.36Å; F429-V438 HydrophobicContact CZ-CG2 3.94Å; F429-V495 WeakPolarHBondContact O-CG2 3.44Å
430	A	73.6	Confident	81.7	Confident	55 Å²	55	43.4 Å²	43.4	46%	0.455	22%	0.217	S	C	.	.	S	Bend	trans	-76.6	-35.1	172.5	0	0	0	0	0	111.9	P390	P390-A430 WeakPolarHBondContact O-CB 3.37Å
431	K	77	Confident	81.5	Confident	128 Å²	128	43.9 Å²	43.9	56%	0.557	22%	0.22	S	C	*	.			trans	-110.3	135.9	-176.1	-64.4	179.8	-179.6	178	0	111.1	E433 E434	K431-E433 PolarHBondContact O-N 3.22Å; K431-E434 HydrophobicContact CB-CG 4.21Å; K431-E434 PolarHBondContact O-N 3.49Å
432	V	78.4	Confident	81.5	Confident	7 Å²	7	44.1 Å²	44.1	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-32	174.3	-170.4	0	0	0	0	111.6	E434 L435 S436 Y488 V495 R498 V499	V432-E434 VanDerWaalsContact C-N 3.34Å; V432-E434 PolarHBondContact O-N 2.71Å; V432-L435 PolarHBondContact O-N 2.8Å; V432-S436 PolarHBondContact O-N 2.87Å; V432-Y488 HydrophobicContact CB-CE2 3.76Å; V432-Y488 HydrophobicContact CG1-CE2 3.81Å; V432-Y488 HydrophobicContact CG2-CD2 4.31Å; V432-Y488 HydrophobicContact CG2-CE2 3.91Å; V432-V495 HydrophobicContact CB-CG1 4.21Å; V432-V495 HydrophobicContact CG1-CG1 4.49Å; V432-V495 HydrophobicContact CG2-CG1 4.06Å; V432-R498 HydrophobicContact CG1-CB 4.29Å; V432-R498 HydrophobicContact CG2-CB 3.73Å; V432-V499 HydrophobicContact CG1-CB 4.4Å; V432-V499 HydrophobicContact CG1-CG1 4.38Å; V432-V499 HydrophobicContact CG1-CG2 4.47Å
433	E	79.6	Confident	81.3	Confident	125 Å²	125	40.2 Å²	40.2	58%	0.584	20%	0.203	S	C	*	.	H	α-helix	trans	-61.1	-40.3	177.9	-64.3	-176.9	178	0	0	112.6	K431 S436 V437	K431-E433 PolarHBondContact O-N 3.22Å; E433-S436 WeakPolarHBondContact CA-OG 3.44Å; E433-S436 WeakPolarHBondContact O-CB 3.31Å; E433-S436 PolarHBondContact O-N 2.76Å; E433-S436 PolarHBondContact O-OG 3.18Å; E433-V437 WeakPolarHBondContact O-CG2 3.34Å; E433-V437 PolarHBondContact O-N 3.16Å
434	E	80.6	Confident	81	Confident	10 Å²	10	38 Å²	38	5%	0.047	19%	0.193	C	C	.	.	H	α-helix	trans	-63.6	-45.8	-179.5	-71.6	167.4	-164.4	0	0	111	Q393 F429 K431 V432 S436 V437 V438	Q393-E434 VanDerWaalsContact NE2-CD 3.27Å; Q393-E434 PolarHBondContact NE2-OE1 2.92Å; Q393-E434 PolarHBondContact NE2-OE2 3.45Å; F429-E434 HydrophobicContact CB-CB 4.25Å; F429-E434 HydrophobicContact CD1-CB 3.85Å; F429-E434 WeakPolarHBondContact CD1-OE2 3.29Å; F429-E434 HydrophobicContact CE1-CB 4.48Å; F429-E434 HydrophobicContact CG-CB 4.12Å; K431-E434 HydrophobicContact CB-CG 4.21Å; K431-E434 PolarHBondContact O-N 3.49Å; V432-E434 VanDerWaalsContact C-N 3.34Å; V432-E434 PolarHBondContact O-N 2.71Å; E434-S436 VanDerWaalsContact C-N 3.32Å; E434-S436 PolarHBondContact O-N 3.26Å; E434-V437 PolarHBondContact O-N 3.29Å; E434-V438 WeakPolarHBondContact O-CG2 3.18Å; E434-V438 PolarHBondContact O-N 3.49Å
435	L	83.6	Confident	80.8	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-64.9	-38.3	175.5	-174.2	51.2	0	0	0	111.3	V425 F429 V432 V437 V438 Y439 V495 Q496 V499	V425-L435 HydrophobicContact CG2-CD1 4.25Å; F429-L435 HydrophobicContact CD2-CB 3.85Å; F429-L435 HydrophobicContact CD2-CD1 4.03Å; F429-L435 HydrophobicContact CD2-CG 4.36Å; F429-L435 HydrophobicContact CE2-CB 4.4Å; F429-L435 HydrophobicContact CE2-CD1 3.88Å; V432-L435 PolarHBondContact O-N 2.8Å; L435-V437 VanDerWaalsContact C-N 3.29Å; L435-V437 PolarHBondContact O-N 3.36Å; L435-V438 PolarHBondContact O-N 3.29Å; L435-Y439 HydrophobicContact CD1-CD2 3.92Å; L435-Y439 HydrophobicContact CD1-CE2 3.67Å; L435-Y439 HydrophobicContact CD2-CE2 4.29Å; L435-Y439 HydrophobicContact CG-CD2 3.94Å; L435-Y439 HydrophobicContact CG-CE2 3.75Å; L435-Y439 VanDerWaalsContact O-CD2 3.26Å; L435-Y439 WeakPolarHBondContact O-CD2 3.16Å; L435-Y439 PolarHBondContact O-N 2.96Å; L435-V495 HydrophobicContact CB-CG1 4.13Å; L435-V495 HydrophobicContact CD2-CG1 4.06Å; L435-Q496 HydrophobicContact CD2-CG 3.94Å; L435-V499 HydrophobicContact CB-CG2 4.32Å; L435-V499 HydrophobicContact CD2-CG2 3.29Å; L435-V499 HydrophobicContact CG-CG1 4.41Å; L435-V499 HydrophobicContact CG-CG2 3.76Å
436	S	81.2	Confident	80.6	Confident	4 Å²	4	37.4 Å²	37.4	3%	0.028	19%	0.189	C	C	.	.	H	α-helix	trans	-61.8	-37.6	174.6	83.7	0	0	0	0	112.1	V432 E433 E434 Y439 C440	V432-S436 PolarHBondContact O-N 2.87Å; E433-S436 WeakPolarHBondContact CA-OG 3.44Å; E433-S436 WeakPolarHBondContact O-CB 3.31Å; E433-S436 PolarHBondContact O-N 2.76Å; E433-S436 PolarHBondContact O-OG 3.18Å; E434-S436 VanDerWaalsContact C-N 3.32Å; E434-S436 PolarHBondContact O-N 3.26Å; S436-Y439 PolarHBondContact O-N 3.14Å; S436-C440 WeakPolarHBondContact O-CB 3.49Å; S436-C440 PolarHBondContact O-N 2.83Å; S436-C440 PolarHBondContact O-SG 3.18Å
437	V	87	Confident	80.4	Confident	33 Å²	33	32.9 Å²	32.9	20%	0.2	17%	0.169	C	C	.	.	H	α-helix	trans	-68.3	-41.6	176.1	170.8	0	0	0	0	110.7	T402 E433 E434 L435 Y439 C440 S441	T402-V437 HydrophobicContact CG2-CG1 4.4Å; E433-V437 WeakPolarHBondContact O-CG2 3.34Å; E433-V437 PolarHBondContact O-N 3.16Å; E434-V437 PolarHBondContact O-N 3.29Å; L435-V437 VanDerWaalsContact C-N 3.29Å; L435-V437 PolarHBondContact O-N 3.36Å; V437-Y439 PolarHBondContact O-N 2.89Å; V437-C440 PolarHBondContact O-N 3.3Å; V437-S441 VanDerWaalsContact O-CB 3.29Å; V437-S441 WeakPolarHBondContact O-CB 3.39Å; V437-S441 PolarHBondContact O-N 2.86Å; V437-S441 PolarHBondContact O-OG 3.4Å
438	V	84.9	Confident	80.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.9	-48.9	173.6	175.2	0	0	0	0	110.2	W401 F421 A424 F429 E434 L435 C440 S441 W442	W401-V438 HydrophobicContact CB-CG2 4.37Å; F421-V438 HydrophobicContact CD1-CG1 3.74Å; F421-V438 HydrophobicContact CE1-CG1 4.17Å; A424-V438 HydrophobicContact CB-CG1 3.79Å; F429-V438 HydrophobicContact CE2-CG2 4.36Å; F429-V438 HydrophobicContact CZ-CG2 3.94Å; E434-V438 WeakPolarHBondContact O-CG2 3.18Å; E434-V438 PolarHBondContact O-N 3.49Å; L435-V438 PolarHBondContact O-N 3.29Å; V438-C440 PolarHBondContact O-N 2.92Å; V438-S441 WeakPolarHBondContact CA-OG 3.37Å; V438-S441 PolarHBondContact O-N 3.33Å; V438-S441 PolarHBondContact O-OG 3.36Å; V438-W442 WeakPolarHBondContact O-CB 3.46Å; V438-W442 PolarHBondContact O-N 3.04Å
439	Y	86.6	Confident	79.6	Confident	17 Å²	17	32.2 Å²	32.2	7%	0.067	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-42.6	175.6	-82.5	-66.9	0	0	0	113.6	V425 L435 S436 V437 S441 W442 A443 V474 C478 V499	V425-Y439 HydrophobicContact CG1-CE2 4.46Å; V425-Y439 WeakPolarHBondContact CG1-OH 3.46Å; V425-Y439 HydrophobicContact CG2-CD1 4.36Å; V425-Y439 HydrophobicContact CG2-CE1 3.71Å; V425-Y439 HydrophobicContact CG2-CE2 4.07Å; L435-Y439 HydrophobicContact CD1-CD2 3.92Å; L435-Y439 HydrophobicContact CD1-CE2 3.67Å; L435-Y439 HydrophobicContact CD2-CE2 4.29Å; L435-Y439 HydrophobicContact CG-CD2 3.94Å; L435-Y439 HydrophobicContact CG-CE2 3.75Å; L435-Y439 VanDerWaalsContact O-CD2 3.26Å; L435-Y439 WeakPolarHBondContact O-CD2 3.16Å; L435-Y439 PolarHBondContact O-N 2.96Å; S436-Y439 PolarHBondContact O-N 3.14Å; V437-Y439 PolarHBondContact O-N 2.89Å; Y439-S441 VanDerWaalsContact C-N 3.29Å; Y439-S441 PolarHBondContact O-N 3.09Å; Y439-W442 HydrophobicContact CD1-CE3 4.21Å; Y439-W442 HydrophobicContact CE1-CE3 4.31Å; Y439-W442 HydrophobicContact CE1-CZ3 4.32Å; Y439-W442 PolarHBondContact O-N 3.33Å; Y439-A443 WeakPolarHBondContact O-CB 3.07Å; Y439-A443 PolarHBondContact O-N 3.49Å; Y439-V474 HydrophobicContact CD1-CG1 4Å; Y439-C478 HydrophobicContact CD1-CB 3.91Å; Y439-C478 HydrophobicContact CD2-CB 3.87Å; Y439-C478 HydrophobicContact CE1-CB 3.83Å; Y439-C478 HydrophobicContact CE2-CB 3.8Å; Y439-C478 HydrophobicContact CG-CB 3.91Å; Y439-V499 HydrophobicContact CD2-CG1 4.25Å; Y439-V499 HydrophobicContact CE2-CG1 4.46Å
440	C	84	Confident	78.4	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.007	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-42.3	175.1	-69.1	0	0	0	0	110.6	S436 V437 V438 A443 E444	S436-C440 WeakPolarHBondContact O-CB 3.49Å; S436-C440 PolarHBondContact O-N 2.83Å; S436-C440 PolarHBondContact O-SG 3.18Å; V437-C440 PolarHBondContact O-N 3.3Å; V438-C440 PolarHBondContact O-N 2.92Å; C440-A443 PolarHBondContact O-N 3.4Å; C440-E444 WeakPolarHBondContact O-CB 3.2Å; C440-E444 WeakPolarHBondContact O-CG 3.41Å; C440-E444 PolarHBondContact O-N 3.25Å
441	S	81.2	Confident	76.8	Confident	13 Å²	13	42.6 Å²	42.6	9%	0.091	19%	0.187	C	C	.	.	H	α-helix	trans	-69.2	-33.6	178.8	74.4	0	0	0	0	112.4	T402 F421 V437 V438 Y439 M445	T402-S441 VanDerWaalsContact CG2-OG 3.27Å; T402-S441 WeakPolarHBondContact CG2-OG 3.17Å; F421-S441 WeakPolarHBondContact CE1-OG 3.47Å; F421-S441 WeakPolarHBondContact CZ-OG 3.27Å; V437-S441 VanDerWaalsContact O-CB 3.29Å; V437-S441 WeakPolarHBondContact O-CB 3.39Å; V437-S441 PolarHBondContact O-N 2.86Å; V437-S441 PolarHBondContact O-OG 3.4Å; V438-S441 WeakPolarHBondContact CA-OG 3.37Å; V438-S441 PolarHBondContact O-N 3.33Å; V438-S441 PolarHBondContact O-OG 3.36Å; Y439-S441 VanDerWaalsContact C-N 3.29Å; Y439-S441 PolarHBondContact O-N 3.09Å; S441-M445 VanDerWaalsContact O-CB 3.26Å; S441-M445 WeakPolarHBondContact O-CB 3.38Å; S441-M445 PolarHBondContact O-N 2.97Å
442	W	86.2	Confident	75.4	Confident	8 Å²	8	45.8 Å²	45.8	3%	0.03	20%	0.201	C	C	.	.	H	α-helix	trans	-68.2	-44.7	172.5	-174.1	9.1	0	0	0	110.5	F421 E422 V425 V438 Y439 E444 M445 E446 V474	F421-W442 HydrophobicContact CB-CB 4.27Å; F421-W442 HydrophobicContact CB-CD2 3.76Å; F421-W442 HydrophobicContact CB-CE3 4Å; F421-W442 HydrophobicContact CB-CG 3.88Å; F421-W442 HydrophobicContact CD1-CB 4.09Å; F421-W442 HydrophobicContact CD2-CB 3.89Å; F421-W442 AromaticContact CD2-CD1 3.76Å; F421-W442 AromaticContact CD2-CG 3.8Å; F421-W442 HydrophobicContact CD2-CG 3.8Å; F421-W442 HydrophobicContact CE1-CB 4.36Å; F421-W442 HydrophobicContact CE2-CB 4.13Å; F421-W442 HydrophobicContact CE2-CG 4.41Å; F421-W442 HydrophobicContact CG-CB 3.85Å; F421-W442 HydrophobicContact CG-CD2 4.28Å; F421-W442 AromaticContact CG-CG 3.87Å; F421-W442 HydrophobicContact CG-CG 3.87Å; F421-W442 HydrophobicContact CZ-CB 4.36Å; E422-W442 HydrophobicContact CG-CH2 3.57Å; E422-W442 HydrophobicContact CG-CZ2 4.12Å; E422-W442 HydrophobicContact CG-CZ3 4.32Å; V425-W442 HydrophobicContact CG2-CE3 4.46Å; V425-W442 HydrophobicContact CG2-CZ3 4.27Å; V438-W442 WeakPolarHBondContact O-CB 3.46Å; V438-W442 PolarHBondContact O-N 3.04Å; Y439-W442 HydrophobicContact CD1-CE3 4.21Å; Y439-W442 HydrophobicContact CE1-CE3 4.31Å; Y439-W442 HydrophobicContact CE1-CZ3 4.32Å; Y439-W442 PolarHBondContact O-N 3.33Å; W442-E444 PolarHBondContact O-N 3.08Å; W442-M445 WeakPolarHBondContact O-CB 3.4Å; W442-M445 PolarHBondContact O-N 2.96Å; W442-M445 VanDerWaalsContact O-N 3.15Å; W442-E446 PolarHBondContact NE1-OE1 2.86Å; W442-E446 WeakPolarHBondContact O-CG 3.12Å; W442-E446 PolarHBondContact O-N 3.43Å; W442-V474 HydrophobicContact CB-CG1 4.19Å; W442-V474 HydrophobicContact CD2-CB 4.28Å; W442-V474 HydrophobicContact CD2-CG1 3.39Å; W442-V474 HydrophobicContact CD2-CG2 3.84Å; W442-V474 HydrophobicContact CE3-CB 4.39Å; W442-V474 HydrophobicContact CE3-CG1 3.31Å; W442-V474 HydrophobicContact CE3-CG2 4.24Å; W442-V474 HydrophobicContact CG-CG1 3.8Å; W442-V474 HydrophobicContact CG-CG2 4.4Å; W442-V474 HydrophobicContact CH2-CG1 4.47Å; W442-V474 HydrophobicContact CH2-CG2 4.12Å; W442-V474 HydrophobicContact CZ2-CG2 3.67Å; W442-V474 HydrophobicContact CZ3-CG1 3.88Å; W442-V474 HydrophobicContact CZ3-CG2 4.36Å
443	A	81.9	Confident	73.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-44.5	174.3	0	0	0	0	0	111.5	Y439 C440 M445 E446 L447 A471 L475	Y439-A443 WeakPolarHBondContact O-CB 3.07Å; Y439-A443 PolarHBondContact O-N 3.49Å; C440-A443 PolarHBondContact O-N 3.4Å; A443-M445 VanDerWaalsContact C-N 3.34Å; A443-M445 PolarHBondContact O-N 3.19Å; A443-E446 PolarHBondContact O-N 3.17Å; A443-L447 VanDerWaalsContact O-CG 3.23Å; A443-L447 WeakPolarHBondContact O-CG 3.37Å; A443-L447 PolarHBondContact O-N 3.11Å; A443-A471 HydrophobicContact CB-CB 4.47Å; A443-L475 HydrophobicContact CB-CD1 4.2Å; A443-L475 HydrophobicContact CB-CD2 4.18Å; A443-L475 HydrophobicContact CB-CG 4.11Å
444	E	80.5	Confident	71.9	Confident	53 Å²	53	52.8 Å²	52.8	25%	0.248	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-40.5	172.8	-78.1	-178.4	-148	0	0	112.1	C440 W442 E446 L447 R448 M508	C440-E444 WeakPolarHBondContact O-CB 3.2Å; C440-E444 WeakPolarHBondContact O-CG 3.41Å; C440-E444 PolarHBondContact O-N 3.25Å; W442-E444 PolarHBondContact O-N 3.08Å; E444-E446 VanDerWaalsContact C-N 3.35Å; E444-L447 PolarHBondContact O-N 3.28Å; E444-R448 WeakPolarHBondContact O-CB 3.23Å; E444-R448 VanDerWaalsContact O-CG 3.24Å; E444-R448 WeakPolarHBondContact O-CG 3.49Å; E444-R448 PolarHBondContact O-N 3.45Å; E444-R448 IonicContact OE2-CZ 2.94Å; E444-R448 IonicContact OE2-NE 2.63Å; E444-R448 IonicContact OE2-NH2 3.48Å; E444-R448 PolarHBondContact OE2-NH2 3.47Å; E444-M508 HydrophobicContact CG-CE 4.34Å
445	M	80.1	Confident	70	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.02	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-48.1	177.9	-166.7	-109.3	-69.3	0	0	109.4	E409 A417 R418 F421 S441 W442 A443 L447 R448 Q449	E409-M445 HydrophobicContact CG-CG 4.49Å; A417-M445 HydrophobicContact CB-CE 3.56Å; A417-M445 HydrophobicContact CB-SD 4.1Å; R418-M445 HydrophobicContact CG-CE 4.48Å; F421-M445 HydrophobicContact CD2-CE 3.15Å; F421-M445 HydrophobicContact CE2-CB 4.05Å; F421-M445 HydrophobicContact CE2-CE 3.16Å; F421-M445 HydrophobicContact CE2-CG 4.22Å; F421-M445 HydrophobicContact CE2-SD 4.5Å; S441-M445 VanDerWaalsContact O-CB 3.26Å; S441-M445 WeakPolarHBondContact O-CB 3.38Å; S441-M445 PolarHBondContact O-N 2.97Å; W442-M445 WeakPolarHBondContact O-CB 3.4Å; W442-M445 PolarHBondContact O-N 2.96Å; W442-M445 VanDerWaalsContact O-N 3.15Å; A443-M445 VanDerWaalsContact C-N 3.34Å; A443-M445 PolarHBondContact O-N 3.19Å; M445-L447 VanDerWaalsContact C-N 3.31Å; M445-L447 PolarHBondContact O-N 3.45Å; M445-R448 PolarHBondContact O-N 3.42Å; M445-R448 VanDerWaalsContact O-N 3.16Å; M445-Q449 WeakPolarHBondContact O-CG 3.24Å; M445-Q449 PolarHBondContact O-N 2.99Å; M445-Q449 HydrophobicContact SD-CG 4.46Å; M445-Q449 PolarHBondContact SD-NE2 3.4Å
446	E	77.1	Confident	68.1	Low	5 Å²	5	68.1 Å²	68.1	2%	0.023	30%	0.303	C	S	.	.	H	α-helix	trans	-61.2	-35.7	175.3	-64	-64.1	166.2	0	0	112.8	R418 W442 A443 E444 A471	R418-E446 IonicContact CZ-OE1 3.66Å; R418-E446 IonicContact CZ-OE2 3.64Å; R418-E446 IonicContact NE-OE1 3.95Å; R418-E446 PolarHBondContact NE-OE1 3.39Å; R418-E446 IonicContact NE-OE2 2.77Å; R418-E446 IonicContact NH2-OE1 3Å; R418-E446 PolarHBondContact NH2-OE1 2.79Å; R418-E446 IonicContact NH2-OE2 3.65Å; R418-E446 PolarHBondContact NH2-OE2 3.36Å; W442-E446 PolarHBondContact NE1-OE1 2.86Å; W442-E446 WeakPolarHBondContact O-CG 3.12Å; W442-E446 PolarHBondContact O-N 3.43Å; A443-E446 PolarHBondContact O-N 3.17Å; E444-E446 VanDerWaalsContact C-N 3.35Å; E446-A471 HydrophobicContact CB-CB 4.39Å
447	L	77.5	Confident	66.7	Low	48 Å²	48	73.8 Å²	73.8	25%	0.251	34%	0.338	S	S	.	.	H	α-helix	trans	-70.6	-36.7	175	-68.3	166.2	0	0	0	112.3	A443 E444 M445 A471 L512	A443-L447 VanDerWaalsContact O-CG 3.23Å; A443-L447 WeakPolarHBondContact O-CG 3.37Å; A443-L447 PolarHBondContact O-N 3.11Å; E444-L447 PolarHBondContact O-N 3.28Å; M445-L447 VanDerWaalsContact C-N 3.31Å; M445-L447 PolarHBondContact O-N 3.45Å; L447-A471 HydrophobicContact CD2-CB 4.39Å; L447-A471 HydrophobicContact CG-CB 4.35Å; L447-L512 HydrophobicContact CD1-CD1 4.3Å; L447-L512 HydrophobicContact CD1-CD2 3.75Å; L447-L512 HydrophobicContact CD2-CD2 3.96Å; L447-L512 HydrophobicContact CG-CD2 4.49Å
448	R	74.8	Confident	64.9	Low	123 Å²	123	80.6 Å²	80.6	46%	0.464	37%	0.368	S	S	.	.	H	α-helix	trans	-70.7	-32	-179.4	-74.6	173.8	-160.6	-125.4	4.2	113	E444 M445 K450 W451	E444-R448 WeakPolarHBondContact O-CB 3.23Å; E444-R448 VanDerWaalsContact O-CG 3.24Å; E444-R448 WeakPolarHBondContact O-CG 3.49Å; E444-R448 PolarHBondContact O-N 3.45Å; E444-R448 IonicContact OE2-CZ 2.94Å; E444-R448 IonicContact OE2-NE 2.63Å; E444-R448 IonicContact OE2-NH2 3.48Å; E444-R448 PolarHBondContact OE2-NH2 3.47Å; M445-R448 PolarHBondContact O-N 3.42Å; M445-R448 VanDerWaalsContact O-N 3.16Å; R448-K450 PolarHBondContact O-N 3.06Å; R448-W451 PolarHBondContact O-N 3.38Å
449	Q	60.6	Low	63.4	Low	35 Å²	35	82.6 Å²	82.6	16%	0.164	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-13.9	-163.1	-61.1	-151.5	-18	0	0	117.8	I414 M445	I414-Q449 VanDerWaalsContact CG2-OE1 3.25Å; M445-Q449 WeakPolarHBondContact O-CG 3.24Å; M445-Q449 PolarHBondContact O-N 2.99Å; M445-Q449 HydrophobicContact SD-CG 4.46Å; M445-Q449 PolarHBondContact SD-NE2 3.4Å
450	K	50.3	Low	61.7	Low	63 Å²	63	85.5 Å²	85.5	27%	0.274	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-8.5	-176.1	-72.6	-166.6	-172	153.8	0	116.8	R448 K452 N453 L463 N467	R448-K450 PolarHBondContact O-N 3.06Å; K450-K452 PolarHBondContact O-N 2.73Å; K450-K452 VanDerWaalsContact O-N 3.12Å; K450-N453 PolarHBondContact O-N 3.21Å; K450-L463 HydrophobicContact CD-CB 3.93Å; K450-L463 HydrophobicContact CD-CD1 4.46Å; K450-L463 HydrophobicContact CD-CD2 4.42Å; K450-L463 HydrophobicContact CD-CG 4.5Å; K450-L463 PolarHBondContact NZ-O 3.36Å; K450-N467 VanDerWaalsContact CD-ND2 3.26Å; K450-N467 WeakPolarHBondContact CD-ND2 3.4Å; K450-N467 VanDerWaalsContact CE-OD1 3.23Å; K450-N467 WeakPolarHBondContact CE-OD1 3.47Å; K450-N467 WeakPolarHBondContact CG-ND2 3.26Å; K450-N467 PolarHBondContact NZ-OD1 3.5Å
451	W	39.7	Very low	60.1	Low	216 Å²	216	91.6 Å²	91.6	82%	0.818	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.8	-179.5	-75.2	94.3	0	0	0	113.2	R448	R448-W451 PolarHBondContact O-N 3.38Å
452	K	47.7	Very low	58.9	Low	195 Å²	195	97.1 Å²	97.1	85%	0.848	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-25.2	179.4	-72	-177.9	177.3	177.2	0	114.3	K450	K450-K452 PolarHBondContact O-N 2.73Å; K450-K452 VanDerWaalsContact O-N 3.12Å
453	N	40.4	Very low	57.4	Low	115 Å²	115	100 Å²	100	62%	0.615	47%	0.468	S	S	*	.	S	Bend	trans	-106	92.6	-170.5	-68.9	-16.1	0	0	0	110.9	K450	K450-N453 PolarHBondContact O-N 3.21Å
454	Q	43.2	Very low	56.1	Low	165 Å²	165	103 Å²	103	77%	0.771	48%	0.484	S	S	*	.			trans	84.4	128.5	153.1	-66	165	-19.7	0	0	119.5	T456	Q454-T456 PolarHBondContact O-N 2.94Å
455	R	42.7	Very low	55	Low	248 Å²	248	103.5 Å²	103.5	94%	0.936	49%	0.485	S	S	*	.			trans	-82.1	22.8	-167.4	-70.5	171.1	169.6	154.9	-3.7	115.4
456	T	42.8	Very low	54.1	Low	84 Å²	84	110.8 Å²	110.8	52%	0.515	51%	0.513	S	S	.	.			trans	-94.8	106.2	-176.5	30.5	0	0	0	0	111.8	Q454 Q458 S459 L460	Q454-T456 PolarHBondContact O-N 2.94Å; T456-Q458 PolarHBondContact O-N 3.41Å; T456-S459 WeakPolarHBondContact CB-OG 3.36Å; T456-S459 PolarHBondContact O-N 3.32Å; T456-S459 PolarHBondContact O-OG 3.17Å; T456-S459 PolarHBondContact OG1-OG 3.16Å; T456-L460 PolarHBondContact O-N 3.12Å
457	T	51.1	Low	53.4	Low	123 Å²	123	111.1 Å²	111.1	76%	0.755	51%	0.514	S	S	*	.	H	α-helix	trans	-61.3	-29.3	-169.6	41.9	0	0	0	0	115.6	L460	T457-L460 WeakPolarHBondContact O-CB 3.17Å
458	Q	49.3	Very low	53.1	Low	177 Å²	177	110.2 Å²	110.2	83%	0.827	51%	0.507	S	S	*	.	H	α-helix	trans	-86.5	-34.7	179.2	-91.2	177.3	-11	0	0	114.1	T456 L460	T456-Q458 PolarHBondContact O-N 3.41Å; Q458-L460 PolarHBondContact O-N 3.26Å
459	S	53.7	Low	53.2	Low	42 Å²	42	110.1 Å²	110.1	29%	0.294	51%	0.511	S	S	.	.	H	α-helix	trans	-67.6	-20.5	168.9	46.8	0	0	0	0	111.6	T456 F461 L462 L463	T456-S459 WeakPolarHBondContact CB-OG 3.36Å; T456-S459 PolarHBondContact O-N 3.32Å; T456-S459 PolarHBondContact O-OG 3.17Å; T456-S459 PolarHBondContact OG1-OG 3.16Å; S459-F461 PolarHBondContact O-N 2.85Å; S459-L462 PolarHBondContact O-N 2.96Å; S459-L463 WeakPolarHBondContact O-CB 3.46Å; S459-L463 WeakPolarHBondContact O-CD1 3.39Å; S459-L463 WeakPolarHBondContact O-CG 3.49Å; S459-L463 PolarHBondContact O-N 3.12Å
460	L	51.2	Low	53.8	Low	78 Å²	78	111.2 Å²	111.2	41%	0.408	52%	0.516	S	S	.	.	H	α-helix	trans	-57.8	-46.8	179.4	-140.9	111.9	0	0	0	111.4	T456 T457 Q458 L463 L464	T456-L460 PolarHBondContact O-N 3.12Å; T457-L460 WeakPolarHBondContact O-CB 3.17Å; Q458-L460 PolarHBondContact O-N 3.26Å; L460-L463 PolarHBondContact O-N 3.24Å; L460-L464 HydrophobicContact CD2-CD1 3.76Å; L460-L464 HydrophobicContact CG-CD1 4.37Å; L460-L464 WeakPolarHBondContact O-CB 3.04Å; L460-L464 WeakPolarHBondContact O-CD1 3.42Å; L460-L464 WeakPolarHBondContact O-CG 3.09Å; L460-L464 PolarHBondContact O-N 3.3Å
461	F	50.2	Low	55	Low	129 Å²	129	108.2 Å²	108.2	57%	0.566	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-50.3	-178.9	-173.8	-97.7	0	0	0	112.3	S459 L463 L464 F465	S459-F461 PolarHBondContact O-N 2.85Å; F461-L463 VanDerWaalsContact C-N 3.3Å; F461-L463 PolarHBondContact O-N 2.86Å; F461-L464 PolarHBondContact O-N 2.73Å; F461-F465 AromaticContact CD1-CD2 3.81Å; F461-F465 HydrophobicContact CD1-CD2 3.81Å; F461-F465 HydrophobicContact CD1-CE2 4.07Å; F461-F465 HydrophobicContact CD2-CD2 4.14Å; F461-F465 AromaticContact CD2-CE2 3.95Å; F461-F465 HydrophobicContact CD2-CE2 3.95Å; F461-F465 AromaticContact CE1-CD2 3.55Å; F461-F465 HydrophobicContact CE1-CD2 3.55Å; F461-F465 AromaticContact CE1-CE2 3.4Å; F461-F465 HydrophobicContact CE1-CE2 3.4Å; F461-F465 VanDerWaalsContact CE1-CE2 3.4Å; F461-F465 HydrophobicContact CE1-CG 4.39Å; F461-F465 HydrophobicContact CE1-CZ 4.08Å; F461-F465 AromaticContact CE2-CD2 3.92Å; F461-F465 HydrophobicContact CE2-CD2 3.92Å; F461-F465 AromaticContact CE2-CE2 3.29Å; F461-F465 HydrophobicContact CE2-CE2 3.29Å; F461-F465 HydrophobicContact CE2-CZ 4.21Å; F461-F465 HydrophobicContact CG-CD2 4.12Å; F461-F465 HydrophobicContact CG-CE2 4.32Å; F461-F465 AromaticContact CZ-CD2 3.63Å; F461-F465 HydrophobicContact CZ-CD2 3.63Å; F461-F465 AromaticContact CZ-CE2 2.98Å; F461-F465 HydrophobicContact CZ-CE2 2.98Å; F461-F465 AromaticContact CZ-CZ 3.61Å; F461-F465 HydrophobicContact CZ-CZ 3.61Å; F461-F465 WeakPolarHBondContact O-CB 3.13Å; F461-F465 WeakPolarHBondContact O-CD2 3.43Å; F461-F465 PolarHBondContact O-N 3.44Å
462	L	56.7	Low	56.8	Low	129 Å²	129	98.2 Å²	98.2	68%	0.675	47%	0.465	S	S	*	.	H	α-helix	trans	-64.6	-35.6	178.8	-75.2	170.6	0	0	0	112.3	S459 F465 R466	S459-L462 PolarHBondContact O-N 2.96Å; L462-F465 PolarHBondContact O-N 3.12Å; L462-R466 PolarHBondContact O-N 2.68Å
463	L	54.5	Low	58.3	Low	68 Å²	68	95.1 Å²	95.1	36%	0.356	45%	0.452	S	S	.	.	H	α-helix	trans	-73.7	-37.2	177.7	-69.7	172	0	0	0	112.1	K450 S459 L460 F461 F465 R466 N467	K450-L463 HydrophobicContact CD-CB 3.93Å; K450-L463 HydrophobicContact CD-CD1 4.46Å; K450-L463 HydrophobicContact CD-CD2 4.42Å; K450-L463 HydrophobicContact CD-CG 4.5Å; K450-L463 PolarHBondContact NZ-O 3.36Å; S459-L463 WeakPolarHBondContact O-CB 3.46Å; S459-L463 WeakPolarHBondContact O-CD1 3.39Å; S459-L463 WeakPolarHBondContact O-CG 3.49Å; S459-L463 PolarHBondContact O-N 3.12Å; L460-L463 PolarHBondContact O-N 3.24Å; F461-L463 VanDerWaalsContact C-N 3.3Å; F461-L463 PolarHBondContact O-N 2.86Å; L463-F465 VanDerWaalsContact C-N 3.3Å; L463-R466 PolarHBondContact O-N 2.92Å; L463-N467 WeakPolarHBondContact O-CB 3.44Å; L463-N467 PolarHBondContact O-N 3Å; L463-N467 VanDerWaalsContact O-N 3.11Å; L463-N467 PolarHBondContact O-OD1 2.63Å; L463-N467 VanDerWaalsContact O-OD1 3.08Å
464	L	53.7	Low	60.1	Low	63 Å²	63	90 Å²	90	33%	0.33	42%	0.424	S	S	.	.	H	α-helix	trans	-61	-44.1	169.5	-75.1	169.4	0	0	0	109.7	L460 F461 R466 N467 W468	L460-L464 HydrophobicContact CD2-CD1 3.76Å; L460-L464 HydrophobicContact CG-CD1 4.37Å; L460-L464 WeakPolarHBondContact O-CB 3.04Å; L460-L464 WeakPolarHBondContact O-CD1 3.42Å; L460-L464 WeakPolarHBondContact O-CG 3.09Å; L460-L464 PolarHBondContact O-N 3.3Å; F461-L464 PolarHBondContact O-N 2.73Å; L464-R466 VanDerWaalsContact C-N 3.32Å; L464-R466 PolarHBondContact O-N 3.46Å; L464-N467 PolarHBondContact O-N 2.96Å; L464-N467 VanDerWaalsContact O-N 3.13Å; L464-W468 PolarHBondContact O-N 2.91Å
465	F	57.3	Low	61.7	Low	64 Å²	64	82.1 Å²	82.1	28%	0.281	39%	0.388	S	S	.	.	H	α-helix	trans	-59.5	-40.1	177.4	-97.8	-98	0	0	0	113.7	F461 L462 L463 W468 K469	F461-F465 AromaticContact CD1-CD2 3.81Å; F461-F465 HydrophobicContact CD1-CD2 3.81Å; F461-F465 HydrophobicContact CD1-CE2 4.07Å; F461-F465 HydrophobicContact CD2-CD2 4.14Å; F461-F465 AromaticContact CD2-CE2 3.95Å; F461-F465 HydrophobicContact CD2-CE2 3.95Å; F461-F465 AromaticContact CE1-CD2 3.55Å; F461-F465 HydrophobicContact CE1-CD2 3.55Å; F461-F465 AromaticContact CE1-CE2 3.4Å; F461-F465 HydrophobicContact CE1-CE2 3.4Å; F461-F465 VanDerWaalsContact CE1-CE2 3.4Å; F461-F465 HydrophobicContact CE1-CG 4.39Å; F461-F465 HydrophobicContact CE1-CZ 4.08Å; F461-F465 AromaticContact CE2-CD2 3.92Å; F461-F465 HydrophobicContact CE2-CD2 3.92Å; F461-F465 AromaticContact CE2-CE2 3.29Å; F461-F465 HydrophobicContact CE2-CE2 3.29Å; F461-F465 HydrophobicContact CE2-CZ 4.21Å; F461-F465 HydrophobicContact CG-CD2 4.12Å; F461-F465 HydrophobicContact CG-CE2 4.32Å; F461-F465 AromaticContact CZ-CD2 3.63Å; F461-F465 HydrophobicContact CZ-CD2 3.63Å; F461-F465 AromaticContact CZ-CE2 2.98Å; F461-F465 HydrophobicContact CZ-CE2 2.98Å; F461-F465 AromaticContact CZ-CZ 3.61Å; F461-F465 HydrophobicContact CZ-CZ 3.61Å; F461-F465 WeakPolarHBondContact O-CB 3.13Å; F461-F465 WeakPolarHBondContact O-CD2 3.43Å; F461-F465 PolarHBondContact O-N 3.44Å; L462-F465 PolarHBondContact O-N 3.12Å; L463-F465 VanDerWaalsContact C-N 3.3Å; F465-W468 VanDerWaalsContact CA-CD1 3.41Å; F465-W468 VanDerWaalsContact CA-NE1 3.33Å; F465-W468 AromaticContact CD1-CE2 3.74Å; F465-W468 AromaticContact CD1-CZ2 3.63Å; F465-W468 HydrophobicContact CD1-CZ2 3.63Å; F465-W468 AromaticContact CD1-NE1 3.33Å; F465-W468 VanDerWaalsContact CD1-NE1 3.33Å; F465-W468 AromaticContact CD2-NE1 3.88Å; F465-W468 AromaticContact CE1-CE2 3.98Å; F465-W468 AromaticContact CE1-CZ2 3.62Å; F465-W468 HydrophobicContact CE1-CZ2 3.62Å; F465-W468 AromaticContact CE1-NE1 3.68Å; F465-W468 AromaticContact CG-NE1 3.47Å; F465-K469 WeakPolarHBondContact O-CB 3.1Å; F465-K469 WeakPolarHBondContact O-CG 3.16Å; F465-K469 PolarHBondContact O-N 3.21Å
466	R	61.5	Low	63.2	Low	157 Å²	157	74.7 Å²	74.7	59%	0.592	36%	0.362	S	S	*	.	H	α-helix	trans	-71.4	-34.3	177.6	-151.9	172.9	87.5	156	2.7	112.2	L462 L463 L464 Q470	L462-R466 PolarHBondContact O-N 2.68Å; L463-R466 PolarHBondContact O-N 2.92Å; L464-R466 VanDerWaalsContact C-N 3.32Å; L464-R466 PolarHBondContact O-N 3.46Å; R466-Q470 WeakPolarHBondContact O-CG 3.47Å; R466-Q470 PolarHBondContact O-N 3.34Å
467	N	62.7	Low	64.7	Low	11 Å²	11	76.1 Å²	76.1	6%	0.059	36%	0.358	C	S	.	.	H	α-helix	trans	-75.2	-46.4	-175.9	-73.5	12.3	0	0	0	112.5	K450 L463 L464 K469 Q470 A471	K450-N467 VanDerWaalsContact CD-ND2 3.26Å; K450-N467 WeakPolarHBondContact CD-ND2 3.4Å; K450-N467 VanDerWaalsContact CE-OD1 3.23Å; K450-N467 WeakPolarHBondContact CE-OD1 3.47Å; K450-N467 WeakPolarHBondContact CG-ND2 3.26Å; K450-N467 PolarHBondContact NZ-OD1 3.5Å; L463-N467 WeakPolarHBondContact O-CB 3.44Å; L463-N467 PolarHBondContact O-N 3Å; L463-N467 VanDerWaalsContact O-N 3.11Å; L463-N467 PolarHBondContact O-OD1 2.63Å; L463-N467 VanDerWaalsContact O-OD1 3.08Å; L464-N467 PolarHBondContact O-N 2.96Å; L464-N467 VanDerWaalsContact O-N 3.13Å; N467-K469 PolarHBondContact O-N 2.91Å; N467-Q470 WeakPolarHBondContact O-CB 3.45Å; N467-Q470 PolarHBondContact O-N 3.19Å; N467-A471 PolarHBondContact O-N 3.11Å
468	W	71.7	Confident	65.1	Low	29 Å²	29	70.5 Å²	70.5	11%	0.11	32%	0.324	C	S	.	.	H	α-helix	trans	-64.5	-35.8	176.7	72.4	-112.6	0	0	0	110.7	L464 F465 Q470 A471 I472 F516	L464-W468 PolarHBondContact O-N 2.91Å; F465-W468 VanDerWaalsContact CA-CD1 3.41Å; F465-W468 VanDerWaalsContact CA-NE1 3.33Å; F465-W468 AromaticContact CD1-CE2 3.74Å; F465-W468 AromaticContact CD1-CZ2 3.63Å; F465-W468 HydrophobicContact CD1-CZ2 3.63Å; F465-W468 AromaticContact CD1-NE1 3.33Å; F465-W468 VanDerWaalsContact CD1-NE1 3.33Å; F465-W468 AromaticContact CD2-NE1 3.88Å; F465-W468 AromaticContact CE1-CE2 3.98Å; F465-W468 AromaticContact CE1-CZ2 3.62Å; F465-W468 HydrophobicContact CE1-CZ2 3.62Å; F465-W468 AromaticContact CE1-NE1 3.68Å; F465-W468 AromaticContact CG-NE1 3.47Å; W468-Q470 VanDerWaalsContact C-N 3.25Å; W468-Q470 PolarHBondContact O-N 3.01Å; W468-A471 PolarHBondContact O-N 3.39Å; W468-I472 HydrophobicContact CD2-CD1 4.44Å; W468-I472 HydrophobicContact CE3-CB 4.42Å; W468-I472 HydrophobicContact CE3-CD1 3.28Å; W468-I472 HydrophobicContact CE3-CG1 4.05Å; W468-I472 HydrophobicContact CZ3-CD1 3.55Å; W468-I472 VanDerWaalsContact O-CB 3.29Å; W468-I472 WeakPolarHBondContact O-CB 3.26Å; W468-I472 VanDerWaalsContact O-CG1 3.29Å; W468-I472 WeakPolarHBondContact O-CG1 3.38Å; W468-I472 PolarHBondContact O-N 3.44Å; W468-F516 HydrophobicContact CB-CB 4.4Å; W468-F516 HydrophobicContact CB-CD2 4.15Å; W468-F516 HydrophobicContact CB-CG 4.23Å; W468-F516 AromaticContact CD1-CG 4Å; W468-F516 HydrophobicContact CD2-CB 4.11Å; W468-F516 HydrophobicContact CG-CB 3.96Å; W468-F516 HydrophobicContact CG-CG 4.17Å
469	K	75.4	Confident	65.7	Low	122 Å²	122	63.1 Å²	63.1	53%	0.53	29%	0.29	S	S	.	.	H	α-helix	trans	-60.6	-35.1	173.1	-75.9	-179.4	-177.6	-174.5	0	112.3	F465 N467 K473	F465-K469 WeakPolarHBondContact O-CB 3.1Å; F465-K469 WeakPolarHBondContact O-CG 3.16Å; F465-K469 PolarHBondContact O-N 3.21Å; N467-K469 PolarHBondContact O-N 2.91Å; K469-K473 VanDerWaalsContact O-CB 3.25Å; K469-K473 WeakPolarHBondContact O-CB 3.21Å; K469-K473 PolarHBondContact O-N 3.49Å
470	Q	74.1	Confident	66.1	Low	58 Å²	58	67.8 Å²	67.8	27%	0.271	31%	0.311	S	S	.	.	H	α-helix	trans	-71.6	-45.9	174.4	-75.4	176.6	-24.4	0	0	111.7	R466 N467 W468 I472 K473 V474	R466-Q470 WeakPolarHBondContact O-CG 3.47Å; R466-Q470 PolarHBondContact O-N 3.34Å; N467-Q470 WeakPolarHBondContact O-CB 3.45Å; N467-Q470 PolarHBondContact O-N 3.19Å; W468-Q470 VanDerWaalsContact C-N 3.25Å; W468-Q470 PolarHBondContact O-N 3.01Å; Q470-I472 VanDerWaalsContact C-N 3.31Å; Q470-I472 PolarHBondContact O-N 3.4Å; Q470-K473 WeakPolarHBondContact O-CA 3.24Å; Q470-K473 WeakPolarHBondContact O-CB 3.43Å; Q470-K473 PolarHBondContact O-N 2.78Å; Q470-V474 WeakPolarHBondContact O-CG2 3.29Å; Q470-V474 PolarHBondContact O-N 3.32Å
471	A	76	Confident	66.2	Low	0 Å²	0	65.8 Å²	65.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.9	-43.8	174.8	0	0	0	0	0	111.6	A443 E446 L447 N467 W468 K473 V474 L475 L512	A443-A471 HydrophobicContact CB-CB 4.47Å; E446-A471 HydrophobicContact CB-CB 4.39Å; L447-A471 HydrophobicContact CD2-CB 4.39Å; L447-A471 HydrophobicContact CG-CB 4.35Å; N467-A471 PolarHBondContact O-N 3.11Å; W468-A471 PolarHBondContact O-N 3.39Å; A471-K473 VanDerWaalsContact C-N 3.33Å; A471-K473 PolarHBondContact O-N 3.37Å; A471-V474 WeakPolarHBondContact O-CB 3.15Å; A471-V474 PolarHBondContact O-N 3.31Å; A471-L475 WeakPolarHBondContact O-CG 3Å; A471-L475 PolarHBondContact O-N 2.81Å; A471-L512 HydrophobicContact CB-CD1 4.36Å
472	I	76.5	Confident	66.2	Low	5 Å²	5	65.9 Å²	65.9	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-66.8	-34.2	174.5	-70.1	-174.5	0	0	0	111.2	W468 Q470 V474 L475 K476 Y509 E513	W468-I472 HydrophobicContact CD2-CD1 4.44Å; W468-I472 HydrophobicContact CE3-CB 4.42Å; W468-I472 HydrophobicContact CE3-CD1 3.28Å; W468-I472 HydrophobicContact CE3-CG1 4.05Å; W468-I472 HydrophobicContact CZ3-CD1 3.55Å; W468-I472 VanDerWaalsContact O-CB 3.29Å; W468-I472 WeakPolarHBondContact O-CB 3.26Å; W468-I472 VanDerWaalsContact O-CG1 3.29Å; W468-I472 WeakPolarHBondContact O-CG1 3.38Å; W468-I472 PolarHBondContact O-N 3.44Å; Q470-I472 VanDerWaalsContact C-N 3.31Å; Q470-I472 PolarHBondContact O-N 3.4Å; I472-V474 VanDerWaalsContact C-N 3.34Å; I472-L475 PolarHBondContact O-N 3.08Å; I472-K476 HydrophobicContact CG2-CD 3.72Å; I472-K476 HydrophobicContact CG2-CG 4.06Å; I472-K476 WeakPolarHBondContact O-CB 3.29Å; I472-K476 WeakPolarHBondContact O-CG 3.23Å; I472-K476 PolarHBondContact O-N 3.4Å; I472-Y509 HydrophobicContact CB-CE2 4.12Å; I472-Y509 HydrophobicContact CD1-CE2 3.96Å; I472-Y509 HydrophobicContact CG1-CD2 4.13Å; I472-Y509 HydrophobicContact CG1-CE2 3.79Å; I472-Y509 HydrophobicContact CG2-CD2 4.45Å; I472-Y509 HydrophobicContact CG2-CE2 3.52Å; I472-E513 HydrophobicContact CD1-CG 3.97Å; I472-E513 VanDerWaalsContact CD1-OE1 3.29Å; I472-E513 WeakPolarHBondContact CD1-OE1 3.38Å
473	K	79.9	Confident	65.9	Low	131 Å²	131	62.3 Å²	62.3	57%	0.57	31%	0.306	S	S	*	.	H	α-helix	trans	-65.4	-40.2	173.6	-168.9	176.3	-176.3	179.5	0	111.2	K469 Q470 A471 R477	K469-K473 VanDerWaalsContact O-CB 3.25Å; K469-K473 WeakPolarHBondContact O-CB 3.21Å; K469-K473 PolarHBondContact O-N 3.49Å; Q470-K473 WeakPolarHBondContact O-CA 3.24Å; Q470-K473 WeakPolarHBondContact O-CB 3.43Å; Q470-K473 PolarHBondContact O-N 2.78Å; A471-K473 VanDerWaalsContact C-N 3.33Å; A471-K473 PolarHBondContact O-N 3.37Å; K473-R477 WeakPolarHBondContact O-CG 3.41Å; K473-R477 PolarHBondContact O-N 3.12Å
474	V	78	Confident	66	Low	7 Å²	7	63.8 Å²	63.8	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-64.1	-47.8	174.8	169.4	0	0	0	0	110.8	Y439 W442 Q470 A471 I472 R477 C478	Y439-V474 HydrophobicContact CD1-CG1 4Å; W442-V474 HydrophobicContact CB-CG1 4.19Å; W442-V474 HydrophobicContact CD2-CB 4.28Å; W442-V474 HydrophobicContact CD2-CG1 3.39Å; W442-V474 HydrophobicContact CD2-CG2 3.84Å; W442-V474 HydrophobicContact CE3-CB 4.39Å; W442-V474 HydrophobicContact CE3-CG1 3.31Å; W442-V474 HydrophobicContact CE3-CG2 4.24Å; W442-V474 HydrophobicContact CG-CG1 3.8Å; W442-V474 HydrophobicContact CG-CG2 4.4Å; W442-V474 HydrophobicContact CH2-CG1 4.47Å; W442-V474 HydrophobicContact CH2-CG2 4.12Å; W442-V474 HydrophobicContact CZ2-CG2 3.67Å; W442-V474 HydrophobicContact CZ3-CG1 3.88Å; W442-V474 HydrophobicContact CZ3-CG2 4.36Å; Q470-V474 WeakPolarHBondContact O-CG2 3.29Å; Q470-V474 PolarHBondContact O-N 3.32Å; A471-V474 WeakPolarHBondContact O-CB 3.15Å; A471-V474 PolarHBondContact O-N 3.31Å; I472-V474 VanDerWaalsContact C-N 3.34Å; V474-R477 WeakPolarHBondContact O-CB 3.29Å; V474-R477 PolarHBondContact O-N 3.17Å; V474-C478 PolarHBondContact O-N 3.37Å
475	L	76.1	Confident	66.4	Low	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66.4	-39.8	177.2	-68.3	172.5	0	0	0	111.5	A443 A471 I472 R477 C478 L479 Y509 L512	A443-L475 HydrophobicContact CB-CD1 4.2Å; A443-L475 HydrophobicContact CB-CD2 4.18Å; A443-L475 HydrophobicContact CB-CG 4.11Å; A471-L475 WeakPolarHBondContact O-CG 3Å; A471-L475 PolarHBondContact O-N 2.81Å; I472-L475 PolarHBondContact O-N 3.08Å; L475-R477 VanDerWaalsContact C-N 3.27Å; L475-R477 PolarHBondContact O-N 3.16Å; L475-C478 WeakPolarHBondContact O-CA 3.37Å; L475-C478 VanDerWaalsContact O-CB 3.23Å; L475-C478 WeakPolarHBondContact O-CB 3.06Å; L475-C478 PolarHBondContact O-N 2.89Å; L475-L479 VanDerWaalsContact O-CG 3.24Å; L475-L479 WeakPolarHBondContact O-CG 3.29Å; L475-L479 PolarHBondContact O-N 3.41Å; L475-L479 VanDerWaalsContact O-N 3.08Å; L475-Y509 HydrophobicContact CB-CD2 4.28Å; L475-Y509 HydrophobicContact CD1-CD2 4.23Å; L475-L512 HydrophobicContact CD1-CD1 3.69Å
476	K	75.9	Confident	66.5	Low	92 Å²	92	66.9 Å²	66.9	40%	0.4	33%	0.333	S	S	.	.	H	α-helix	trans	-59.5	-36.4	172.7	-78.4	176	-179.8	174.6	0	111.9	I472 C478 L479 L480 Y509	I472-K476 HydrophobicContact CG2-CD 3.72Å; I472-K476 HydrophobicContact CG2-CG 4.06Å; I472-K476 WeakPolarHBondContact O-CB 3.29Å; I472-K476 WeakPolarHBondContact O-CG 3.23Å; I472-K476 PolarHBondContact O-N 3.4Å; K476-C478 VanDerWaalsContact C-N 3.28Å; K476-C478 PolarHBondContact O-N 3.01Å; K476-L479 CarbonylContact O-C 3.56Å; K476-L479 PolarHBondContact O-N 3.13Å; K476-L479 VanDerWaalsContact O-N 3.09Å; K476-L480 HydrophobicContact CB-CD1 4.35Å; K476-L480 WeakPolarHBondContact O-CB 3.42Å; K476-L480 VanDerWaalsContact O-CD1 3.24Å; K476-L480 WeakPolarHBondContact O-CD1 3.3Å; K476-L480 WeakPolarHBondContact O-CG 3.4Å; K476-L480 PolarHBondContact O-N 3.36Å; K476-Y509 WeakPolarHBondContact CE-OH 3.41Å
477	R	72.9	Confident	66.5	Low	114 Å²	114	66 Å²	66	43%	0.43	34%	0.335	S	S	.	.	H	α-helix	trans	-59.3	-40	173.8	-73.6	169.8	175.6	-173.5	-6	111.8	E422 K473 V474 L475 L479	E422-R477 IonicContact OE1-CZ 3.67Å; E422-R477 IonicContact OE1-NH1 3.77Å; E422-R477 PolarHBondContact OE1-NH1 2.89Å; K473-R477 WeakPolarHBondContact O-CG 3.41Å; K473-R477 PolarHBondContact O-N 3.12Å; V474-R477 WeakPolarHBondContact O-CB 3.29Å; V474-R477 PolarHBondContact O-N 3.17Å; L475-R477 VanDerWaalsContact C-N 3.27Å; L475-R477 PolarHBondContact O-N 3.16Å; R477-L479 VanDerWaalsContact C-N 3.31Å; R477-L479 PolarHBondContact O-N 2.82Å
478	C	60.3	Low	66.6	Low	4 Å²	4	68.3 Å²	68.3	3%	0.027	34%	0.343	C	S	.	.	H	α-helix	trans	-64.5	-36.1	174.7	177.8	0	0	0	0	112.5	Y439 V474 L475 K476 V499	Y439-C478 HydrophobicContact CD1-CB 3.91Å; Y439-C478 HydrophobicContact CD2-CB 3.87Å; Y439-C478 HydrophobicContact CE1-CB 3.83Å; Y439-C478 HydrophobicContact CE2-CB 3.8Å; Y439-C478 HydrophobicContact CG-CB 3.91Å; V474-C478 PolarHBondContact O-N 3.37Å; L475-C478 WeakPolarHBondContact O-CA 3.37Å; L475-C478 VanDerWaalsContact O-CB 3.23Å; L475-C478 WeakPolarHBondContact O-CB 3.06Å; L475-C478 PolarHBondContact O-N 2.89Å; K476-C478 VanDerWaalsContact C-N 3.28Å; K476-C478 PolarHBondContact O-N 3.01Å; C478-V499 VanDerWaalsContact SG-CB 3.58Å; C478-V499 WeakPolarHBondContact SG-CG1 3.39Å
479	L	62	Low	66.1	Low	23 Å²	23	74.7 Å²	74.7	12%	0.12	37%	0.372	C	S	.	.	H	α-helix	trans	-88	-18.6	-173.9	-60.4	171.4	0	0	0	113.7	L475 K476 R477 S481 W506 Y509	L475-L479 VanDerWaalsContact O-CG 3.24Å; L475-L479 WeakPolarHBondContact O-CG 3.29Å; L475-L479 PolarHBondContact O-N 3.41Å; L475-L479 VanDerWaalsContact O-N 3.08Å; K476-L479 CarbonylContact O-C 3.56Å; K476-L479 PolarHBondContact O-N 3.13Å; K476-L479 VanDerWaalsContact O-N 3.09Å; R477-L479 VanDerWaalsContact C-N 3.31Å; R477-L479 PolarHBondContact O-N 2.82Å; L479-S481 PolarHBondContact O-N 3.37Å; L479-W506 HydrophobicContact CB-CH2 4.31Å; L479-W506 HydrophobicContact CB-CZ2 4.19Å; L479-W506 HydrophobicContact CD1-CD2 4.24Å; L479-W506 HydrophobicContact CD1-CE3 3.93Å; L479-W506 HydrophobicContact CD1-CH2 3.78Å; L479-W506 HydrophobicContact CD1-CZ2 4.07Å; L479-W506 HydrophobicContact CD1-CZ3 3.71Å; L479-W506 HydrophobicContact CD2-CD2 3.7Å; L479-W506 HydrophobicContact CD2-CE3 4.26Å; L479-W506 HydrophobicContact CD2-CG 4.2Å; L479-W506 HydrophobicContact CD2-CH2 4.02Å; L479-W506 HydrophobicContact CD2-CZ2 3.39Å; L479-W506 HydrophobicContact CD2-CZ3 4.41Å; L479-W506 HydrophobicContact CG-CH2 4.22Å; L479-W506 HydrophobicContact CG-CZ2 4.05Å; L479-Y509 HydrophobicContact CD1-CD1 3.4Å; L479-Y509 HydrophobicContact CD1-CE1 3.82Å; L479-Y509 HydrophobicContact CD1-CG 4.02Å
480	L	61.2	Low	65.6	Low	140 Å²	140	72.6 Å²	72.6	73%	0.733	37%	0.366	S	S	*	.			trans	-78	63.8	176.3	-73.7	156.6	0	0	0	110.3	K476	K476-L480 HydrophobicContact CB-CD1 4.35Å; K476-L480 WeakPolarHBondContact O-CB 3.42Å; K476-L480 VanDerWaalsContact O-CD1 3.24Å; K476-L480 WeakPolarHBondContact O-CD1 3.3Å; K476-L480 WeakPolarHBondContact O-CG 3.4Å; K476-L480 PolarHBondContact O-N 3.36Å
481	S	54.2	Low	65.1	Low	35 Å²	35	78.3 Å²	78.3	25%	0.245	39%	0.393	C	S	.	.			trans	-122.3	120.6	161.3	-158.1	0	0	0	0	109.6	L479 S483	L479-S481 PolarHBondContact O-N 3.37Å; S481-S483 PolarHBondContact O-N 2.77Å
482	S	49.2	Very low	64.5	Low	131 Å²	131	83 Å²	83	92%	0.916	43%	0.426	S	S	*	.			trans	-89.4	7	-157.9	-173.9	0	0	0	0	114.5
483	S	51.3	Low	64	Low	54 Å²	54	85.5 Å²	85.5	38%	0.378	44%	0.437	S	S	.	.			trans	-108	98.7	-179.3	-171.3	0	0	0	0	111.2	S481 K485	S481-S483 PolarHBondContact O-N 2.77Å; S483-K485 PolarHBondContact O-N 3.2Å
484	S	56.5	Low	63.4	Low	99 Å²	99	81.5 Å²	81.5	69%	0.692	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-15.6	170.7	179.2	0	0	0	0	113.6
485	K	60.8	Low	62.9	Low	190 Å²	190	81.6 Å²	81.6	83%	0.826	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-9.3	-169.9	-66.2	-172.7	177.8	-176.7	0	115	S483 H487	S483-K485 PolarHBondContact O-N 3.2Å; K485-H487 PolarHBondContact O-N 3.34Å
486	V	61.1	Low	62.6	Low	3 Å²	3	85 Å²	85	2%	0.018	44%	0.441	C	S	.	.			trans	-77.1	116.5	-172.2	-174.7	0	0	0	0	111.1	E493 R498 K501	V486-E493 HydrophobicContact CG1-CB 4.28Å; V486-E493 HydrophobicContact CG1-CG 4.38Å; V486-E493 WeakPolarHBondContact CG1-OE2 3.44Å; V486-E493 WeakPolarHBondContact CG2-OE2 3.17Å; V486-R498 HydrophobicContact CG1-CG 3.91Å; V486-K501 WeakPolarHBondContact O-CE 3.41Å; V486-K501 PolarHBondContact O-NZ 2.95Å
487	H	61.4	Low	62.4	Low	137 Å²	137	83.1 Å²	83.1	63%	0.634	44%	0.436	S	S	*	.			trans	-64.7	140.9	173.1	-98.5	-83.8	0	0	0	111.1	K485 F489 D490	K485-H487 PolarHBondContact O-N 3.34Å; H487-F489 PolarHBondContact O-N 3.47Å; H487-D490 PolarHBondContact O-N 2.8Å
488	Y	63.8	Low	62.2	Low	61 Å²	61	78.2 Å²	78.2	24%	0.239	42%	0.417	C	S	.	.	S	Bend	trans	-58	-34.9	-179.4	-179	-102.8	0	0	0	112.3	V432 R498 K501	V432-Y488 HydrophobicContact CB-CE2 3.76Å; V432-Y488 HydrophobicContact CG1-CE2 3.81Å; V432-Y488 HydrophobicContact CG2-CD2 4.31Å; V432-Y488 HydrophobicContact CG2-CE2 3.91Å; Y488-R498 WeakPolarHBondContact O-CD 3.32Å; Y488-R498 PolarHBondContact O-NH1 2.71Å; Y488-K501 HydrophobicContact CD2-CB 3.79Å
489	F	61.5	Low	62.7	Low	162 Å²	162	78 Å²	78	71%	0.711	42%	0.416	S	S	*	.	S	Bend	trans	-86.2	-30.8	-173.5	-66.9	-71.4	0	0	0	114.1	H487 R498	H487-F489 PolarHBondContact O-N 3.47Å; F489-R498 PolarHBondContact O-NH1 2.68Å
490	D	64.8	Low	63.2	Low	78 Å²	78	77.1 Å²	77.1	42%	0.417	41%	0.411	S	S	.	.			trans	-14.6	-119	-163.6	-161.3	-51.6	0	0	0	113.5	H487 S492	H487-D490 PolarHBondContact O-N 2.8Å; D490-S492 VanDerWaalsContact CG-OG 3.25Å; D490-S492 WeakPolarHBondContact OD1-CB 3.35Å; D490-S492 PolarHBondContact OD1-N 2.79Å; D490-S492 PolarHBondContact OD1-OG 2.65Å; D490-S492 PolarHBondContact OD2-OG 3.32Å
491	Q	63.3	Low	63.8	Low	179 Å²	179	72.7 Å²	72.7	84%	0.836	39%	0.386	S	S	*	.	S	Bend	trans	164.1	-28.4	162.3	-97.1	-174.4	39.1	0	0	105.1	R498	Q491-R498 VanDerWaalsContact C-NH2 3.31Å
492	S	63	Low	64.9	Low	97 Å²	97	71.2 Å²	71.2	68%	0.678	38%	0.376	S	S	*	.	S	Bend	trans	-63.1	-41.9	172.2	69.1	0	0	0	0	112.9	D490	D490-S492 VanDerWaalsContact CG-OG 3.25Å; D490-S492 WeakPolarHBondContact OD1-CB 3.35Å; D490-S492 PolarHBondContact OD1-N 2.79Å; D490-S492 PolarHBondContact OD1-OG 2.65Å; D490-S492 PolarHBondContact OD2-OG 3.32Å
493	E	66.2	Low	66.4	Low	58 Å²	58	67.8 Å²	67.8	27%	0.271	35%	0.347	S	S	.	.	S	Bend	trans	-82.7	141.6	-178	-72.1	-155.7	-163.6	0	0	113.1	V486 V495 N497 R498	V486-E493 HydrophobicContact CG1-CB 4.28Å; V486-E493 HydrophobicContact CG1-CG 4.38Å; V486-E493 WeakPolarHBondContact CG1-OE2 3.44Å; V486-E493 WeakPolarHBondContact CG2-OE2 3.17Å; E493-V495 PolarHBondContact O-N 3.46Å; E493-N497 PolarHBondContact OE2-ND2 2.73Å; E493-N497 VanDerWaalsContact OE2-ND2 3.13Å; E493-R498 PolarHBondContact O-NE 2.86Å; E493-R498 PolarHBondContact O-NH2 3.19Å
494	P	67.7	Low	67.9	Low	48 Å²	48	71.2 Å²	71.2	31%	0.312	35%	0.351	S	S	.	.			trans	-59.1	140.7	176	25.6	-33.8	0	0	0	110.6	Q496 N497	P494-Q496 PolarHBondContact O-N 2.77Å; P494-N497 WeakPolarHBondContact O-CB 3.47Å; P494-N497 PolarHBondContact O-N 3.29Å
495	V	67.5	Low	69.1	Low	9 Å²	9	66.5 Å²	66.5	6%	0.055	32%	0.319	C	S	.	.	H	α-helix	trans	-55.6	-28.1	-178.4	165.6	0	0	0	0	112.8	F429 V432 L435 E493 N497 R498 V499	F429-V495 WeakPolarHBondContact O-CG2 3.44Å; V432-V495 HydrophobicContact CB-CG1 4.21Å; V432-V495 HydrophobicContact CG1-CG1 4.49Å; V432-V495 HydrophobicContact CG2-CG1 4.06Å; L435-V495 HydrophobicContact CB-CG1 4.13Å; L435-V495 HydrophobicContact CD2-CG1 4.06Å; E493-V495 PolarHBondContact O-N 3.46Å; V495-N497 PolarHBondContact O-N 2.89Å; V495-R498 PolarHBondContact O-N 2.87Å; V495-V499 WeakPolarHBondContact O-CG2 3.49Å; V495-V499 PolarHBondContact O-N 2.97Å
496	Q	69.7	Low	70.3	Confident	71 Å²	71	57.9 Å²	57.9	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-53.6	-36.4	172.8	-68.3	169.2	7.4	0	0	113.4	V425 Q426 L435 P494 R498	V425-Q496 PolarHBondContact O-NE2 3.07Å; Q426-Q496 PolarHBondContact O-NE2 2.84Å; Q426-Q496 VanDerWaalsContact O-NE2 3.1Å; L435-Q496 HydrophobicContact CD2-CG 3.94Å; P494-Q496 PolarHBondContact O-N 2.77Å; Q496-R498 VanDerWaalsContact C-N 3.27Å; Q496-R498 PolarHBondContact O-N 3.08Å
497	N	71.7	Confident	71.5	Confident	52 Å²	52	59.3 Å²	59.3	28%	0.278	29%	0.291	S	S	.	.	H	α-helix	trans	-72.6	-24.1	177.4	-72.4	-5.4	0	0	0	112.2	E493 P494 V495 H500	E493-N497 PolarHBondContact OE2-ND2 2.73Å; E493-N497 VanDerWaalsContact OE2-ND2 3.13Å; P494-N497 WeakPolarHBondContact O-CB 3.47Å; P494-N497 PolarHBondContact O-N 3.29Å; V495-N497 PolarHBondContact O-N 2.89Å; N497-H500 PolarHBondContact O-CE1 3.42Å; N497-H500 PolarHBondContact O-ND1 3.18Å
498	R	70.1	Confident	72.5	Confident	11 Å²	11	54.9 Å²	54.9	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-92.3	-14.7	-174.4	-50.5	-169.4	-156.7	168	2.9	113.8	V432 V486 Y488 F489 Q491 E493 V495 Q496 H500 K501	V432-R498 HydrophobicContact CG1-CB 4.29Å; V432-R498 HydrophobicContact CG2-CB 3.73Å; V486-R498 HydrophobicContact CG1-CG 3.91Å; Y488-R498 WeakPolarHBondContact O-CD 3.32Å; Y488-R498 PolarHBondContact O-NH1 2.71Å; F489-R498 PolarHBondContact O-NH1 2.68Å; Q491-R498 VanDerWaalsContact C-NH2 3.31Å; E493-R498 PolarHBondContact O-NE 2.86Å; E493-R498 PolarHBondContact O-NH2 3.19Å; V495-R498 PolarHBondContact O-N 2.87Å; Q496-R498 VanDerWaalsContact C-N 3.27Å; Q496-R498 PolarHBondContact O-N 3.08Å; R498-H500 PolarHBondContact O-N 3.32Å; R498-H500 VanDerWaalsContact O-N 3.16Å; R498-K501 WeakPolarHBondContact O-CB 3.43Å; R498-K501 PolarHBondContact O-N 3.05Å
499	V	71.1	Confident	73.5	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-63.6	-25.8	-173.1	-153	0	0	0	0	112.7	V432 L435 Y439 C478 V495 K501 S502	V432-V499 HydrophobicContact CG1-CB 4.4Å; V432-V499 HydrophobicContact CG1-CG1 4.38Å; V432-V499 HydrophobicContact CG1-CG2 4.47Å; L435-V499 HydrophobicContact CB-CG2 4.32Å; L435-V499 HydrophobicContact CD2-CG2 3.29Å; L435-V499 HydrophobicContact CG-CG1 4.41Å; L435-V499 HydrophobicContact CG-CG2 3.76Å; Y439-V499 HydrophobicContact CD2-CG1 4.25Å; Y439-V499 HydrophobicContact CE2-CG1 4.46Å; C478-V499 VanDerWaalsContact SG-CB 3.58Å; C478-V499 WeakPolarHBondContact SG-CG1 3.39Å; V495-V499 WeakPolarHBondContact O-CG2 3.49Å; V495-V499 PolarHBondContact O-N 2.97Å; V499-K501 PolarHBondContact O-N 3.43Å; V499-S502 VanDerWaalsContact O-CB 3.32Å; V499-S502 WeakPolarHBondContact O-CB 3.47Å; V499-S502 PolarHBondContact O-N 3.25Å; V499-S502 PolarHBondContact O-OG 3.27Å
500	H	72.4	Confident	74.5	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.019	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-60.7	-14.9	172	78	-88.9	0	0	0	112.9	N497 R498 W506 I534	N497-H500 PolarHBondContact O-CE1 3.42Å; N497-H500 PolarHBondContact O-ND1 3.18Å; R498-H500 PolarHBondContact O-N 3.32Å; R498-H500 VanDerWaalsContact O-N 3.16Å; H500-W506 PolarHBondContact O-NE1 3.09Å; H500-I534 WeakPolarHBondContact O-CD1 3.25Å
501	K	72.6	Confident	75.5	Confident	46 Å²	46	44 Å²	44	20%	0.2	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-91.2	-4.4	172.4	-65.8	-170.1	174.3	-168.7	0	114.5	V486 Y488 R498 V499 L503 I534	V486-K501 WeakPolarHBondContact O-CE 3.41Å; V486-K501 PolarHBondContact O-NZ 2.95Å; Y488-K501 HydrophobicContact CD2-CB 3.79Å; R498-K501 WeakPolarHBondContact O-CB 3.43Å; R498-K501 PolarHBondContact O-N 3.05Å; V499-K501 PolarHBondContact O-N 3.43Å; K501-L503 PolarHBondContact O-N 2.83Å; K501-I534 VanDerWaalsContact CA-CD1 3.47Å; K501-I534 HydrophobicContact CB-CD1 4.24Å; K501-I534 HydrophobicContact CG-CD1 4.39Å; K501-I534 WeakPolarHBondContact O-CG2 3.42Å
502	S	77.8	Confident	76.3	Confident	5 Å²	5	36.1 Å²	36.1	4%	0.035	19%	0.188	C	C	.	.			trans	-75.4	115.4	-178.9	68.5	0	0	0	0	111.2	V499 R504 A505 W506	V499-S502 VanDerWaalsContact O-CB 3.32Å; V499-S502 WeakPolarHBondContact O-CB 3.47Å; V499-S502 PolarHBondContact O-N 3.25Å; V499-S502 PolarHBondContact O-OG 3.27Å; S502-R504 PolarHBondContact O-N 3.29Å; S502-A505 PolarHBondContact O-N 3.04Å; S502-A505 VanDerWaalsContact OG-CB 3.3Å; S502-A505 WeakPolarHBondContact OG-CB 3.35Å; S502-W506 VanDerWaalsContact O-CD1 3.29Å; S502-W506 PolarHBondContact O-N 3.36Å
503	L	81.4	Confident	77.3	Confident	59 Å²	59	31.7 Å²	31.7	31%	0.309	16%	0.156	S	C	.	.	H	α-helix	trans	-57.8	-37.9	177.3	176.4	64.7	0	0	0	112.1	K501 A505 W506 S507 I534 T536	K501-L503 PolarHBondContact O-N 2.83Å; L503-A505 PolarHBondContact O-N 2.88Å; L503-W506 CarbonylContact O-C 3.58Å; L503-W506 PolarHBondContact O-N 2.93Å; L503-S507 WeakPolarHBondContact O-CB 3.33Å; L503-S507 PolarHBondContact O-N 2.86Å; L503-I534 HydrophobicContact CB-CG2 3.76Å; L503-I534 HydrophobicContact CD1-CG2 4.19Å; L503-T536 HydrophobicContact CD1-CG2 4.37Å; L503-T536 HydrophobicContact CD2-CG2 3.4Å
504	R	81.7	Confident	78.1	Confident	125 Å²	125	31.8 Å²	31.8	47%	0.472	16%	0.156	S	C	.	.	H	α-helix	trans	-64.2	-40.6	-176.5	-173.8	-176.5	173.7	133.2	2.2	112.9	S502 W506 S507 M508	S502-R504 PolarHBondContact O-N 3.29Å; R504-W506 VanDerWaalsContact C-N 3.32Å; R504-S507 PolarHBondContact O-N 3.19Å; R504-S507 PolarHBondContact O-OG 2.69Å; R504-M508 WeakPolarHBondContact O-CG 3.19Å; R504-M508 PolarHBondContact O-N 3Å
505	A	82.4	Confident	78.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.8	-39.6	176.2	0	0	0	0	0	110.5	S502 L503 Y509	S502-A505 PolarHBondContact O-N 3.04Å; S502-A505 VanDerWaalsContact OG-CB 3.3Å; S502-A505 WeakPolarHBondContact OG-CB 3.35Å; L503-A505 PolarHBondContact O-N 2.88Å; A505-Y509 VanDerWaalsContact O-CB 3.22Å; A505-Y509 WeakPolarHBondContact O-CB 3.32Å; A505-Y509 PolarHBondContact O-N 2.9Å
506	W	86.4	Confident	79	Confident	9 Å²	9	38.5 Å²	38.5	3%	0.034	19%	0.186	C	C	.	.	H	α-helix	trans	-68.1	-37.7	175	-79.5	113.5	0	0	0	113.6	L479 H500 S502 L503 R504 Y509 A510 V525 K528 I529 L532	L479-W506 HydrophobicContact CB-CH2 4.31Å; L479-W506 HydrophobicContact CB-CZ2 4.19Å; L479-W506 HydrophobicContact CD1-CD2 4.24Å; L479-W506 HydrophobicContact CD1-CE3 3.93Å; L479-W506 HydrophobicContact CD1-CH2 3.78Å; L479-W506 HydrophobicContact CD1-CZ2 4.07Å; L479-W506 HydrophobicContact CD1-CZ3 3.71Å; L479-W506 HydrophobicContact CD2-CD2 3.7Å; L479-W506 HydrophobicContact CD2-CE3 4.26Å; L479-W506 HydrophobicContact CD2-CG 4.2Å; L479-W506 HydrophobicContact CD2-CH2 4.02Å; L479-W506 HydrophobicContact CD2-CZ2 3.39Å; L479-W506 HydrophobicContact CD2-CZ3 4.41Å; L479-W506 HydrophobicContact CG-CH2 4.22Å; L479-W506 HydrophobicContact CG-CZ2 4.05Å; H500-W506 PolarHBondContact O-NE1 3.09Å; S502-W506 VanDerWaalsContact O-CD1 3.29Å; S502-W506 PolarHBondContact O-N 3.36Å; L503-W506 CarbonylContact O-C 3.58Å; L503-W506 PolarHBondContact O-N 2.93Å; R504-W506 VanDerWaalsContact C-N 3.32Å; W506-Y509 AromaticContact CE3-CD1 3.8Å; W506-Y509 HydrophobicContact CE3-CD1 3.8Å; W506-Y509 AromaticContact CZ3-CD1 3.73Å; W506-Y509 HydrophobicContact CZ3-CD1 3.73Å; W506-Y509 HydrophobicContact CZ3-CE1 4.03Å; W506-Y509 PolarHBondContact O-N 3Å; W506-A510 VanDerWaalsContact O-CB 3.26Å; W506-A510 WeakPolarHBondContact O-CB 3.47Å; W506-A510 PolarHBondContact O-N 2.97Å; W506-V525 HydrophobicContact CE3-CG1 4Å; W506-V525 HydrophobicContact CZ3-CG1 3.99Å; W506-K528 HydrophobicContact CH2-CB 3.88Å; W506-K528 HydrophobicContact CH2-CD 4.26Å; W506-K528 HydrophobicContact CZ3-CB 4.22Å; W506-I529 HydrophobicContact CB-CD1 3.88Å; W506-I529 HydrophobicContact CB-CG1 3.9Å; W506-I529 HydrophobicContact CD2-CD1 4.22Å; W506-I529 HydrophobicContact CD2-CG1 3.55Å; W506-I529 HydrophobicContact CE3-CD1 3.79Å; W506-I529 HydrophobicContact CE3-CG1 3.35Å; W506-I529 HydrophobicContact CG-CD1 4.31Å; W506-I529 HydrophobicContact CG-CG1 3.82Å; W506-I529 HydrophobicContact CZ3-CG1 4.05Å; W506-L532 HydrophobicContact CH2-CD1 4.39Å; W506-L532 HydrophobicContact CZ2-CD1 3.37Å
507	S	84.5	Confident	79.1	Confident	34 Å²	34	36.3 Å²	36.3	24%	0.238	18%	0.182	C	C	.	.	H	α-helix	trans	-66.7	-47.6	177.3	71.1	0	0	0	0	110.2	L503 R504 Y509 A510 D511	L503-S507 WeakPolarHBondContact O-CB 3.33Å; L503-S507 PolarHBondContact O-N 2.86Å; R504-S507 PolarHBondContact O-N 3.19Å; R504-S507 PolarHBondContact O-OG 2.69Å; S507-Y509 PolarHBondContact O-N 2.64Å; S507-A510 PolarHBondContact O-N 3.11Å; S507-D511 WeakPolarHBondContact O-CB 3.47Å; S507-D511 PolarHBondContact O-N 3.44Å
508	M	82.9	Confident	79.4	Confident	43 Å²	43	38.1 Å²	38.1	21%	0.212	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-36.9	174	-70.1	-67.5	-73.9	0	0	111.6	E444 R504 L512	E444-M508 HydrophobicContact CG-CE 4.34Å; R504-M508 WeakPolarHBondContact O-CG 3.19Å; R504-M508 PolarHBondContact O-N 3Å; M508-L512 WeakPolarHBondContact O-CB 3.09Å; M508-L512 WeakPolarHBondContact O-CG 3.21Å; M508-L512 PolarHBondContact O-N 3.35Å
509	Y	84.5	Confident	79.9	Confident	12 Å²	12	40.2 Å²	40.2	5%	0.047	21%	0.205	C	C	.	.	H	α-helix	trans	-68.9	-42	177	-175.1	-136.2	0	0	0	112	I472 L475 K476 L479 A505 W506 S507 L512 E513 V525	I472-Y509 HydrophobicContact CB-CE2 4.12Å; I472-Y509 HydrophobicContact CD1-CE2 3.96Å; I472-Y509 HydrophobicContact CG1-CD2 4.13Å; I472-Y509 HydrophobicContact CG1-CE2 3.79Å; I472-Y509 HydrophobicContact CG2-CD2 4.45Å; I472-Y509 HydrophobicContact CG2-CE2 3.52Å; L475-Y509 HydrophobicContact CB-CD2 4.28Å; L475-Y509 HydrophobicContact CD1-CD2 4.23Å; K476-Y509 WeakPolarHBondContact CE-OH 3.41Å; L479-Y509 HydrophobicContact CD1-CD1 3.4Å; L479-Y509 HydrophobicContact CD1-CE1 3.82Å; L479-Y509 HydrophobicContact CD1-CG 4.02Å; A505-Y509 VanDerWaalsContact O-CB 3.22Å; A505-Y509 WeakPolarHBondContact O-CB 3.32Å; A505-Y509 PolarHBondContact O-N 2.9Å; W506-Y509 AromaticContact CE3-CD1 3.8Å; W506-Y509 HydrophobicContact CE3-CD1 3.8Å; W506-Y509 AromaticContact CZ3-CD1 3.73Å; W506-Y509 HydrophobicContact CZ3-CD1 3.73Å; W506-Y509 HydrophobicContact CZ3-CE1 4.03Å; W506-Y509 PolarHBondContact O-N 3Å; S507-Y509 PolarHBondContact O-N 2.64Å; Y509-L512 PolarHBondContact O-N 3Å; Y509-E513 HydrophobicContact CD2-CG 4.04Å; Y509-E513 HydrophobicContact CE2-CG 3.55Å; Y509-E513 WeakPolarHBondContact CE2-OE1 3.49Å; Y509-E513 VanDerWaalsContact CZ-OE1 3.23Å; Y509-E513 WeakPolarHBondContact O-CB 3.09Å; Y509-E513 VanDerWaalsContact O-CG 3.25Å; Y509-E513 WeakPolarHBondContact O-CG 3.5Å; Y509-E513 PolarHBondContact O-N 3.18Å; Y509-E513 PolarHBondContact OH-OE1 2.93Å; Y509-V525 HydrophobicContact CD1-CB 4.41Å; Y509-V525 HydrophobicContact CD1-CG1 3.61Å; Y509-V525 HydrophobicContact CD1-CG2 3.85Å; Y509-V525 HydrophobicContact CE1-CB 4.11Å; Y509-V525 HydrophobicContact CE1-CG1 3.82Å; Y509-V525 HydrophobicContact CE1-CG2 3.14Å; Y509-V525 HydrophobicContact CE2-CG2 4.44Å; Y509-V525 HydrophobicContact CG-CG1 4.42Å; Y509-V525 VanDerWaalsContact CZ-CG2 3.44Å; Y509-V525 WeakPolarHBondContact OH-CG2 3.42Å
510	A	83.2	Confident	80.5	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-63.3	-47.5	174.6	0	0	0	0	0	110.9	W506 S507 L512 E513 E514 V525 Y526 I529 L539	W506-A510 VanDerWaalsContact O-CB 3.26Å; W506-A510 WeakPolarHBondContact O-CB 3.47Å; W506-A510 PolarHBondContact O-N 2.97Å; S507-A510 PolarHBondContact O-N 3.11Å; A510-L512 VanDerWaalsContact C-N 3.31Å; A510-L512 PolarHBondContact O-N 2.97Å; A510-E513 CarbonylContact O-C 3.55Å; A510-E513 PolarHBondContact O-N 3.18Å; A510-E513 VanDerWaalsContact O-N 3.11Å; A510-E514 WeakPolarHBondContact O-CG 3.36Å; A510-E514 PolarHBondContact O-N 3.33Å; A510-V525 HydrophobicContact CB-CG1 4.36Å; A510-Y526 HydrophobicContact CB-CE1 3.99Å; A510-I529 HydrophobicContact CB-CD1 4.23Å; A510-L539 HydrophobicContact CB-CD1 4.45Å
511	D	84.9	Confident	81.1	Confident	60 Å²	60	48.8 Å²	48.8	32%	0.321	25%	0.248	S	C	.	.	H	α-helix	trans	-60.8	-39.9	177.9	-61.7	-23.5	0	0	0	111.3	S507 N515	S507-D511 WeakPolarHBondContact O-CB 3.47Å; S507-D511 PolarHBondContact O-N 3.44Å; D511-N515 WeakPolarHBondContact O-CB 3.27Å; D511-N515 PolarHBondContact O-N 2.97Å; D511-N515 VanDerWaalsContact O-N 3.14Å; D511-N515 PolarHBondContact O-ND2 3.18Å
512	L	81.9	Confident	81.6	Confident	14 Å²	14	46.7 Å²	46.7	7%	0.073	24%	0.239	C	C	.	.	H	α-helix	trans	-68.5	-37	175.9	-73.1	174.1	0	0	0	112.4	L447 A471 L475 M508 Y509 A510 F516	L447-L512 HydrophobicContact CD1-CD1 4.3Å; L447-L512 HydrophobicContact CD1-CD2 3.75Å; L447-L512 HydrophobicContact CD2-CD2 3.96Å; L447-L512 HydrophobicContact CG-CD2 4.49Å; A471-L512 HydrophobicContact CB-CD1 4.36Å; L475-L512 HydrophobicContact CD1-CD1 3.69Å; M508-L512 WeakPolarHBondContact O-CB 3.09Å; M508-L512 WeakPolarHBondContact O-CG 3.21Å; M508-L512 PolarHBondContact O-N 3.35Å; Y509-L512 PolarHBondContact O-N 3Å; A510-L512 VanDerWaalsContact C-N 3.31Å; A510-L512 PolarHBondContact O-N 2.97Å; L512-F516 HydrophobicContact CD2-CD2 4.31Å; L512-F516 HydrophobicContact CD2-CE2 4.14Å; L512-F516 WeakPolarHBondContact O-CB 3.29Å; L512-F516 WeakPolarHBondContact O-CD2 3.25Å; L512-F516 PolarHBondContact O-N 3.46Å
513	E	82.6	Confident	81.9	Confident	3 Å²	3	48.5 Å²	48.5	1%	0.014	25%	0.246	C	C	.	.	H	α-helix	trans	-72.9	-40.5	175.7	-68.3	-86.8	-174.5	0	0	110.8	I472 Y509 A510 N515 F516 G517 S521 C522 V525	I472-E513 HydrophobicContact CD1-CG 3.97Å; I472-E513 VanDerWaalsContact CD1-OE1 3.29Å; I472-E513 WeakPolarHBondContact CD1-OE1 3.38Å; Y509-E513 HydrophobicContact CD2-CG 4.04Å; Y509-E513 HydrophobicContact CE2-CG 3.55Å; Y509-E513 WeakPolarHBondContact CE2-OE1 3.49Å; Y509-E513 VanDerWaalsContact CZ-OE1 3.23Å; Y509-E513 WeakPolarHBondContact O-CB 3.09Å; Y509-E513 VanDerWaalsContact O-CG 3.25Å; Y509-E513 WeakPolarHBondContact O-CG 3.5Å; Y509-E513 PolarHBondContact O-N 3.18Å; Y509-E513 PolarHBondContact OH-OE1 2.93Å; A510-E513 CarbonylContact O-C 3.55Å; A510-E513 PolarHBondContact O-N 3.18Å; A510-E513 VanDerWaalsContact O-N 3.11Å; E513-N515 PolarHBondContact O-N 3.4Å; E513-F516 PolarHBondContact O-N 2.76Å; E513-G517 WeakPolarHBondContact O-CA 3.46Å; E513-G517 PolarHBondContact O-N 3.31Å; E513-G517 WeakPolarHBondContact OE2-CA 3.36Å; E513-S521 VanDerWaalsContact OE2-CB 3.29Å; E513-S521 WeakPolarHBondContact OE2-CB 3.31Å; E513-S521 PolarHBondContact OE2-OG 3.27Å; E513-C522 HydrophobicContact CB-CB 4.45Å; E513-C522 PolarHBondContact O-SG 3.17Å; E513-V525 HydrophobicContact CG-CG2 4.04Å
514	E	82.7	Confident	82.2	Confident	60 Å²	60	47.6 Å²	47.6	28%	0.28	25%	0.247	S	C	.	.	H	α-helix	trans	-57.5	-38.6	174.3	-75.7	-169.7	157.8	0	0	112.2	A510 Y526 F546	A510-E514 WeakPolarHBondContact O-CG 3.36Å; A510-E514 PolarHBondContact O-N 3.33Å; E514-Y526 HydrophobicContact CG-CE2 3.98Å; E514-Y526 WeakPolarHBondContact OE1-CE2 3.49Å; E514-Y526 VanDerWaalsContact OE1-CZ 3.25Å; E514-Y526 PolarHBondContact OE1-OH 2.83Å; E514-F546 HydrophobicContact CG-CD2 4.22Å
515	N	80.9	Confident	82.4	Confident	123 Å²	123	41.8 Å²	41.8	66%	0.658	23%	0.225	S	C	*	.	H	α-helix	trans	-82.2	-34.2	-178	-72.3	-54.9	0	0	0	114.3	D511 E513	D511-N515 WeakPolarHBondContact O-CB 3.27Å; D511-N515 PolarHBondContact O-N 2.97Å; D511-N515 VanDerWaalsContact O-N 3.14Å; D511-N515 PolarHBondContact O-ND2 3.18Å; E513-N515 PolarHBondContact O-N 3.4Å
516	F	73.4	Confident	82.5	Confident	76 Å²	76	42 Å²	42	33%	0.333	23%	0.226	S	C	.	.	H	α-helix	trans	-125.3	-16.6	-171.7	-59.6	-71.6	0	0	0	114.9	W468 L512 E513	W468-F516 HydrophobicContact CB-CB 4.4Å; W468-F516 HydrophobicContact CB-CD2 4.15Å; W468-F516 HydrophobicContact CB-CG 4.23Å; W468-F516 AromaticContact CD1-CG 4Å; W468-F516 HydrophobicContact CD2-CB 4.11Å; W468-F516 HydrophobicContact CG-CB 3.96Å; W468-F516 HydrophobicContact CG-CG 4.17Å; L512-F516 HydrophobicContact CD2-CD2 4.31Å; L512-F516 HydrophobicContact CD2-CE2 4.14Å; L512-F516 WeakPolarHBondContact O-CB 3.29Å; L512-F516 WeakPolarHBondContact O-CD2 3.25Å; L512-F516 PolarHBondContact O-N 3.46Å; E513-F516 PolarHBondContact O-N 2.76Å
517	G	71.8	Confident	82.5	Confident	24 Å²	24	44.3 Å²	44.3	25%	0.247	24%	0.238	C	C	.	.	S	Bend	trans	-76.2	167	-169.2	0	0	0	0	0	113.9	E513	E513-G517 WeakPolarHBondContact O-CA 3.46Å; E513-G517 PolarHBondContact O-N 3.31Å; E513-G517 WeakPolarHBondContact OE2-CA 3.36Å
518	T	78.8	Confident	82.4	Confident	90 Å²	90	48.3 Å²	48.3	55%	0.552	25%	0.251	S	S	*	.			trans	-82.2	149.2	168.4	50.3	0	0	0	0	109.4	E520 S521 C522	T518-E520 PolarHBondContact O-N 3.47Å; T518-E520 VanDerWaalsContact O-N 3.09Å; T518-S521 PolarHBondContact N-OG 2.94Å; T518-S521 PolarHBondContact O-N 3.4Å; T518-S521 PolarHBondContact O-OG 3.3Å; T518-S521 VanDerWaalsContact OG1-CB 3.27Å; T518-S521 WeakPolarHBondContact OG1-CB 3.32Å; T518-S521 PolarHBondContact OG1-N 3.01Å; T518-S521 PolarHBondContact OG1-OG 3.48Å; T518-C522 PolarHBondContact O-N 3.07Å; T518-C522 PolarHBondContact O-SG 2.74Å
519	F	80.5	Confident	82.6	Confident	56 Å²	56	46.3 Å²	46.3	25%	0.246	24%	0.241	C	C	.	.	H	α-helix	trans	-47.2	-44.1	176.9	177.9	-101.7	0	0	0	113	K523 F546 L547 N550 H552	F519-K523 HydrophobicContact CE1-CD 4.39Å; F519-K523 VanDerWaalsContact O-CB 3.28Å; F519-K523 WeakPolarHBondContact O-CB 3.26Å; F519-K523 PolarHBondContact O-N 3.39Å; F519-F546 AromaticContact CD2-CE1 3.84Å; F519-F546 HydrophobicContact CD2-CE1 3.84Å; F519-F546 HydrophobicContact CD2-CZ 4.23Å; F519-F546 HydrophobicContact CE2-CE1 4.12Å; F519-L547 HydrophobicContact CE2-CD2 3.73Å; F519-L547 HydrophobicContact CZ-CD2 3.68Å; F519-N550 HydrophobicContact CD2-CB 3.8Å; F519-N550 WeakPolarHBondContact CD2-ND2 3.18Å; F519-N550 HydrophobicContact CE2-CB 3.6Å; F519-H552 AromaticContact CE1-CD2 3.69Å; F519-H552 AromaticContact CE1-NE2 3.77Å; F519-H552 AromaticContact CE2-CD2 3.49Å; F519-H552 VanDerWaalsContact CE2-CD2 3.49Å; F519-H552 WeakPolarHBondContact CE2-CD2 3.12Å; F519-H552 HydrophobicContact CZ-CB 4.14Å; F519-H552 AromaticContact CZ-CD2 3.11Å; F519-H552 WeakPolarHBondContact CZ-CD2 3.31Å; F519-H552 AromaticContact CZ-CG 3.68Å; F519-H552 AromaticContact CZ-NE2 3.7Å
520	E	84	Confident	82.5	Confident	158 Å²	158	46.2 Å²	46.2	74%	0.738	24%	0.241	S	C	*	.	H	α-helix	trans	-67.4	-38	178.7	-63.1	179.2	178.3	0	0	113.3	T518 A524	T518-E520 PolarHBondContact O-N 3.47Å; T518-E520 VanDerWaalsContact O-N 3.09Å; E520-A524 VanDerWaalsContact O-CB 3.31Å; E520-A524 WeakPolarHBondContact O-CB 3.38Å; E520-A524 PolarHBondContact O-N 3.46Å
521	S	83.7	Confident	82.5	Confident	27 Å²	27	51.8 Å²	51.8	19%	0.189	27%	0.271	C	S	.	.	H	α-helix	trans	-68.9	-47	178	63.3	0	0	0	0	110.7	E513 T518 K523 A524 V525	E513-S521 VanDerWaalsContact OE2-CB 3.29Å; E513-S521 WeakPolarHBondContact OE2-CB 3.31Å; E513-S521 PolarHBondContact OE2-OG 3.27Å; T518-S521 PolarHBondContact N-OG 2.94Å; T518-S521 PolarHBondContact O-N 3.4Å; T518-S521 PolarHBondContact O-OG 3.3Å; T518-S521 VanDerWaalsContact OG1-CB 3.27Å; T518-S521 WeakPolarHBondContact OG1-CB 3.32Å; T518-S521 PolarHBondContact OG1-N 3.01Å; T518-S521 PolarHBondContact OG1-OG 3.48Å; S521-K523 VanDerWaalsContact C-N 3.32Å; S521-K523 PolarHBondContact O-N 2.88Å; S521-A524 PolarHBondContact O-N 3.45Å; S521-V525 VanDerWaalsContact O-CG2 3.31Å; S521-V525 WeakPolarHBondContact O-CG2 3.46Å; S521-V525 PolarHBondContact O-N 3.37Å
522	C	83.4	Confident	82.4	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.007	27%	0.268	C	S	.	.	H	α-helix	trans	-58.6	-46.2	177.3	-51.8	0	0	0	0	111.2	E513 T518 A524 V525 Y526 F546	E513-C522 HydrophobicContact CB-CB 4.45Å; E513-C522 PolarHBondContact O-SG 3.17Å; T518-C522 PolarHBondContact O-N 3.07Å; T518-C522 PolarHBondContact O-SG 2.74Å; C522-A524 PolarHBondContact O-N 3.21Å; C522-V525 PolarHBondContact O-N 3.28Å; C522-Y526 VanDerWaalsContact O-CD2 3.32Å; C522-Y526 WeakPolarHBondContact O-CD2 3.22Å; C522-Y526 PolarHBondContact O-N 2.98Å; C522-F546 HydrophobicContact CB-CD1 4.47Å; C522-F546 HydrophobicContact CB-CE1 3.61Å; C522-F546 HydrophobicContact CB-CE2 4.43Å; C522-F546 HydrophobicContact CB-CZ 3.58Å
523	K	85.4	Confident	82.2	Confident	43 Å²	43	60.4 Å²	60.4	19%	0.187	30%	0.301	C	S	.	.	H	α-helix	trans	-58.2	-48.2	176	-172.5	-178.4	175.9	176.5	0	111.6	F519 S521 V525 Y526 E527 Y543 E555	F519-K523 HydrophobicContact CE1-CD 4.39Å; F519-K523 VanDerWaalsContact O-CB 3.28Å; F519-K523 WeakPolarHBondContact O-CB 3.26Å; F519-K523 PolarHBondContact O-N 3.39Å; S521-K523 VanDerWaalsContact C-N 3.32Å; S521-K523 PolarHBondContact O-N 2.88Å; K523-V525 VanDerWaalsContact C-N 3.27Å; K523-V525 PolarHBondContact O-N 3.31Å; K523-Y526 PolarHBondContact O-N 3.19Å; K523-E527 HydrophobicContact CG-CG 4.47Å; K523-E527 WeakPolarHBondContact O-CB 3.44Å; K523-E527 WeakPolarHBondContact O-CG 3.39Å; K523-E527 PolarHBondContact O-N 3.11Å; K523-Y543 HydrophobicContact CG-CE2 4.32Å; K523-Y543 WeakPolarHBondContact CG-OH 3.49Å; K523-E555 WeakPolarHBondContact CE-OE2 3.02Å; K523-E555 IonicContact NZ-OE1 3.15Å; K523-E555 PolarHBondContact NZ-OE1 3.46Å; K523-E555 IonicContact NZ-OE2 3.37Å; K523-E555 PolarHBondContact NZ-OE2 3.19Å
524	A	86.8	Confident	81.9	Confident	40 Å²	40	61.7 Å²	61.7	33%	0.331	31%	0.308	S	S	.	.	H	α-helix	trans	-63.3	-31.8	178.4	0	0	0	0	0	113	E520 S521 C522 K528	E520-A524 VanDerWaalsContact O-CB 3.31Å; E520-A524 WeakPolarHBondContact O-CB 3.38Å; E520-A524 PolarHBondContact O-N 3.46Å; S521-A524 PolarHBondContact O-N 3.45Å; C522-A524 PolarHBondContact O-N 3.21Å; A524-K528 WeakPolarHBondContact O-CB 3.3Å; A524-K528 WeakPolarHBondContact O-CD 3.41Å; A524-K528 WeakPolarHBondContact O-CG 3.4Å; A524-K528 PolarHBondContact O-N 3.22Å; A524-K528 VanDerWaalsContact O-N 3.11Å
525	V	84.9	Confident	81.6	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.018	30%	0.297	C	S	.	.	H	α-helix	trans	-68	-50.3	174	172.3	0	0	0	0	110.7	W506 Y509 A510 E513 S521 C522 K523 E527 K528 I529	W506-V525 HydrophobicContact CE3-CG1 4Å; W506-V525 HydrophobicContact CZ3-CG1 3.99Å; Y509-V525 HydrophobicContact CD1-CB 4.41Å; Y509-V525 HydrophobicContact CD1-CG1 3.61Å; Y509-V525 HydrophobicContact CD1-CG2 3.85Å; Y509-V525 HydrophobicContact CE1-CB 4.11Å; Y509-V525 HydrophobicContact CE1-CG1 3.82Å; Y509-V525 HydrophobicContact CE1-CG2 3.14Å; Y509-V525 HydrophobicContact CE2-CG2 4.44Å; Y509-V525 HydrophobicContact CG-CG1 4.42Å; Y509-V525 VanDerWaalsContact CZ-CG2 3.44Å; Y509-V525 WeakPolarHBondContact OH-CG2 3.42Å; A510-V525 HydrophobicContact CB-CG1 4.36Å; E513-V525 HydrophobicContact CG-CG2 4.04Å; S521-V525 VanDerWaalsContact O-CG2 3.31Å; S521-V525 WeakPolarHBondContact O-CG2 3.46Å; S521-V525 PolarHBondContact O-N 3.37Å; C522-V525 PolarHBondContact O-N 3.28Å; K523-V525 VanDerWaalsContact C-N 3.27Å; K523-V525 PolarHBondContact O-N 3.31Å; V525-E527 PolarHBondContact O-N 2.98Å; V525-K528 WeakPolarHBondContact O-CB 3.41Å; V525-K528 PolarHBondContact O-N 2.96Å; V525-I529 HydrophobicContact CG1-CD1 3.91Å; V525-I529 VanDerWaalsContact O-CG1 3.29Å; V525-I529 WeakPolarHBondContact O-CG1 3.29Å; V525-I529 PolarHBondContact O-N 3.34Å
526	Y	85.4	Confident	81.6	Confident	5 Å²	5	55.7 Å²	55.7	2%	0.02	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-42.2	178.7	-82.6	-60.5	0	0	0	113.1	A510 E514 C522 K523 K528 I529 L530 L539 Y543	A510-Y526 HydrophobicContact CB-CE1 3.99Å; E514-Y526 HydrophobicContact CG-CE2 3.98Å; E514-Y526 WeakPolarHBondContact OE1-CE2 3.49Å; E514-Y526 VanDerWaalsContact OE1-CZ 3.25Å; E514-Y526 PolarHBondContact OE1-OH 2.83Å; C522-Y526 VanDerWaalsContact O-CD2 3.32Å; C522-Y526 WeakPolarHBondContact O-CD2 3.22Å; C522-Y526 PolarHBondContact O-N 2.98Å; K523-Y526 PolarHBondContact O-N 3.19Å; Y526-K528 VanDerWaalsContact C-N 3.33Å; Y526-K528 PolarHBondContact O-N 3.4Å; Y526-I529 HydrophobicContact CD1-CD1 4.34Å; Y526-I529 PolarHBondContact O-N 3.36Å; Y526-L530 WeakPolarHBondContact O-CG 3.47Å; Y526-L530 PolarHBondContact O-N 3.37Å; Y526-L539 HydrophobicContact CD1-CD1 4.42Å; Y526-L539 HydrophobicContact CD1-CD2 4.41Å; Y526-L539 HydrophobicContact CD1-CG 4.13Å; Y526-L539 HydrophobicContact CE1-CD1 3.59Å; Y526-L539 HydrophobicContact CE1-CD2 4.35Å; Y526-L539 HydrophobicContact CE1-CG 3.68Å; Y526-Y543 VanDerWaalsContact CB-CE2 3.48Å; Y526-Y543 HydrophobicContact CD1-CD2 4.17Å; Y526-Y543 AromaticContact CD1-CG 3.99Å; Y526-Y543 HydrophobicContact CD1-CG 3.99Å; Y526-Y543 AromaticContact CD2-CD2 3.3Å; Y526-Y543 HydrophobicContact CD2-CD2 3.3Å; Y526-Y543 AromaticContact CD2-CE2 3.99Å; Y526-Y543 HydrophobicContact CD2-CE2 3.99Å; Y526-Y543 AromaticContact CD2-CG 3.97Å; Y526-Y543 HydrophobicContact CD2-CG 3.97Å; Y526-Y543 HydrophobicContact CE2-CD2 4.12Å; Y526-Y543 HydrophobicContact CG-CD1 4.41Å; Y526-Y543 AromaticContact CG-CD2 3.32Å; Y526-Y543 HydrophobicContact CG-CD2 3.32Å; Y526-Y543 AromaticContact CG-CE2 3.99Å; Y526-Y543 HydrophobicContact CG-CE2 3.99Å; Y526-Y543 AromaticContact CG-CG 3.58Å; Y526-Y543 HydrophobicContact CG-CG 3.58Å
527	E	85.7	Confident	82.1	Confident	58 Å²	58	53.5 Å²	53.5	27%	0.271	27%	0.274	S	S	.	.	H	α-helix	trans	-61.7	-41.3	174.5	-70.4	-167.3	137	0	0	111.7	K523 V525 I529 L530 D531 K562	K523-E527 HydrophobicContact CG-CG 4.47Å; K523-E527 WeakPolarHBondContact O-CB 3.44Å; K523-E527 WeakPolarHBondContact O-CG 3.39Å; K523-E527 PolarHBondContact O-N 3.11Å; V525-E527 PolarHBondContact O-N 2.98Å; E527-I529 VanDerWaalsContact C-N 3.32Å; E527-I529 PolarHBondContact O-N 3.42Å; E527-L530 WeakPolarHBondContact O-CB 3.45Å; E527-L530 PolarHBondContact O-N 2.75Å; E527-D531 WeakPolarHBondContact O-CB 3.28Å; E527-D531 PolarHBondContact O-N 2.97Å; E527-K562 IonicContact OE1-NZ 2.62Å; E527-K562 PolarHBondContact OE1-NZ 3.39Å
528	K	84	Confident	82.7	Confident	118 Å²	118	57.6 Å²	57.6	51%	0.513	29%	0.287	S	S	.	.	H	α-helix	trans	-62.2	-38.1	173.5	-75.5	171.5	-175.3	-178	0	112.9	W506 A524 V525 Y526 L530 D531 L532	W506-K528 HydrophobicContact CH2-CB 3.88Å; W506-K528 HydrophobicContact CH2-CD 4.26Å; W506-K528 HydrophobicContact CZ3-CB 4.22Å; A524-K528 WeakPolarHBondContact O-CB 3.3Å; A524-K528 WeakPolarHBondContact O-CD 3.41Å; A524-K528 WeakPolarHBondContact O-CG 3.4Å; A524-K528 PolarHBondContact O-N 3.22Å; A524-K528 VanDerWaalsContact O-N 3.11Å; V525-K528 WeakPolarHBondContact O-CB 3.41Å; V525-K528 PolarHBondContact O-N 2.96Å; Y526-K528 VanDerWaalsContact C-N 3.33Å; Y526-K528 PolarHBondContact O-N 3.4Å; K528-L530 VanDerWaalsContact C-N 3.31Å; K528-D531 PolarHBondContact O-N 2.74Å; K528-L532 WeakPolarHBondContact O-CB 3.11Å; K528-L532 VanDerWaalsContact O-CG 3.25Å; K528-L532 WeakPolarHBondContact O-CG 3.39Å; K528-L532 PolarHBondContact O-N 3.36Å
529	I	85.3	Confident	83	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.6	-38.3	178.2	-61	163.8	0	0	0	110.8	W506 A510 V525 Y526 E527 R533 I534 A535 L539	W506-I529 HydrophobicContact CB-CD1 3.88Å; W506-I529 HydrophobicContact CB-CG1 3.9Å; W506-I529 HydrophobicContact CD2-CD1 4.22Å; W506-I529 HydrophobicContact CD2-CG1 3.55Å; W506-I529 HydrophobicContact CE3-CD1 3.79Å; W506-I529 HydrophobicContact CE3-CG1 3.35Å; W506-I529 HydrophobicContact CG-CD1 4.31Å; W506-I529 HydrophobicContact CG-CG1 3.82Å; W506-I529 HydrophobicContact CZ3-CG1 4.05Å; A510-I529 HydrophobicContact CB-CD1 4.23Å; V525-I529 HydrophobicContact CG1-CD1 3.91Å; V525-I529 VanDerWaalsContact O-CG1 3.29Å; V525-I529 WeakPolarHBondContact O-CG1 3.29Å; V525-I529 PolarHBondContact O-N 3.34Å; Y526-I529 HydrophobicContact CD1-CD1 4.34Å; Y526-I529 PolarHBondContact O-N 3.36Å; E527-I529 VanDerWaalsContact C-N 3.32Å; E527-I529 PolarHBondContact O-N 3.42Å; I529-R533 PolarHBondContact O-N 3.41Å; I529-I534 PolarHBondContact O-N 3.01Å; I529-A535 HydrophobicContact CG2-CB 4.09Å; I529-L539 HydrophobicContact CB-CD2 4.03Å; I529-L539 HydrophobicContact CD1-CD2 3.84Å; I529-L539 HydrophobicContact CG1-CD2 4.47Å; I529-L539 HydrophobicContact CG2-CD2 3.29Å
530	L	82.3	Confident	83.3	Confident	10 Å²	10	51.2 Å²	51.2	5%	0.052	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-44.7	173.5	-68.2	170.4	0	0	0	111.5	Y526 E527 K528 L532 R533 A535 V540 Y543 K562 L566	Y526-L530 WeakPolarHBondContact O-CG 3.47Å; Y526-L530 PolarHBondContact O-N 3.37Å; E527-L530 WeakPolarHBondContact O-CB 3.45Å; E527-L530 PolarHBondContact O-N 2.75Å; K528-L530 VanDerWaalsContact C-N 3.31Å; L530-L532 VanDerWaalsContact C-N 3.3Å; L530-L532 PolarHBondContact O-N 3.14Å; L530-R533 WeakPolarHBondContact O-CA 3.35Å; L530-R533 PolarHBondContact O-N 3.25Å; L530-A535 HydrophobicContact CD2-CB 3.94Å; L530-V540 HydrophobicContact CD2-CG2 3.93Å; L530-Y543 HydrophobicContact CD1-CD1 4.06Å; L530-Y543 HydrophobicContact CD1-CE1 3.95Å; L530-K562 HydrophobicContact CD1-CB 4.34Å; L530-K562 HydrophobicContact CD1-CD 4.35Å; L530-L566 HydrophobicContact CB-CD1 4.12Å; L530-L566 HydrophobicContact CD2-CD1 3.61Å; L530-L566 HydrophobicContact CG-CD1 4.49Å
531	D	84.4	Confident	83.5	Confident	118 Å²	118	45.1 Å²	45.1	63%	0.631	22%	0.224	S	C	*	.	H	α-helix	trans	-62.8	-37.4	179.5	-67.6	-18.6	0	0	0	111.9	E527 K528 R533	E527-D531 WeakPolarHBondContact O-CB 3.28Å; E527-D531 PolarHBondContact O-N 2.97Å; K528-D531 PolarHBondContact O-N 2.74Å; D531-R533 PolarHBondContact O-N 2.78Å
532	L	82.2	Confident	83.7	Confident	51 Å²	51	46.3 Å²	46.3	27%	0.267	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-8.6	175.1	-68.5	174.3	0	0	0	113.7	W506 K528 L530 I534	W506-L532 HydrophobicContact CH2-CD1 4.39Å; W506-L532 HydrophobicContact CZ2-CD1 3.37Å; K528-L532 WeakPolarHBondContact O-CB 3.11Å; K528-L532 VanDerWaalsContact O-CG 3.25Å; K528-L532 WeakPolarHBondContact O-CG 3.39Å; K528-L532 PolarHBondContact O-N 3.36Å; L530-L532 VanDerWaalsContact C-N 3.3Å; L530-L532 PolarHBondContact O-N 3.14Å; L532-I534 VanDerWaalsContact C-N 3.29Å; L532-I534 HydrophobicContact CB-CD1 3.43Å; L532-I534 VanDerWaalsContact CB-CD1 3.43Å; L532-I534 HydrophobicContact CB-CG1 4.02Å; L532-I534 HydrophobicContact CD1-CD1 3.87Å; L532-I534 HydrophobicContact CG-CD1 4.26Å; L532-I534 PolarHBondContact O-N 2.47Å
533	R	78.2	Confident	83.8	Confident	204 Å²	204	46.5 Å²	46.5	77%	0.77	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	30.3	-178.9	-48.6	-168.7	175.8	173.4	-3.6	115	I529 L530 D531 L566	I529-R533 PolarHBondContact O-N 3.41Å; L530-R533 WeakPolarHBondContact O-CA 3.35Å; L530-R533 PolarHBondContact O-N 3.25Å; D531-R533 PolarHBondContact O-N 2.78Å; R533-L566 HydrophobicContact CB-CD2 4.32Å; R533-L566 HydrophobicContact CG-CD2 3.73Å
534	I	76.2	Confident	83.9	Confident	31 Å²	31	44.4 Å²	44.4	16%	0.159	22%	0.22	C	C	.	.			trans	-98.6	-11.1	179.9	-53.6	148.1	0	0	0	111.5	H500 K501 L503 I529 L532	H500-I534 WeakPolarHBondContact O-CD1 3.25Å; K501-I534 VanDerWaalsContact CA-CD1 3.47Å; K501-I534 HydrophobicContact CB-CD1 4.24Å; K501-I534 HydrophobicContact CG-CD1 4.39Å; K501-I534 WeakPolarHBondContact O-CG2 3.42Å; L503-I534 HydrophobicContact CB-CG2 3.76Å; L503-I534 HydrophobicContact CD1-CG2 4.19Å; I529-I534 PolarHBondContact O-N 3.01Å; L532-I534 VanDerWaalsContact C-N 3.29Å; L532-I534 HydrophobicContact CB-CD1 3.43Å; L532-I534 VanDerWaalsContact CB-CD1 3.43Å; L532-I534 HydrophobicContact CB-CG1 4.02Å; L532-I534 HydrophobicContact CD1-CD1 3.87Å; L532-I534 HydrophobicContact CG-CD1 4.26Å; L532-I534 PolarHBondContact O-N 2.47Å
535	A	75.4	Confident	83.9	Confident	7 Å²	7	44 Å²	44	6%	0.058	22%	0.216	C	C	.	.			trans	-52.5	143.7	-173.7	0	0	0	0	0	111.8	I529 L530 L539 V540 F567	I529-A535 HydrophobicContact CG2-CB 4.09Å; L530-A535 HydrophobicContact CD2-CB 3.94Å; A535-L539 HydrophobicContact CB-CD2 4.15Å; A535-V540 HydrophobicContact CB-CG2 4.21Å; A535-F567 HydrophobicContact CB-CZ 4.21Å; A535-F567 WeakPolarHBondContact O-CE1 3.48Å; A535-F567 WeakPolarHBondContact O-CZ 3.39Å
536	T	82.2	Confident	83.9	Confident	50 Å²	50	45 Å²	45	31%	0.307	22%	0.22	S	C	.	.			trans	-92.1	155.8	162.5	51.7	0	0	0	0	109.4	L503 Q538 L539 V540	L503-T536 HydrophobicContact CD1-CG2 4.37Å; L503-T536 HydrophobicContact CD2-CG2 3.4Å; T536-Q538 PolarHBondContact O-N 2.72Å; T536-Q538 VanDerWaalsContact O-N 3.16Å; T536-L539 WeakPolarHBondContact O-CB 3.36Å; T536-L539 PolarHBondContact O-N 2.9Å; T536-L539 WeakPolarHBondContact OG1-CB 3.49Å; T536-L539 PolarHBondContact OG1-N 3Å; T536-V540 PolarHBondContact O-N 3.28Å; T536-V540 VanDerWaalsContact O-N 3.15Å
537	P	83.1	Confident	84	Confident	29 Å²	29	44.8 Å²	44.8	19%	0.188	22%	0.219	C	C	.	.	H	α-helix	trans	-53.5	-35.8	173.9	-27.4	35.1	0	0	0	112.4	V540 I541 F567 N571 I575	P537-V540 PolarHBondContact O-N 3.27Å; P537-I541 VanDerWaalsContact O-CG1 3.28Å; P537-I541 WeakPolarHBondContact O-CG1 3.37Å; P537-I541 PolarHBondContact O-N 2.81Å; P537-F567 HydrophobicContact CG-CD1 4.45Å; P537-F567 HydrophobicContact CG-CD2 4.48Å; P537-F567 HydrophobicContact CG-CE1 4.24Å; P537-F567 HydrophobicContact CG-CE2 4.28Å; P537-F567 HydrophobicContact CG-CZ 4.16Å; P537-N571 HydrophobicContact CG-CB 3.87Å; P537-I575 HydrophobicContact CB-CD1 3.99Å; P537-I575 HydrophobicContact CB-CG1 4Å
538	Q	84.9	Confident	84	Confident	111 Å²	111	44.2 Å²	44.2	52%	0.519	22%	0.217	S	C	.	.	H	α-helix	trans	-63.6	-41.9	175.5	-172.6	59.8	31.6	0	0	112.4	T536 V540 I541 N542	T536-Q538 PolarHBondContact O-N 2.72Å; T536-Q538 VanDerWaalsContact O-N 3.16Å; Q538-V540 VanDerWaalsContact C-N 3.28Å; Q538-V540 PolarHBondContact O-N 2.84Å; Q538-I541 PolarHBondContact O-N 3.36Å; Q538-N542 PolarHBondContact NE2-OD1 3.34Å; Q538-N542 VanDerWaalsContact O-CG 3.25Å; Q538-N542 PolarHBondContact O-N 2.99Å; Q538-N542 PolarHBondContact O-OD1 3.11Å
539	L	85.7	Confident	84.1	Confident	10 Å²	10	45.9 Å²	45.9	5%	0.052	23%	0.226	C	C	.	.	H	α-helix	trans	-63	-37.3	176.9	-167.4	79.1	0	0	0	111.5	A510 Y526 I529 A535 T536 N542 Y543	A510-L539 HydrophobicContact CB-CD1 4.45Å; Y526-L539 HydrophobicContact CD1-CD1 4.42Å; Y526-L539 HydrophobicContact CD1-CD2 4.41Å; Y526-L539 HydrophobicContact CD1-CG 4.13Å; Y526-L539 HydrophobicContact CE1-CD1 3.59Å; Y526-L539 HydrophobicContact CE1-CD2 4.35Å; Y526-L539 HydrophobicContact CE1-CG 3.68Å; I529-L539 HydrophobicContact CB-CD2 4.03Å; I529-L539 HydrophobicContact CD1-CD2 3.84Å; I529-L539 HydrophobicContact CG1-CD2 4.47Å; I529-L539 HydrophobicContact CG2-CD2 3.29Å; A535-L539 HydrophobicContact CB-CD2 4.15Å; T536-L539 WeakPolarHBondContact O-CB 3.36Å; T536-L539 PolarHBondContact O-N 2.9Å; T536-L539 WeakPolarHBondContact OG1-CB 3.49Å; T536-L539 PolarHBondContact OG1-N 3Å; L539-N542 PolarHBondContact O-N 3.38Å; L539-Y543 WeakPolarHBondContact O-CB 3Å; L539-Y543 PolarHBondContact O-N 3.2Å
540	V	87.2	Confident	84.1	Confident	1 Å²	1	49 Å²	49	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-42.6	173.7	-179.3	0	0	0	0	111.1	L530 A535 T536 P537 Q538 N542 Y543 A544 F560 F567 I575	L530-V540 HydrophobicContact CD2-CG2 3.93Å; A535-V540 HydrophobicContact CB-CG2 4.21Å; T536-V540 PolarHBondContact O-N 3.28Å; T536-V540 VanDerWaalsContact O-N 3.15Å; P537-V540 PolarHBondContact O-N 3.27Å; Q538-V540 VanDerWaalsContact C-N 3.28Å; Q538-V540 PolarHBondContact O-N 2.84Å; V540-N542 VanDerWaalsContact C-N 3.33Å; V540-Y543 PolarHBondContact O-N 3.22Å; V540-A544 VanDerWaalsContact O-CB 3.31Å; V540-A544 WeakPolarHBondContact O-CB 3.27Å; V540-A544 PolarHBondContact O-N 3.44Å; V540-F560 HydrophobicContact CG1-CD1 4.38Å; V540-F567 HydrophobicContact CG2-CE2 3.84Å; V540-F567 HydrophobicContact CG2-CZ 4.4Å; V540-I575 HydrophobicContact CG1-CG2 4.47Å
541	I	87.4	Confident	84	Confident	31 Å²	31	56.4 Å²	56.4	16%	0.159	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-41.6	176.3	-67.2	164.4	0	0	0	110.7	P537 Q538 A544 A545 T578	P537-I541 VanDerWaalsContact O-CG1 3.28Å; P537-I541 WeakPolarHBondContact O-CG1 3.37Å; P537-I541 PolarHBondContact O-N 2.81Å; Q538-I541 PolarHBondContact O-N 3.36Å; I541-A544 PolarHBondContact O-N 3.47Å; I541-A545 WeakPolarHBondContact O-CB 3.35Å; I541-A545 PolarHBondContact O-N 3.26Å; I541-T578 HydrophobicContact CD1-CG2 4.39Å
542	N	87.3	Confident	84	Confident	51 Å²	51	54.6 Å²	54.6	27%	0.273	26%	0.262	S	S	.	.	H	α-helix	trans	-64.1	-48.1	176	-68.7	2.5	0	0	0	111	Q538 L539 V540 A544 A545 F546	Q538-N542 PolarHBondContact NE2-OD1 3.34Å; Q538-N542 VanDerWaalsContact O-CG 3.25Å; Q538-N542 PolarHBondContact O-N 2.99Å; Q538-N542 PolarHBondContact O-OD1 3.11Å; L539-N542 PolarHBondContact O-N 3.38Å; V540-N542 VanDerWaalsContact C-N 3.33Å; N542-A544 VanDerWaalsContact C-N 3.29Å; N542-A544 PolarHBondContact O-N 2.8Å; N542-A545 WeakPolarHBondContact O-CB 3.08Å; N542-A545 PolarHBondContact O-N 3.5Å; N542-A545 VanDerWaalsContact O-N 3.11Å; N542-F546 WeakPolarHBondContact O-CB 3.37Å; N542-F546 PolarHBondContact O-N 3.45Å
543	Y	85.9	Confident	84	Confident	5 Å²	5	54.7 Å²	54.7	2%	0.02	26%	0.26	C	S	.	.	H	α-helix	trans	-57.7	-44.2	175.9	178.6	-140	0	0	0	111.8	K523 Y526 L530 L539 V540 A545 F546 L547 A559	K523-Y543 HydrophobicContact CG-CE2 4.32Å; K523-Y543 WeakPolarHBondContact CG-OH 3.49Å; Y526-Y543 VanDerWaalsContact CB-CE2 3.48Å; Y526-Y543 HydrophobicContact CD1-CD2 4.17Å; Y526-Y543 AromaticContact CD1-CG 3.99Å; Y526-Y543 HydrophobicContact CD1-CG 3.99Å; Y526-Y543 AromaticContact CD2-CD2 3.3Å; Y526-Y543 HydrophobicContact CD2-CD2 3.3Å; Y526-Y543 AromaticContact CD2-CE2 3.99Å; Y526-Y543 HydrophobicContact CD2-CE2 3.99Å; Y526-Y543 AromaticContact CD2-CG 3.97Å; Y526-Y543 HydrophobicContact CD2-CG 3.97Å; Y526-Y543 HydrophobicContact CE2-CD2 4.12Å; Y526-Y543 HydrophobicContact CG-CD1 4.41Å; Y526-Y543 AromaticContact CG-CD2 3.32Å; Y526-Y543 HydrophobicContact CG-CD2 3.32Å; Y526-Y543 AromaticContact CG-CE2 3.99Å; Y526-Y543 HydrophobicContact CG-CE2 3.99Å; Y526-Y543 AromaticContact CG-CG 3.58Å; Y526-Y543 HydrophobicContact CG-CG 3.58Å; L530-Y543 HydrophobicContact CD1-CD1 4.06Å; L530-Y543 HydrophobicContact CD1-CE1 3.95Å; L539-Y543 WeakPolarHBondContact O-CB 3Å; L539-Y543 PolarHBondContact O-N 3.2Å; V540-Y543 PolarHBondContact O-N 3.22Å; Y543-A545 PolarHBondContact O-N 2.91Å; Y543-F546 PolarHBondContact O-N 2.79Å; Y543-L547 HydrophobicContact CD1-CD1 4.38Å; Y543-L547 HydrophobicContact CD2-CD1 4.02Å; Y543-L547 HydrophobicContact CD2-CG 4.09Å; Y543-L547 HydrophobicContact CE1-CD1 3.97Å; Y543-L547 HydrophobicContact CE2-CD1 3.58Å; Y543-L547 HydrophobicContact CE2-CD2 4.06Å; Y543-L547 HydrophobicContact CE2-CG 3.79Å; Y543-L547 HydrophobicContact CG-CD1 4.41Å; Y543-L547 VanDerWaalsContact O-CG 3.31Å; Y543-L547 WeakPolarHBondContact O-CG 3.45Å; Y543-L547 PolarHBondContact O-N 2.89Å; Y543-A559 HydrophobicContact CD1-CB 3.41Å; Y543-A559 VanDerWaalsContact CD1-CB 3.41Å; Y543-A559 HydrophobicContact CE1-CB 3.35Å; Y543-A559 HydrophobicContact CG-CB 4.4Å
544	A	86.6	Confident	84.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-67.2	-35.8	177.5	0	0	0	0	0	112.8	V540 I541 N542 E548 S556 F560	V540-A544 VanDerWaalsContact O-CB 3.31Å; V540-A544 WeakPolarHBondContact O-CB 3.27Å; V540-A544 PolarHBondContact O-N 3.44Å; I541-A544 PolarHBondContact O-N 3.47Å; N542-A544 VanDerWaalsContact C-N 3.29Å; N542-A544 PolarHBondContact O-N 2.8Å; A544-E548 VanDerWaalsContact O-CG 3.3Å; A544-E548 WeakPolarHBondContact O-CG 3.41Å; A544-E548 PolarHBondContact O-N 3.4Å; A544-S556 WeakPolarHBondContact CB-OG 3.3Å; A544-S556 PolarHBondContact O-OG 3.01Å; A544-F560 HydrophobicContact CB-CD1 4.12Å; A544-F560 HydrophobicContact CB-CD2 3.93Å; A544-F560 HydrophobicContact CB-CE1 3.57Å; A544-F560 HydrophobicContact CB-CE2 3.36Å; A544-F560 HydrophobicContact CB-CG 4.29Å; A544-F560 HydrophobicContact CB-CZ 3.16Å
545	A	87.2	Confident	84.6	Confident	30 Å²	30	51.4 Å²	51.4	25%	0.248	25%	0.253	C	S	.	.	H	α-helix	trans	-67	-44	173.4	0	0	0	0	0	111.6	I541 N542 Y543 L547 E548 E549	I541-A545 WeakPolarHBondContact O-CB 3.35Å; I541-A545 PolarHBondContact O-N 3.26Å; N542-A545 WeakPolarHBondContact O-CB 3.08Å; N542-A545 PolarHBondContact O-N 3.5Å; N542-A545 VanDerWaalsContact O-N 3.11Å; Y543-A545 PolarHBondContact O-N 2.91Å; A545-L547 VanDerWaalsContact C-N 3.29Å; A545-L547 PolarHBondContact O-N 3.42Å; A545-E548 WeakPolarHBondContact O-CA 3.48Å; A545-E548 WeakPolarHBondContact O-CB 3.36Å; A545-E548 PolarHBondContact O-N 2.86Å; A545-E549 WeakPolarHBondContact O-CG 3.31Å; A545-E549 PolarHBondContact O-N 2.83Å
546	F	85.6	Confident	85.2	Confident	25 Å²	25	51.1 Å²	51.1	11%	0.11	25%	0.251	C	S	.	.	H	α-helix	trans	-58.5	-41.2	174.8	176.7	-98.4	0	0	0	111.8	E514 F519 C522 N542 Y543 N550	E514-F546 HydrophobicContact CG-CD2 4.22Å; F519-F546 AromaticContact CD2-CE1 3.84Å; F519-F546 HydrophobicContact CD2-CE1 3.84Å; F519-F546 HydrophobicContact CD2-CZ 4.23Å; F519-F546 HydrophobicContact CE2-CE1 4.12Å; C522-F546 HydrophobicContact CB-CD1 4.47Å; C522-F546 HydrophobicContact CB-CE1 3.61Å; C522-F546 HydrophobicContact CB-CE2 4.43Å; C522-F546 HydrophobicContact CB-CZ 3.58Å; N542-F546 WeakPolarHBondContact O-CB 3.37Å; N542-F546 PolarHBondContact O-N 3.45Å; Y543-F546 PolarHBondContact O-N 2.79Å; F546-N550 WeakPolarHBondContact CE1-ND2 3.49Å; F546-N550 VanDerWaalsContact CZ-ND2 3.3Å; F546-N550 WeakPolarHBondContact CZ-ND2 3.31Å; F546-N550 PolarHBondContact O-N 3.23Å; F546-N550 PolarHBondContact O-ND2 3.28Å
547	L	87.4	Confident	85.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-68.5	-34	175.1	-69.3	174.1	0	0	0	112.6	F519 Y543 A545 K551 H552 E555 A559	F519-L547 HydrophobicContact CE2-CD2 3.73Å; F519-L547 HydrophobicContact CZ-CD2 3.68Å; Y543-L547 HydrophobicContact CD1-CD1 4.38Å; Y543-L547 HydrophobicContact CD2-CD1 4.02Å; Y543-L547 HydrophobicContact CD2-CG 4.09Å; Y543-L547 HydrophobicContact CE1-CD1 3.97Å; Y543-L547 HydrophobicContact CE2-CD1 3.58Å; Y543-L547 HydrophobicContact CE2-CD2 4.06Å; Y543-L547 HydrophobicContact CE2-CG 3.79Å; Y543-L547 HydrophobicContact CG-CD1 4.41Å; Y543-L547 VanDerWaalsContact O-CG 3.31Å; Y543-L547 WeakPolarHBondContact O-CG 3.45Å; Y543-L547 PolarHBondContact O-N 2.89Å; A545-L547 VanDerWaalsContact C-N 3.29Å; A545-L547 PolarHBondContact O-N 3.42Å; L547-K551 PolarHBondContact O-N 3.15Å; L547-H552 HydrophobicContact CD2-CB 4.46Å; L547-H552 PolarHBondContact O-N 3.16Å; L547-E555 HydrophobicContact CD1-CB 4.01Å; L547-E555 HydrophobicContact CD2-CB 4.29Å; L547-A559 HydrophobicContact CD1-CB 3.96Å
548	E	85.2	Confident	85.4	Confident	47 Å²	47	53.2 Å²	53.2	22%	0.22	25%	0.253	C	S	.	.	H	α-helix	trans	-67.7	-43.2	174.7	-78.5	175.2	167.9	0	0	112.6	A544 A545 N550 K551 F553 K582	A544-E548 VanDerWaalsContact O-CG 3.3Å; A544-E548 WeakPolarHBondContact O-CG 3.41Å; A544-E548 PolarHBondContact O-N 3.4Å; A545-E548 WeakPolarHBondContact O-CA 3.48Å; A545-E548 WeakPolarHBondContact O-CB 3.36Å; A545-E548 PolarHBondContact O-N 2.86Å; E548-N550 PolarHBondContact O-N 3.18Å; E548-K551 WeakPolarHBondContact O-CA 3.45Å; E548-K551 PolarHBondContact O-N 3.33Å; E548-F553 HydrophobicContact CB-CE1 4.38Å; E548-F553 HydrophobicContact CG-CD1 4.08Å; E548-F553 HydrophobicContact CG-CE1 4.33Å; E548-K582 VanDerWaalsContact CD-NZ 3.35Å; E548-K582 WeakPolarHBondContact OE1-CD 3.33Å; E548-K582 IonicContact OE1-NZ 3.38Å; E548-K582 PolarHBondContact OE1-NZ 3.49Å; E548-K582 WeakPolarHBondContact OE2-CE 3.4Å; E548-K582 IonicContact OE2-NZ 3.2Å; E548-K582 PolarHBondContact OE2-NZ 3.38Å
549	E	87	Confident	85.5	Confident	153 Å²	153	48 Å²	48	72%	0.715	23%	0.228	S	C	*	.	H	α-helix	trans	-59.7	-38.7	176.3	-72.4	-179.8	178.7	0	0	111.3	A545 K551	A545-E549 WeakPolarHBondContact O-CG 3.31Å; A545-E549 PolarHBondContact O-N 2.83Å; E549-K551 PolarHBondContact O-N 2.96Å
550	N	84.2	Confident	85.5	Confident	65 Å²	65	47.5 Å²	47.5	35%	0.348	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	6.3	175.3	-67	-55.2	0	0	0	114.2	F519 F546 E548 H552	F519-N550 HydrophobicContact CD2-CB 3.8Å; F519-N550 WeakPolarHBondContact CD2-ND2 3.18Å; F519-N550 HydrophobicContact CE2-CB 3.6Å; F546-N550 WeakPolarHBondContact CE1-ND2 3.49Å; F546-N550 VanDerWaalsContact CZ-ND2 3.3Å; F546-N550 WeakPolarHBondContact CZ-ND2 3.31Å; F546-N550 PolarHBondContact O-N 3.23Å; F546-N550 PolarHBondContact O-ND2 3.28Å; E548-N550 PolarHBondContact O-N 3.18Å; N550-H552 PolarHBondContact O-CD2 3.41Å; N550-H552 VanDerWaalsContact O-CD2 3.27Å; N550-H552 PolarHBondContact O-N 2.98Å
551	K	81.9	Confident	85.4	Confident	165 Å²	165	51 Å²	51	72%	0.717	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.3	17.1	179.6	-53.7	174	-177.2	172.7	0	115.2	L547 E548 E549 F553	L547-K551 PolarHBondContact O-N 3.15Å; E548-K551 WeakPolarHBondContact O-CA 3.45Å; E548-K551 PolarHBondContact O-N 3.33Å; E549-K551 PolarHBondContact O-N 2.96Å; K551-F553 VanDerWaalsContact CA-CE2 3.45Å; K551-F553 HydrophobicContact CB-CE2 3.76Å; K551-F553 HydrophobicContact CB-CZ 4.28Å; K551-F553 HydrophobicContact CG-CE2 4.36Å; K551-F553 HydrophobicContact CG-CZ 4.48Å; K551-F553 WeakPolarHBondContact O-CD2 3.49Å; K551-F553 VanDerWaalsContact O-CE2 3.31Å; K551-F553 WeakPolarHBondContact O-CE2 3.34Å; K551-F553 PolarHBondContact O-N 2.88Å
552	H	82.8	Confident	85.3	Confident	80 Å²	80	53.6 Å²	53.6	37%	0.37	25%	0.252	S	S	.	.			trans	-92.4	68.9	174.9	-68.6	-73.3	0	0	0	111.2	F519 L547 N550 E554 E555 S556	F519-H552 AromaticContact CE1-CD2 3.69Å; F519-H552 AromaticContact CE1-NE2 3.77Å; F519-H552 AromaticContact CE2-CD2 3.49Å; F519-H552 VanDerWaalsContact CE2-CD2 3.49Å; F519-H552 WeakPolarHBondContact CE2-CD2 3.12Å; F519-H552 HydrophobicContact CZ-CB 4.14Å; F519-H552 AromaticContact CZ-CD2 3.11Å; F519-H552 WeakPolarHBondContact CZ-CD2 3.31Å; F519-H552 AromaticContact CZ-CG 3.68Å; F519-H552 AromaticContact CZ-NE2 3.7Å; L547-H552 HydrophobicContact CD2-CB 4.46Å; L547-H552 PolarHBondContact O-N 3.16Å; N550-H552 PolarHBondContact O-CD2 3.41Å; N550-H552 VanDerWaalsContact O-CD2 3.27Å; N550-H552 PolarHBondContact O-N 2.98Å; H552-E554 PolarHBondContact O-N 3.45Å; H552-E555 HydrophobicContact CB-CB 4.2Å; H552-E555 HydrophobicContact CB-CG 4.17Å; H552-E555 PolarHBondContact O-N 2.9Å; H552-S556 PolarHBondContact O-N 3.38Å
553	F	81.7	Confident	85.1	Confident	53 Å²	53	51.1 Å²	51.1	23%	0.232	24%	0.239	C	C	.	.	H	α-helix	trans	-69.9	-35.6	-172.1	-55.7	-83.9	0	0	0	113.9	E548 K551 E555 S556 F557	E548-F553 HydrophobicContact CB-CE1 4.38Å; E548-F553 HydrophobicContact CG-CD1 4.08Å; E548-F553 HydrophobicContact CG-CE1 4.33Å; K551-F553 VanDerWaalsContact CA-CE2 3.45Å; K551-F553 HydrophobicContact CB-CE2 3.76Å; K551-F553 HydrophobicContact CB-CZ 4.28Å; K551-F553 HydrophobicContact CG-CE2 4.36Å; K551-F553 HydrophobicContact CG-CZ 4.48Å; K551-F553 WeakPolarHBondContact O-CD2 3.49Å; K551-F553 VanDerWaalsContact O-CE2 3.31Å; K551-F553 WeakPolarHBondContact O-CE2 3.34Å; K551-F553 PolarHBondContact O-N 2.88Å; F553-E555 VanDerWaalsContact C-N 3.27Å; F553-E555 PolarHBondContact O-N 2.79Å; F553-S556 WeakPolarHBondContact O-CB 2.86Å; F553-S556 PolarHBondContact O-N 3.45Å; F553-F557 HydrophobicContact CB-CE2 4.28Å; F553-F557 WeakPolarHBondContact O-CD2 3.49Å; F553-F557 VanDerWaalsContact O-CG 3.27Å; F553-F557 WeakPolarHBondContact O-CG 3.34Å; F553-F557 PolarHBondContact O-N 3.08Å
554	E	83.5	Confident	85	Confident	116 Å²	116	52 Å²	52	54%	0.542	25%	0.245	S	C	.	.	H	α-helix	trans	-65.7	-34.8	176.1	-64.1	-167.5	163.7	0	0	111.8	H552 F557 K558	H552-E554 PolarHBondContact O-N 3.45Å; E554-F557 PolarHBondContact O-N 2.86Å; E554-K558 WeakPolarHBondContact O-CG 3.45Å; E554-K558 PolarHBondContact O-N 3.45Å
555	E	85	Confident	84.8	Confident	51 Å²	51	56.2 Å²	56.2	24%	0.238	28%	0.28	C	S	.	.	H	α-helix	trans	-71.9	-37	175	-53.7	-164.2	152.8	0	0	111.2	K523 L547 H552 F553 F557 K558 A559	K523-E555 WeakPolarHBondContact CE-OE2 3.02Å; K523-E555 IonicContact NZ-OE1 3.15Å; K523-E555 PolarHBondContact NZ-OE1 3.46Å; K523-E555 IonicContact NZ-OE2 3.37Å; K523-E555 PolarHBondContact NZ-OE2 3.19Å; L547-E555 HydrophobicContact CD1-CB 4.01Å; L547-E555 HydrophobicContact CD2-CB 4.29Å; H552-E555 HydrophobicContact CB-CB 4.2Å; H552-E555 HydrophobicContact CB-CG 4.17Å; H552-E555 PolarHBondContact O-N 2.9Å; F553-E555 VanDerWaalsContact C-N 3.27Å; F553-E555 PolarHBondContact O-N 2.79Å; E555-F557 VanDerWaalsContact C-N 3.31Å; E555-F557 PolarHBondContact O-N 3.48Å; E555-K558 CarbonylContact O-C 3.59Å; E555-K558 PolarHBondContact O-N 3.21Å; E555-A559 WeakPolarHBondContact O-CB 3.33Å; E555-A559 PolarHBondContact O-N 3.19Å
556	S	86.6	Confident	84.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-43.7	172.8	-175.5	0	0	0	0	111.3	A544 H552 F553 A559 F560	A544-S556 WeakPolarHBondContact CB-OG 3.3Å; A544-S556 PolarHBondContact O-OG 3.01Å; H552-S556 PolarHBondContact O-N 3.38Å; F553-S556 WeakPolarHBondContact O-CB 2.86Å; F553-S556 PolarHBondContact O-N 3.45Å; S556-A559 WeakPolarHBondContact O-CB 3.04Å; S556-A559 PolarHBondContact O-N 3.08Å; S556-F560 WeakPolarHBondContact O-CD2 3.31Å; S556-F560 PolarHBondContact O-N 3.43Å
557	F	85.5	Confident	84.2	Confident	2 Å²	2	58 Å²	58	1%	0.009	28%	0.284	C	S	.	.	H	α-helix	trans	-66.6	-40	175.3	-59.3	-38.7	0	0	0	112.7	F553 E554 E555 A559 F560 E561 Y579 F583 Y587	F553-F557 HydrophobicContact CB-CE2 4.28Å; F553-F557 WeakPolarHBondContact O-CD2 3.49Å; F553-F557 VanDerWaalsContact O-CG 3.27Å; F553-F557 WeakPolarHBondContact O-CG 3.34Å; F553-F557 PolarHBondContact O-N 3.08Å; E554-F557 PolarHBondContact O-N 2.86Å; E555-F557 VanDerWaalsContact C-N 3.31Å; E555-F557 PolarHBondContact O-N 3.48Å; F557-A559 VanDerWaalsContact C-N 3.27Å; F557-A559 PolarHBondContact O-N 3.44Å; F557-F560 HydrophobicContact CD1-CD2 4.37Å; F557-F560 PolarHBondContact O-N 3.32Å; F557-E561 WeakPolarHBondContact O-CG 3.39Å; F557-E561 PolarHBondContact O-N 3.37Å; F557-Y579 HydrophobicContact CB-CE2 3.76Å; F557-Y579 AromaticContact CD1-CD2 3.7Å; F557-Y579 HydrophobicContact CD1-CD2 3.7Å; F557-Y579 AromaticContact CD1-CE2 3.26Å; F557-Y579 HydrophobicContact CD1-CE2 3.26Å; F557-Y579 HydrophobicContact CE1-CD2 4.26Å; F557-Y579 HydrophobicContact CE1-CE2 4.04Å; F557-Y579 AromaticContact CG-CE2 3.77Å; F557-Y579 HydrophobicContact CG-CE2 3.77Å; F557-F583 HydrophobicContact CD1-CD2 4.16Å; F557-F583 HydrophobicContact CD2-CD2 4.27Å; F557-F583 HydrophobicContact CD2-CE2 4.33Å; F557-F583 HydrophobicContact CE1-CB 4.2Å; F557-F583 AromaticContact CE1-CD2 3.81Å; F557-F583 HydrophobicContact CE1-CD2 3.81Å; F557-F583 HydrophobicContact CE1-CG 4.45Å; F557-F583 HydrophobicContact CE2-CD2 4.03Å; F557-F583 HydrophobicContact CE2-CE2 4.22Å; F557-F583 HydrophobicContact CG-CD2 4.32Å; F557-F583 HydrophobicContact CZ-CB 4.48Å; F557-F583 AromaticContact CZ-CD2 3.74Å; F557-F583 HydrophobicContact CZ-CD2 3.74Å; F557-F583 HydrophobicContact CZ-CE2 4.37Å; F557-F583 HydrophobicContact CZ-CG 4.41Å; F557-Y587 HydrophobicContact CE2-CD2 4.5Å; F557-Y587 AromaticContact CE2-CE2 3.68Å; F557-Y587 HydrophobicContact CE2-CE2 3.68Å; F557-Y587 HydrophobicContact CZ-CE2 4.18Å
558	K	85.9	Confident	83.8	Confident	121 Å²	121	62.7 Å²	62.7	53%	0.526	31%	0.314	S	S	.	.	H	α-helix	trans	-61.6	-35.6	170.8	-71.6	175.1	-176.2	178.9	0	112.2	E554 E555 E561 K562	E554-K558 WeakPolarHBondContact O-CG 3.45Å; E554-K558 PolarHBondContact O-N 3.45Å; E555-K558 CarbonylContact O-C 3.59Å; E555-K558 PolarHBondContact O-N 3.21Å; K558-E561 PolarHBondContact O-N 2.89Å; K558-K562 WeakPolarHBondContact O-CB 3.41Å; K558-K562 VanDerWaalsContact O-CG 3.27Å; K558-K562 WeakPolarHBondContact O-CG 3.48Å; K558-K562 PolarHBondContact O-N 3.39Å
559	A	85.8	Confident	83.1	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-65.9	-40.9	175.7	0	0	0	0	0	111.5	Y543 L547 E555 S556 F557 G563	Y543-A559 HydrophobicContact CD1-CB 3.41Å; Y543-A559 VanDerWaalsContact CD1-CB 3.41Å; Y543-A559 HydrophobicContact CE1-CB 3.35Å; Y543-A559 HydrophobicContact CG-CB 4.4Å; L547-A559 HydrophobicContact CD1-CB 3.96Å; E555-A559 WeakPolarHBondContact O-CB 3.33Å; E555-A559 PolarHBondContact O-N 3.19Å; S556-A559 WeakPolarHBondContact O-CB 3.04Å; S556-A559 PolarHBondContact O-N 3.08Å; F557-A559 VanDerWaalsContact C-N 3.27Å; F557-A559 PolarHBondContact O-N 3.44Å; A559-G563 PolarHBondContact O-N 3.25Å
560	F	85.5	Confident	82.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.5	-45.3	172.3	-73.8	-59.3	0	0	0	112.2	V540 A544 S556 F557 K562 G563 V564 I575 Y579 K582	V540-F560 HydrophobicContact CG1-CD1 4.38Å; A544-F560 HydrophobicContact CB-CD1 4.12Å; A544-F560 HydrophobicContact CB-CD2 3.93Å; A544-F560 HydrophobicContact CB-CE1 3.57Å; A544-F560 HydrophobicContact CB-CE2 3.36Å; A544-F560 HydrophobicContact CB-CG 4.29Å; A544-F560 HydrophobicContact CB-CZ 3.16Å; S556-F560 WeakPolarHBondContact O-CD2 3.31Å; S556-F560 PolarHBondContact O-N 3.43Å; F557-F560 HydrophobicContact CD1-CD2 4.37Å; F557-F560 PolarHBondContact O-N 3.32Å; F560-K562 PolarHBondContact O-N 2.96Å; F560-G563 CarbonylContact O-C 3.57Å; F560-G563 WeakPolarHBondContact O-CA 3.17Å; F560-G563 PolarHBondContact O-N 3.49Å; F560-G563 VanDerWaalsContact O-N 3.08Å; F560-V564 WeakPolarHBondContact O-CG2 3.27Å; F560-V564 PolarHBondContact O-N 3.29Å; F560-I575 HydrophobicContact CD1-CG2 3.77Å; F560-I575 HydrophobicContact CE1-CG2 4.49Å; F560-Y579 HydrophobicContact CB-CD1 4.21Å; F560-Y579 HydrophobicContact CB-CD2 3.68Å; F560-Y579 HydrophobicContact CB-CE2 4.19Å; F560-Y579 HydrophobicContact CB-CG 3.71Å; F560-Y579 AromaticContact CD2-CD2 3.51Å; F560-Y579 HydrophobicContact CD2-CD2 3.51Å; F560-Y579 HydrophobicContact CD2-CE2 4.3Å; F560-Y579 HydrophobicContact CD2-CG 4.09Å; F560-Y579 HydrophobicContact CE2-CD2 4.31Å; F560-Y579 AromaticContact CG-CD2 3.79Å; F560-Y579 HydrophobicContact CG-CD2 3.79Å; F560-Y579 AromaticContact CG-CG 3.94Å; F560-Y579 HydrophobicContact CG-CG 3.94Å; F560-K582 HydrophobicContact CE2-CD 3.78Å; F560-K582 HydrophobicContact CZ-CD 3.6Å
561	E	86	Confident	82.1	Confident	76 Å²	76	60.1 Å²	60.1	36%	0.355	31%	0.308	S	S	.	.	H	α-helix	trans	-60.4	-44.9	176.4	-71.7	168.3	-173.5	0	0	111.6	F557 K558 G563 V564 A565 Y579 R594	F557-E561 WeakPolarHBondContact O-CG 3.39Å; F557-E561 PolarHBondContact O-N 3.37Å; K558-E561 PolarHBondContact O-N 2.89Å; E561-G563 VanDerWaalsContact C-N 3.31Å; E561-G563 PolarHBondContact O-N 3.3Å; E561-V564 PolarHBondContact O-N 3Å; E561-A565 PolarHBondContact O-N 2.87Å; E561-A565 VanDerWaalsContact O-N 3.08Å; E561-Y579 HydrophobicContact CG-CE1 4.48Å; E561-Y579 PolarHBondContact OE1-OH 2.96Å; E561-R594 IonicContact OE1-NH2 3.7Å
562	K	84.7	Confident	82	Confident	84 Å²	84	52.3 Å²	52.3	37%	0.365	27%	0.274	S	S	.	.	H	α-helix	trans	-59.6	-42	171.6	-74.6	-179.9	-179.4	-171.4	0	111.4	E527 L530 K558 F560 A565 L566	E527-K562 IonicContact OE1-NZ 2.62Å; E527-K562 PolarHBondContact OE1-NZ 3.39Å; L530-K562 HydrophobicContact CD1-CB 4.34Å; L530-K562 HydrophobicContact CD1-CD 4.35Å; K558-K562 WeakPolarHBondContact O-CB 3.41Å; K558-K562 VanDerWaalsContact O-CG 3.27Å; K558-K562 WeakPolarHBondContact O-CG 3.48Å; K558-K562 PolarHBondContact O-N 3.39Å; F560-K562 PolarHBondContact O-N 2.96Å; K562-A565 PolarHBondContact O-N 3.05Å; K562-L566 WeakPolarHBondContact O-CG 3.28Å; K562-L566 PolarHBondContact O-N 2.86Å
563	G	83.9	Confident	81.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-44.6	177.9	0	0	0	0	0	112.9	A559 F560 E561 A565 L566 F567	A559-G563 PolarHBondContact O-N 3.25Å; F560-G563 CarbonylContact O-C 3.57Å; F560-G563 WeakPolarHBondContact O-CA 3.17Å; F560-G563 PolarHBondContact O-N 3.49Å; F560-G563 VanDerWaalsContact O-N 3.08Å; E561-G563 VanDerWaalsContact C-N 3.31Å; E561-G563 PolarHBondContact O-N 3.3Å; G563-A565 VanDerWaalsContact C-N 3.31Å; G563-A565 PolarHBondContact O-N 3.04Å; G563-L566 PolarHBondContact O-N 2.87Å; G563-F567 WeakPolarHBondContact O-CD2 3.44Å; G563-F567 PolarHBondContact O-N 3.18Å
564	V	82.7	Confident	81.8	Confident	24 Å²	24	49.3 Å²	49.3	15%	0.145	28%	0.275	C	S	.	.	H	α-helix	trans	-60.4	-42.2	176.7	168	0	0	0	0	110.9	F560 E561 L566 V572 I575 W576	F560-V564 WeakPolarHBondContact O-CG2 3.27Å; F560-V564 PolarHBondContact O-N 3.29Å; E561-V564 PolarHBondContact O-N 3Å; V564-L566 PolarHBondContact O-N 3Å; V564-V572 HydrophobicContact CB-CG1 4.3Å; V564-V572 HydrophobicContact CG1-CG1 3.88Å; V564-V572 HydrophobicContact CG2-CG1 4.11Å; V564-I575 HydrophobicContact CG2-CG2 3.94Å; V564-W576 HydrophobicContact CB-CZ2 4.32Å; V564-W576 HydrophobicContact CG1-CH2 4.45Å; V564-W576 HydrophobicContact CG1-CZ2 3.48Å; V564-W576 VanDerWaalsContact CG1-CZ2 3.48Å; V564-W576 HydrophobicContact CG2-CD2 3.97Å; V564-W576 HydrophobicContact CG2-CG 4.38Å; V564-W576 HydrophobicContact CG2-CZ2 4.05Å
565	A	83.3	Confident	81.9	Confident	88 Å²	88	43.8 Å²	43.8	73%	0.727	25%	0.249	S	C	*	.	H	α-helix	trans	-65.3	-19	-180	0	0	0	0	0	114.1	E561 K562 G563	E561-A565 PolarHBondContact O-N 2.87Å; E561-A565 VanDerWaalsContact O-N 3.08Å; K562-A565 PolarHBondContact O-N 3.05Å; G563-A565 VanDerWaalsContact C-N 3.31Å; G563-A565 PolarHBondContact O-N 3.04Å
566	L	81.3	Confident	82	Confident	55 Å²	55	41.7 Å²	41.7	29%	0.288	24%	0.239	S	C	.	.	H	α-helix	trans	-91.4	-34.5	-176.8	-71.3	173	0	0	0	113.7	L530 R533 K562 G563 V564	L530-L566 HydrophobicContact CB-CD1 4.12Å; L530-L566 HydrophobicContact CD2-CD1 3.61Å; L530-L566 HydrophobicContact CG-CD1 4.49Å; R533-L566 HydrophobicContact CB-CD2 4.32Å; R533-L566 HydrophobicContact CG-CD2 3.73Å; K562-L566 WeakPolarHBondContact O-CG 3.28Å; K562-L566 PolarHBondContact O-N 2.86Å; G563-L566 PolarHBondContact O-N 2.87Å; V564-L566 PolarHBondContact O-N 3Å
567	F	78.5	Confident	81.8	Confident	38 Å²	38	45.6 Å²	45.6	17%	0.167	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-98.6	146.4	-174.6	-59.5	-71.4	0	0	0	111.8	A535 P537 V540 G563 V572 I575	A535-F567 HydrophobicContact CB-CZ 4.21Å; A535-F567 WeakPolarHBondContact O-CE1 3.48Å; A535-F567 WeakPolarHBondContact O-CZ 3.39Å; P537-F567 HydrophobicContact CG-CD1 4.45Å; P537-F567 HydrophobicContact CG-CD2 4.48Å; P537-F567 HydrophobicContact CG-CE1 4.24Å; P537-F567 HydrophobicContact CG-CE2 4.28Å; P537-F567 HydrophobicContact CG-CZ 4.16Å; V540-F567 HydrophobicContact CG2-CE2 3.84Å; V540-F567 HydrophobicContact CG2-CZ 4.4Å; G563-F567 WeakPolarHBondContact O-CD2 3.44Å; G563-F567 PolarHBondContact O-N 3.18Å; F567-V572 HydrophobicContact CB-CG2 3.55Å; F567-V572 WeakPolarHBondContact O-CG2 3.42Å; F567-I575 HydrophobicContact CD2-CD1 3.33Å; F567-I575 HydrophobicContact CE2-CD1 3.63Å; F567-I575 HydrophobicContact CG-CD1 4.38Å
568	P	78.5	Confident	81.8	Confident	97 Å²	97	47.2 Å²	47.2	63%	0.63	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-85	159.1	162.6	32.9	-32.5	0	0	0	111.4	N571 V572	P568-N571 PolarHBondContact O-N 3.48Å; P568-V572 WeakPolarHBondContact O-CG2 3.38Å
569	W	70.2	Confident	81.8	Confident	47 Å²	47	41.5 Å²	41.5	18%	0.178	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	134.8	166.7	-65.2	91.2	0	0	0	109.2	V572 W576 S605 C606 P607 L614	W569-V572 HydrophobicContact CD2-CB 4.35Å; W569-W576 AromaticContact CH2-CD1 3.57Å; W569-W576 AromaticContact CZ2-CD1 3.66Å; W569-W576 AromaticContact CZ2-NE1 3.88Å; W569-S605 VanDerWaalsContact NE1-C 3.26Å; W569-S605 PolarHBondContact NE1-O 2.97Å; W569-C606 HydrophobicContact CH2-CB 4.34Å; W569-C606 WeakPolarHBondContact CH2-SG 3.19Å; W569-C606 HydrophobicContact CZ2-CB 4.23Å; W569-C606 WeakPolarHBondContact CZ2-SG 3.5Å; W569-P607 HydrophobicContact CB-CG 3.59Å; W569-P607 HydrophobicContact CD2-CG 4.25Å; W569-P607 HydrophobicContact CG-CG 3.76Å; W569-L614 HydrophobicContact CH2-CD1 3.87Å; W569-L614 HydrophobicContact CZ3-CD1 4.23Å
570	P	76.8	Confident	81.7	Confident	73 Å²	73	41.6 Å²	41.6	47%	0.474	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	cis	-97	-15.3	23.9	-11.4	31.9	0	0	0	116.6	V572 G573 Y610	P570-V572 PolarHBondContact O-N 2.99Å; P570-G573 PolarHBondContact O-N 2.79Å; P570-Y610 HydrophobicContact CB-CE2 3.98Å; P570-Y610 HydrophobicContact CG-CE2 4.5Å
571	N	73.7	Confident	81.7	Confident	91 Å²	91	43.9 Å²	43.9	49%	0.487	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-31.1	-171.8	-71.4	-21.2	0	0	0	112.9	P537 P568 G573 A574	P537-N571 HydrophobicContact CG-CB 3.87Å; P568-N571 PolarHBondContact O-N 3.48Å; N571-G573 PolarHBondContact O-N 3.19Å; N571-A574 PolarHBondContact O-N 3.16Å
572	V	81.2	Confident	81.5	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.012	25%	0.245	C	C	.	.	H	α-helix	trans	-59.4	-31.4	174.7	-171.6	0	0	0	0	111.1	V564 F567 P568 W569 P570 A574 I575 W576	V564-V572 HydrophobicContact CB-CG1 4.3Å; V564-V572 HydrophobicContact CG1-CG1 3.88Å; V564-V572 HydrophobicContact CG2-CG1 4.11Å; F567-V572 HydrophobicContact CB-CG2 3.55Å; F567-V572 WeakPolarHBondContact O-CG2 3.42Å; P568-V572 WeakPolarHBondContact O-CG2 3.38Å; W569-V572 HydrophobicContact CD2-CB 4.35Å; P570-V572 PolarHBondContact O-N 2.99Å; V572-A574 PolarHBondContact O-N 3.28Å; V572-I575 CarbonylContact O-C 3.58Å; V572-I575 WeakPolarHBondContact O-CA 3.48Å; V572-I575 WeakPolarHBondContact O-CB 3.48Å; V572-I575 PolarHBondContact O-N 3.27Å; V572-W576 HydrophobicContact CG1-CG 4.21Å; V572-W576 PolarHBondContact O-N 2.99Å
573	G	79	Confident	81.5	Confident	17 Å²	17	38.3 Å²	38.3	18%	0.175	23%	0.228	C	C	.	.	H	α-helix	trans	-57.1	-36.4	-179	0	0	0	0	0	113.1	P570 N571 H577	P570-G573 PolarHBondContact O-N 2.79Å; N571-G573 PolarHBondContact O-N 3.19Å; G573-H577 WeakPolarHBondContact O-CB 3.45Å; G573-H577 PolarHBondContact O-N 3.32Å
574	A	81	Confident	81.2	Confident	53 Å²	53	39.7 Å²	39.7	44%	0.438	24%	0.236	S	C	.	.	H	α-helix	trans	-70.8	-39.2	175.4	0	0	0	0	0	112.3	N571 V572 H577 T578	N571-A574 PolarHBondContact O-N 3.16Å; V572-A574 PolarHBondContact O-N 3.28Å; A574-H577 PolarHBondContact O-N 2.8Å; A574-T578 WeakPolarHBondContact O-CG2 3.37Å; A574-T578 PolarHBondContact O-N 2.9Å; A574-T578 PolarHBondContact O-OG1 3.33Å
575	I	84.6	Confident	81.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.9	-47.7	176.8	-55.5	178.8	0	0	0	109.6	P537 V540 F560 V564 F567 V572 H577 T578 Y579	P537-I575 HydrophobicContact CB-CD1 3.99Å; P537-I575 HydrophobicContact CB-CG1 4Å; V540-I575 HydrophobicContact CG1-CG2 4.47Å; F560-I575 HydrophobicContact CD1-CG2 3.77Å; F560-I575 HydrophobicContact CE1-CG2 4.49Å; V564-I575 HydrophobicContact CG2-CG2 3.94Å; F567-I575 HydrophobicContact CD2-CD1 3.33Å; F567-I575 HydrophobicContact CE2-CD1 3.63Å; F567-I575 HydrophobicContact CG-CD1 4.38Å; V572-I575 CarbonylContact O-C 3.58Å; V572-I575 WeakPolarHBondContact O-CA 3.48Å; V572-I575 WeakPolarHBondContact O-CB 3.48Å; V572-I575 PolarHBondContact O-N 3.27Å; I575-H577 PolarHBondContact O-N 3.33Å; I575-T578 PolarHBondContact O-N 3.44Å; I575-T578 PolarHBondContact O-OG1 2.7Å; I575-Y579 WeakPolarHBondContact O-CB 3.22Å; I575-Y579 PolarHBondContact O-N 2.82Å
576	W	86.5	Confident	80.7	Confident	7 Å²	7	49.5 Å²	49.5	3%	0.027	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-46.7	174.8	-85.1	131.3	0	0	0	111.9	V564 W569 V572 T578 Y579 L580 Q601 C602	V564-W576 HydrophobicContact CB-CZ2 4.32Å; V564-W576 HydrophobicContact CG1-CH2 4.45Å; V564-W576 HydrophobicContact CG1-CZ2 3.48Å; V564-W576 VanDerWaalsContact CG1-CZ2 3.48Å; V564-W576 HydrophobicContact CG2-CD2 3.97Å; V564-W576 HydrophobicContact CG2-CG 4.38Å; V564-W576 HydrophobicContact CG2-CZ2 4.05Å; W569-W576 AromaticContact CH2-CD1 3.57Å; W569-W576 AromaticContact CZ2-CD1 3.66Å; W569-W576 AromaticContact CZ2-NE1 3.88Å; V572-W576 HydrophobicContact CG1-CG 4.21Å; V572-W576 PolarHBondContact O-N 2.99Å; W576-T578 VanDerWaalsContact C-N 3.34Å; W576-T578 PolarHBondContact O-N 2.7Å; W576-Y579 AromaticContact CE3-CD1 3.6Å; W576-Y579 HydrophobicContact CE3-CD1 3.6Å; W576-Y579 HydrophobicContact CE3-CE1 4.21Å; W576-Y579 HydrophobicContact CH2-CE1 4.41Å; W576-Y579 AromaticContact CZ3-CD1 3.5Å; W576-Y579 HydrophobicContact CZ3-CD1 3.5Å; W576-Y579 VanDerWaalsContact CZ3-CD1 3.5Å; W576-Y579 AromaticContact CZ3-CE1 3.61Å; W576-Y579 HydrophobicContact CZ3-CE1 3.61Å; W576-Y579 PolarHBondContact O-N 3.41Å; W576-L580 HydrophobicContact CB-CD1 4.47Å; W576-L580 HydrophobicContact CE3-CG 4.32Å; W576-L580 VanDerWaalsContact O-CB 3.25Å; W576-L580 WeakPolarHBondContact O-CB 3.26Å; W576-L580 WeakPolarHBondContact O-CD1 3.22Å; W576-L580 WeakPolarHBondContact O-CG 3.38Å; W576-L580 PolarHBondContact O-N 3.41Å; W576-Q601 HydrophobicContact CH2-CB 4.33Å; W576-C602 HydrophobicContact CD2-CB 3.88Å; W576-C602 HydrophobicContact CE3-CB 4.02Å; W576-C602 HydrophobicContact CG-CB 4.35Å; W576-C602 HydrophobicContact CH2-CB 4.26Å; W576-C602 HydrophobicContact CZ2-CB 4.08Å; W576-C602 HydrophobicContact CZ3-CB 4.2Å
577	H	84.1	Confident	80.4	Confident	82 Å²	82	48.3 Å²	48.3	38%	0.38	24%	0.243	S	C	.	.	H	α-helix	trans	-61.6	-43.8	-179.1	-170.8	64.6	0	0	0	111.8	G573 A574 I575 I581 L617	G573-H577 WeakPolarHBondContact O-CB 3.45Å; G573-H577 PolarHBondContact O-N 3.32Å; A574-H577 PolarHBondContact O-N 2.8Å; I575-H577 PolarHBondContact O-N 3.33Å; H577-I581 VanDerWaalsContact CE1-CD1 3.49Å; H577-I581 WeakPolarHBondContact CE1-CD1 3.16Å; H577-I581 VanDerWaalsContact NE2-CD1 3.28Å; H577-I581 WeakPolarHBondContact NE2-CD1 3.24Å; H577-I581 WeakPolarHBondContact O-CB 3.47Å; H577-I581 VanDerWaalsContact O-CG1 3.24Å; H577-I581 WeakPolarHBondContact O-CG1 3.2Å; H577-I581 PolarHBondContact O-N 3.31Å; H577-L617 WeakPolarHBondContact ND1-CD1 3.25Å
578	T	84.7	Confident	79.8	Confident	36 Å²	36	48.8 Å²	48.8	22%	0.221	26%	0.255	C	S	.	.	H	α-helix	trans	-68	-43.9	176.1	53.6	0	0	0	0	112	I541 A574 I575 W576 I581 K582	I541-T578 HydrophobicContact CD1-CG2 4.39Å; A574-T578 WeakPolarHBondContact O-CG2 3.37Å; A574-T578 PolarHBondContact O-N 2.9Å; A574-T578 PolarHBondContact O-OG1 3.33Å; I575-T578 PolarHBondContact O-N 3.44Å; I575-T578 PolarHBondContact O-OG1 2.7Å; W576-T578 VanDerWaalsContact C-N 3.34Å; W576-T578 PolarHBondContact O-N 2.7Å; T578-I581 PolarHBondContact O-N 3.46Å; T578-K582 VanDerWaalsContact O-CB 3.25Å; T578-K582 WeakPolarHBondContact O-CB 3.22Å; T578-K582 WeakPolarHBondContact O-CD 3.46Å; T578-K582 WeakPolarHBondContact O-CG 3.24Å; T578-K582 PolarHBondContact O-N 2.79Å
579	Y	85.7	Confident	79.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-49.3	176.9	176.8	-141.4	0	0	0	111.5	F557 F560 E561 I575 W576 K582 F583 L598	F557-Y579 HydrophobicContact CB-CE2 3.76Å; F557-Y579 AromaticContact CD1-CD2 3.7Å; F557-Y579 HydrophobicContact CD1-CD2 3.7Å; F557-Y579 AromaticContact CD1-CE2 3.26Å; F557-Y579 HydrophobicContact CD1-CE2 3.26Å; F557-Y579 HydrophobicContact CE1-CD2 4.26Å; F557-Y579 HydrophobicContact CE1-CE2 4.04Å; F557-Y579 AromaticContact CG-CE2 3.77Å; F557-Y579 HydrophobicContact CG-CE2 3.77Å; F560-Y579 HydrophobicContact CB-CD1 4.21Å; F560-Y579 HydrophobicContact CB-CD2 3.68Å; F560-Y579 HydrophobicContact CB-CE2 4.19Å; F560-Y579 HydrophobicContact CB-CG 3.71Å; F560-Y579 AromaticContact CD2-CD2 3.51Å; F560-Y579 HydrophobicContact CD2-CD2 3.51Å; F560-Y579 HydrophobicContact CD2-CE2 4.3Å; F560-Y579 HydrophobicContact CD2-CG 4.09Å; F560-Y579 HydrophobicContact CE2-CD2 4.31Å; F560-Y579 AromaticContact CG-CD2 3.79Å; F560-Y579 HydrophobicContact CG-CD2 3.79Å; F560-Y579 AromaticContact CG-CG 3.94Å; F560-Y579 HydrophobicContact CG-CG 3.94Å; E561-Y579 HydrophobicContact CG-CE1 4.48Å; E561-Y579 PolarHBondContact OE1-OH 2.96Å; I575-Y579 WeakPolarHBondContact O-CB 3.22Å; I575-Y579 PolarHBondContact O-N 2.82Å; W576-Y579 AromaticContact CE3-CD1 3.6Å; W576-Y579 HydrophobicContact CE3-CD1 3.6Å; W576-Y579 HydrophobicContact CE3-CE1 4.21Å; W576-Y579 HydrophobicContact CH2-CE1 4.41Å; W576-Y579 AromaticContact CZ3-CD1 3.5Å; W576-Y579 HydrophobicContact CZ3-CD1 3.5Å; W576-Y579 VanDerWaalsContact CZ3-CD1 3.5Å; W576-Y579 AromaticContact CZ3-CE1 3.61Å; W576-Y579 HydrophobicContact CZ3-CE1 3.61Å; W576-Y579 PolarHBondContact O-N 3.41Å; Y579-K582 PolarHBondContact O-N 2.92Å; Y579-F583 HydrophobicContact CE2-CD2 4.18Å; Y579-F583 VanDerWaalsContact O-CB 3.22Å; Y579-F583 WeakPolarHBondContact O-CB 3.3Å; Y579-F583 PolarHBondContact O-N 2.91Å; Y579-L598 HydrophobicContact CE1-CD1 4.03Å; Y579-L598 HydrophobicContact CE1-CD2 3.78Å; Y579-L598 HydrophobicContact CE1-CG 4.42Å; Y579-L598 WeakPolarHBondContact OH-CD1 3.15Å; Y579-L598 WeakPolarHBondContact OH-CD2 3.25Å
580	L	83.6	Confident	79.2	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-63.8	-46.2	179.3	-69.1	166.9	0	0	0	111.2	W576 K582 F583 L584 L598 F599 L614	W576-L580 HydrophobicContact CB-CD1 4.47Å; W576-L580 HydrophobicContact CE3-CG 4.32Å; W576-L580 VanDerWaalsContact O-CB 3.25Å; W576-L580 WeakPolarHBondContact O-CB 3.26Å; W576-L580 WeakPolarHBondContact O-CD1 3.22Å; W576-L580 WeakPolarHBondContact O-CG 3.38Å; W576-L580 PolarHBondContact O-N 3.41Å; L580-K582 PolarHBondContact O-N 3Å; L580-F583 PolarHBondContact O-N 3.07Å; L580-L584 WeakPolarHBondContact O-CB 3.41Å; L580-L584 WeakPolarHBondContact O-CG 3.17Å; L580-L584 PolarHBondContact O-N 2.91Å; L580-L598 HydrophobicContact CD2-CB 4.38Å; L580-F599 HydrophobicContact CB-CZ 4.48Å; L580-F599 HydrophobicContact CD1-CD1 3.97Å; L580-F599 HydrophobicContact CD1-CE1 3.62Å; L580-F599 HydrophobicContact CD1-CZ 4.26Å; L580-F599 HydrophobicContact CD2-CD1 4.06Å; L580-F599 HydrophobicContact CD2-CD2 4.28Å; L580-F599 HydrophobicContact CD2-CE1 3.93Å; L580-F599 HydrophobicContact CD2-CE2 4.12Å; L580-F599 HydrophobicContact CD2-CG 4.24Å; L580-F599 HydrophobicContact CD2-CZ 3.95Å; L580-F599 HydrophobicContact CG-CE1 4.26Å; L580-F599 HydrophobicContact CG-CZ 4.46Å; L580-L614 HydrophobicContact CD1-CD2 3.73Å
581	I	85.3	Confident	79.2	Confident	48 Å²	48	49.1 Å²	49.1	25%	0.246	26%	0.257	C	S	.	.	H	α-helix	trans	-61.5	-44.4	176.8	-71.3	170.9	0	0	0	111.3	H577 T578 L584 R585	H577-I581 VanDerWaalsContact CE1-CD1 3.49Å; H577-I581 WeakPolarHBondContact CE1-CD1 3.16Å; H577-I581 VanDerWaalsContact NE2-CD1 3.28Å; H577-I581 WeakPolarHBondContact NE2-CD1 3.24Å; H577-I581 WeakPolarHBondContact O-CB 3.47Å; H577-I581 VanDerWaalsContact O-CG1 3.24Å; H577-I581 WeakPolarHBondContact O-CG1 3.2Å; H577-I581 PolarHBondContact O-N 3.31Å; T578-I581 PolarHBondContact O-N 3.46Å; I581-L584 PolarHBondContact O-N 3.5Å; I581-R585 HydrophobicContact CG2-CG 4.47Å; I581-R585 WeakPolarHBondContact O-CG 3.38Å; I581-R585 PolarHBondContact O-N 3.07Å
582	K	82.7	Confident	79.4	Confident	40 Å²	40	46.6 Å²	46.6	17%	0.174	24%	0.243	C	C	.	.	H	α-helix	trans	-64.7	-41	178.7	-75.3	168.4	165.6	-138.5	0	111.3	E548 F560 T578 Y579 L580 R586	E548-K582 VanDerWaalsContact CD-NZ 3.35Å; E548-K582 WeakPolarHBondContact OE1-CD 3.33Å; E548-K582 IonicContact OE1-NZ 3.38Å; E548-K582 PolarHBondContact OE1-NZ 3.49Å; E548-K582 WeakPolarHBondContact OE2-CE 3.4Å; E548-K582 IonicContact OE2-NZ 3.2Å; E548-K582 PolarHBondContact OE2-NZ 3.38Å; F560-K582 HydrophobicContact CE2-CD 3.78Å; F560-K582 HydrophobicContact CZ-CD 3.6Å; T578-K582 VanDerWaalsContact O-CB 3.25Å; T578-K582 WeakPolarHBondContact O-CB 3.22Å; T578-K582 WeakPolarHBondContact O-CD 3.46Å; T578-K582 WeakPolarHBondContact O-CG 3.24Å; T578-K582 PolarHBondContact O-N 2.79Å; Y579-K582 PolarHBondContact O-N 2.92Å; L580-K582 PolarHBondContact O-N 3Å; K582-R586 PolarHBondContact O-N 3.02Å
583	F	83.2	Confident	79.3	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.009	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-44.5	176	-163.5	-79.5	0	0	0	111.5	F557 Y579 L580 R586 Y587 R594 I595 L598	F557-F583 HydrophobicContact CD1-CD2 4.16Å; F557-F583 HydrophobicContact CD2-CD2 4.27Å; F557-F583 HydrophobicContact CD2-CE2 4.33Å; F557-F583 HydrophobicContact CE1-CB 4.2Å; F557-F583 AromaticContact CE1-CD2 3.81Å; F557-F583 HydrophobicContact CE1-CD2 3.81Å; F557-F583 HydrophobicContact CE1-CG 4.45Å; F557-F583 HydrophobicContact CE2-CD2 4.03Å; F557-F583 HydrophobicContact CE2-CE2 4.22Å; F557-F583 HydrophobicContact CG-CD2 4.32Å; F557-F583 HydrophobicContact CZ-CB 4.48Å; F557-F583 AromaticContact CZ-CD2 3.74Å; F557-F583 HydrophobicContact CZ-CD2 3.74Å; F557-F583 HydrophobicContact CZ-CE2 4.37Å; F557-F583 HydrophobicContact CZ-CG 4.41Å; Y579-F583 HydrophobicContact CE2-CD2 4.18Å; Y579-F583 VanDerWaalsContact O-CB 3.22Å; Y579-F583 WeakPolarHBondContact O-CB 3.3Å; Y579-F583 PolarHBondContact O-N 2.91Å; L580-F583 PolarHBondContact O-N 3.07Å; F583-R586 PolarHBondContact O-N 3.31Å; F583-Y587 HydrophobicContact CD1-CD2 4.03Å; F583-Y587 HydrophobicContact CD2-CD2 4.17Å; F583-Y587 HydrophobicContact CD2-CE2 4.4Å; F583-Y587 AromaticContact CE1-CD2 3.58Å; F583-Y587 HydrophobicContact CE1-CD2 3.58Å; F583-Y587 HydrophobicContact CE1-CE2 4.42Å; F583-Y587 HydrophobicContact CE1-CG 4.15Å; F583-Y587 AromaticContact CE2-CD2 3.79Å; F583-Y587 HydrophobicContact CE2-CD2 3.79Å; F583-Y587 AromaticContact CE2-CE2 3.85Å; F583-Y587 HydrophobicContact CE2-CE2 3.85Å; F583-Y587 HydrophobicContact CG-CD2 4.29Å; F583-Y587 AromaticContact CZ-CD2 3.48Å; F583-Y587 HydrophobicContact CZ-CD2 3.48Å; F583-Y587 VanDerWaalsContact CZ-CD2 3.48Å; F583-Y587 AromaticContact CZ-CE2 3.87Å; F583-Y587 HydrophobicContact CZ-CE2 3.87Å; F583-Y587 HydrophobicContact CZ-CG 4.29Å; F583-Y587 PolarHBondContact O-N 2.85Å; F583-R594 HydrophobicContact CZ-CB 4.46Å; F583-R594 HydrophobicContact CZ-CG 3.92Å; F583-I595 HydrophobicContact CD1-CD1 4.22Å; F583-I595 HydrophobicContact CD1-CG1 3.58Å; F583-I595 HydrophobicContact CE1-CD1 4.03Å; F583-I595 HydrophobicContact CE1-CG1 3.29Å; F583-I595 HydrophobicContact CZ-CG1 4.45Å; F583-L598 HydrophobicContact CD1-CD1 4.38Å; F583-L598 HydrophobicContact CD2-CD1 3.8Å; F583-L598 HydrophobicContact CE1-CD1 4.42Å; F583-L598 HydrophobicContact CE2-CD1 3.81Å; F583-L598 HydrophobicContact CG-CD1 4.09Å; F583-L598 HydrophobicContact CZ-CD1 4.13Å
584	L	79.2	Confident	79.5	Confident	29 Å²	29	56.4 Å²	56.4	15%	0.152	28%	0.281	C	S	.	.	H	α-helix	trans	-63.9	-45.7	178.4	-72	171.6	0	0	0	112.7	L580 I581 R586 A588 I595 F599 V621	L580-L584 WeakPolarHBondContact O-CB 3.41Å; L580-L584 WeakPolarHBondContact O-CG 3.17Å; L580-L584 PolarHBondContact O-N 2.91Å; I581-L584 PolarHBondContact O-N 3.5Å; L584-R586 PolarHBondContact O-N 3.39Å; L584-A588 PolarHBondContact O-N 3.12Å; L584-A588 VanDerWaalsContact O-N 3.09Å; L584-I595 HydrophobicContact CD2-CD1 4.11Å; L584-I595 HydrophobicContact CD2-CG2 4.13Å; L584-F599 HydrophobicContact CD1-CZ 4.44Å; L584-V621 HydrophobicContact CD1-CG2 3.42Å; L584-V621 VanDerWaalsContact CD1-CG2 3.42Å; L584-V621 HydrophobicContact CD2-CB 4.18Å; L584-V621 HydrophobicContact CD2-CG1 3.67Å; L584-V621 HydrophobicContact CD2-CG2 3.35Å; L584-V621 HydrophobicContact CG-CG2 4.01Å
585	R	79.8	Confident	79.6	Confident	208 Å²	208	54 Å²	54	79%	0.785	26%	0.261	S	S	*	.	H	α-helix	trans	-58.8	-31.6	177.4	-77.4	-179	-175.9	175.7	2.8	112.7	I581	I581-R585 HydrophobicContact CG2-CG 4.47Å; I581-R585 WeakPolarHBondContact O-CG 3.38Å; I581-R585 PolarHBondContact O-N 3.07Å
586	R	76	Confident	79.6	Confident	110 Å²	110	56.4 Å²	56.4	42%	0.415	27%	0.27	S	S	.	.	H	α-helix	trans	-85.3	-48.7	-178.5	-173.7	-176.3	-179	86.3	-4.4	112.8	K582 F583 L584	K582-R586 PolarHBondContact O-N 3.02Å; F583-R586 PolarHBondContact O-N 3.31Å; L584-R586 PolarHBondContact O-N 3.39Å
587	Y	73.8	Confident	79.6	Confident	30 Å²	30	60.2 Å²	60.2	12%	0.118	29%	0.29	C	S	.	.	H	α-helix	trans	-96.8	-15.2	-167.1	-75.6	-66.6	0	0	0	115.2	F557 F583 G589 T590 K591	F557-Y587 HydrophobicContact CE2-CD2 4.5Å; F557-Y587 AromaticContact CE2-CE2 3.68Å; F557-Y587 HydrophobicContact CE2-CE2 3.68Å; F557-Y587 HydrophobicContact CZ-CE2 4.18Å; F583-Y587 HydrophobicContact CD1-CD2 4.03Å; F583-Y587 HydrophobicContact CD2-CD2 4.17Å; F583-Y587 HydrophobicContact CD2-CE2 4.4Å; F583-Y587 AromaticContact CE1-CD2 3.58Å; F583-Y587 HydrophobicContact CE1-CD2 3.58Å; F583-Y587 HydrophobicContact CE1-CE2 4.42Å; F583-Y587 HydrophobicContact CE1-CG 4.15Å; F583-Y587 AromaticContact CE2-CD2 3.79Å; F583-Y587 HydrophobicContact CE2-CD2 3.79Å; F583-Y587 AromaticContact CE2-CE2 3.85Å; F583-Y587 HydrophobicContact CE2-CE2 3.85Å; F583-Y587 HydrophobicContact CG-CD2 4.29Å; F583-Y587 AromaticContact CZ-CD2 3.48Å; F583-Y587 HydrophobicContact CZ-CD2 3.48Å; F583-Y587 VanDerWaalsContact CZ-CD2 3.48Å; F583-Y587 AromaticContact CZ-CE2 3.87Å; F583-Y587 HydrophobicContact CZ-CE2 3.87Å; F583-Y587 HydrophobicContact CZ-CG 4.29Å; F583-Y587 PolarHBondContact O-N 2.85Å; Y587-G589 PolarHBondContact O-N 3.16Å; Y587-T590 WeakPolarHBondContact CD1-OG1 3.38Å; Y587-T590 PolarHBondContact O-N 3.12Å; Y587-T590 PolarHBondContact O-OG1 3.49Å; Y587-K591 HydrophobicContact CD1-CD 4.24Å; Y587-K591 HydrophobicContact CD1-CG 4.42Å; Y587-K591 HydrophobicContact CE1-CD 4.09Å
588	A	65.5	Low	79.6	Confident	49 Å²	49	56.5 Å²	56.5	41%	0.405	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	23.4	47.9	164.7	0	0	0	0	0	116.5	L584 Y625	L584-A588 PolarHBondContact O-N 3.12Å; L584-A588 VanDerWaalsContact O-N 3.09Å; A588-Y625 HydrophobicContact CB-CE1 4.14Å; A588-Y625 WeakPolarHBondContact CB-OH 3.35Å; A588-Y625 WeakPolarHBondContact O-CD1 3.13Å; A588-Y625 WeakPolarHBondContact O-CE1 3.25Å
589	G	65.1	Low	79.6	Confident	26 Å²	26	54.8 Å²	54.8	27%	0.268	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.3	-17	177.6	0	0	0	0	0	118.4	Y587	Y587-G589 PolarHBondContact O-N 3.16Å
590	T	71.6	Confident	79.5	Confident	112 Å²	112	58.3 Å²	58.3	69%	0.687	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-32.6	-175.7	52.4	0	0	0	0	114.4	Y587	Y587-T590 WeakPolarHBondContact CD1-OG1 3.38Å; Y587-T590 PolarHBondContact O-N 3.12Å; Y587-T590 PolarHBondContact O-OG1 3.49Å
591	K	76.3	Confident	79.4	Confident	86 Å²	86	62.7 Å²	62.7	37%	0.374	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.6	62.3	-176.2	-65.1	-174.2	179.7	179.6	0	111.1	Y587 R594 I595	Y587-K591 HydrophobicContact CD1-CD 4.24Å; Y587-K591 HydrophobicContact CD1-CG 4.42Å; Y587-K591 HydrophobicContact CE1-CD 4.09Å; K591-R594 HydrophobicContact CB-CB 4.26Å; K591-R594 PolarHBondContact O-N 2.99Å; K591-I595 WeakPolarHBondContact O-CG1 3.34Å; K591-I595 PolarHBondContact O-N 3.41Å
592	L	77.8	Confident	79.1	Confident	37 Å²	37	60.4 Å²	60.4	19%	0.194	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-40.8	-177.4	-70.3	167	0	0	0	113	R594 I595 R596 Y625	L592-R594 VanDerWaalsContact C-N 3.35Å; L592-R594 PolarHBondContact O-N 3.27Å; L592-I595 HydrophobicContact CD2-CD1 4.42Å; L592-I595 WeakPolarHBondContact O-CB 3.14Å; L592-I595 PolarHBondContact O-N 3.08Å; L592-R596 WeakPolarHBondContact O-CG 3.44Å; L592-R596 PolarHBondContact O-N 3.16Å; L592-Y625 VanDerWaalsContact CD1-O 3.25Å; L592-Y625 WeakPolarHBondContact CD1-O 3.37Å; L592-Y625 HydrophobicContact CD2-CG 4.22Å
593	E	80.3	Confident	78.8	Confident	149 Å²	149	59.6 Å²	59.6	70%	0.696	29%	0.286	S	S	*	.	H	α-helix	trans	-59.4	-46.4	178.7	-65.1	177.5	172	0	0	111.3	I595 R596 D597	E593-I595 VanDerWaalsContact C-N 3.27Å; E593-I595 PolarHBondContact O-N 2.84Å; E593-R596 WeakPolarHBondContact O-CB 3.4Å; E593-R596 PolarHBondContact O-N 3Å; E593-R596 VanDerWaalsContact O-N 3.09Å; E593-D597 VanDerWaalsContact O-CG 3.23Å; E593-D597 PolarHBondContact O-N 3.14Å
594	R	81.7	Confident	78.6	Confident	77 Å²	77	67.5 Å²	67.5	29%	0.291	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-35.3	175	-175.2	171.2	175.4	-175.6	2.6	112.6	E561 F583 K591 L592 L598	E561-R594 IonicContact OE1-NH2 3.7Å; F583-R594 HydrophobicContact CZ-CB 4.46Å; F583-R594 HydrophobicContact CZ-CG 3.92Å; K591-R594 HydrophobicContact CB-CB 4.26Å; K591-R594 PolarHBondContact O-N 2.99Å; L592-R594 VanDerWaalsContact C-N 3.35Å; L592-R594 PolarHBondContact O-N 3.27Å; R594-L598 HydrophobicContact CG-CD1 4.45Å; R594-L598 VanDerWaalsContact O-CG 3.24Å; R594-L598 WeakPolarHBondContact O-CG 3.37Å; R594-L598 PolarHBondContact O-N 3.33Å; R594-L598 VanDerWaalsContact O-N 3.07Å
595	I	84.3	Confident	78	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-65.1	-44.2	176.1	-65.7	166.8	0	0	0	110	F583 L584 K591 L592 E593 L598 F599 V621	F583-I595 HydrophobicContact CD1-CD1 4.22Å; F583-I595 HydrophobicContact CD1-CG1 3.58Å; F583-I595 HydrophobicContact CE1-CD1 4.03Å; F583-I595 HydrophobicContact CE1-CG1 3.29Å; F583-I595 HydrophobicContact CZ-CG1 4.45Å; L584-I595 HydrophobicContact CD2-CD1 4.11Å; L584-I595 HydrophobicContact CD2-CG2 4.13Å; K591-I595 WeakPolarHBondContact O-CG1 3.34Å; K591-I595 PolarHBondContact O-N 3.41Å; L592-I595 HydrophobicContact CD2-CD1 4.42Å; L592-I595 WeakPolarHBondContact O-CB 3.14Å; L592-I595 PolarHBondContact O-N 3.08Å; E593-I595 VanDerWaalsContact C-N 3.27Å; E593-I595 PolarHBondContact O-N 2.84Å; I595-L598 PolarHBondContact O-N 3.29Å; I595-F599 HydrophobicContact CG2-CD2 3.48Å; I595-F599 VanDerWaalsContact CG2-CD2 3.48Å; I595-F599 HydrophobicContact CG2-CE2 3.39Å; I595-F599 VanDerWaalsContact O-CD2 3.22Å; I595-F599 WeakPolarHBondContact O-CD2 3.31Å; I595-F599 PolarHBondContact O-N 3.19Å; I595-V621 HydrophobicContact CG2-CG1 3.89Å
596	R	84.8	Confident	77.3	Confident	50 Å²	50	60.4 Å²	60.4	19%	0.189	31%	0.307	C	S	.	.	H	α-helix	trans	-59.6	-48.1	176.2	-66.4	173.4	178.3	155.7	2.4	111.1	L592 E593 L598 F599 E600 Y618 E622 N630	L592-R596 WeakPolarHBondContact O-CG 3.44Å; L592-R596 PolarHBondContact O-N 3.16Å; E593-R596 WeakPolarHBondContact O-CB 3.4Å; E593-R596 PolarHBondContact O-N 3Å; E593-R596 VanDerWaalsContact O-N 3.09Å; R596-L598 VanDerWaalsContact C-N 3.28Å; R596-L598 PolarHBondContact O-N 2.82Å; R596-F599 CarbonylContact O-C 3.59Å; R596-F599 PolarHBondContact O-N 3.21Å; R596-F599 VanDerWaalsContact O-N 3.12Å; R596-E600 WeakPolarHBondContact O-CB 3.49Å; R596-E600 WeakPolarHBondContact O-CG 3.39Å; R596-E600 PolarHBondContact O-N 3.31Å; R596-Y618 HydrophobicContact CB-CE2 4.46Å; R596-Y618 WeakPolarHBondContact CB-OH 3.28Å; R596-Y618 HydrophobicContact CG-CE2 3.98Å; R596-Y618 WeakPolarHBondContact CG-OH 3.41Å; R596-E622 VanDerWaalsContact CG-OE1 3.31Å; R596-E622 WeakPolarHBondContact CG-OE1 3.38Å; R596-E622 IonicContact CZ-OE1 3.57Å; R596-E622 IonicContact CZ-OE2 3.56Å; R596-E622 IonicContact NE-OE1 3.42Å; R596-E622 PolarHBondContact NE-OE1 3.5Å; R596-E622 IonicContact NE-OE2 2.75Å; R596-E622 PolarHBondContact NE-OE2 3.43Å; R596-E622 IonicContact NH2-OE1 3.82Å; R596-E622 PolarHBondContact NH2-OE1 3.19Å; R596-E622 IonicContact NH2-OE2 3.67Å; R596-E622 PolarHBondContact NH2-OE2 2.98Å; R596-N630 PolarHBondContact NH2-ND2 2.8Å
597	D	86	Confident	77.2	Confident	87 Å²	87	57.4 Å²	57.4	47%	0.465	30%	0.302	S	S	.	.	H	α-helix	trans	-58.1	-41.6	177.8	-60.1	-15.5	0	0	0	111.6	E593 E600 Q601	E593-D597 VanDerWaalsContact O-CG 3.23Å; E593-D597 PolarHBondContact O-N 3.14Å; D597-E600 PolarHBondContact O-N 2.72Å; D597-Q601 WeakPolarHBondContact O-CB 3.38Å; D597-Q601 VanDerWaalsContact O-CG 3.26Å; D597-Q601 WeakPolarHBondContact O-CG 3.47Å; D597-Q601 PolarHBondContact O-N 3.09Å
598	L	84.7	Confident	77	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-67.6	-39.6	177.1	-70.4	177	0	0	0	112.6	Y579 L580 F583 R594 I595 R596 C602	Y579-L598 HydrophobicContact CE1-CD1 4.03Å; Y579-L598 HydrophobicContact CE1-CD2 3.78Å; Y579-L598 HydrophobicContact CE1-CG 4.42Å; Y579-L598 WeakPolarHBondContact OH-CD1 3.15Å; Y579-L598 WeakPolarHBondContact OH-CD2 3.25Å; L580-L598 HydrophobicContact CD2-CB 4.38Å; F583-L598 HydrophobicContact CD1-CD1 4.38Å; F583-L598 HydrophobicContact CD2-CD1 3.8Å; F583-L598 HydrophobicContact CE1-CD1 4.42Å; F583-L598 HydrophobicContact CE2-CD1 3.81Å; F583-L598 HydrophobicContact CG-CD1 4.09Å; F583-L598 HydrophobicContact CZ-CD1 4.13Å; R594-L598 HydrophobicContact CG-CD1 4.45Å; R594-L598 VanDerWaalsContact O-CG 3.24Å; R594-L598 WeakPolarHBondContact O-CG 3.37Å; R594-L598 PolarHBondContact O-N 3.33Å; R594-L598 VanDerWaalsContact O-N 3.07Å; I595-L598 PolarHBondContact O-N 3.29Å; R596-L598 VanDerWaalsContact C-N 3.28Å; R596-L598 PolarHBondContact O-N 2.82Å; L598-C602 VanDerWaalsContact O-CB 3.3Å; L598-C602 WeakPolarHBondContact O-CB 3.37Å; L598-C602 PolarHBondContact O-N 2.99Å
599	F	83.3	Confident	77.2	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67	-40.4	173.6	-84.2	-70.5	0	0	0	111.3	L580 L584 I595 R596 C602 L603 L617 Y618 V621	L580-F599 HydrophobicContact CB-CZ 4.48Å; L580-F599 HydrophobicContact CD1-CD1 3.97Å; L580-F599 HydrophobicContact CD1-CE1 3.62Å; L580-F599 HydrophobicContact CD1-CZ 4.26Å; L580-F599 HydrophobicContact CD2-CD1 4.06Å; L580-F599 HydrophobicContact CD2-CD2 4.28Å; L580-F599 HydrophobicContact CD2-CE1 3.93Å; L580-F599 HydrophobicContact CD2-CE2 4.12Å; L580-F599 HydrophobicContact CD2-CG 4.24Å; L580-F599 HydrophobicContact CD2-CZ 3.95Å; L580-F599 HydrophobicContact CG-CE1 4.26Å; L580-F599 HydrophobicContact CG-CZ 4.46Å; L584-F599 HydrophobicContact CD1-CZ 4.44Å; I595-F599 HydrophobicContact CG2-CD2 3.48Å; I595-F599 VanDerWaalsContact CG2-CD2 3.48Å; I595-F599 HydrophobicContact CG2-CE2 3.39Å; I595-F599 VanDerWaalsContact O-CD2 3.22Å; I595-F599 WeakPolarHBondContact O-CD2 3.31Å; I595-F599 PolarHBondContact O-N 3.19Å; R596-F599 CarbonylContact O-C 3.59Å; R596-F599 PolarHBondContact O-N 3.21Å; R596-F599 VanDerWaalsContact O-N 3.12Å; F599-C602 WeakPolarHBondContact O-CB 3.38Å; F599-C602 PolarHBondContact O-N 3.39Å; F599-L603 WeakPolarHBondContact O-CB 3.22Å; F599-L603 WeakPolarHBondContact O-CG 3.48Å; F599-L603 PolarHBondContact O-N 3.2Å; F599-L617 HydrophobicContact CE1-CB 4.19Å; F599-L617 HydrophobicContact CZ-CB 4.36Å; F599-Y618 HydrophobicContact CB-CD1 3.85Å; F599-Y618 HydrophobicContact CB-CD2 3.81Å; F599-Y618 HydrophobicContact CB-CE1 3.97Å; F599-Y618 HydrophobicContact CB-CE2 3.99Å; F599-Y618 HydrophobicContact CB-CG 3.77Å; F599-Y618 HydrophobicContact CD1-CD2 4.25Å; F599-Y618 AromaticContact CD1-CG 3.92Å; F599-Y618 HydrophobicContact CD1-CG 3.92Å; F599-Y618 AromaticContact CD2-CD2 3.4Å; F599-Y618 HydrophobicContact CD2-CD2 3.4Å; F599-Y618 VanDerWaalsContact CD2-CD2 3.4Å; F599-Y618 AromaticContact CD2-CE2 3.95Å; F599-Y618 HydrophobicContact CD2-CE2 3.95Å; F599-Y618 AromaticContact CD2-CG 3.94Å; F599-Y618 HydrophobicContact CD2-CG 3.94Å; F599-Y618 HydrophobicContact CE1-CG 4.46Å; F599-Y618 AromaticContact CE2-CD2 3.97Å; F599-Y618 HydrophobicContact CE2-CD2 3.97Å; F599-Y618 HydrophobicContact CG-CD1 4.22Å; F599-Y618 AromaticContact CG-CD2 3.58Å; F599-Y618 HydrophobicContact CG-CD2 3.58Å; F599-Y618 HydrophobicContact CG-CE2 4.18Å; F599-Y618 AromaticContact CG-CG 3.63Å; F599-Y618 HydrophobicContact CG-CG 3.63Å; F599-V621 HydrophobicContact CE2-CB 4.35Å; F599-V621 HydrophobicContact CE2-CG1 4.42Å; F599-V621 HydrophobicContact CE2-CG2 4.12Å; F599-V621 HydrophobicContact CZ-CG2 4.17Å
600	E	83.8	Confident	77.2	Confident	74 Å²	74	66.1 Å²	66.1	35%	0.346	33%	0.331	S	S	.	.	H	α-helix	trans	-65.3	-44.8	178	-72.6	-175.4	170.4	0	0	111.5	R596 D597 C602 L603 E604 R637	R596-E600 WeakPolarHBondContact O-CB 3.49Å; R596-E600 WeakPolarHBondContact O-CG 3.39Å; R596-E600 PolarHBondContact O-N 3.31Å; D597-E600 PolarHBondContact O-N 2.72Å; E600-C602 VanDerWaalsContact C-N 3.28Å; E600-C602 PolarHBondContact O-N 2.86Å; E600-L603 PolarHBondContact O-N 3.43Å; E600-L603 VanDerWaalsContact O-N 3.16Å; E600-E604 WeakPolarHBondContact O-CG 3.47Å; E600-E604 PolarHBondContact O-N 2.95Å; E600-R637 IonicContact OE1-NH1 2.68Å
601	Q	83.1	Confident	77.3	Confident	95 Å²	95	60.9 Å²	60.9	44%	0.444	30%	0.299	S	S	.	.	H	α-helix	trans	-58.6	-40.5	172.4	-74	172.8	14.5	0	0	112.6	W576 D597 S605	W576-Q601 HydrophobicContact CH2-CB 4.33Å; D597-Q601 WeakPolarHBondContact O-CB 3.38Å; D597-Q601 VanDerWaalsContact O-CG 3.26Å; D597-Q601 WeakPolarHBondContact O-CG 3.47Å; D597-Q601 PolarHBondContact O-N 3.09Å; Q601-S605 PolarHBondContact O-N 3.44Å; Q601-S605 PolarHBondContact O-OG 3.34Å; Q601-S605 VanDerWaalsContact O-OG 3.08Å
602	C	78.1	Confident	77	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63	-49.5	176.2	-173.5	0	0	0	0	110.1	W576 L598 F599 E600 E604 S605 C606	W576-C602 HydrophobicContact CD2-CB 3.88Å; W576-C602 HydrophobicContact CE3-CB 4.02Å; W576-C602 HydrophobicContact CG-CB 4.35Å; W576-C602 HydrophobicContact CH2-CB 4.26Å; W576-C602 HydrophobicContact CZ2-CB 4.08Å; W576-C602 HydrophobicContact CZ3-CB 4.2Å; L598-C602 VanDerWaalsContact O-CB 3.3Å; L598-C602 WeakPolarHBondContact O-CB 3.37Å; L598-C602 PolarHBondContact O-N 2.99Å; F599-C602 WeakPolarHBondContact O-CB 3.38Å; F599-C602 PolarHBondContact O-N 3.39Å; E600-C602 VanDerWaalsContact C-N 3.28Å; E600-C602 PolarHBondContact O-N 2.86Å; C602-E604 PolarHBondContact O-N 3.09Å; C602-S605 PolarHBondContact O-N 2.93Å; C602-S605 VanDerWaalsContact O-N 3.12Å; C602-C606 PolarHBondContact O-N 3.28Å; C602-C606 VanDerWaalsContact O-N 3.14Å; C602-C606 PolarHBondContact O-SG 3.06Å
603	L	75.8	Confident	77.1	Confident	24 Å²	24	62.7 Å²	62.7	13%	0.126	31%	0.306	C	S	.	.	H	α-helix	trans	-65.7	-37	-178	-70.5	173.9	0	0	0	113.3	F599 E600 S605 C606 L614 Y615 Y618	F599-L603 WeakPolarHBondContact O-CB 3.22Å; F599-L603 WeakPolarHBondContact O-CG 3.48Å; F599-L603 PolarHBondContact O-N 3.2Å; E600-L603 PolarHBondContact O-N 3.43Å; E600-L603 VanDerWaalsContact O-N 3.16Å; L603-S605 PolarHBondContact O-N 2.89Å; L603-C606 PolarHBondContact O-N 3.43Å; L603-L614 HydrophobicContact CD2-CB 4.36Å; L603-Y615 HydrophobicContact CD1-CD1 3.96Å; L603-Y615 HydrophobicContact CD1-CE1 3.41Å; L603-Y615 VanDerWaalsContact CD1-CE1 3.41Å; L603-Y615 HydrophobicContact CD2-CD1 4.04Å; L603-Y615 HydrophobicContact CD2-CD2 3.94Å; L603-Y615 HydrophobicContact CD2-CE1 3.72Å; L603-Y615 HydrophobicContact CD2-CE2 3.6Å; L603-Y615 HydrophobicContact CD2-CG 4.13Å; L603-Y615 VanDerWaalsContact CD2-CZ 3.46Å; L603-Y615 HydrophobicContact CG-CE1 4.16Å; L603-Y618 HydrophobicContact CD1-CD1 3.96Å; L603-Y618 HydrophobicContact CD1-CE1 4.28Å
604	E	79.2	Confident	77.1	Confident	167 Å²	167	56 Å²	56	78%	0.78	28%	0.275	S	S	*	.	H	α-helix	trans	-59.3	-33	173	-77	178.3	179.8	0	0	112	E600 C602	E600-E604 WeakPolarHBondContact O-CG 3.47Å; E600-E604 PolarHBondContact O-N 2.95Å; C602-E604 PolarHBondContact O-N 3.09Å
605	S	67.9	Low	77.2	Confident	64 Å²	64	53.7 Å²	53.7	45%	0.448	27%	0.267	S	S	.	.	H	α-helix	trans	-86.9	-17.8	-179.1	-55	0	0	0	0	112.8	W569 Q601 C602 L603	W569-S605 VanDerWaalsContact NE1-C 3.26Å; W569-S605 PolarHBondContact NE1-O 2.97Å; Q601-S605 PolarHBondContact O-N 3.44Å; Q601-S605 PolarHBondContact O-OG 3.34Å; Q601-S605 VanDerWaalsContact O-OG 3.08Å; C602-S605 PolarHBondContact O-N 2.93Å; C602-S605 VanDerWaalsContact O-N 3.12Å; L603-S605 PolarHBondContact O-N 2.89Å
606	C	65	Low	77.1	Confident	25 Å²	25	55.3 Å²	55.3	17%	0.169	28%	0.275	C	S	.	.			trans	-75.1	131.5	-165.3	-79.9	0	0	0	0	115.1	W569 C602 L603 A611 L614	W569-C606 HydrophobicContact CH2-CB 4.34Å; W569-C606 WeakPolarHBondContact CH2-SG 3.19Å; W569-C606 HydrophobicContact CZ2-CB 4.23Å; W569-C606 WeakPolarHBondContact CZ2-SG 3.5Å; C602-C606 PolarHBondContact O-N 3.28Å; C602-C606 VanDerWaalsContact O-N 3.14Å; C602-C606 PolarHBondContact O-SG 3.06Å; L603-C606 PolarHBondContact O-N 3.43Å; C606-A611 HydrophobicContact CB-CB 4.46Å; C606-L614 WeakPolarHBondContact SG-CD1 3.15Å
607	P	72.4	Confident	76.9	Confident	46 Å²	46	54.7 Å²	54.7	30%	0.299	28%	0.276	S	S	.	.			trans	-66.3	150.7	156.6	-17.7	31.1	0	0	0	111.7	W569 E609 Y610	W569-P607 HydrophobicContact CB-CG 3.59Å; W569-P607 HydrophobicContact CD2-CG 4.25Å; W569-P607 HydrophobicContact CG-CG 3.76Å; P607-E609 VanDerWaalsContact C-N 3.25Å; P607-E609 PolarHBondContact O-N 2.93Å; P607-E609 VanDerWaalsContact O-N 3.16Å; P607-Y610 PolarHBondContact O-N 3.28Å
608	P	69.7	Low	76.8	Confident	71 Å²	71	50.9 Å²	50.9	46%	0.461	26%	0.255	S	S	.	.	H	α-helix	trans	-62.1	-28.2	-171.6	24.5	-34.8	0	0	0	113.8	Y610 A611 A641 P643	P608-Y610 PolarHBondContact O-N 2.78Å; P608-A611 WeakPolarHBondContact O-CB 3.37Å; P608-A611 PolarHBondContact O-N 3.5Å; P608-A641 WeakPolarHBondContact CB-O 3.44Å; P608-P643 WeakPolarHBondContact O-CD 3.5Å
609	E	69.3	Low	76.6	Confident	121 Å²	121	50.6 Å²	50.6	57%	0.565	25%	0.253	S	S	*	.	H	α-helix	trans	-65.3	-37.5	-175.4	-61.9	-179.4	178.2	0	0	114.6	P607	P607-E609 VanDerWaalsContact C-N 3.25Å; P607-E609 PolarHBondContact O-N 2.93Å; P607-E609 VanDerWaalsContact O-N 3.16Å
610	Y	66.8	Low	76.6	Confident	96 Å²	96	55.6 Å²	55.6	38%	0.376	28%	0.275	S	S	.	.	H	α-helix	trans	-96.7	-11.7	-177.9	-60.7	-76.9	0	0	0	112.5	P570 P607 P608 A612 K613	P570-Y610 HydrophobicContact CB-CE2 3.98Å; P570-Y610 HydrophobicContact CG-CE2 4.5Å; P607-Y610 PolarHBondContact O-N 3.28Å; P608-Y610 PolarHBondContact O-N 2.78Å; Y610-A612 VanDerWaalsContact C-N 3.28Å; Y610-A612 PolarHBondContact O-N 3.23Å; Y610-K613 PolarHBondContact O-N 3.05Å
611	A	72.1	Confident	76.5	Confident	3 Å²	3	52.4 Å²	52.4	3%	0.025	26%	0.26	C	S	.	.	H	α-helix	trans	-60.8	-36.7	-175.7	0	0	0	0	0	111.8	C606 P608 K613 L614 Y615	C606-A611 HydrophobicContact CB-CB 4.46Å; P608-A611 WeakPolarHBondContact O-CB 3.37Å; P608-A611 PolarHBondContact O-N 3.5Å; A611-K613 VanDerWaalsContact C-N 3.32Å; A611-K613 PolarHBondContact O-N 3.3Å; A611-L614 PolarHBondContact O-N 3.43Å; A611-Y615 HydrophobicContact CB-CD2 3.88Å; A611-Y615 HydrophobicContact CB-CE2 3.8Å; A611-Y615 WeakPolarHBondContact O-CD2 3.31Å; A611-Y615 PolarHBondContact O-N 2.83Å
612	A	71.4	Confident	76.3	Confident	5 Å²	5	47.9 Å²	47.9	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-54.1	-45.2	-178.1	0	0	0	0	0	112.9	Y610 L614 L616 V642 V650	Y610-A612 VanDerWaalsContact C-N 3.28Å; Y610-A612 PolarHBondContact O-N 3.23Å; A612-L614 PolarHBondContact O-N 3.4Å; A612-L616 WeakPolarHBondContact O-CB 3.33Å; A612-L616 WeakPolarHBondContact O-CG 3.42Å; A612-L616 PolarHBondContact O-N 3.43Å; A612-V642 HydrophobicContact CB-CG1 4.24Å; A612-V642 HydrophobicContact CB-CG2 3.8Å; A612-V650 HydrophobicContact CB-CG2 4.44Å
613	K	80	Confident	76.4	Confident	155 Å²	155	50 Å²	50	67%	0.674	25%	0.249	S	C	*	.	H	α-helix	trans	-67.2	-38.8	179.5	-68.6	178.4	-176.5	171.3	0	111.9	Y610 A611 L617	Y610-K613 PolarHBondContact O-N 3.05Å; A611-K613 VanDerWaalsContact C-N 3.32Å; A611-K613 PolarHBondContact O-N 3.3Å; K613-L617 WeakPolarHBondContact O-CD1 3.25Å; K613-L617 VanDerWaalsContact O-CG 3.27Å; K613-L617 WeakPolarHBondContact O-CG 3.38Å; K613-L617 PolarHBondContact O-N 3.48Å
614	L	80.2	Confident	76.6	Confident	8 Å²	8	54.6 Å²	54.6	4%	0.042	27%	0.274	C	S	.	.	H	α-helix	trans	-70.6	-43	-179.9	-68.6	165.3	0	0	0	111.4	W569 L580 L603 C606 A611 A612 L617 Y618	W569-L614 HydrophobicContact CH2-CD1 3.87Å; W569-L614 HydrophobicContact CZ3-CD1 4.23Å; L580-L614 HydrophobicContact CD1-CD2 3.73Å; L603-L614 HydrophobicContact CD2-CB 4.36Å; C606-L614 WeakPolarHBondContact SG-CD1 3.15Å; A611-L614 PolarHBondContact O-N 3.43Å; A612-L614 PolarHBondContact O-N 3.4Å; L614-L617 PolarHBondContact O-N 3.07Å; L614-Y618 WeakPolarHBondContact O-CB 3.21Å; L614-Y618 PolarHBondContact O-N 3.36Å
615	Y	82.3	Confident	76.3	Confident	29 Å²	29	51.1 Å²	51.1	11%	0.114	25%	0.254	C	S	.	.	H	α-helix	trans	-61.1	-43.7	172.5	-82.1	-65	0	0	0	112.2	L603 A611 L617 Y618 A619 R637 A638 A641	L603-Y615 HydrophobicContact CD1-CD1 3.96Å; L603-Y615 HydrophobicContact CD1-CE1 3.41Å; L603-Y615 VanDerWaalsContact CD1-CE1 3.41Å; L603-Y615 HydrophobicContact CD2-CD1 4.04Å; L603-Y615 HydrophobicContact CD2-CD2 3.94Å; L603-Y615 HydrophobicContact CD2-CE1 3.72Å; L603-Y615 HydrophobicContact CD2-CE2 3.6Å; L603-Y615 HydrophobicContact CD2-CG 4.13Å; L603-Y615 VanDerWaalsContact CD2-CZ 3.46Å; L603-Y615 HydrophobicContact CG-CE1 4.16Å; A611-Y615 HydrophobicContact CB-CD2 3.88Å; A611-Y615 HydrophobicContact CB-CE2 3.8Å; A611-Y615 WeakPolarHBondContact O-CD2 3.31Å; A611-Y615 PolarHBondContact O-N 2.83Å; Y615-L617 VanDerWaalsContact C-N 3.3Å; Y615-L617 PolarHBondContact O-N 3.23Å; Y615-Y618 PolarHBondContact O-N 3.13Å; Y615-A619 VanDerWaalsContact O-CB 3.27Å; Y615-A619 WeakPolarHBondContact O-CB 3.3Å; Y615-A619 PolarHBondContact O-N 3.46Å; Y615-R637 HydrophobicContact CE1-CB 4.22Å; Y615-A638 HydrophobicContact CD1-CB 3.93Å; Y615-A638 HydrophobicContact CD2-CB 4.1Å; Y615-A638 HydrophobicContact CG-CB 3.61Å; Y615-A641 HydrophobicContact CE2-CB 3.59Å
616	L	82.7	Confident	76.5	Confident	37 Å²	37	49.4 Å²	49.4	19%	0.194	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-34.9	176.3	-73	174.4	0	0	0	112.4	A612 K620 Y635 I653	A612-L616 WeakPolarHBondContact O-CB 3.33Å; A612-L616 WeakPolarHBondContact O-CG 3.42Å; A612-L616 PolarHBondContact O-N 3.43Å; L616-K620 WeakPolarHBondContact O-CB 2.99Å; L616-K620 WeakPolarHBondContact O-CG 3.5Å; L616-K620 PolarHBondContact O-N 3.46Å; L616-K620 VanDerWaalsContact O-N 3.11Å; L616-Y635 HydrophobicContact CD2-CE1 4.27Å; L616-I653 HydrophobicContact CD1-CD1 3.89Å; L616-I653 HydrophobicContact CD2-CB 4.33Å; L616-I653 HydrophobicContact CD2-CD1 3.69Å; L616-I653 HydrophobicContact CD2-CG2 3.89Å; L616-I653 HydrophobicContact CG-CD1 4.47Å
617	L	82.1	Confident	77.2	Confident	37 Å²	37	53.5 Å²	53.5	19%	0.194	27%	0.266	C	S	.	.	H	α-helix	trans	-69	-45.6	172.7	-73.3	163.9	0	0	0	111	H577 F599 K613 L614 Y615 A619 K620 V621	H577-L617 WeakPolarHBondContact ND1-CD1 3.25Å; F599-L617 HydrophobicContact CE1-CB 4.19Å; F599-L617 HydrophobicContact CZ-CB 4.36Å; K613-L617 WeakPolarHBondContact O-CD1 3.25Å; K613-L617 VanDerWaalsContact O-CG 3.27Å; K613-L617 WeakPolarHBondContact O-CG 3.38Å; K613-L617 PolarHBondContact O-N 3.48Å; L614-L617 PolarHBondContact O-N 3.07Å; Y615-L617 VanDerWaalsContact C-N 3.3Å; Y615-L617 PolarHBondContact O-N 3.23Å; L617-A619 VanDerWaalsContact C-N 3.33Å; L617-A619 PolarHBondContact O-N 3.37Å; L617-K620 PolarHBondContact O-N 3.06Å; L617-V621 WeakPolarHBondContact O-CG2 3.46Å; L617-V621 PolarHBondContact O-N 3.2Å
618	Y	82.9	Confident	77.3	Confident	6 Å²	6	52.5 Å²	52.5	2%	0.024	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-43.1	179.4	-171.6	-161.7	0	0	0	111.5	R596 F599 L603 L614 Y615 K620 V621 E622 L634	R596-Y618 HydrophobicContact CB-CE2 4.46Å; R596-Y618 WeakPolarHBondContact CB-OH 3.28Å; R596-Y618 HydrophobicContact CG-CE2 3.98Å; R596-Y618 WeakPolarHBondContact CG-OH 3.41Å; F599-Y618 HydrophobicContact CB-CD1 3.85Å; F599-Y618 HydrophobicContact CB-CD2 3.81Å; F599-Y618 HydrophobicContact CB-CE1 3.97Å; F599-Y618 HydrophobicContact CB-CE2 3.99Å; F599-Y618 HydrophobicContact CB-CG 3.77Å; F599-Y618 HydrophobicContact CD1-CD2 4.25Å; F599-Y618 AromaticContact CD1-CG 3.92Å; F599-Y618 HydrophobicContact CD1-CG 3.92Å; F599-Y618 AromaticContact CD2-CD2 3.4Å; F599-Y618 HydrophobicContact CD2-CD2 3.4Å; F599-Y618 VanDerWaalsContact CD2-CD2 3.4Å; F599-Y618 AromaticContact CD2-CE2 3.95Å; F599-Y618 HydrophobicContact CD2-CE2 3.95Å; F599-Y618 AromaticContact CD2-CG 3.94Å; F599-Y618 HydrophobicContact CD2-CG 3.94Å; F599-Y618 HydrophobicContact CE1-CG 4.46Å; F599-Y618 AromaticContact CE2-CD2 3.97Å; F599-Y618 HydrophobicContact CE2-CD2 3.97Å; F599-Y618 HydrophobicContact CG-CD1 4.22Å; F599-Y618 AromaticContact CG-CD2 3.58Å; F599-Y618 HydrophobicContact CG-CD2 3.58Å; F599-Y618 HydrophobicContact CG-CE2 4.18Å; F599-Y618 AromaticContact CG-CG 3.63Å; F599-Y618 HydrophobicContact CG-CG 3.63Å; L603-Y618 HydrophobicContact CD1-CD1 3.96Å; L603-Y618 HydrophobicContact CD1-CE1 4.28Å; L614-Y618 WeakPolarHBondContact O-CB 3.21Å; L614-Y618 PolarHBondContact O-N 3.36Å; Y615-Y618 PolarHBondContact O-N 3.13Å; Y618-K620 PolarHBondContact O-N 3.45Å; Y618-V621 WeakPolarHBondContact O-CB 3.21Å; Y618-V621 PolarHBondContact O-N 2.74Å; Y618-E622 HydrophobicContact CD2-CG 4.15Å; Y618-E622 HydrophobicContact CE2-CG 3.88Å; Y618-E622 PolarHBondContact O-N 3.35Å; Y618-L634 HydrophobicContact CD1-CD1 3.41Å; Y618-L634 VanDerWaalsContact CD1-CD1 3.41Å; Y618-L634 HydrophobicContact CD1-CD2 3.44Å; Y618-L634 VanDerWaalsContact CD1-CD2 3.44Å; Y618-L634 HydrophobicContact CD1-CG 4Å; Y618-L634 HydrophobicContact CD2-CD1 3.77Å; Y618-L634 HydrophobicContact CE1-CD1 3.46Å; Y618-L634 VanDerWaalsContact CE1-CD1 3.46Å; Y618-L634 HydrophobicContact CE1-CD2 3.12Å; Y618-L634 HydrophobicContact CE1-CG 3.9Å; Y618-L634 HydrophobicContact CE2-CD1 3.76Å; Y618-L634 HydrophobicContact CG-CD1 3.58Å; Y618-L634 HydrophobicContact CG-CD2 4.45Å
619	A	81.2	Confident	77.8	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-40.9	177.2	0	0	0	0	0	112.1	Y615 L617 V621 E622 E623 Y635	Y615-A619 VanDerWaalsContact O-CB 3.27Å; Y615-A619 WeakPolarHBondContact O-CB 3.3Å; Y615-A619 PolarHBondContact O-N 3.46Å; L617-A619 VanDerWaalsContact C-N 3.33Å; L617-A619 PolarHBondContact O-N 3.37Å; A619-V621 VanDerWaalsContact C-N 3.31Å; A619-V621 PolarHBondContact O-N 3.06Å; A619-E622 PolarHBondContact O-N 2.87Å; A619-E623 WeakPolarHBondContact O-CG 3.49Å; A619-E623 PolarHBondContact O-N 2.94Å; A619-Y635 HydrophobicContact CB-CD1 3.92Å; A619-Y635 HydrophobicContact CB-CD2 4.41Å; A619-Y635 HydrophobicContact CB-CE1 3.37Å; A619-Y635 HydrophobicContact CB-CE2 3.92Å; A619-Y635 HydrophobicContact CB-CG 4.39Å
620	K	81.9	Confident	78.3	Confident	105 Å²	105	55.4 Å²	55.4	46%	0.457	27%	0.265	S	S	.	.	H	α-helix	trans	-60.8	-39.8	172.4	-76.6	172.7	-176.8	179.4	0	112.4	L616 L617 Y618 E623 D624	L616-K620 WeakPolarHBondContact O-CB 2.99Å; L616-K620 WeakPolarHBondContact O-CG 3.5Å; L616-K620 PolarHBondContact O-N 3.46Å; L616-K620 VanDerWaalsContact O-N 3.11Å; L617-K620 PolarHBondContact O-N 3.06Å; Y618-K620 PolarHBondContact O-N 3.45Å; K620-E623 WeakPolarHBondContact O-CB 3.27Å; K620-E623 PolarHBondContact O-N 3.5Å; K620-D624 WeakPolarHBondContact O-CB 3.27Å; K620-D624 VanDerWaalsContact O-CG 3.26Å; K620-D624 PolarHBondContact O-N 2.83Å
621	V	81.6	Confident	78.9	Confident	6 Å²	6	50.8 Å²	50.8	4%	0.036	25%	0.247	C	C	.	.	H	α-helix	trans	-66.8	-40.3	178.4	172.4	0	0	0	0	111.3	L584 I595 F599 L617 Y618 A619 E623 D624 Y625	L584-V621 HydrophobicContact CD1-CG2 3.42Å; L584-V621 VanDerWaalsContact CD1-CG2 3.42Å; L584-V621 HydrophobicContact CD2-CB 4.18Å; L584-V621 HydrophobicContact CD2-CG1 3.67Å; L584-V621 HydrophobicContact CD2-CG2 3.35Å; L584-V621 HydrophobicContact CG-CG2 4.01Å; I595-V621 HydrophobicContact CG2-CG1 3.89Å; F599-V621 HydrophobicContact CE2-CB 4.35Å; F599-V621 HydrophobicContact CE2-CG1 4.42Å; F599-V621 HydrophobicContact CE2-CG2 4.12Å; F599-V621 HydrophobicContact CZ-CG2 4.17Å; L617-V621 WeakPolarHBondContact O-CG2 3.46Å; L617-V621 PolarHBondContact O-N 3.2Å; Y618-V621 WeakPolarHBondContact O-CB 3.21Å; Y618-V621 PolarHBondContact O-N 2.74Å; A619-V621 VanDerWaalsContact C-N 3.31Å; A619-V621 PolarHBondContact O-N 3.06Å; V621-E623 VanDerWaalsContact C-N 3.34Å; V621-D624 PolarHBondContact O-N 3.28Å; V621-Y625 HydrophobicContact CG1-CD2 4.39Å; V621-Y625 PolarHBondContact O-N 3.45Å
622	E	80	Confident	79.2	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-70.6	-27.8	173.5	-72.1	-60.8	142.2	0	0	112.9	R596 Y618 A619 G626 N630 A631 L634	R596-E622 VanDerWaalsContact CG-OE1 3.31Å; R596-E622 WeakPolarHBondContact CG-OE1 3.38Å; R596-E622 IonicContact CZ-OE1 3.57Å; R596-E622 IonicContact CZ-OE2 3.56Å; R596-E622 IonicContact NE-OE1 3.42Å; R596-E622 PolarHBondContact NE-OE1 3.5Å; R596-E622 IonicContact NE-OE2 2.75Å; R596-E622 PolarHBondContact NE-OE2 3.43Å; R596-E622 IonicContact NH2-OE1 3.82Å; R596-E622 PolarHBondContact NH2-OE1 3.19Å; R596-E622 IonicContact NH2-OE2 3.67Å; R596-E622 PolarHBondContact NH2-OE2 2.98Å; Y618-E622 HydrophobicContact CD2-CG 4.15Å; Y618-E622 HydrophobicContact CE2-CG 3.88Å; Y618-E622 PolarHBondContact O-N 3.35Å; A619-E622 PolarHBondContact O-N 2.87Å; E622-G626 CarbonylContact O-C 3.21Å; E622-G626 WeakPolarHBondContact O-CA 3.18Å; E622-G626 PolarHBondContact O-N 3.42Å; E622-N630 HydrophobicContact CG-CB 4.4Å; E622-A631 HydrophobicContact CB-CB 4.13Å; E622-L634 HydrophobicContact CB-CD1 4.19Å; E622-L634 HydrophobicContact CG-CD1 3.46Å; E622-L634 VanDerWaalsContact CG-CD1 3.46Å
623	E	79.3	Confident	79.7	Confident	45 Å²	45	53 Å²	53	21%	0.21	26%	0.262	C	S	.	.	H	α-helix	trans	-69	-44.4	171.2	-77.3	176.9	-179.8	0	0	111.7	A619 K620 V621 A631 Y635 R657	A619-E623 WeakPolarHBondContact O-CG 3.49Å; A619-E623 PolarHBondContact O-N 2.94Å; K620-E623 WeakPolarHBondContact O-CB 3.27Å; K620-E623 PolarHBondContact O-N 3.5Å; V621-E623 VanDerWaalsContact C-N 3.34Å; E623-A631 HydrophobicContact CG-CB 4.01Å; E623-Y635 VanDerWaalsContact CD-OH 3.26Å; E623-Y635 WeakPolarHBondContact OE1-CE2 3.37Å; E623-Y635 VanDerWaalsContact OE1-CZ 3.27Å; E623-Y635 PolarHBondContact OE1-OH 3.25Å; E623-R657 WeakPolarHBondContact OE1-CB 3.31Å; E623-R657 VanDerWaalsContact OE1-CD 3.3Å; E623-R657 WeakPolarHBondContact OE1-CD 3.26Å; E623-R657 VanDerWaalsContact OE1-CG 3.32Å; E623-R657 WeakPolarHBondContact OE1-CG 3.42Å; E623-R657 IonicContact OE1-NE 3.41Å; E623-R657 IonicContact OE2-CZ 2.88Å; E623-R657 IonicContact OE2-NE 3.16Å; E623-R657 IonicContact OE2-NH1 2.79Å
624	D	80	Confident	79.9	Confident	119 Å²	119	45.7 Å²	45.7	64%	0.636	23%	0.23	S	C	*	.	H	α-helix	trans	-75	-37.9	-174.4	-70.4	-20.6	0	0	0	112.5	K620 V621	K620-D624 WeakPolarHBondContact O-CB 3.27Å; K620-D624 VanDerWaalsContact O-CG 3.26Å; K620-D624 PolarHBondContact O-N 2.83Å; V621-D624 PolarHBondContact O-N 3.28Å
625	Y	72.9	Confident	80	Confident	95 Å²	95	45.5 Å²	45.5	37%	0.373	23%	0.229	S	C	.	.	H	α-helix	trans	-126	-15.7	-172.5	-56.5	-76.4	0	0	0	114.4	A588 L592 V621	A588-Y625 HydrophobicContact CB-CE1 4.14Å; A588-Y625 WeakPolarHBondContact CB-OH 3.35Å; A588-Y625 WeakPolarHBondContact O-CD1 3.13Å; A588-Y625 WeakPolarHBondContact O-CE1 3.25Å; L592-Y625 VanDerWaalsContact CD1-O 3.25Å; L592-Y625 WeakPolarHBondContact CD1-O 3.37Å; L592-Y625 HydrophobicContact CD2-CG 4.22Å; V621-Y625 HydrophobicContact CG1-CD2 4.39Å; V621-Y625 PolarHBondContact O-N 3.45Å
626	G	73.5	Confident	79.9	Confident	27 Å²	27	47.2 Å²	47.2	28%	0.278	24%	0.238	S	C	.	.	S	Bend	trans	-97.4	-167.8	-170.8	0	0	0	0	0	114.2	E622	E622-G626 CarbonylContact O-C 3.21Å; E622-G626 WeakPolarHBondContact O-CA 3.18Å; E622-G626 PolarHBondContact O-N 3.42Å
627	L	78	Confident	80	Confident	111 Å²	111	50.4 Å²	50.4	58%	0.581	25%	0.247	S	C	*	.			trans	-87.7	128.5	171.6	-72.9	143.4	0	0	0	107.6	R629 N630 A631	L627-R629 PolarHBondContact O-N 3.24Å; L627-N630 WeakPolarHBondContact O-CB 3.22Å; L627-N630 PolarHBondContact O-N 2.72Å; L627-A631 PolarHBondContact O-N 3.02Å
628	G	76.1	Confident	79.9	Confident	25 Å²	25	48.8 Å²	48.8	26%	0.258	24%	0.239	S	C	.	.	H	α-helix	trans	-55.7	-18.2	175.8	0	0	0	0	0	114.1	M632 Y662	G628-M632 VanDerWaalsContact O-CG 3.25Å; G628-M632 WeakPolarHBondContact O-CG 3.47Å; G628-M632 PolarHBondContact O-N 3.11Å; G628-Y662 PolarHBondContact O-OH 3.26Å
629	R	79	Confident	79.6	Confident	198 Å²	198	48.9 Å²	48.9	75%	0.747	24%	0.241	S	C	*	.	H	α-helix	trans	-71	-39.2	172.7	-68.6	-176.4	-178.9	-179.8	0.2	112.4	L627 A631 M632 A633 Y662	L627-R629 PolarHBondContact O-N 3.24Å; R629-A631 VanDerWaalsContact C-N 3.35Å; R629-M632 PolarHBondContact O-N 3.43Å; R629-A633 PolarHBondContact O-N 3.44Å; R629-A633 VanDerWaalsContact O-N 3.16Å; R629-Y662 VanDerWaalsContact CA-OH 3.27Å; R629-Y662 WeakPolarHBondContact CA-OH 3.33Å; R629-Y662 WeakPolarHBondContact CG-OH 3.27Å; R629-Y662 PolarHBondContact N-OH 2.74Å
630	N	79.4	Confident	79.6	Confident	55 Å²	55	56.3 Å²	56.3	29%	0.294	28%	0.276	S	S	.	.	H	α-helix	trans	-67.2	-41.2	177.8	-68.1	1.7	0	0	0	110.1	R596 E622 L627 M632 A633 L634	R596-N630 PolarHBondContact NH2-ND2 2.8Å; E622-N630 HydrophobicContact CG-CB 4.4Å; L627-N630 WeakPolarHBondContact O-CB 3.22Å; L627-N630 PolarHBondContact O-N 2.72Å; N630-M632 VanDerWaalsContact C-N 3.29Å; N630-M632 PolarHBondContact O-N 2.78Å; N630-A633 PolarHBondContact O-N 3.43Å; N630-L634 VanDerWaalsContact O-CG 3.31Å; N630-L634 WeakPolarHBondContact O-CG 2.83Å; N630-L634 PolarHBondContact O-N 3.48Å
631	A	80.2	Confident	79.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-54.8	-44.6	174.9	0	0	0	0	0	111.9	E622 E623 L627 R629 L634 Y635	E622-A631 HydrophobicContact CB-CB 4.13Å; E623-A631 HydrophobicContact CG-CB 4.01Å; L627-A631 PolarHBondContact O-N 3.02Å; R629-A631 VanDerWaalsContact C-N 3.35Å; A631-L634 PolarHBondContact O-N 2.96Å; A631-Y635 HydrophobicContact CB-CE2 4.38Å; A631-Y635 WeakPolarHBondContact O-CD2 3.02Å; A631-Y635 PolarHBondContact O-N 2.93Å
632	M	77.9	Confident	78.9	Confident	21 Å²	21	53 Å²	53	10%	0.103	27%	0.268	C	S	.	.	H	α-helix	trans	-63.4	-47	177.3	-56.8	-71.5	-96.3	0	0	111.8	G628 R629 N630 L634 Y635 E636 Y654 T658 Y662	G628-M632 VanDerWaalsContact O-CG 3.25Å; G628-M632 WeakPolarHBondContact O-CG 3.47Å; G628-M632 PolarHBondContact O-N 3.11Å; R629-M632 PolarHBondContact O-N 3.43Å; N630-M632 VanDerWaalsContact C-N 3.29Å; N630-M632 PolarHBondContact O-N 2.78Å; M632-L634 PolarHBondContact O-N 3.43Å; M632-Y635 PolarHBondContact O-N 3.35Å; M632-Y635 VanDerWaalsContact O-N 3.12Å; M632-E636 WeakPolarHBondContact O-CG 3.25Å; M632-E636 PolarHBondContact O-N 3.32Å; M632-Y654 HydrophobicContact CB-CE2 4.43Å; M632-Y654 HydrophobicContact CE-CE2 4.42Å; M632-Y654 HydrophobicContact SD-CE2 3.85Å; M632-T658 HydrophobicContact CE-CG2 3.23Å; M632-T658 HydrophobicContact SD-CG2 3.29Å; M632-T658 WeakPolarHBondContact SD-CG2 3.46Å; M632-Y662 HydrophobicContact CE-CD2 3.24Å; M632-Y662 HydrophobicContact CE-CE2 3.51Å; M632-Y662 HydrophobicContact CE-CG 4.14Å; M632-Y662 HydrophobicContact CG-CD2 4.14Å; M632-Y662 HydrophobicContact CG-CE2 3.38Å; M632-Y662 HydrophobicContact SD-CD2 3.8Å; M632-Y662 HydrophobicContact SD-CE2 3.61Å
633	A	83	Confident	78.5	Confident	34 Å²	34	54.8 Å²	54.8	28%	0.281	28%	0.28	S	S	.	.	H	α-helix	trans	-61.2	-31.4	177.3	0	0	0	0	0	112.4	R629 N630 R637	R629-A633 PolarHBondContact O-N 3.44Å; R629-A633 VanDerWaalsContact O-N 3.16Å; N630-A633 PolarHBondContact O-N 3.43Å; A633-R637 WeakPolarHBondContact O-CB 3.41Å; A633-R637 WeakPolarHBondContact O-CG 3.44Å; A633-R637 PolarHBondContact O-N 3.21Å
634	L	82.9	Confident	78	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-74.4	-37.8	174.2	-69.4	177.4	0	0	0	112.8	Y618 E622 N630 A631 M632 E636 R637 A638	Y618-L634 HydrophobicContact CD1-CD1 3.41Å; Y618-L634 VanDerWaalsContact CD1-CD1 3.41Å; Y618-L634 HydrophobicContact CD1-CD2 3.44Å; Y618-L634 VanDerWaalsContact CD1-CD2 3.44Å; Y618-L634 HydrophobicContact CD1-CG 4Å; Y618-L634 HydrophobicContact CD2-CD1 3.77Å; Y618-L634 HydrophobicContact CE1-CD1 3.46Å; Y618-L634 VanDerWaalsContact CE1-CD1 3.46Å; Y618-L634 HydrophobicContact CE1-CD2 3.12Å; Y618-L634 HydrophobicContact CE1-CG 3.9Å; Y618-L634 HydrophobicContact CE2-CD1 3.76Å; Y618-L634 HydrophobicContact CG-CD1 3.58Å; Y618-L634 HydrophobicContact CG-CD2 4.45Å; E622-L634 HydrophobicContact CB-CD1 4.19Å; E622-L634 HydrophobicContact CG-CD1 3.46Å; E622-L634 VanDerWaalsContact CG-CD1 3.46Å; N630-L634 VanDerWaalsContact O-CG 3.31Å; N630-L634 WeakPolarHBondContact O-CG 2.83Å; N630-L634 PolarHBondContact O-N 3.48Å; A631-L634 PolarHBondContact O-N 2.96Å; M632-L634 PolarHBondContact O-N 3.43Å; L634-E636 VanDerWaalsContact C-N 3.32Å; L634-R637 PolarHBondContact O-N 3.21Å; L634-A638 VanDerWaalsContact O-CB 3.22Å; L634-A638 WeakPolarHBondContact O-CB 3.26Å; L634-A638 PolarHBondContact O-N 3.38Å
635	Y	82.8	Confident	77.6	Confident	3 Å²	3	57.5 Å²	57.5	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-66.2	-36	172.6	-72.7	-58.2	0	0	0	112.2	L616 A619 E623 A631 M632 A638 A639 I653 Y654 R657	L616-Y635 HydrophobicContact CD2-CE1 4.27Å; A619-Y635 HydrophobicContact CB-CD1 3.92Å; A619-Y635 HydrophobicContact CB-CD2 4.41Å; A619-Y635 HydrophobicContact CB-CE1 3.37Å; A619-Y635 HydrophobicContact CB-CE2 3.92Å; A619-Y635 HydrophobicContact CB-CG 4.39Å; E623-Y635 VanDerWaalsContact CD-OH 3.26Å; E623-Y635 WeakPolarHBondContact OE1-CE2 3.37Å; E623-Y635 VanDerWaalsContact OE1-CZ 3.27Å; E623-Y635 PolarHBondContact OE1-OH 3.25Å; A631-Y635 HydrophobicContact CB-CE2 4.38Å; A631-Y635 WeakPolarHBondContact O-CD2 3.02Å; A631-Y635 PolarHBondContact O-N 2.93Å; M632-Y635 PolarHBondContact O-N 3.35Å; M632-Y635 VanDerWaalsContact O-N 3.12Å; Y635-A638 WeakPolarHBondContact O-CB 3.41Å; Y635-A638 PolarHBondContact O-N 3.16Å; Y635-A639 WeakPolarHBondContact O-CB 3.38Å; Y635-A639 PolarHBondContact O-N 2.95Å; Y635-I653 HydrophobicContact CE1-CG2 4.16Å; Y635-Y654 HydrophobicContact CD1-CD2 4.4Å; Y635-Y654 AromaticContact CD2-CD2 3.68Å; Y635-Y654 HydrophobicContact CD2-CD2 3.68Å; Y635-Y654 HydrophobicContact CD2-CE2 4.08Å; Y635-Y654 AromaticContact CG-CD2 3.51Å; Y635-Y654 HydrophobicContact CG-CD2 3.51Å; Y635-Y654 HydrophobicContact CG-CE2 4.08Å; Y635-Y654 HydrophobicContact CG-CG 4.17Å; Y635-R657 HydrophobicContact CE2-CB 4Å; Y635-R657 HydrophobicContact CE2-CG 4.3Å
636	E	81.5	Confident	77.5	Confident	65 Å²	65	56.4 Å²	56.4	30%	0.304	29%	0.294	S	S	.	.	H	α-helix	trans	-63.1	-49.6	172.1	-69.5	179.5	166.9	0	0	111.1	M632 L634 A638 A639 E640 Y654 R673	M632-E636 WeakPolarHBondContact O-CG 3.25Å; M632-E636 PolarHBondContact O-N 3.32Å; L634-E636 VanDerWaalsContact C-N 3.32Å; E636-A638 VanDerWaalsContact C-N 3.26Å; E636-A638 PolarHBondContact O-N 2.79Å; E636-A639 WeakPolarHBondContact O-CB 3.39Å; E636-A639 PolarHBondContact O-N 3.43Å; E636-A639 VanDerWaalsContact O-N 3.1Å; E636-E640 PolarHBondContact O-N 3.08Å; E636-E640 VanDerWaalsContact O-N 3.16Å; E636-Y654 HydrophobicContact CG-CE1 3.96Å; E636-Y654 VanDerWaalsContact CG-OH 3.22Å; E636-Y654 WeakPolarHBondContact CG-OH 3.25Å; E636-Y654 PolarHBondContact OE1-OH 3.19Å; E636-Y654 VanDerWaalsContact OE1-OH 3.1Å; E636-R673 IonicContact OE1-CZ 3.14Å; E636-R673 IonicContact OE1-NH1 2.6Å; E636-R673 PolarHBondContact OE1-NH1 3.01Å; E636-R673 IonicContact OE1-NH2 3.07Å; E636-R673 IonicContact OE2-NH1 2.74Å
637	R	83.3	Confident	77.6	Confident	105 Å²	105	56.5 Å²	56.5	40%	0.396	29%	0.287	S	S	.	.	H	α-helix	trans	-58.4	-38.5	173.3	-77.9	-171.6	-101.7	172.7	-9.3	112.4	E600 Y615 A633 L634 E640 A641	E600-R637 IonicContact OE1-NH1 2.68Å; Y615-R637 HydrophobicContact CE1-CB 4.22Å; A633-R637 WeakPolarHBondContact O-CB 3.41Å; A633-R637 WeakPolarHBondContact O-CG 3.44Å; A633-R637 PolarHBondContact O-N 3.21Å; L634-R637 PolarHBondContact O-N 3.21Å; R637-E640 PolarHBondContact O-N 3.33Å; R637-A641 WeakPolarHBondContact O-CB 3.38Å; R637-A641 PolarHBondContact O-N 3.03Å
638	A	80.5	Confident	77.6	Confident	2 Å²	2	51.6 Å²	51.6	2%	0.017	26%	0.261	C	S	.	.	H	α-helix	trans	-64.7	-40.4	176.3	0	0	0	0	0	111.7	Y615 L634 Y635 E636 E640 A641 V642 V650	Y615-A638 HydrophobicContact CD1-CB 3.93Å; Y615-A638 HydrophobicContact CD2-CB 4.1Å; Y615-A638 HydrophobicContact CG-CB 3.61Å; L634-A638 VanDerWaalsContact O-CB 3.22Å; L634-A638 WeakPolarHBondContact O-CB 3.26Å; L634-A638 PolarHBondContact O-N 3.38Å; Y635-A638 WeakPolarHBondContact O-CB 3.41Å; Y635-A638 PolarHBondContact O-N 3.16Å; E636-A638 VanDerWaalsContact C-N 3.26Å; E636-A638 PolarHBondContact O-N 2.79Å; A638-E640 VanDerWaalsContact C-N 3.29Å; A638-E640 PolarHBondContact O-N 3.32Å; A638-A641 PolarHBondContact O-N 3.26Å; A638-V642 VanDerWaalsContact O-CB 3.25Å; A638-V642 WeakPolarHBondContact O-CB 3.43Å; A638-V642 WeakPolarHBondContact O-CG2 3Å; A638-V642 PolarHBondContact O-N 3.37Å; A638-V650 HydrophobicContact CB-CG1 3.97Å
639	A	77.3	Confident	77.8	Confident	9 Å²	9	55 Å²	55	7%	0.074	27%	0.274	C	S	.	.	H	α-helix	trans	-65.1	-33.5	178.6	0	0	0	0	0	112.5	Y635 E636 F651	Y635-A639 WeakPolarHBondContact O-CB 3.38Å; Y635-A639 PolarHBondContact O-N 2.95Å; E636-A639 WeakPolarHBondContact O-CB 3.39Å; E636-A639 PolarHBondContact O-N 3.43Å; E636-A639 VanDerWaalsContact O-N 3.1Å; A639-F651 HydrophobicContact CB-CD1 4.41Å; A639-F651 HydrophobicContact CB-CE1 3.7Å; A639-F651 HydrophobicContact CB-CE2 4.3Å; A639-F651 HydrophobicContact CB-CZ 3.63Å
640	E	80.1	Confident	77.9	Confident	155 Å²	155	45.8 Å²	45.8	72%	0.724	24%	0.239	S	C	*	.	H	α-helix	trans	-75.3	-42.6	176.6	-68.9	174.7	-179.1	0	0	112.6	E636 R637 A638	E636-E640 PolarHBondContact O-N 3.08Å; E636-E640 VanDerWaalsContact O-N 3.16Å; R637-E640 PolarHBondContact O-N 3.33Å; A638-E640 VanDerWaalsContact C-N 3.29Å; A638-E640 PolarHBondContact O-N 3.32Å
641	A	75.8	Confident	78.1	Confident	38 Å²	38	43.5 Å²	43.5	31%	0.314	23%	0.227	S	C	.	.	H	α-helix	trans	-80.3	-19.7	-172.2	0	0	0	0	0	114.8	P608 Y615 R637 A638	P608-A641 WeakPolarHBondContact CB-O 3.44Å; Y615-A641 HydrophobicContact CE2-CB 3.59Å; R637-A641 WeakPolarHBondContact O-CB 3.38Å; R637-A641 PolarHBondContact O-N 3.03Å; A638-A641 PolarHBondContact O-N 3.26Å
642	V	72.6	Confident	78.3	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.024	24%	0.235	C	C	.	.	S	Bend	trans	-84.1	142	-171.7	167.4	0	0	0	0	111.2	A612 A638 Q646 K647 V650	A612-V642 HydrophobicContact CB-CG1 4.24Å; A612-V642 HydrophobicContact CB-CG2 3.8Å; A638-V642 VanDerWaalsContact O-CB 3.25Å; A638-V642 WeakPolarHBondContact O-CB 3.43Å; A638-V642 WeakPolarHBondContact O-CG2 3Å; A638-V642 PolarHBondContact O-N 3.37Å; V642-Q646 HydrophobicContact CG1-CB 3.42Å; V642-Q646 VanDerWaalsContact CG1-CB 3.42Å; V642-K647 HydrophobicContact CB-CG 4.42Å; V642-K647 HydrophobicContact CG1-CG 4.25Å; V642-K647 WeakPolarHBondContact O-CE 3.44Å; V642-K647 WeakPolarHBondContact O-CG 3.46Å; V642-V650 HydrophobicContact CB-CG2 4.44Å; V642-V650 HydrophobicContact CG1-CG2 4.05Å; V642-V650 HydrophobicContact CG2-CG2 4.16Å
643	P	73.5	Confident	78.7	Confident	38 Å²	38	46.9 Å²	46.9	25%	0.247	24%	0.243	C	C	.	.			trans	-65.6	150.4	176.3	23.9	-31.7	0	0	0	111.9	P608 D645 Q646 K647	P608-P643 WeakPolarHBondContact O-CD 3.5Å; P643-D645 PolarHBondContact O-N 3.34Å; P643-Q646 PolarHBondContact O-N 3.05Å; P643-K647 PolarHBondContact O-N 3.25Å
644	N	68	Low	78.7	Confident	84 Å²	84	45.5 Å²	45.5	45%	0.449	23%	0.231	S	C	.	.	H	α-helix	trans	-49.9	-37.8	-168.4	-69.5	-15.6	0	0	0	114.1	Q646 K647	N644-Q646 VanDerWaalsContact C-N 3.3Å; N644-Q646 PolarHBondContact O-N 3.41Å; N644-K647 PolarHBondContact O-N 3.09Å; N644-K647 VanDerWaalsContact OD1-CE 3.26Å; N644-K647 WeakPolarHBondContact OD1-CE 3.02Å; N644-K647 PolarHBondContact OD1-NZ 3.24Å
645	D	71.3	Confident	78.8	Confident	137 Å²	137	46.2 Å²	46.2	73%	0.733	23%	0.234	S	C	*	.	H	α-helix	trans	-64.1	-32.3	-178.5	-54.2	-26.4	0	0	0	113.6	P643	P643-D645 PolarHBondContact O-N 3.34Å
646	Q	70.8	Confident	79	Confident	72 Å²	72	52.8 Å²	52.8	34%	0.336	26%	0.263	S	S	.	.	H	α-helix	trans	-98.6	-10.8	-177.9	-67.6	179.6	24	0	0	112.4	V642 P643 N644 N648 D649 V650	V642-Q646 HydrophobicContact CG1-CB 3.42Å; V642-Q646 VanDerWaalsContact CG1-CB 3.42Å; P643-Q646 PolarHBondContact O-N 3.05Å; N644-Q646 VanDerWaalsContact C-N 3.3Å; N644-Q646 PolarHBondContact O-N 3.41Å; Q646-N648 PolarHBondContact O-N 2.95Å; Q646-D649 PolarHBondContact O-N 3.34Å; Q646-V650 WeakPolarHBondContact O-CG2 3.38Å; Q646-V650 PolarHBondContact O-N 3.39Å; Q646-V650 VanDerWaalsContact O-N 3.17Å
647	K	74.9	Confident	78.9	Confident	30 Å²	30	54.2 Å²	54.2	13%	0.13	27%	0.265	C	S	.	.	H	α-helix	trans	-57.7	-40.4	179.2	-74.8	-174.3	-175.6	172.1	0	111.3	V642 P643 N644 D649 V650 F651 L678	V642-K647 HydrophobicContact CB-CG 4.42Å; V642-K647 HydrophobicContact CG1-CG 4.25Å; V642-K647 WeakPolarHBondContact O-CE 3.44Å; V642-K647 WeakPolarHBondContact O-CG 3.46Å; P643-K647 PolarHBondContact O-N 3.25Å; N644-K647 PolarHBondContact O-N 3.09Å; N644-K647 VanDerWaalsContact OD1-CE 3.26Å; N644-K647 WeakPolarHBondContact OD1-CE 3.02Å; N644-K647 PolarHBondContact OD1-NZ 3.24Å; K647-D649 VanDerWaalsContact C-N 3.34Å; K647-D649 PolarHBondContact O-N 3.45Å; K647-V650 PolarHBondContact O-N 3.43Å; K647-F651 HydrophobicContact CB-CD2 4.15Å; K647-F651 HydrophobicContact CB-CE2 4.08Å; K647-F651 WeakPolarHBondContact O-CD2 3.33Å; K647-F651 PolarHBondContact O-N 3.21Å; K647-L678 HydrophobicContact CB-CD2 3.78Å
648	N	77.9	Confident	78.9	Confident	7 Å²	7	49.2 Å²	49.2	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-57.6	-45.9	-179.9	-170.8	2.6	0	0	0	112.1	Q646 F651 K652 L678 E682	Q646-N648 PolarHBondContact O-N 2.95Å; N648-F651 PolarHBondContact O-N 2.91Å; N648-K652 PolarHBondContact ND2-NZ 3.25Å; N648-K652 WeakPolarHBondContact O-CB 3.46Å; N648-K652 WeakPolarHBondContact O-CG 3.14Å; N648-K652 PolarHBondContact O-N 3.47Å; N648-K652 WeakPolarHBondContact OD1-CD 3.39Å; N648-K652 WeakPolarHBondContact OD1-CE 3.3Å; N648-K652 PolarHBondContact OD1-NZ 2.84Å; N648-K652 VanDerWaalsContact OD1-NZ 3.1Å; N648-L678 HydrophobicContact CB-CD2 4.12Å; N648-E682 VanDerWaalsContact CB-OE1 3.29Å; N648-E682 WeakPolarHBondContact CB-OE1 3.48Å; N648-E682 WeakPolarHBondContact CB-OE2 3.37Å; N648-E682 PolarHBondContact ND2-OE1 3.06Å
649	D	80.6	Confident	79.1	Confident	98 Å²	98	51.5 Å²	51.5	52%	0.524	26%	0.262	S	S	.	.	H	α-helix	trans	-66.8	-39.2	178.2	-74	-21.2	0	0	0	112.1	Q646 K647 K652 I653	Q646-D649 PolarHBondContact O-N 3.34Å; K647-D649 VanDerWaalsContact C-N 3.34Å; K647-D649 PolarHBondContact O-N 3.45Å; D649-K652 PolarHBondContact O-N 3.41Å; D649-I653 VanDerWaalsContact O-CG1 3.3Å; D649-I653 WeakPolarHBondContact O-CG1 3.32Å; D649-I653 PolarHBondContact O-N 2.86Å
650	V	81.2	Confident	79.5	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.018	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-45.4	174.6	177.2	0	0	0	0	110.8	A612 A638 V642 Q646 K647 K652 I653 Y654	A612-V650 HydrophobicContact CB-CG2 4.44Å; A638-V650 HydrophobicContact CB-CG1 3.97Å; V642-V650 HydrophobicContact CB-CG2 4.44Å; V642-V650 HydrophobicContact CG1-CG2 4.05Å; V642-V650 HydrophobicContact CG2-CG2 4.16Å; Q646-V650 WeakPolarHBondContact O-CG2 3.38Å; Q646-V650 PolarHBondContact O-N 3.39Å; Q646-V650 VanDerWaalsContact O-N 3.17Å; K647-V650 PolarHBondContact O-N 3.43Å; V650-K652 PolarHBondContact O-N 3.03Å; V650-I653 PolarHBondContact O-N 2.91Å; V650-Y654 VanDerWaalsContact O-CB 3.3Å; V650-Y654 WeakPolarHBondContact O-CB 3.49Å; V650-Y654 PolarHBondContact O-N 3.17Å
651	F	83.1	Confident	79.5	Confident	7 Å²	7	53.1 Å²	53.1	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-39.6	176	-78.9	-64.4	0	0	0	112.3	A639 K647 N648 I653 Y654 I655 I670 A674 S677 L678 M686	A639-F651 HydrophobicContact CB-CD1 4.41Å; A639-F651 HydrophobicContact CB-CE1 3.7Å; A639-F651 HydrophobicContact CB-CE2 4.3Å; A639-F651 HydrophobicContact CB-CZ 3.63Å; K647-F651 HydrophobicContact CB-CD2 4.15Å; K647-F651 HydrophobicContact CB-CE2 4.08Å; K647-F651 WeakPolarHBondContact O-CD2 3.33Å; K647-F651 PolarHBondContact O-N 3.21Å; N648-F651 PolarHBondContact O-N 2.91Å; F651-I653 VanDerWaalsContact C-N 3.3Å; F651-I653 PolarHBondContact O-N 3.35Å; F651-Y654 HydrophobicContact CD1-CD1 4.49Å; F651-Y654 PolarHBondContact O-N 3.16Å; F651-I655 WeakPolarHBondContact O-CB 3.47Å; F651-I655 WeakPolarHBondContact O-CD1 3.1Å; F651-I655 WeakPolarHBondContact O-CG1 3.47Å; F651-I655 PolarHBondContact O-N 2.89Å; F651-I670 HydrophobicContact CD1-CG2 4.28Å; F651-A674 HydrophobicContact CB-CB 4.37Å; F651-A674 HydrophobicContact CD1-CB 3.77Å; F651-A674 HydrophobicContact CD2-CB 4.15Å; F651-A674 HydrophobicContact CE1-CB 4.02Å; F651-A674 HydrophobicContact CE2-CB 4.4Å; F651-A674 HydrophobicContact CG-CB 3.85Å; F651-A674 HydrophobicContact CZ-CB 4.33Å; F651-S677 WeakPolarHBondContact CE2-OG 3.16Å; F651-S677 WeakPolarHBondContact CZ-OG 3.29Å; F651-L678 HydrophobicContact CD2-CD1 4.17Å; F651-L678 HydrophobicContact CD2-CD2 4.05Å; F651-L678 HydrophobicContact CD2-CG 4.12Å; F651-L678 HydrophobicContact CE2-CD2 4.34Å; F651-L678 HydrophobicContact CE2-CG 4.26Å; F651-M686 HydrophobicContact CB-CE 3.74Å
652	K	85.9	Confident	79.6	Confident	38 Å²	38	55.2 Å²	55.2	17%	0.165	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-42.1	174.6	-76.9	170.5	171.9	156.7	0	111.3	N648 D649 V650 K656 E685 M686 R689	N648-K652 PolarHBondContact ND2-NZ 3.25Å; N648-K652 WeakPolarHBondContact O-CB 3.46Å; N648-K652 WeakPolarHBondContact O-CG 3.14Å; N648-K652 PolarHBondContact O-N 3.47Å; N648-K652 WeakPolarHBondContact OD1-CD 3.39Å; N648-K652 WeakPolarHBondContact OD1-CE 3.3Å; N648-K652 PolarHBondContact OD1-NZ 2.84Å; N648-K652 VanDerWaalsContact OD1-NZ 3.1Å; D649-K652 PolarHBondContact O-N 3.41Å; V650-K652 PolarHBondContact O-N 3.03Å; K652-K656 VanDerWaalsContact O-CG 3.26Å; K652-K656 WeakPolarHBondContact O-CG 3.15Å; K652-K656 PolarHBondContact O-N 2.91Å; K652-E685 IonicContact NZ-OE1 2.72Å; K652-E685 IonicContact NZ-OE2 3.32Å; K652-E685 PolarHBondContact NZ-OE2 3.3Å; K652-M686 HydrophobicContact CG-SD 4.43Å; K652-R689 VanDerWaalsContact CE-NH1 3.27Å
653	I	84.9	Confident	79.9	Confident	54 Å²	54	56.3 Å²	56.3	28%	0.277	29%	0.286	S	S	.	.	H	α-helix	trans	-70.8	-46.4	176.5	-66.4	165.9	0	0	0	110.2	L616 Y635 D649 V650 F651 I655 K656 R657	L616-I653 HydrophobicContact CD1-CD1 3.89Å; L616-I653 HydrophobicContact CD2-CB 4.33Å; L616-I653 HydrophobicContact CD2-CD1 3.69Å; L616-I653 HydrophobicContact CD2-CG2 3.89Å; L616-I653 HydrophobicContact CG-CD1 4.47Å; Y635-I653 HydrophobicContact CE1-CG2 4.16Å; D649-I653 VanDerWaalsContact O-CG1 3.3Å; D649-I653 WeakPolarHBondContact O-CG1 3.32Å; D649-I653 PolarHBondContact O-N 2.86Å; V650-I653 PolarHBondContact O-N 2.91Å; F651-I653 VanDerWaalsContact C-N 3.3Å; F651-I653 PolarHBondContact O-N 3.35Å; I653-I655 VanDerWaalsContact C-N 3.34Å; I653-I655 PolarHBondContact O-N 3.24Å; I653-K656 PolarHBondContact O-N 2.92Å; I653-K656 VanDerWaalsContact O-N 3.16Å; I653-R657 HydrophobicContact CG2-CG 4.12Å; I653-R657 VanDerWaalsContact O-CG 3.3Å; I653-R657 WeakPolarHBondContact O-CG 3.3Å; I653-R657 PolarHBondContact O-N 3.18Å
654	Y	83.8	Confident	80.2	Confident	6 Å²	6	58 Å²	58	2%	0.024	29%	0.293	C	S	.	.	H	α-helix	trans	-56.4	-48.9	179.1	-175.1	-152.1	0	0	0	110.6	M632 Y635 E636 V650 F651 K656 R657 T658 I670	M632-Y654 HydrophobicContact CB-CE2 4.43Å; M632-Y654 HydrophobicContact CE-CE2 4.42Å; M632-Y654 HydrophobicContact SD-CE2 3.85Å; Y635-Y654 HydrophobicContact CD1-CD2 4.4Å; Y635-Y654 AromaticContact CD2-CD2 3.68Å; Y635-Y654 HydrophobicContact CD2-CD2 3.68Å; Y635-Y654 HydrophobicContact CD2-CE2 4.08Å; Y635-Y654 AromaticContact CG-CD2 3.51Å; Y635-Y654 HydrophobicContact CG-CD2 3.51Å; Y635-Y654 HydrophobicContact CG-CE2 4.08Å; Y635-Y654 HydrophobicContact CG-CG 4.17Å; E636-Y654 HydrophobicContact CG-CE1 3.96Å; E636-Y654 VanDerWaalsContact CG-OH 3.22Å; E636-Y654 WeakPolarHBondContact CG-OH 3.25Å; E636-Y654 PolarHBondContact OE1-OH 3.19Å; E636-Y654 VanDerWaalsContact OE1-OH 3.1Å; V650-Y654 VanDerWaalsContact O-CB 3.3Å; V650-Y654 WeakPolarHBondContact O-CB 3.49Å; V650-Y654 PolarHBondContact O-N 3.17Å; F651-Y654 HydrophobicContact CD1-CD1 4.49Å; F651-Y654 PolarHBondContact O-N 3.16Å; Y654-K656 PolarHBondContact O-N 3.35Å; Y654-R657 PolarHBondContact O-N 3.26Å; Y654-T658 HydrophobicContact CD2-CG2 3.26Å; Y654-T658 HydrophobicContact CE2-CG2 3.12Å; Y654-T658 HydrophobicContact CG-CG2 4.11Å; Y654-T658 WeakPolarHBondContact O-CB 3.2Å; Y654-T658 WeakPolarHBondContact O-CG2 3.33Å; Y654-T658 PolarHBondContact O-N 2.9Å; Y654-T658 PolarHBondContact O-OG1 3.01Å; Y654-I670 HydrophobicContact CD1-CB 4.34Å; Y654-I670 HydrophobicContact CD1-CD1 4.03Å; Y654-I670 HydrophobicContact CD1-CG1 4.18Å; Y654-I670 HydrophobicContact CD1-CG2 3.29Å; Y654-I670 HydrophobicContact CD2-CD1 4.32Å; Y654-I670 HydrophobicContact CE1-CB 4.12Å; Y654-I670 HydrophobicContact CE1-CD1 3.56Å; Y654-I670 HydrophobicContact CE1-CG1 3.55Å; Y654-I670 HydrophobicContact CE1-CG2 3.53Å; Y654-I670 HydrophobicContact CE2-CD1 3.89Å; Y654-I670 HydrophobicContact CG-CD1 4.37Å; Y654-I670 HydrophobicContact CG-CG2 4.12Å; Y654-I670 VanDerWaalsContact CZ-CD1 3.45Å
655	I	85.2	Confident	80.9	Confident	15 Å²	15	58.1 Å²	58.1	8%	0.077	30%	0.296	C	S	.	.	H	α-helix	trans	-61.3	-42.5	177.5	-69	164.9	0	0	0	112.2	F651 I653 T658 C659 I670 Y671 M686	F651-I655 WeakPolarHBondContact O-CB 3.47Å; F651-I655 WeakPolarHBondContact O-CD1 3.1Å; F651-I655 WeakPolarHBondContact O-CG1 3.47Å; F651-I655 PolarHBondContact O-N 2.89Å; I653-I655 VanDerWaalsContact C-N 3.34Å; I653-I655 PolarHBondContact O-N 3.24Å; I655-T658 VanDerWaalsContact CA-OG1 3.29Å; I655-T658 WeakPolarHBondContact CA-OG1 3.44Å; I655-T658 PolarHBondContact O-OG1 3.12Å; I655-C659 VanDerWaalsContact O-CB 3.24Å; I655-C659 WeakPolarHBondContact O-CB 3.3Å; I655-C659 PolarHBondContact O-N 2.9Å; I655-I670 HydrophobicContact CD1-CG2 4.39Å; I655-I670 HydrophobicContact CG1-CB 4.43Å; I655-I670 HydrophobicContact CG1-CG2 3.65Å; I655-Y671 HydrophobicContact CD1-CD1 3.88Å; I655-Y671 HydrophobicContact CD1-CE1 3.58Å; I655-Y671 HydrophobicContact CD1-CE2 4.2Å; I655-Y671 HydrophobicContact CD1-CG 4.36Å; I655-Y671 HydrophobicContact CG1-CE2 4.44Å; I655-Y671 HydrophobicContact CG2-CE2 3.9Å; I655-Y671 WeakPolarHBondContact CG2-OH 3.35Å; I655-M686 HydrophobicContact CD1-CE 3.2Å
656	K	86	Confident	81.3	Confident	142 Å²	142	54.7 Å²	54.7	62%	0.617	28%	0.278	S	S	*	.	H	α-helix	trans	-60.8	-48.2	176.2	-75.5	173.4	-178.5	179.7	0	110.9	K652 I653 Y654 C659 D660	K652-K656 VanDerWaalsContact O-CG 3.26Å; K652-K656 WeakPolarHBondContact O-CG 3.15Å; K652-K656 PolarHBondContact O-N 2.91Å; I653-K656 PolarHBondContact O-N 2.92Å; I653-K656 VanDerWaalsContact O-N 3.16Å; Y654-K656 PolarHBondContact O-N 3.35Å; K656-C659 WeakPolarHBondContact O-CB 2.96Å; K656-C659 PolarHBondContact O-N 3.1Å; K656-D660 VanDerWaalsContact O-CG 3.27Å; K656-D660 PolarHBondContact O-N 3.37Å; K656-D660 VanDerWaalsContact O-N 3.09Å
657	R	80.8	Confident	81.8	Confident	94 Å²	94	51.2 Å²	51.2	36%	0.355	26%	0.262	S	S	.	.	H	α-helix	trans	-69.5	-38.1	-177.3	-64.7	-62.4	-177.8	-176.5	3.6	113.3	E623 Y635 I653 Y654 C659 D660 L661	E623-R657 WeakPolarHBondContact OE1-CB 3.31Å; E623-R657 VanDerWaalsContact OE1-CD 3.3Å; E623-R657 WeakPolarHBondContact OE1-CD 3.26Å; E623-R657 VanDerWaalsContact OE1-CG 3.32Å; E623-R657 WeakPolarHBondContact OE1-CG 3.42Å; E623-R657 IonicContact OE1-NE 3.41Å; E623-R657 IonicContact OE2-CZ 2.88Å; E623-R657 IonicContact OE2-NE 3.16Å; E623-R657 IonicContact OE2-NH1 2.79Å; Y635-R657 HydrophobicContact CE2-CB 4Å; Y635-R657 HydrophobicContact CE2-CG 4.3Å; I653-R657 HydrophobicContact CG2-CG 4.12Å; I653-R657 VanDerWaalsContact O-CG 3.3Å; I653-R657 WeakPolarHBondContact O-CG 3.3Å; I653-R657 PolarHBondContact O-N 3.18Å; Y654-R657 PolarHBondContact O-N 3.26Å; R657-C659 VanDerWaalsContact C-N 3.33Å; R657-D660 PolarHBondContact O-N 3.24Å; R657-L661 WeakPolarHBondContact O-CB 3.16Å; R657-L661 WeakPolarHBondContact O-CG 3.35Å; R657-L661 PolarHBondContact O-N 2.82Å
658	T	83.3	Confident	82.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-38.5	175.5	57.3	0	0	0	0	111.7	M632 Y654 I655 D660 L661 Y662 G663 I670	M632-T658 HydrophobicContact CE-CG2 3.23Å; M632-T658 HydrophobicContact SD-CG2 3.29Å; M632-T658 WeakPolarHBondContact SD-CG2 3.46Å; Y654-T658 HydrophobicContact CD2-CG2 3.26Å; Y654-T658 HydrophobicContact CE2-CG2 3.12Å; Y654-T658 HydrophobicContact CG-CG2 4.11Å; Y654-T658 WeakPolarHBondContact O-CB 3.2Å; Y654-T658 WeakPolarHBondContact O-CG2 3.33Å; Y654-T658 PolarHBondContact O-N 2.9Å; Y654-T658 PolarHBondContact O-OG1 3.01Å; I655-T658 VanDerWaalsContact CA-OG1 3.29Å; I655-T658 WeakPolarHBondContact CA-OG1 3.44Å; I655-T658 PolarHBondContact O-OG1 3.12Å; T658-D660 VanDerWaalsContact C-N 3.31Å; T658-D660 PolarHBondContact O-N 3.3Å; T658-L661 PolarHBondContact O-N 3.31Å; T658-Y662 PolarHBondContact O-N 2.86Å; T658-G663 PolarHBondContact O-N 3.33Å; T658-I670 HydrophobicContact CG2-CD1 3.15Å; T658-I670 WeakPolarHBondContact OG1-CD1 3.18Å
659	C	85	Confident	82.8	Confident	50 Å²	50	53.7 Å²	53.7	34%	0.338	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-40.5	172.4	-173	0	0	0	0	111.5	I655 K656 R657 G663 T667	I655-C659 VanDerWaalsContact O-CB 3.24Å; I655-C659 WeakPolarHBondContact O-CB 3.3Å; I655-C659 PolarHBondContact O-N 2.9Å; K656-C659 WeakPolarHBondContact O-CB 2.96Å; K656-C659 PolarHBondContact O-N 3.1Å; R657-C659 VanDerWaalsContact C-N 3.33Å; C659-G663 WeakPolarHBondContact O-CA 3.29Å; C659-G663 PolarHBondContact O-N 3.42Å; C659-T667 HydrophobicContact CB-CG2 4.15Å
660	D	84.8	Confident	83	Confident	117 Å²	117	49.1 Å²	49.1	63%	0.626	25%	0.253	S	S	*	.	H	α-helix	trans	-70.3	-41.6	179	-64.6	-23.1	0	0	0	112.6	K656 R657 T658	K656-D660 VanDerWaalsContact O-CG 3.27Å; K656-D660 PolarHBondContact O-N 3.37Å; K656-D660 VanDerWaalsContact O-N 3.09Å; R657-D660 PolarHBondContact O-N 3.24Å; T658-D660 VanDerWaalsContact C-N 3.31Å; T658-D660 PolarHBondContact O-N 3.3Å
661	L	80.2	Confident	83.2	Confident	82 Å²	82	49.7 Å²	49.7	43%	0.429	26%	0.255	S	S	.	.	H	α-helix	trans	-84.1	-44.7	-172.4	-70.9	173.3	0	0	0	114.2	R657 T658	R657-L661 WeakPolarHBondContact O-CB 3.16Å; R657-L661 WeakPolarHBondContact O-CG 3.35Å; R657-L661 PolarHBondContact O-N 2.82Å; T658-L661 PolarHBondContact O-N 3.31Å
662	Y	77.7	Confident	83.4	Confident	81 Å²	81	54.1 Å²	54.1	32%	0.318	28%	0.276	S	S	.	.	H	α-helix	trans	-119.6	-1.7	-170.6	-64.5	-88.5	0	0	0	113.7	G628 R629 M632 T658 N666	G628-Y662 PolarHBondContact O-OH 3.26Å; R629-Y662 VanDerWaalsContact CA-OH 3.27Å; R629-Y662 WeakPolarHBondContact CA-OH 3.33Å; R629-Y662 WeakPolarHBondContact CG-OH 3.27Å; R629-Y662 PolarHBondContact N-OH 2.74Å; M632-Y662 HydrophobicContact CE-CD2 3.24Å; M632-Y662 HydrophobicContact CE-CE2 3.51Å; M632-Y662 HydrophobicContact CE-CG 4.14Å; M632-Y662 HydrophobicContact CG-CD2 4.14Å; M632-Y662 HydrophobicContact CG-CE2 3.38Å; M632-Y662 HydrophobicContact SD-CD2 3.8Å; M632-Y662 HydrophobicContact SD-CE2 3.61Å; T658-Y662 PolarHBondContact O-N 2.86Å; Y662-N666 WeakPolarHBondContact CB-ND2 3.22Å
663	G	79.7	Confident	83.3	Confident	27 Å²	27	57.7 Å²	57.7	28%	0.278	29%	0.288	S	S	.	.			trans	78.4	-179.6	-176.4	0	0	0	0	0	113.5	T658 C659 T665	T658-G663 PolarHBondContact O-N 3.33Å; C659-G663 WeakPolarHBondContact O-CA 3.29Å; C659-G663 PolarHBondContact O-N 3.42Å; G663-T665 VanDerWaalsContact C-N 3.32Å; G663-T665 PolarHBondContact O-N 2.75Å
664	I	80.1	Confident	83.2	Confident	75 Å²	75	55.1 Å²	55.1	39%	0.385	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-69.3	-29.3	-163.5	-53.6	168.7	0	0	0	111.9	N666 T667 L693 L697	I664-N666 VanDerWaalsContact C-N 3.29Å; I664-N666 PolarHBondContact O-N 2.98Å; I664-T667 WeakPolarHBondContact O-CB 3.3Å; I664-T667 PolarHBondContact O-N 3.44Å; I664-T667 VanDerWaalsContact O-N 3.13Å; I664-T667 PolarHBondContact O-OG1 3.05Å; I664-L693 HydrophobicContact CG2-CD1 3.81Å; I664-L693 HydrophobicContact CG2-CD2 3.62Å; I664-L693 HydrophobicContact CG2-CG 3.68Å; I664-L697 HydrophobicContact CB-CD2 4.2Å; I664-L697 HydrophobicContact CD1-CD2 4.26Å; I664-L697 HydrophobicContact CG2-CD1 3.79Å; I664-L697 HydrophobicContact CG2-CD2 3.89Å; I664-L697 HydrophobicContact CG2-CG 4.02Å
665	T	81.6	Confident	83.1	Confident	85 Å²	85	55.8 Å²	55.8	52%	0.521	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-62.8	-34.3	-176.1	52.7	0	0	0	0	113.3	G663 T667	G663-T665 VanDerWaalsContact C-N 3.32Å; G663-T665 PolarHBondContact O-N 2.75Å; T665-T667 PolarHBondContact O-N 2.55Å
666	N	79.6	Confident	83.1	Confident	65 Å²	65	62.7 Å²	62.7	35%	0.348	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-79.2	-7.5	-178.5	-73.2	8.4	0	0	0	113	Y662 I664 R668 P669	Y662-N666 WeakPolarHBondContact CB-ND2 3.22Å; I664-N666 VanDerWaalsContact C-N 3.29Å; I664-N666 PolarHBondContact O-N 2.98Å; N666-R668 VanDerWaalsContact C-N 3.34Å; N666-P669 WeakPolarHBondContact O-CD 3.28Å; N666-P669 WeakPolarHBondContact O-CG 3.48Å
667	T	82.5	Confident	82.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-75.4	-24.4	176.8	68.1	0	0	0	0	112.5	C659 I664 T665 I670 Y671	C659-T667 HydrophobicContact CB-CG2 4.15Å; I664-T667 WeakPolarHBondContact O-CB 3.3Å; I664-T667 PolarHBondContact O-N 3.44Å; I664-T667 VanDerWaalsContact O-N 3.13Å; I664-T667 PolarHBondContact O-OG1 3.05Å; T665-T667 PolarHBondContact O-N 2.55Å; T667-I670 WeakPolarHBondContact O-CB 3.26Å; T667-I670 PolarHBondContact O-N 3.39Å; T667-I670 VanDerWaalsContact O-N 3.1Å; T667-Y671 WeakPolarHBondContact O-CD2 3.42Å; T667-Y671 PolarHBondContact O-N 3.13Å
668	R	86.2	Confident	82.4	Confident	30 Å²	30	54 Å²	54	11%	0.113	28%	0.281	C	S	.	.	H	α-helix	trans	-52.1	-57.5	-179.3	-64.3	-177.7	166.8	162.6	0.5	114.4	N666 I670 Y671 E672 F690 E694 E699	N666-R668 VanDerWaalsContact C-N 3.34Å; R668-I670 PolarHBondContact O-N 3.32Å; R668-I670 VanDerWaalsContact O-N 3.16Å; R668-Y671 PolarHBondContact O-N 3.16Å; R668-E672 PolarHBondContact O-N 3.41Å; R668-E672 VanDerWaalsContact O-N 3.07Å; R668-F690 HydrophobicContact CB-CE2 4.28Å; R668-F690 HydrophobicContact CB-CZ 4.44Å; R668-F690 HydrophobicContact CG-CE2 4.12Å; R668-E694 WeakPolarHBondContact CD-OE1 3.35Å; R668-E694 VanDerWaalsContact CG-OE1 3.29Å; R668-E694 WeakPolarHBondContact CG-OE1 3.19Å; R668-E694 IonicContact CZ-OE1 3.55Å; R668-E694 IonicContact CZ-OE2 3.64Å; R668-E694 IonicContact NE-OE1 2.73Å; R668-E694 PolarHBondContact NE-OE1 3.04Å; R668-E694 IonicContact NE-OE2 3.67Å; R668-E694 PolarHBondContact NE-OE2 2.81Å; R668-E694 IonicContact NH2-OE1 3.62Å; R668-E694 IonicContact NH2-OE2 3.48Å; R668-E694 PolarHBondContact NH2-OE2 3.22Å; R668-E699 IonicContact CZ-OE1 3.98Å; R668-E699 IonicContact NH1-OE1 2.67Å; R668-E699 PolarHBondContact NH1-OE1 3.19Å; R668-E699 IonicContact NH1-OE2 2.75Å; R668-E699 IonicContact NH2-OE1 3.94Å; R668-E699 PolarHBondContact NH2-OE1 3.13Å; R668-E699 IonicContact NH2-OE2 2.81Å
669	P	85.9	Confident	82	Confident	58 Å²	58	56.7 Å²	56.7	38%	0.377	30%	0.298	S	S	.	.	H	α-helix	trans	-62.8	-25.2	179.8	25.8	-36.5	0	0	0	112.7	N666 R673	N666-P669 WeakPolarHBondContact O-CD 3.28Å; N666-P669 WeakPolarHBondContact O-CG 3.48Å; P669-R673 WeakPolarHBondContact O-CG 2.98Å; P669-R673 PolarHBondContact O-N 2.94Å
670	I	84.6	Confident	81.5	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.015	31%	0.312	C	S	.	.	H	α-helix	trans	-75.5	-40.6	180	-56.1	173.5	0	0	0	110.4	F651 Y654 I655 T658 T667 R668 R673 A674	F651-I670 HydrophobicContact CD1-CG2 4.28Å; Y654-I670 HydrophobicContact CD1-CB 4.34Å; Y654-I670 HydrophobicContact CD1-CD1 4.03Å; Y654-I670 HydrophobicContact CD1-CG1 4.18Å; Y654-I670 HydrophobicContact CD1-CG2 3.29Å; Y654-I670 HydrophobicContact CD2-CD1 4.32Å; Y654-I670 HydrophobicContact CE1-CB 4.12Å; Y654-I670 HydrophobicContact CE1-CD1 3.56Å; Y654-I670 HydrophobicContact CE1-CG1 3.55Å; Y654-I670 HydrophobicContact CE1-CG2 3.53Å; Y654-I670 HydrophobicContact CE2-CD1 3.89Å; Y654-I670 HydrophobicContact CG-CD1 4.37Å; Y654-I670 HydrophobicContact CG-CG2 4.12Å; Y654-I670 VanDerWaalsContact CZ-CD1 3.45Å; I655-I670 HydrophobicContact CD1-CG2 4.39Å; I655-I670 HydrophobicContact CG1-CB 4.43Å; I655-I670 HydrophobicContact CG1-CG2 3.65Å; T658-I670 HydrophobicContact CG2-CD1 3.15Å; T658-I670 WeakPolarHBondContact OG1-CD1 3.18Å; T667-I670 WeakPolarHBondContact O-CB 3.26Å; T667-I670 PolarHBondContact O-N 3.39Å; T667-I670 VanDerWaalsContact O-N 3.1Å; R668-I670 PolarHBondContact O-N 3.32Å; R668-I670 VanDerWaalsContact O-N 3.16Å; I670-R673 PolarHBondContact O-N 2.78Å; I670-A674 VanDerWaalsContact O-CB 3.28Å; I670-A674 WeakPolarHBondContact O-CB 3.09Å; I670-A674 PolarHBondContact O-N 3.1Å
671	Y	87.1	Confident	80.9	Confident	15 Å²	15	60.6 Å²	60.6	6%	0.059	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-43.2	172	-80.9	-72.9	0	0	0	111.6	I655 T667 R668 R673 A674 I675 M686 R689 F690 L693	I655-Y671 HydrophobicContact CD1-CD1 3.88Å; I655-Y671 HydrophobicContact CD1-CE1 3.58Å; I655-Y671 HydrophobicContact CD1-CE2 4.2Å; I655-Y671 HydrophobicContact CD1-CG 4.36Å; I655-Y671 HydrophobicContact CG1-CE2 4.44Å; I655-Y671 HydrophobicContact CG2-CE2 3.9Å; I655-Y671 WeakPolarHBondContact CG2-OH 3.35Å; T667-Y671 WeakPolarHBondContact O-CD2 3.42Å; T667-Y671 PolarHBondContact O-N 3.13Å; R668-Y671 PolarHBondContact O-N 3.16Å; Y671-R673 PolarHBondContact O-N 3.38Å; Y671-A674 WeakPolarHBondContact O-CB 3.38Å; Y671-A674 PolarHBondContact O-N 2.83Å; Y671-I675 WeakPolarHBondContact O-CD1 3.35Å; Y671-I675 WeakPolarHBondContact O-CG1 3.5Å; Y671-I675 PolarHBondContact O-N 2.91Å; Y671-M686 HydrophobicContact CE1-CE 4.45Å; Y671-R689 HydrophobicContact CE1-CB 3.88Å; Y671-F690 VanDerWaalsContact CB-CD2 3.41Å; Y671-F690 VanDerWaalsContact CB-CG 3.48Å; Y671-F690 HydrophobicContact CD1-CB 3.56Å; Y671-F690 HydrophobicContact CD1-CD2 4.18Å; Y671-F690 HydrophobicContact CD1-CG 4.05Å; Y671-F690 HydrophobicContact CD2-CB 4.32Å; Y671-F690 AromaticContact CD2-CD2 3.41Å; Y671-F690 HydrophobicContact CD2-CD2 3.41Å; Y671-F690 VanDerWaalsContact CD2-CD2 3.41Å; Y671-F690 HydrophobicContact CD2-CE2 4.03Å; Y671-F690 HydrophobicContact CD2-CG 4.11Å; Y671-F690 HydrophobicContact CE1-CB 4.04Å; Y671-F690 HydrophobicContact CE2-CD2 4.19Å; Y671-F690 HydrophobicContact CG-CB 3.7Å; Y671-F690 AromaticContact CG-CD2 3.41Å; Y671-F690 HydrophobicContact CG-CD2 3.41Å; Y671-F690 VanDerWaalsContact CG-CD2 3.41Å; Y671-F690 HydrophobicContact CG-CE2 4.17Å; Y671-F690 AromaticContact CG-CG 3.64Å; Y671-F690 HydrophobicContact CG-CG 3.64Å; Y671-L693 HydrophobicContact CE2-CD1 3.77Å
672	E	86.1	Confident	80.6	Confident	100 Å²	100	58.7 Å²	58.7	47%	0.467	30%	0.301	S	S	.	.	H	α-helix	trans	-57.3	-50.2	175.9	-70.1	169	177.9	0	0	111.1	R668 A674 I675 E676 F690	R668-E672 PolarHBondContact O-N 3.41Å; R668-E672 VanDerWaalsContact O-N 3.07Å; E672-A674 VanDerWaalsContact C-N 3.35Å; E672-A674 PolarHBondContact O-N 3.5Å; E672-I675 WeakPolarHBondContact O-CB 3.49Å; E672-I675 PolarHBondContact O-N 3.42Å; E672-E676 WeakPolarHBondContact O-CG 3.47Å; E672-E676 PolarHBondContact O-N 3.26Å; E672-E676 VanDerWaalsContact O-N 3.12Å; E672-F690 HydrophobicContact CG-CE1 4.42Å
673	R	83.5	Confident	80.6	Confident	113 Å²	113	55 Å²	55	43%	0.426	29%	0.286	S	S	.	.	H	α-helix	trans	-63.5	-36.3	175.5	-72.2	179.5	-175.6	160.4	-0.4	113.8	E636 P669 I670 Y671 I675 E676 S677	E636-R673 IonicContact OE1-CZ 3.14Å; E636-R673 IonicContact OE1-NH1 2.6Å; E636-R673 PolarHBondContact OE1-NH1 3.01Å; E636-R673 IonicContact OE1-NH2 3.07Å; E636-R673 IonicContact OE2-NH1 2.74Å; P669-R673 WeakPolarHBondContact O-CG 2.98Å; P669-R673 PolarHBondContact O-N 2.94Å; I670-R673 PolarHBondContact O-N 2.78Å; Y671-R673 PolarHBondContact O-N 3.38Å; R673-I675 VanDerWaalsContact C-N 3.28Å; R673-I675 PolarHBondContact O-N 2.97Å; R673-E676 PolarHBondContact O-N 3.2Å; R673-S677 WeakPolarHBondContact O-CB 3.34Å; R673-S677 PolarHBondContact O-N 3.35Å; R673-S677 VanDerWaalsContact O-N 3.12Å; R673-S677 PolarHBondContact O-OG 3.1Å
674	A	83.1	Confident	80.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.1	-40.6	176	0	0	0	0	0	110.5	F651 I670 Y671 E672 S677 L678 M686	F651-A674 HydrophobicContact CB-CB 4.37Å; F651-A674 HydrophobicContact CD1-CB 3.77Å; F651-A674 HydrophobicContact CD2-CB 4.15Å; F651-A674 HydrophobicContact CE1-CB 4.02Å; F651-A674 HydrophobicContact CE2-CB 4.4Å; F651-A674 HydrophobicContact CG-CB 3.85Å; F651-A674 HydrophobicContact CZ-CB 4.33Å; I670-A674 VanDerWaalsContact O-CB 3.28Å; I670-A674 WeakPolarHBondContact O-CB 3.09Å; I670-A674 PolarHBondContact O-N 3.1Å; Y671-A674 WeakPolarHBondContact O-CB 3.38Å; Y671-A674 PolarHBondContact O-N 2.83Å; E672-A674 VanDerWaalsContact C-N 3.35Å; E672-A674 PolarHBondContact O-N 3.5Å; A674-S677 PolarHBondContact O-N 2.84Å; A674-S677 PolarHBondContact O-OG 3.06Å; A674-L678 HydrophobicContact CB-CD1 4Å; A674-L678 WeakPolarHBondContact O-CB 3.17Å; A674-L678 VanDerWaalsContact O-CD1 3.26Å; A674-L678 WeakPolarHBondContact O-CD1 3.48Å; A674-L678 WeakPolarHBondContact O-CG 3.4Å; A674-L678 PolarHBondContact O-N 3.36Å; A674-M686 HydrophobicContact CB-CE 3.85Å
675	I	82.4	Confident	80.6	Confident	19 Å²	19	55 Å²	55	10%	0.097	28%	0.276	C	S	.	.	H	α-helix	trans	-66.1	-39.5	179.3	-68.5	165.7	0	0	0	111.5	Y671 E672 R673 C687 F690 Y709	Y671-I675 WeakPolarHBondContact O-CD1 3.35Å; Y671-I675 WeakPolarHBondContact O-CG1 3.5Å; Y671-I675 PolarHBondContact O-N 2.91Å; E672-I675 WeakPolarHBondContact O-CB 3.49Å; E672-I675 PolarHBondContact O-N 3.42Å; R673-I675 VanDerWaalsContact C-N 3.28Å; R673-I675 PolarHBondContact O-N 2.97Å; I675-C687 WeakPolarHBondContact CD1-SG 3.16Å; I675-C687 WeakPolarHBondContact CG1-SG 3.37Å; I675-F690 HydrophobicContact CD1-CD1 4.06Å; I675-Y709 HydrophobicContact CG2-CD1 4.03Å; I675-Y709 HydrophobicContact CG2-CE1 3.16Å
676	E	84	Confident	80.6	Confident	160 Å²	160	51 Å²	51	75%	0.748	25%	0.251	S	S	*	.	H	α-helix	trans	-69.9	-32	178.7	-69.6	173.5	174.8	0	0	113.4	E672 R673	E672-E676 WeakPolarHBondContact O-CG 3.47Å; E672-E676 PolarHBondContact O-N 3.26Å; E672-E676 VanDerWaalsContact O-N 3.12Å; R673-E676 PolarHBondContact O-N 3.2Å
677	S	78.5	Confident	80.8	Confident	40 Å²	40	47.9 Å²	47.9	28%	0.28	24%	0.235	S	C	.	.	H	α-helix	trans	-98.9	-20	-170.7	59.2	0	0	0	0	115	F651 R673 A674	F651-S677 WeakPolarHBondContact CE2-OG 3.16Å; F651-S677 WeakPolarHBondContact CZ-OG 3.29Å; R673-S677 WeakPolarHBondContact O-CB 3.34Å; R673-S677 PolarHBondContact O-N 3.35Å; R673-S677 VanDerWaalsContact O-N 3.12Å; R673-S677 PolarHBondContact O-OG 3.1Å; A674-S677 PolarHBondContact O-N 2.84Å; A674-S677 PolarHBondContact O-OG 3.06Å
678	L	75.2	Confident	80.9	Confident	14 Å²	14	50 Å²	50	7%	0.073	25%	0.246	C	C	.	.	S	Bend	trans	-89.2	148.5	-174.1	-72.1	169.5	0	0	0	112.7	K647 N648 F651 A674 E682 A683 M686	K647-L678 HydrophobicContact CB-CD2 3.78Å; N648-L678 HydrophobicContact CB-CD2 4.12Å; F651-L678 HydrophobicContact CD2-CD1 4.17Å; F651-L678 HydrophobicContact CD2-CD2 4.05Å; F651-L678 HydrophobicContact CD2-CG 4.12Å; F651-L678 HydrophobicContact CE2-CD2 4.34Å; F651-L678 HydrophobicContact CE2-CG 4.26Å; A674-L678 HydrophobicContact CB-CD1 4Å; A674-L678 WeakPolarHBondContact O-CB 3.17Å; A674-L678 VanDerWaalsContact O-CD1 3.26Å; A674-L678 WeakPolarHBondContact O-CD1 3.48Å; A674-L678 WeakPolarHBondContact O-CG 3.4Å; A674-L678 PolarHBondContact O-N 3.36Å; L678-E682 HydrophobicContact CB-CB 4.28Å; L678-E682 HydrophobicContact CD1-CB 4.45Å; L678-E682 HydrophobicContact CD2-CB 4.36Å; L678-A683 HydrophobicContact CB-CB 4.23Å; L678-M686 HydrophobicContact CD1-CB 4.25Å; L678-M686 HydrophobicContact CD1-CG 3.5Å; L678-M686 VanDerWaalsContact CD1-CG 3.5Å
679	P	74.7	Confident	80.9	Confident	56 Å²	56	53 Å²	53	36%	0.364	26%	0.257	S	S	.	.			trans	-62.4	153.3	169.8	22.2	-28.1	0	0	0	111.9	N681 E682 A683	P679-N681 PolarHBondContact O-N 2.94Å; P679-E682 HydrophobicContact CG-CG 4.25Å; P679-E682 PolarHBondContact O-N 2.68Å; P679-A683 PolarHBondContact O-N 2.94Å
680	E	73.1	Confident	80.9	Confident	134 Å²	134	50.7 Å²	50.7	63%	0.626	24%	0.241	S	C	*	.	H	α-helix	trans	-52.9	-32.3	-166.7	-62	-179.9	174.5	0	0	114.7	R684	E680-R684 WeakPolarHBondContact O-CD 3.24Å; E680-R684 WeakPolarHBondContact O-CG 3.41Å; E680-R684 PolarHBondContact O-N 3.08Å; E680-R684 PolarHBondContact O-NE 2.87Å; E680-R684 VanDerWaalsContact O-NE 3.11Å
681	N	73.3	Confident	80.9	Confident	115 Å²	115	50.5 Å²	50.5	62%	0.615	24%	0.24	S	C	*	.	H	α-helix	trans	-70.3	-41.7	178	-70.4	-28.9	0	0	0	112.8	P679 R684	P679-N681 PolarHBondContact O-N 2.94Å; N681-R684 PolarHBondContact OD1-NH2 3.22Å
682	E	73.4	Confident	80.8	Confident	43 Å²	43	52.1 Å²	52.1	20%	0.201	25%	0.25	C	S	.	.	H	α-helix	trans	-83.2	-35.3	-176.1	-56.3	-167	124.2	0	0	111.3	N648 L678 P679 R684 E685 M686	N648-E682 VanDerWaalsContact CB-OE1 3.29Å; N648-E682 WeakPolarHBondContact CB-OE1 3.48Å; N648-E682 WeakPolarHBondContact CB-OE2 3.37Å; N648-E682 PolarHBondContact ND2-OE1 3.06Å; L678-E682 HydrophobicContact CB-CB 4.28Å; L678-E682 HydrophobicContact CD1-CB 4.45Å; L678-E682 HydrophobicContact CD2-CB 4.36Å; P679-E682 HydrophobicContact CG-CG 4.25Å; P679-E682 PolarHBondContact O-N 2.68Å; E682-R684 PolarHBondContact O-N 3.4Å; E682-E685 PolarHBondContact O-N 3.5Å; E682-E685 VanDerWaalsContact O-N 3.08Å; E682-M686 WeakPolarHBondContact O-CG 3.16Å; E682-M686 PolarHBondContact O-N 3.42Å
683	A	78.6	Confident	80.7	Confident	2 Å²	2	48.6 Å²	48.6	2%	0.017	23%	0.234	C	C	.	.	H	α-helix	trans	-53.7	-38.9	170.5	0	0	0	0	0	111	L678 P679 M686 C687 L713	L678-A683 HydrophobicContact CB-CB 4.23Å; P679-A683 PolarHBondContact O-N 2.94Å; A683-M686 PolarHBondContact O-N 3.49Å; A683-C687 VanDerWaalsContact O-CB 3.23Å; A683-C687 WeakPolarHBondContact O-CB 3.29Å; A683-C687 PolarHBondContact O-N 2.93Å; A683-C687 PolarHBondContact O-SG 3.02Å; A683-L713 HydrophobicContact CB-CD1 4.22Å
684	R	76.4	Confident	80.7	Confident	34 Å²	34	43.2 Å²	43.2	13%	0.128	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-41.6	176.6	-70.9	173.9	-47.2	132.4	-22	113.3	E680 N681 E682 M686 L688 L713 C714 H719	E680-R684 WeakPolarHBondContact O-CD 3.24Å; E680-R684 WeakPolarHBondContact O-CG 3.41Å; E680-R684 PolarHBondContact O-N 3.08Å; E680-R684 PolarHBondContact O-NE 2.87Å; E680-R684 VanDerWaalsContact O-NE 3.11Å; N681-R684 PolarHBondContact OD1-NH2 3.22Å; E682-R684 PolarHBondContact O-N 3.4Å; R684-M686 VanDerWaalsContact C-N 3.3Å; R684-M686 PolarHBondContact O-N 3.12Å; R684-L688 WeakPolarHBondContact O-CB 3.45Å; R684-L688 WeakPolarHBondContact O-CG 3.31Å; R684-L688 PolarHBondContact O-N 3.23Å; R684-L713 WeakPolarHBondContact CD-O 3.47Å; R684-L713 HydrophobicContact CG-CB 3.85Å; R684-L713 HydrophobicContact CG-CD1 4.46Å; R684-C714 VanDerWaalsContact CD-SG 3.51Å; R684-H719 VanDerWaalsContact CZ-NE2 3.31Å; R684-H719 PolarHBondContact NH1-CD2 2.92Å; R684-H719 PolarHBondContact NH1-CE1 2.76Å; R684-H719 PolarHBondContact NH1-ND1 2.98Å; R684-H719 VanDerWaalsContact NH1-ND1 3.17Å; R684-H719 PolarHBondContact NH1-NE2 3.22Å; R684-H719 PolarHBondContact NH2-CE1 3.09Å; R684-H719 VanDerWaalsContact NH2-CE1 3.34Å; R684-H719 PolarHBondContact NH2-NE2 3.38Å
685	E	82.4	Confident	80.8	Confident	69 Å²	69	47.4 Å²	47.4	32%	0.322	23%	0.23	S	C	.	.	H	α-helix	trans	-62.6	-42.3	175.6	-165.3	-167.4	171	0	0	110.6	K652 E682 L688 R689	K652-E685 IonicContact NZ-OE1 2.72Å; K652-E685 IonicContact NZ-OE2 3.32Å; K652-E685 PolarHBondContact NZ-OE2 3.3Å; E682-E685 PolarHBondContact O-N 3.5Å; E682-E685 VanDerWaalsContact O-N 3.08Å; E685-L688 PolarHBondContact O-N 3.12Å; E685-R689 VanDerWaalsContact O-CG 3.31Å; E685-R689 WeakPolarHBondContact O-CG 3.2Å; E685-R689 PolarHBondContact O-N 3.42Å; E685-R689 IonicContact OE1-CZ 3.96Å; E685-R689 IonicContact OE1-NE 2.57Å; E685-R689 PolarHBondContact OE1-NE 2.82Å; E685-R689 IonicContact OE1-NH2 2.97Å; E685-R689 PolarHBondContact OE1-NH2 3.39Å
686	M	82.7	Confident	80.7	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.6	-41.9	-179.6	-65	-61.4	-79.7	0	0	112.2	F651 K652 I655 Y671 A674 L678 E682 A683 R684 L688 R689 F690	F651-M686 HydrophobicContact CB-CE 3.74Å; K652-M686 HydrophobicContact CG-SD 4.43Å; I655-M686 HydrophobicContact CD1-CE 3.2Å; Y671-M686 HydrophobicContact CE1-CE 4.45Å; A674-M686 HydrophobicContact CB-CE 3.85Å; L678-M686 HydrophobicContact CD1-CB 4.25Å; L678-M686 HydrophobicContact CD1-CG 3.5Å; L678-M686 VanDerWaalsContact CD1-CG 3.5Å; E682-M686 WeakPolarHBondContact O-CG 3.16Å; E682-M686 PolarHBondContact O-N 3.42Å; A683-M686 PolarHBondContact O-N 3.49Å; R684-M686 VanDerWaalsContact C-N 3.3Å; R684-M686 PolarHBondContact O-N 3.12Å; M686-L688 PolarHBondContact O-N 3.17Å; M686-R689 WeakPolarHBondContact O-CB 3.43Å; M686-R689 PolarHBondContact O-N 3.41Å; M686-F690 WeakPolarHBondContact O-CB 3.37Å; M686-F690 PolarHBondContact O-N 3.11Å
687	C	83.4	Confident	80.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-43.3	172.1	-79.6	0	0	0	0	112.9	I675 A683 R689 F690 A691 I706 C710	I675-C687 WeakPolarHBondContact CD1-SG 3.16Å; I675-C687 WeakPolarHBondContact CG1-SG 3.37Å; A683-C687 VanDerWaalsContact O-CB 3.23Å; A683-C687 WeakPolarHBondContact O-CB 3.29Å; A683-C687 PolarHBondContact O-N 2.93Å; A683-C687 PolarHBondContact O-SG 3.02Å; C687-R689 VanDerWaalsContact C-N 3.3Å; C687-R689 PolarHBondContact O-N 3.22Å; C687-F690 WeakPolarHBondContact O-CB 3.35Å; C687-F690 PolarHBondContact O-N 3.46Å; C687-A691 WeakPolarHBondContact O-CB 3.38Å; C687-A691 PolarHBondContact O-N 2.89Å; C687-I706 HydrophobicContact CB-CG2 4.43Å; C687-C710 WeakPolarHBondContact CB-SG 3.42Å
688	L	85.1	Confident	80.8	Confident	45 Å²	45	50.9 Å²	50.9	24%	0.236	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-38.7	175.5	-82.8	175.1	0	0	0	111.8	R684 E685 M686 N692 F707 F722 L725	R684-L688 WeakPolarHBondContact O-CB 3.45Å; R684-L688 WeakPolarHBondContact O-CG 3.31Å; R684-L688 PolarHBondContact O-N 3.23Å; E685-L688 PolarHBondContact O-N 3.12Å; M686-L688 PolarHBondContact O-N 3.17Å; L688-N692 WeakPolarHBondContact O-CB 3.15Å; L688-N692 PolarHBondContact O-N 3.41Å; L688-N692 PolarHBondContact O-ND2 3.08Å; L688-F707 HydrophobicContact CD2-CE1 4.38Å; L688-F722 HydrophobicContact CD2-CD2 3.71Å; L688-F722 HydrophobicContact CD2-CE2 4.14Å; L688-F722 HydrophobicContact CG-CD2 4.28Å; L688-L725 HydrophobicContact CD2-CD1 4.12Å
689	R	85.1	Confident	81.2	Confident	92 Å²	92	53.5 Å²	53.5	35%	0.347	27%	0.266	S	S	.	.	H	α-helix	trans	-67	-40.4	174.3	-70.8	170.2	179.1	-156.7	-1.5	111.3	K652 Y671 E685 M686 C687 N692 L693	K652-R689 VanDerWaalsContact CE-NH1 3.27Å; Y671-R689 HydrophobicContact CE1-CB 3.88Å; E685-R689 VanDerWaalsContact O-CG 3.31Å; E685-R689 WeakPolarHBondContact O-CG 3.2Å; E685-R689 PolarHBondContact O-N 3.42Å; E685-R689 IonicContact OE1-CZ 3.96Å; E685-R689 IonicContact OE1-NE 2.57Å; E685-R689 PolarHBondContact OE1-NE 2.82Å; E685-R689 IonicContact OE1-NH2 2.97Å; E685-R689 PolarHBondContact OE1-NH2 3.39Å; M686-R689 WeakPolarHBondContact O-CB 3.43Å; M686-R689 PolarHBondContact O-N 3.41Å; C687-R689 VanDerWaalsContact C-N 3.3Å; C687-R689 PolarHBondContact O-N 3.22Å; R689-N692 PolarHBondContact O-N 3.46Å; R689-L693 WeakPolarHBondContact O-CB 3.42Å; R689-L693 PolarHBondContact O-N 3.41Å
690	F	86.1	Confident	81.7	Confident	10 Å²	10	53.1 Å²	53.1	4%	0.044	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-47.8	177.2	-169.9	-146.5	0	0	0	111.7	R668 Y671 E672 I675 M686 C687 N692 L693 E694 I706	R668-F690 HydrophobicContact CB-CE2 4.28Å; R668-F690 HydrophobicContact CB-CZ 4.44Å; R668-F690 HydrophobicContact CG-CE2 4.12Å; Y671-F690 VanDerWaalsContact CB-CD2 3.41Å; Y671-F690 VanDerWaalsContact CB-CG 3.48Å; Y671-F690 HydrophobicContact CD1-CB 3.56Å; Y671-F690 HydrophobicContact CD1-CD2 4.18Å; Y671-F690 HydrophobicContact CD1-CG 4.05Å; Y671-F690 HydrophobicContact CD2-CB 4.32Å; Y671-F690 AromaticContact CD2-CD2 3.41Å; Y671-F690 HydrophobicContact CD2-CD2 3.41Å; Y671-F690 VanDerWaalsContact CD2-CD2 3.41Å; Y671-F690 HydrophobicContact CD2-CE2 4.03Å; Y671-F690 HydrophobicContact CD2-CG 4.11Å; Y671-F690 HydrophobicContact CE1-CB 4.04Å; Y671-F690 HydrophobicContact CE2-CD2 4.19Å; Y671-F690 HydrophobicContact CG-CB 3.7Å; Y671-F690 AromaticContact CG-CD2 3.41Å; Y671-F690 HydrophobicContact CG-CD2 3.41Å; Y671-F690 VanDerWaalsContact CG-CD2 3.41Å; Y671-F690 HydrophobicContact CG-CE2 4.17Å; Y671-F690 AromaticContact CG-CG 3.64Å; Y671-F690 HydrophobicContact CG-CG 3.64Å; E672-F690 HydrophobicContact CG-CE1 4.42Å; I675-F690 HydrophobicContact CD1-CD1 4.06Å; M686-F690 WeakPolarHBondContact O-CB 3.37Å; M686-F690 PolarHBondContact O-N 3.11Å; C687-F690 WeakPolarHBondContact O-CB 3.35Å; C687-F690 PolarHBondContact O-N 3.46Å; F690-N692 VanDerWaalsContact C-N 3.3Å; F690-N692 PolarHBondContact O-N 3.02Å; F690-L693 WeakPolarHBondContact O-CB 3.45Å; F690-L693 PolarHBondContact O-N 2.99Å; F690-L693 VanDerWaalsContact O-N 3.08Å; F690-E694 HydrophobicContact CD2-CG 4.26Å; F690-E694 HydrophobicContact CE2-CG 3.99Å; F690-E694 WeakPolarHBondContact CE2-OE1 3.2Å; F690-E694 HydrophobicContact CZ-CG 4.39Å; F690-E694 PolarHBondContact O-N 3.39Å; F690-I706 HydrophobicContact CB-CD1 4.44Å; F690-I706 HydrophobicContact CB-CG2 4.5Å; F690-I706 HydrophobicContact CD1-CB 4.43Å; F690-I706 HydrophobicContact CD1-CD1 3.19Å; F690-I706 HydrophobicContact CD1-CG1 3.51Å; F690-I706 HydrophobicContact CD1-CG2 4.02Å; F690-I706 HydrophobicContact CD2-CD1 4.25Å; F690-I706 HydrophobicContact CE1-CD1 3.28Å; F690-I706 HydrophobicContact CE1-CG1 3.57Å; F690-I706 HydrophobicContact CE2-CD1 4.3Å; F690-I706 HydrophobicContact CG-CD1 3.71Å; F690-I706 HydrophobicContact CG-CG1 4.43Å; F690-I706 HydrophobicContact CZ-CD1 3.86Å
691	A	84.3	Confident	82.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.7	-39.1	176.1	0	0	0	0	0	112.2	C687 L693 R695 I706 F707	C687-A691 WeakPolarHBondContact O-CB 3.38Å; C687-A691 PolarHBondContact O-N 2.89Å; A691-L693 VanDerWaalsContact C-N 3.34Å; A691-R695 VanDerWaalsContact O-CB 3.28Å; A691-R695 WeakPolarHBondContact O-CB 3.41Å; A691-R695 PolarHBondContact O-N 3.22Å; A691-I706 HydrophobicContact CB-CB 4.39Å; A691-I706 HydrophobicContact CB-CG2 3.93Å; A691-F707 HydrophobicContact CB-CD1 4.47Å; A691-F707 HydrophobicContact CB-CD2 4.34Å; A691-F707 HydrophobicContact CB-CE1 4.02Å; A691-F707 HydrophobicContact CB-CE2 3.84Å; A691-F707 HydrophobicContact CB-CZ 3.66Å
692	N	85.2	Confident	82.7	Confident	49 Å²	49	52.3 Å²	52.3	26%	0.262	25%	0.252	S	S	.	.	H	α-helix	trans	-66.9	-34.6	174.9	-83.7	-51.7	0	0	0	113.1	L688 R689 F690 R695 K696	L688-N692 WeakPolarHBondContact O-CB 3.15Å; L688-N692 PolarHBondContact O-N 3.41Å; L688-N692 PolarHBondContact O-ND2 3.08Å; R689-N692 PolarHBondContact O-N 3.46Å; F690-N692 VanDerWaalsContact C-N 3.3Å; F690-N692 PolarHBondContact O-N 3.02Å; N692-R695 PolarHBondContact OD1-NH2 3.06Å; N692-K696 VanDerWaalsContact O-CG 3.32Å; N692-K696 WeakPolarHBondContact O-CG 3.42Å; N692-K696 PolarHBondContact O-N 3.3Å; N692-K696 VanDerWaalsContact O-N 3.17Å
693	L	83.7	Confident	83.3	Confident	25 Å²	25	50.2 Å²	50.2	13%	0.131	24%	0.242	C	C	.	.	H	α-helix	trans	-71.8	-44.9	177.4	-179	145.5	0	0	0	111.1	I664 Y671 R689 F690 A691 R695 K696 L697	I664-L693 HydrophobicContact CG2-CD1 3.81Å; I664-L693 HydrophobicContact CG2-CD2 3.62Å; I664-L693 HydrophobicContact CG2-CG 3.68Å; Y671-L693 HydrophobicContact CE2-CD1 3.77Å; R689-L693 WeakPolarHBondContact O-CB 3.42Å; R689-L693 PolarHBondContact O-N 3.41Å; F690-L693 WeakPolarHBondContact O-CB 3.45Å; F690-L693 PolarHBondContact O-N 2.99Å; F690-L693 VanDerWaalsContact O-N 3.08Å; A691-L693 VanDerWaalsContact C-N 3.34Å; L693-R695 VanDerWaalsContact C-N 3.32Å; L693-R695 PolarHBondContact O-N 3.46Å; L693-K696 WeakPolarHBondContact O-CB 3.23Å; L693-K696 PolarHBondContact O-N 2.95Å; L693-L697 HydrophobicContact CD2-CD1 3.89Å; L693-L697 PolarHBondContact O-N 3.48Å
694	E	84.1	Confident	83.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-63.7	-37.8	174.5	-69.1	-56	151	0	0	112.2	R668 F690 K696 L697 G698 E699 R702 A703 I706	R668-E694 WeakPolarHBondContact CD-OE1 3.35Å; R668-E694 VanDerWaalsContact CG-OE1 3.29Å; R668-E694 WeakPolarHBondContact CG-OE1 3.19Å; R668-E694 IonicContact CZ-OE1 3.55Å; R668-E694 IonicContact CZ-OE2 3.64Å; R668-E694 IonicContact NE-OE1 2.73Å; R668-E694 PolarHBondContact NE-OE1 3.04Å; R668-E694 IonicContact NE-OE2 3.67Å; R668-E694 PolarHBondContact NE-OE2 2.81Å; R668-E694 IonicContact NH2-OE1 3.62Å; R668-E694 IonicContact NH2-OE2 3.48Å; R668-E694 PolarHBondContact NH2-OE2 3.22Å; F690-E694 HydrophobicContact CD2-CG 4.26Å; F690-E694 HydrophobicContact CE2-CG 3.99Å; F690-E694 WeakPolarHBondContact CE2-OE1 3.2Å; F690-E694 HydrophobicContact CZ-CG 4.39Å; F690-E694 PolarHBondContact O-N 3.39Å; E694-K696 VanDerWaalsContact C-N 3.26Å; E694-K696 PolarHBondContact O-N 3.36Å; E694-L697 PolarHBondContact O-N 3.03Å; E694-L697 VanDerWaalsContact O-N 3.16Å; E694-G698 PolarHBondContact O-N 3.44Å; E694-G698 VanDerWaalsContact O-N 3.07Å; E694-E699 PolarHBondContact O-N 2.62Å; E694-R702 HydrophobicContact CG-CB 4.26Å; E694-A703 HydrophobicContact CB-CB 4.07Å; E694-I706 HydrophobicContact CB-CD1 4.3Å; E694-I706 HydrophobicContact CG-CD1 3.65Å
695	R	84	Confident	84.2	Confident	88 Å²	88	53.8 Å²	53.8	33%	0.332	27%	0.268	S	S	.	.	H	α-helix	trans	-59.1	-38	171.4	-176.3	179.9	65.9	165.9	-3.2	112	A691 N692 L693 G698 F729	A691-R695 VanDerWaalsContact O-CB 3.28Å; A691-R695 WeakPolarHBondContact O-CB 3.41Å; A691-R695 PolarHBondContact O-N 3.22Å; N692-R695 PolarHBondContact OD1-NH2 3.06Å; L693-R695 VanDerWaalsContact C-N 3.32Å; L693-R695 PolarHBondContact O-N 3.46Å; R695-G698 PolarHBondContact O-N 3.09Å; R695-F729 HydrophobicContact CG-CE2 4.46Å
696	K	82.2	Confident	84.4	Confident	178 Å²	178	51.2 Å²	51.2	77%	0.774	26%	0.256	S	S	*	.	H	α-helix	trans	-71.7	-31	177.3	-74.5	174.4	-179.1	-176.5	0	112.7	N692 L693 E694 G698	N692-K696 VanDerWaalsContact O-CG 3.32Å; N692-K696 WeakPolarHBondContact O-CG 3.42Å; N692-K696 PolarHBondContact O-N 3.3Å; N692-K696 VanDerWaalsContact O-N 3.17Å; L693-K696 WeakPolarHBondContact O-CB 3.23Å; L693-K696 PolarHBondContact O-N 2.95Å; E694-K696 VanDerWaalsContact C-N 3.26Å; E694-K696 PolarHBondContact O-N 3.36Å; K696-G698 VanDerWaalsContact C-N 3.31Å
697	L	82.5	Confident	84.6	Confident	65 Å²	65	51.6 Å²	51.6	34%	0.34	26%	0.258	S	S	.	.	H	α-helix	trans	-78.5	-14.5	175.9	-69	176	0	0	0	113.3	I664 L693 E694	I664-L697 HydrophobicContact CB-CD2 4.2Å; I664-L697 HydrophobicContact CD1-CD2 4.26Å; I664-L697 HydrophobicContact CG2-CD1 3.79Å; I664-L697 HydrophobicContact CG2-CD2 3.89Å; I664-L697 HydrophobicContact CG2-CG 4.02Å; L693-L697 HydrophobicContact CD2-CD1 3.89Å; L693-L697 PolarHBondContact O-N 3.48Å; E694-L697 PolarHBondContact O-N 3.03Å; E694-L697 VanDerWaalsContact O-N 3.16Å
698	G	80.9	Confident	84.7	Confident	50 Å²	50	53.1 Å²	53.1	52%	0.515	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	4.5	-179.9	0	0	0	0	0	114.4	E694 R695 K696 I700	E694-G698 PolarHBondContact O-N 3.44Å; E694-G698 VanDerWaalsContact O-N 3.07Å; R695-G698 PolarHBondContact O-N 3.09Å; K696-G698 VanDerWaalsContact C-N 3.31Å; G698-I700 VanDerWaalsContact C-N 3.32Å; G698-I700 PolarHBondContact O-N 2.93Å
699	E	84.5	Confident	84.6	Confident	69 Å²	69	55.5 Å²	55.5	32%	0.322	28%	0.278	S	S	.	.			trans	-84.7	77.6	175.4	-67.3	-161.7	-138.5	0	0	110.6	R668 E694 D701 R702 A703	R668-E699 IonicContact CZ-OE1 3.98Å; R668-E699 IonicContact NH1-OE1 2.67Å; R668-E699 PolarHBondContact NH1-OE1 3.19Å; R668-E699 IonicContact NH1-OE2 2.75Å; R668-E699 IonicContact NH2-OE1 3.94Å; R668-E699 PolarHBondContact NH2-OE1 3.13Å; R668-E699 IonicContact NH2-OE2 2.81Å; E694-E699 PolarHBondContact O-N 2.62Å; E699-D701 VanDerWaalsContact C-N 3.32Å; E699-D701 PolarHBondContact O-N 3.38Å; E699-R702 HydrophobicContact CB-CB 4.41Å; E699-R702 HydrophobicContact CB-CG 4.42Å; E699-R702 PolarHBondContact O-N 3.06Å; E699-R702 IonicContact OE1-NH2 3.48Å; E699-R702 WeakPolarHBondContact OE2-CD 3.42Å; E699-R702 IonicContact OE2-CZ 2.89Å; E699-R702 IonicContact OE2-NE 2.88Å; E699-R702 PolarHBondContact OE2-NE 3.16Å; E699-R702 IonicContact OE2-NH2 3.82Å; E699-R702 PolarHBondContact OE2-NH2 3.04Å; E699-R702 VanDerWaalsContact OE2-NH2 3.07Å; E699-A703 PolarHBondContact O-N 2.98Å; E699-A703 VanDerWaalsContact O-N 3.14Å
700	I	84.5	Confident	84.5	Confident	48 Å²	48	51.2 Å²	51.2	25%	0.246	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-37.8	-174.7	-59.4	165.4	0	0	0	111.3	G698 R702 A703 R704 F729 H733	G698-I700 VanDerWaalsContact C-N 3.32Å; G698-I700 PolarHBondContact O-N 2.93Å; I700-R702 PolarHBondContact O-N 3.22Å; I700-A703 PolarHBondContact O-N 3.49Å; I700-R704 VanDerWaalsContact CG2-NH2 3.3Å; I700-R704 WeakPolarHBondContact O-CG 3.42Å; I700-R704 PolarHBondContact O-N 2.94Å; I700-F729 HydrophobicContact CB-CZ 4.45Å; I700-F729 HydrophobicContact CG2-CE1 4.18Å; I700-F729 HydrophobicContact CG2-CE2 4.37Å; I700-F729 HydrophobicContact CG2-CZ 3.55Å; I700-H733 HydrophobicContact CD1-CB 4.08Å; I700-H733 WeakPolarHBondContact CD1-ND1 3.27Å; I700-H733 HydrophobicContact CG1-CB 4.38Å; I700-H733 HydrophobicContact CG2-CB 3.53Å
701	D	85.3	Confident	84.1	Confident	122 Å²	122	50.8 Å²	50.8	65%	0.652	26%	0.26	S	S	*	.	H	α-helix	trans	-65.4	-37.6	-179	-61.5	-41.7	0	0	0	112.3	E699 R704 A705	E699-D701 VanDerWaalsContact C-N 3.32Å; E699-D701 PolarHBondContact O-N 3.38Å; D701-R704 PolarHBondContact O-N 3.17Å; D701-R704 IonicContact OD1-CZ 3.88Å; D701-R704 IonicContact OD1-NH1 3Å; D701-R704 PolarHBondContact OD1-NH1 3.42Å; D701-A705 PolarHBondContact O-N 3.37Å
702	R	83.4	Confident	83.8	Confident	109 Å²	109	57.5 Å²	57.5	41%	0.411	29%	0.291	S	S	.	.	H	α-helix	trans	-68.3	-43.5	172.9	-66.7	-164.8	-157.3	-159.3	9.4	111.5	E694 E699 I700 R704 A705 I706	E694-R702 HydrophobicContact CG-CB 4.26Å; E699-R702 HydrophobicContact CB-CB 4.41Å; E699-R702 HydrophobicContact CB-CG 4.42Å; E699-R702 PolarHBondContact O-N 3.06Å; E699-R702 IonicContact OE1-NH2 3.48Å; E699-R702 WeakPolarHBondContact OE2-CD 3.42Å; E699-R702 IonicContact OE2-CZ 2.89Å; E699-R702 IonicContact OE2-NE 2.88Å; E699-R702 PolarHBondContact OE2-NE 3.16Å; E699-R702 IonicContact OE2-NH2 3.82Å; E699-R702 PolarHBondContact OE2-NH2 3.04Å; E699-R702 VanDerWaalsContact OE2-NH2 3.07Å; I700-R702 PolarHBondContact O-N 3.22Å; R702-R704 VanDerWaalsContact C-N 3.26Å; R702-R704 PolarHBondContact O-N 3.07Å; R702-A705 PolarHBondContact O-N 3.1Å; R702-A705 VanDerWaalsContact O-N 3.12Å; R702-I706 WeakPolarHBondContact O-CD1 3.48Å; R702-I706 VanDerWaalsContact O-CG1 3.25Å; R702-I706 WeakPolarHBondContact O-CG1 3.45Å; R702-I706 PolarHBondContact O-N 3.31Å
703	A	85	Confident	83.2	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-56.8	-41.9	174.7	0	0	0	0	0	111.3	E694 E699 I700 I706 F707 F729	E694-A703 HydrophobicContact CB-CB 4.07Å; E699-A703 PolarHBondContact O-N 2.98Å; E699-A703 VanDerWaalsContact O-N 3.14Å; I700-A703 PolarHBondContact O-N 3.49Å; A703-I706 PolarHBondContact O-N 2.98Å; A703-F707 WeakPolarHBondContact O-CD2 3.46Å; A703-F707 PolarHBondContact O-N 2.93Å; A703-F729 HydrophobicContact CB-CE2 3.54Å; A703-F729 HydrophobicContact CB-CZ 3.58Å
704	R	87.4	Confident	82.4	Confident	49 Å²	49	55.9 Å²	55.9	19%	0.185	28%	0.283	C	S	.	.	H	α-helix	trans	-60.3	-46.6	172.9	-74.4	-165.7	-154.2	99.1	-5.9	112.9	I700 D701 R702 I706 F707 A708 F729 E730 H733	I700-R704 VanDerWaalsContact CG2-NH2 3.3Å; I700-R704 WeakPolarHBondContact O-CG 3.42Å; I700-R704 PolarHBondContact O-N 2.94Å; D701-R704 PolarHBondContact O-N 3.17Å; D701-R704 IonicContact OD1-CZ 3.88Å; D701-R704 IonicContact OD1-NH1 3Å; D701-R704 PolarHBondContact OD1-NH1 3.42Å; R702-R704 VanDerWaalsContact C-N 3.26Å; R702-R704 PolarHBondContact O-N 3.07Å; R704-I706 VanDerWaalsContact C-N 3.29Å; R704-I706 PolarHBondContact O-N 3.42Å; R704-F707 PolarHBondContact O-N 3.05Å; R704-A708 WeakPolarHBondContact O-CB 3.32Å; R704-A708 PolarHBondContact O-N 2.8Å; R704-F729 HydrophobicContact CB-CE1 4.48Å; R704-F729 HydrophobicContact CG-CD1 4.4Å; R704-F729 HydrophobicContact CG-CE1 3.37Å; R704-F729 HydrophobicContact CG-CZ 3.94Å; R704-E730 WeakPolarHBondContact CD-OE1 3.2Å; R704-E730 WeakPolarHBondContact CG-OE1 3.08Å; R704-E730 IonicContact NE-OE1 2.72Å; R704-E730 IonicContact NE-OE2 3.92Å; R704-E730 PolarHBondContact NE-OE2 2.82Å; R704-H733 PolarHBondContact NH2-O 3.12Å
705	A	87.3	Confident	81.6	Confident	62 Å²	62	57.4 Å²	57.4	51%	0.512	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-40.8	177.9	0	0	0	0	0	111.7	D701 R702 A708 Y709	D701-A705 PolarHBondContact O-N 3.37Å; R702-A705 PolarHBondContact O-N 3.1Å; R702-A705 VanDerWaalsContact O-N 3.12Å; A705-A708 PolarHBondContact O-N 3.48Å; A705-Y709 PolarHBondContact O-N 3.49Å
706	I	86.4	Confident	81	Confident	14 Å²	14	53.8 Å²	53.8	7%	0.072	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-46.4	176	-62.1	156.4	0	0	0	110.4	C687 F690 A691 E694 R702 A703 R704 A708 Y709 C710	C687-I706 HydrophobicContact CB-CG2 4.43Å; F690-I706 HydrophobicContact CB-CD1 4.44Å; F690-I706 HydrophobicContact CB-CG2 4.5Å; F690-I706 HydrophobicContact CD1-CB 4.43Å; F690-I706 HydrophobicContact CD1-CD1 3.19Å; F690-I706 HydrophobicContact CD1-CG1 3.51Å; F690-I706 HydrophobicContact CD1-CG2 4.02Å; F690-I706 HydrophobicContact CD2-CD1 4.25Å; F690-I706 HydrophobicContact CE1-CD1 3.28Å; F690-I706 HydrophobicContact CE1-CG1 3.57Å; F690-I706 HydrophobicContact CE2-CD1 4.3Å; F690-I706 HydrophobicContact CG-CD1 3.71Å; F690-I706 HydrophobicContact CG-CG1 4.43Å; F690-I706 HydrophobicContact CZ-CD1 3.86Å; A691-I706 HydrophobicContact CB-CB 4.39Å; A691-I706 HydrophobicContact CB-CG2 3.93Å; E694-I706 HydrophobicContact CB-CD1 4.3Å; E694-I706 HydrophobicContact CG-CD1 3.65Å; R702-I706 WeakPolarHBondContact O-CD1 3.48Å; R702-I706 VanDerWaalsContact O-CG1 3.25Å; R702-I706 WeakPolarHBondContact O-CG1 3.45Å; R702-I706 PolarHBondContact O-N 3.31Å; A703-I706 PolarHBondContact O-N 2.98Å; R704-I706 VanDerWaalsContact C-N 3.29Å; R704-I706 PolarHBondContact O-N 3.42Å; I706-A708 VanDerWaalsContact C-N 3.3Å; I706-A708 PolarHBondContact O-N 3.17Å; I706-Y709 PolarHBondContact O-N 2.86Å; I706-C710 PolarHBondContact O-N 3.03Å; I706-C710 PolarHBondContact O-SG 3.47Å
707	F	86.1	Confident	80.1	Confident	8 Å²	8	50.3 Å²	50.3	4%	0.035	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-38.6	175.5	-76.7	-64	0	0	0	112.4	L688 A691 A703 R704 C710 S711 F722 W726 F729	L688-F707 HydrophobicContact CD2-CE1 4.38Å; A691-F707 HydrophobicContact CB-CD1 4.47Å; A691-F707 HydrophobicContact CB-CD2 4.34Å; A691-F707 HydrophobicContact CB-CE1 4.02Å; A691-F707 HydrophobicContact CB-CE2 3.84Å; A691-F707 HydrophobicContact CB-CZ 3.66Å; A703-F707 WeakPolarHBondContact O-CD2 3.46Å; A703-F707 PolarHBondContact O-N 2.93Å; R704-F707 PolarHBondContact O-N 3.05Å; F707-C710 WeakPolarHBondContact O-CB 3.34Å; F707-C710 PolarHBondContact O-N 2.95Å; F707-S711 PolarHBondContact O-N 3.01Å; F707-F722 AromaticContact CD1-CE2 3.69Å; F707-F722 HydrophobicContact CD1-CE2 3.69Å; F707-F722 AromaticContact CD1-CZ 3.88Å; F707-F722 HydrophobicContact CD1-CZ 3.88Å; F707-F722 HydrophobicContact CE1-CE2 4.21Å; F707-W726 HydrophobicContact CB-CD2 3.87Å; F707-W726 HydrophobicContact CB-CG 3.85Å; F707-W726 HydrophobicContact CB-CZ2 4.3Å; F707-W726 HydrophobicContact CD1-CB 3.99Å; F707-W726 HydrophobicContact CD1-CG 4.05Å; F707-W726 AromaticContact CD2-CD1 4Å; F707-W726 HydrophobicContact CE1-CB 4.41Å; F707-W726 HydrophobicContact CG-CB 4.38Å; F707-W726 AromaticContact CG-CD1 3.7Å; F707-W726 HydrophobicContact CG-CD2 4.48Å; F707-W726 AromaticContact CG-CG 3.96Å; F707-W726 HydrophobicContact CG-CG 3.96Å; F707-F729 AromaticContact CD2-CD1 3.91Å; F707-F729 HydrophobicContact CD2-CD1 3.91Å; F707-F729 HydrophobicContact CD2-CD2 4.33Å; F707-F729 HydrophobicContact CD2-CE1 4.28Å; F707-F729 AromaticContact CD2-CG 3.96Å; F707-F729 HydrophobicContact CD2-CG 3.96Å; F707-F729 HydrophobicContact CE2-CB 3.9Å; F707-F729 AromaticContact CE2-CD1 3.92Å; F707-F729 HydrophobicContact CE2-CD1 3.92Å; F707-F729 AromaticContact CE2-CD2 3.56Å; F707-F729 HydrophobicContact CE2-CD2 3.56Å; F707-F729 HydrophobicContact CE2-CE1 4.43Å; F707-F729 HydrophobicContact CE2-CE2 4.05Å; F707-F729 AromaticContact CE2-CG 3.47Å; F707-F729 HydrophobicContact CE2-CG 3.47Å; F707-F729 VanDerWaalsContact CE2-CG 3.47Å; F707-F729 HydrophobicContact CE2-CZ 4.45Å; F707-F729 HydrophobicContact CZ-CB 4.26Å; F707-F729 HydrophobicContact CZ-CD2 4.4Å; F707-F729 HydrophobicContact CZ-CG 4.28Å
708	A	84.9	Confident	79.4	Confident	33 Å²	33	51.4 Å²	51.4	27%	0.273	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-41.9	174.2	0	0	0	0	0	111.7	R704 A705 I706 S711	R704-A708 WeakPolarHBondContact O-CB 3.32Å; R704-A708 PolarHBondContact O-N 2.8Å; A705-A708 PolarHBondContact O-N 3.48Å; I706-A708 VanDerWaalsContact C-N 3.3Å; I706-A708 PolarHBondContact O-N 3.17Å; A708-S711 WeakPolarHBondContact O-CB 3.38Å; A708-S711 PolarHBondContact O-N 3.48Å; A708-S711 PolarHBondContact O-OG 3.17Å
709	Y	84.7	Confident	78.7	Confident	95 Å²	95	51.5 Å²	51.5	37%	0.373	26%	0.26	S	S	.	.	H	α-helix	trans	-65.2	-46.5	174.1	-179.3	-92	0	0	0	112.2	I675 A705 I706 S711 Q712 L713	I675-Y709 HydrophobicContact CG2-CD1 4.03Å; I675-Y709 HydrophobicContact CG2-CE1 3.16Å; A705-Y709 PolarHBondContact O-N 3.49Å; I706-Y709 PolarHBondContact O-N 2.86Å; Y709-S711 PolarHBondContact O-N 2.77Å; Y709-S711 VanDerWaalsContact O-N 3.12Å; Y709-Q712 WeakPolarHBondContact O-CB 3.47Å; Y709-Q712 PolarHBondContact O-N 3.34Å; Y709-Q712 VanDerWaalsContact O-N 3.1Å; Y709-L713 HydrophobicContact CD1-CD1 4.41Å; Y709-L713 HydrophobicContact CE1-CD1 3.75Å
710	C	81.5	Confident	78.3	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.007	27%	0.267	C	S	.	.	H	α-helix	trans	-54.3	-34.9	175.1	-63.7	0	0	0	0	112.6	C687 I706 F707 Q712 L713 C714 F722	C687-C710 WeakPolarHBondContact CB-SG 3.42Å; I706-C710 PolarHBondContact O-N 3.03Å; I706-C710 PolarHBondContact O-SG 3.47Å; F707-C710 WeakPolarHBondContact O-CB 3.34Å; F707-C710 PolarHBondContact O-N 2.95Å; C710-Q712 PolarHBondContact O-N 2.96Å; C710-L713 PolarHBondContact O-N 3.03Å; C710-C714 VanDerWaalsContact O-CB 3.27Å; C710-C714 WeakPolarHBondContact O-CB 3.29Å; C710-C714 PolarHBondContact O-N 3.21Å; C710-C714 PolarHBondContact O-SG 3.38Å; C710-F722 HydrophobicContact CB-CD2 4.26Å; C710-F722 HydrophobicContact CB-CE1 4.19Å; C710-F722 HydrophobicContact CB-CE2 3.23Å; C710-F722 HydrophobicContact CB-CZ 3.21Å
711	S	78.7	Confident	78.1	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.014	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-27	-176.5	79.2	0	0	0	0	112.9	F707 A708 Y709 L713 W726 I745 V749	F707-S711 PolarHBondContact O-N 3.01Å; A708-S711 WeakPolarHBondContact O-CB 3.38Å; A708-S711 PolarHBondContact O-N 3.48Å; A708-S711 PolarHBondContact O-OG 3.17Å; Y709-S711 PolarHBondContact O-N 2.77Å; Y709-S711 VanDerWaalsContact O-N 3.12Å; S711-L713 VanDerWaalsContact C-N 3.32Å; S711-W726 VanDerWaalsContact CB-CZ3 3.45Å; S711-I745 WeakPolarHBondContact OG-CG2 3.42Å; S711-V749 WeakPolarHBondContact O-CG2 3.47Å
712	Q	78.7	Confident	77.9	Confident	140 Å²	140	45.6 Å²	45.6	65%	0.654	24%	0.244	S	C	*	.	H	α-helix	trans	-70.6	-31.3	175.4	-59.9	177.4	-8.4	0	0	111.6	Y709 C710	Y709-Q712 WeakPolarHBondContact O-CB 3.47Å; Y709-Q712 PolarHBondContact O-N 3.34Å; Y709-Q712 VanDerWaalsContact O-N 3.1Å; C710-Q712 PolarHBondContact O-N 2.96Å
713	L	71.9	Confident	77.9	Confident	38 Å²	38	40.7 Å²	40.7	20%	0.199	23%	0.225	C	C	.	.	H	α-helix	trans	-89.7	-19.3	179.2	-56.2	175.3	0	0	0	112.6	A683 R684 Y709 C710 S711	A683-L713 HydrophobicContact CB-CD1 4.22Å; R684-L713 WeakPolarHBondContact CD-O 3.47Å; R684-L713 HydrophobicContact CG-CB 3.85Å; R684-L713 HydrophobicContact CG-CD1 4.46Å; Y709-L713 HydrophobicContact CD1-CD1 4.41Å; Y709-L713 HydrophobicContact CE1-CD1 3.75Å; C710-L713 PolarHBondContact O-N 3.03Å; S711-L713 VanDerWaalsContact C-N 3.32Å
714	C	65.7	Low	77.8	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.02	25%	0.251	C	S	.	.			trans	-103.7	103.3	-169.7	-76.9	0	0	0	0	113	R684 C710 P716 F722	R684-C714 VanDerWaalsContact CD-SG 3.51Å; C710-C714 VanDerWaalsContact O-CB 3.27Å; C710-C714 WeakPolarHBondContact O-CB 3.29Å; C710-C714 PolarHBondContact O-N 3.21Å; C710-C714 PolarHBondContact O-SG 3.38Å; C714-P716 WeakPolarHBondContact O-CD 3.43Å; C714-F722 HydrophobicContact CB-CD1 3.69Å; C714-F722 HydrophobicContact CB-CE1 4.1Å; C714-F722 HydrophobicContact CB-CG 4.1Å
715	N	69	Low	77.6	Confident	32 Å²	32	47.1 Å²	47.1	17%	0.171	26%	0.259	C	S	.	.			trans	-60.8	123.9	171.7	-71.2	-14.9	0	0	0	112.6	K717 V718 H719 T753 F759	N715-K717 PolarHBondContact O-N 3.35Å; N715-V718 HydrophobicContact CB-CB 4.46Å; N715-V718 HydrophobicContact CB-CG2 4.37Å; N715-V718 PolarHBondContact O-N 3.21Å; N715-H719 PolarHBondContact O-N 3.35Å; N715-T753 WeakPolarHBondContact OD1-CG2 3.48Å; N715-F759 WeakPolarHBondContact ND2-CZ 3.42Å
716	P	69.8	Low	77.6	Confident	12 Å²	12	44.5 Å²	44.5	8%	0.078	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-24.1	-177.3	-24.6	32.2	0	0	0	116.1	C714 W723 K746 V749 M750	C714-P716 WeakPolarHBondContact O-CD 3.43Å; P716-W723 VanDerWaalsContact CA-NE1 3.32Å; P716-W723 HydrophobicContact CB-CZ2 4.46Å; P716-W723 HydrophobicContact CG-CZ2 3.78Å; P716-K746 HydrophobicContact CB-CG 4.47Å; P716-V749 HydrophobicContact CG-CB 4.28Å; P716-V749 HydrophobicContact CG-CG1 4.01Å; P716-M750 HydrophobicContact CB-CE 4.04Å; P716-M750 HydrophobicContact CG-CB 4.25Å
717	K	64	Low	77.5	Confident	104 Å²	104	50 Å²	50	45%	0.452	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-35.7	-179.5	-62.9	-174.9	-168.9	167.7	0	113.1	N715 N754 Q763	N715-K717 PolarHBondContact O-N 3.35Å; K717-N754 WeakPolarHBondContact CE-OD1 3.48Å; K717-N754 PolarHBondContact NZ-OD1 3.18Å; K717-Q763 VanDerWaalsContact CD-NE2 3.29Å; K717-Q763 VanDerWaalsContact NZ-OE1 3.15Å
718	V	69	Low	77.5	Confident	88 Å²	88	54.1 Å²	54.1	53%	0.533	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-31.5	-176.6	-172.8	0	0	0	0	111.1	N715	N715-V718 HydrophobicContact CB-CB 4.46Å; N715-V718 HydrophobicContact CB-CG2 4.37Å; N715-V718 PolarHBondContact O-N 3.21Å
719	H	66.1	Low	77.5	Confident	53 Å²	53	52.7 Å²	52.7	25%	0.245	27%	0.267	C	S	.	.			trans	-119.5	59.2	-172.1	-58.5	-60.2	0	0	0	112.5	R684 N715 G721 F722 W723	R684-H719 VanDerWaalsContact CZ-NE2 3.31Å; R684-H719 PolarHBondContact NH1-CD2 2.92Å; R684-H719 PolarHBondContact NH1-CE1 2.76Å; R684-H719 PolarHBondContact NH1-ND1 2.98Å; R684-H719 VanDerWaalsContact NH1-ND1 3.17Å; R684-H719 PolarHBondContact NH1-NE2 3.22Å; R684-H719 PolarHBondContact NH2-CE1 3.09Å; R684-H719 VanDerWaalsContact NH2-CE1 3.34Å; R684-H719 PolarHBondContact NH2-NE2 3.38Å; N715-H719 PolarHBondContact O-N 3.35Å; H719-G721 VanDerWaalsContact C-N 3.26Å; H719-G721 PolarHBondContact O-N 3.28Å; H719-F722 HydrophobicContact CB-CB 4.45Å; H719-F722 PolarHBondContact O-N 3.31Å; H719-W723 VanDerWaalsContact O-CD1 3.28Å
720	S	75.5	Confident	77.5	Confident	69 Å²	69	48.5 Å²	48.5	48%	0.483	25%	0.25	S	S	.	.	H	α-helix	trans	-55.6	-39.7	176.4	56.8	0	0	0	0	112.8	F722 W723 E724	S720-F722 VanDerWaalsContact C-N 3.28Å; S720-F722 PolarHBondContact O-N 2.97Å; S720-W723 PolarHBondContact O-N 3.29Å; S720-E724 PolarHBondContact O-N 2.83Å
721	G	79.4	Confident	77.7	Confident	34 Å²	34	53.5 Å²	53.5	35%	0.351	28%	0.281	S	S	.	.	H	α-helix	trans	-60.6	-32.7	-178.6	0	0	0	0	0	114.1	H719 L725	H719-G721 VanDerWaalsContact C-N 3.26Å; H719-G721 PolarHBondContact O-N 3.28Å; G721-L725 WeakPolarHBondContact O-CB 3.4Å; G721-L725 VanDerWaalsContact O-CG 3.3Å; G721-L725 WeakPolarHBondContact O-CG 3.25Å; G721-L725 PolarHBondContact O-N 2.62Å
722	F	81.4	Confident	77.8	Confident	11 Å²	11	59.8 Å²	59.8	5%	0.048	31%	0.308	C	S	.	.	H	α-helix	trans	-65	-44.8	173.6	169.6	-95.2	0	0	0	111.3	L688 F707 C710 C714 H719 S720 E724 L725 W726	L688-F722 HydrophobicContact CD2-CD2 3.71Å; L688-F722 HydrophobicContact CD2-CE2 4.14Å; L688-F722 HydrophobicContact CG-CD2 4.28Å; F707-F722 AromaticContact CD1-CE2 3.69Å; F707-F722 HydrophobicContact CD1-CE2 3.69Å; F707-F722 AromaticContact CD1-CZ 3.88Å; F707-F722 HydrophobicContact CD1-CZ 3.88Å; F707-F722 HydrophobicContact CE1-CE2 4.21Å; C710-F722 HydrophobicContact CB-CD2 4.26Å; C710-F722 HydrophobicContact CB-CE1 4.19Å; C710-F722 HydrophobicContact CB-CE2 3.23Å; C710-F722 HydrophobicContact CB-CZ 3.21Å; C714-F722 HydrophobicContact CB-CD1 3.69Å; C714-F722 HydrophobicContact CB-CE1 4.1Å; C714-F722 HydrophobicContact CB-CG 4.1Å; H719-F722 HydrophobicContact CB-CB 4.45Å; H719-F722 PolarHBondContact O-N 3.31Å; S720-F722 VanDerWaalsContact C-N 3.28Å; S720-F722 PolarHBondContact O-N 2.97Å; F722-E724 VanDerWaalsContact C-N 3.32Å; F722-E724 PolarHBondContact O-N 3.36Å; F722-L725 PolarHBondContact O-N 3.44Å; F722-W726 AromaticContact CE1-CE3 3.87Å; F722-W726 HydrophobicContact CE1-CE3 3.87Å; F722-W726 HydrophobicContact CE1-CZ3 4.49Å; F722-W726 HydrophobicContact CZ-CE3 4.19Å; F722-W726 PolarHBondContact O-N 3.21Å
723	W	83.1	Confident	77.8	Confident	7 Å²	7	56.4 Å²	56.4	3%	0.027	29%	0.292	C	S	.	.	H	α-helix	trans	-69.4	-31	-179.9	-69.4	95.7	0	0	0	112.7	P716 H719 S720 W726 K727 M742 I745 K746	P716-W723 VanDerWaalsContact CA-NE1 3.32Å; P716-W723 HydrophobicContact CB-CZ2 4.46Å; P716-W723 HydrophobicContact CG-CZ2 3.78Å; H719-W723 VanDerWaalsContact O-CD1 3.28Å; S720-W723 PolarHBondContact O-N 3.29Å; W723-W726 AromaticContact CE3-CE3 3.77Å; W723-W726 HydrophobicContact CE3-CE3 3.77Å; W723-W726 HydrophobicContact CE3-CZ3 4.09Å; W723-W726 HydrophobicContact CH2-CE3 4.18Å; W723-W726 AromaticContact CH2-CZ3 3.7Å; W723-W726 HydrophobicContact CH2-CZ3 3.7Å; W723-W726 AromaticContact CZ3-CE3 3.49Å; W723-W726 HydrophobicContact CZ3-CE3 3.49Å; W723-W726 VanDerWaalsContact CZ3-CE3 3.49Å; W723-W726 HydrophobicContact CZ3-CH2 4.46Å; W723-W726 AromaticContact CZ3-CZ3 3.31Å; W723-W726 HydrophobicContact CZ3-CZ3 3.31Å; W723-K727 WeakPolarHBondContact O-CB 3.28Å; W723-K727 PolarHBondContact O-N 3.01Å; W723-M742 HydrophobicContact CE3-SD 4.2Å; W723-M742 HydrophobicContact CZ3-CG 4.48Å; W723-M742 HydrophobicContact CZ3-SD 4.3Å; W723-I745 HydrophobicContact CH2-CG2 4.46Å; W723-K746 HydrophobicContact CD2-CD 4.04Å; W723-K746 HydrophobicContact CD2-CG 3.99Å; W723-K746 HydrophobicContact CE3-CB 3.83Å; W723-K746 HydrophobicContact CE3-CD 3.68Å; W723-K746 HydrophobicContact CE3-CG 3.65Å; W723-K746 HydrophobicContact CH2-CB 3.67Å; W723-K746 HydrophobicContact CH2-CG 3.9Å; W723-K746 HydrophobicContact CZ2-CB 4.46Å; W723-K746 HydrophobicContact CZ2-CG 4.22Å; W723-K746 HydrophobicContact CZ3-CB 3.31Å; W723-K746 HydrophobicContact CZ3-CD 4.1Å; W723-K746 HydrophobicContact CZ3-CG 3.6Å
724	E	83.2	Confident	78	Confident	115 Å²	115	55.7 Å²	55.7	54%	0.537	29%	0.294	S	S	.	.	H	α-helix	trans	-67	-47.4	171.2	-72.2	170.4	-169.6	0	0	111	S720 F722 W726 K727 E728	S720-E724 PolarHBondContact O-N 2.83Å; F722-E724 VanDerWaalsContact C-N 3.32Å; F722-E724 PolarHBondContact O-N 3.36Å; E724-W726 VanDerWaalsContact C-N 3.34Å; E724-W726 PolarHBondContact O-N 3.22Å; E724-K727 WeakPolarHBondContact O-CB 3.4Å; E724-K727 PolarHBondContact O-N 3.35Å; E724-E728 WeakPolarHBondContact O-CG 3.44Å; E724-E728 PolarHBondContact O-N 2.82Å
725	L	83.9	Confident	78.5	Confident	69 Å²	69	61 Å²	61	36%	0.361	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-41.4	175.9	-73.9	168.7	0	0	0	112.3	L688 G721 F722 E728 F729	L688-L725 HydrophobicContact CD2-CD1 4.12Å; G721-L725 WeakPolarHBondContact O-CB 3.4Å; G721-L725 VanDerWaalsContact O-CG 3.3Å; G721-L725 WeakPolarHBondContact O-CG 3.25Å; G721-L725 PolarHBondContact O-N 2.62Å; F722-L725 PolarHBondContact O-N 3.44Å; L725-E728 PolarHBondContact O-N 2.91Å; L725-F729 VanDerWaalsContact O-CB 3.31Å; L725-F729 WeakPolarHBondContact O-CB 3.27Å; L725-F729 PolarHBondContact O-N 3.41Å
726	W	86.2	Confident	79	Confident	6 Å²	6	66.6 Å²	66.6	2%	0.023	35%	0.347	C	S	.	.	H	α-helix	trans	-68.3	-39.7	176	-171.2	12.8	0	0	0	111.6	F707 S711 F722 W723 E724 F729 E730 M742 I745	F707-W726 HydrophobicContact CB-CD2 3.87Å; F707-W726 HydrophobicContact CB-CG 3.85Å; F707-W726 HydrophobicContact CB-CZ2 4.3Å; F707-W726 HydrophobicContact CD1-CB 3.99Å; F707-W726 HydrophobicContact CD1-CG 4.05Å; F707-W726 AromaticContact CD2-CD1 4Å; F707-W726 HydrophobicContact CE1-CB 4.41Å; F707-W726 HydrophobicContact CG-CB 4.38Å; F707-W726 AromaticContact CG-CD1 3.7Å; F707-W726 HydrophobicContact CG-CD2 4.48Å; F707-W726 AromaticContact CG-CG 3.96Å; F707-W726 HydrophobicContact CG-CG 3.96Å; S711-W726 VanDerWaalsContact CB-CZ3 3.45Å; F722-W726 AromaticContact CE1-CE3 3.87Å; F722-W726 HydrophobicContact CE1-CE3 3.87Å; F722-W726 HydrophobicContact CE1-CZ3 4.49Å; F722-W726 HydrophobicContact CZ-CE3 4.19Å; F722-W726 PolarHBondContact O-N 3.21Å; W723-W726 AromaticContact CE3-CE3 3.77Å; W723-W726 HydrophobicContact CE3-CE3 3.77Å; W723-W726 HydrophobicContact CE3-CZ3 4.09Å; W723-W726 HydrophobicContact CH2-CE3 4.18Å; W723-W726 AromaticContact CH2-CZ3 3.7Å; W723-W726 HydrophobicContact CH2-CZ3 3.7Å; W723-W726 AromaticContact CZ3-CE3 3.49Å; W723-W726 HydrophobicContact CZ3-CE3 3.49Å; W723-W726 VanDerWaalsContact CZ3-CE3 3.49Å; W723-W726 HydrophobicContact CZ3-CH2 4.46Å; W723-W726 AromaticContact CZ3-CZ3 3.31Å; W723-W726 HydrophobicContact CZ3-CZ3 3.31Å; E724-W726 VanDerWaalsContact C-N 3.34Å; E724-W726 PolarHBondContact O-N 3.22Å; W726-F729 WeakPolarHBondContact O-CB 3.43Å; W726-F729 PolarHBondContact O-N 3.4Å; W726-E730 PolarHBondContact NE1-OE1 3.06Å; W726-E730 WeakPolarHBondContact O-CG 3.15Å; W726-E730 PolarHBondContact O-N 3.32Å; W726-M742 HydrophobicContact CD2-CB 4.49Å; W726-M742 HydrophobicContact CD2-CG 3.54Å; W726-M742 HydrophobicContact CE3-CG 3.71Å; W726-M742 HydrophobicContact CG-CG 4.13Å; W726-M742 HydrophobicContact CH2-CB 4.32Å; W726-M742 HydrophobicContact CH2-CG 4Å; W726-M742 HydrophobicContact CZ2-CB 3.96Å; W726-M742 HydrophobicContact CZ2-CG 3.84Å; W726-M742 HydrophobicContact CZ3-CG 3.93Å; W726-I745 HydrophobicContact CH2-CB 4.23Å; W726-I745 HydrophobicContact CH2-CD1 3.96Å; W726-I745 HydrophobicContact CH2-CG2 4.07Å; W726-I745 HydrophobicContact CZ2-CD1 4.49Å; W726-I745 HydrophobicContact CZ3-CG2 4.31Å
727	K	84.1	Confident	79.5	Confident	129 Å²	129	70.7 Å²	70.7	56%	0.561	37%	0.368	S	S	*	.	H	α-helix	trans	-61.5	-45.6	173.4	-176.9	-176	177.3	-171.9	0	111.5	W723 E724 F729 E730 V731 M742	W723-K727 WeakPolarHBondContact O-CB 3.28Å; W723-K727 PolarHBondContact O-N 3.01Å; E724-K727 WeakPolarHBondContact O-CB 3.4Å; E724-K727 PolarHBondContact O-N 3.35Å; K727-F729 VanDerWaalsContact C-N 3.27Å; K727-F729 PolarHBondContact O-N 3.17Å; K727-E730 PolarHBondContact O-N 3.27Å; K727-V731 HydrophobicContact CG-CG2 4.37Å; K727-V731 WeakPolarHBondContact O-CB 3.47Å; K727-V731 WeakPolarHBondContact O-CG2 3.38Å; K727-V731 PolarHBondContact O-N 3.05Å; K727-M742 HydrophobicContact CB-CE 4.25Å; K727-M742 HydrophobicContact CG-CE 4.39Å
728	E	86.8	Confident	80.2	Confident	96 Å²	96	67.5 Å²	67.5	45%	0.449	36%	0.357	S	S	.	.	H	α-helix	trans	-61.2	-38.6	175.6	-75.9	-174.7	-170.1	0	0	112.1	E724 L725 K732	E724-E728 WeakPolarHBondContact O-CG 3.44Å; E724-E728 PolarHBondContact O-N 2.82Å; L725-E728 PolarHBondContact O-N 2.91Å; E728-K732 WeakPolarHBondContact O-CB 3.46Å; E728-K732 VanDerWaalsContact O-CG 3.28Å; E728-K732 WeakPolarHBondContact O-CG 3.44Å; E728-K732 PolarHBondContact O-N 3.35Å; E728-K732 VanDerWaalsContact O-N 3.08Å; E728-K732 IonicContact OE2-NZ 3.82Å
729	F	85.3	Confident	80.8	Confident	3 Å²	3	65.2 Å²	65.2	1%	0.013	34%	0.344	C	S	.	.	H	α-helix	trans	-63.4	-49	176.5	173.3	-84.8	0	0	0	111.3	R695 I700 A703 R704 F707 L725 W726 K727 V731 K732 H733	R695-F729 HydrophobicContact CG-CE2 4.46Å; I700-F729 HydrophobicContact CB-CZ 4.45Å; I700-F729 HydrophobicContact CG2-CE1 4.18Å; I700-F729 HydrophobicContact CG2-CE2 4.37Å; I700-F729 HydrophobicContact CG2-CZ 3.55Å; A703-F729 HydrophobicContact CB-CE2 3.54Å; A703-F729 HydrophobicContact CB-CZ 3.58Å; R704-F729 HydrophobicContact CB-CE1 4.48Å; R704-F729 HydrophobicContact CG-CD1 4.4Å; R704-F729 HydrophobicContact CG-CE1 3.37Å; R704-F729 HydrophobicContact CG-CZ 3.94Å; F707-F729 AromaticContact CD2-CD1 3.91Å; F707-F729 HydrophobicContact CD2-CD1 3.91Å; F707-F729 HydrophobicContact CD2-CD2 4.33Å; F707-F729 HydrophobicContact CD2-CE1 4.28Å; F707-F729 AromaticContact CD2-CG 3.96Å; F707-F729 HydrophobicContact CD2-CG 3.96Å; F707-F729 HydrophobicContact CE2-CB 3.9Å; F707-F729 AromaticContact CE2-CD1 3.92Å; F707-F729 HydrophobicContact CE2-CD1 3.92Å; F707-F729 AromaticContact CE2-CD2 3.56Å; F707-F729 HydrophobicContact CE2-CD2 3.56Å; F707-F729 HydrophobicContact CE2-CE1 4.43Å; F707-F729 HydrophobicContact CE2-CE2 4.05Å; F707-F729 AromaticContact CE2-CG 3.47Å; F707-F729 HydrophobicContact CE2-CG 3.47Å; F707-F729 VanDerWaalsContact CE2-CG 3.47Å; F707-F729 HydrophobicContact CE2-CZ 4.45Å; F707-F729 HydrophobicContact CZ-CB 4.26Å; F707-F729 HydrophobicContact CZ-CD2 4.4Å; F707-F729 HydrophobicContact CZ-CG 4.28Å; L725-F729 VanDerWaalsContact O-CB 3.31Å; L725-F729 WeakPolarHBondContact O-CB 3.27Å; L725-F729 PolarHBondContact O-N 3.41Å; W726-F729 WeakPolarHBondContact O-CB 3.43Å; W726-F729 PolarHBondContact O-N 3.4Å; K727-F729 VanDerWaalsContact C-N 3.27Å; K727-F729 PolarHBondContact O-N 3.17Å; F729-V731 VanDerWaalsContact C-N 3.34Å; F729-V731 PolarHBondContact O-N 3.03Å; F729-K732 PolarHBondContact O-N 3.17Å; F729-H733 AromaticContact CD2-CD2 3.92Å; F729-H733 AromaticContact CE2-CD2 3.86Å; F729-H733 PolarHBondContact O-N 2.93Å
730	E	85.2	Confident	81.6	Confident	6 Å²	6	68.1 Å²	68.1	3%	0.028	35%	0.352	C	S	.	.	H	α-helix	trans	-68.8	-31.3	178.4	-67.1	-62	157.1	0	0	112.4	R704 W726 K727 K732 G734 T738 V739	R704-E730 WeakPolarHBondContact CD-OE1 3.2Å; R704-E730 WeakPolarHBondContact CG-OE1 3.08Å; R704-E730 IonicContact NE-OE1 2.72Å; R704-E730 IonicContact NE-OE2 3.92Å; R704-E730 PolarHBondContact NE-OE2 2.82Å; W726-E730 PolarHBondContact NE1-OE1 3.06Å; W726-E730 WeakPolarHBondContact O-CG 3.15Å; W726-E730 PolarHBondContact O-N 3.32Å; K727-E730 PolarHBondContact O-N 3.27Å; E730-K732 VanDerWaalsContact C-N 3.31Å; E730-K732 PolarHBondContact O-N 3.32Å; E730-G734 WeakPolarHBondContact O-CA 3.49Å; E730-G734 PolarHBondContact O-N 3.33Å; E730-T738 VanDerWaalsContact OE2-CB 3.32Å; E730-T738 WeakPolarHBondContact OE2-CB 3.32Å; E730-T738 PolarHBondContact OE2-OG1 2.89Å; E730-V739 HydrophobicContact CB-CG2 3.9Å
731	V	84	Confident	81.8	Confident	107 Å²	107	68.9 Å²	68.9	65%	0.648	35%	0.348	S	S	*	.	H	α-helix	trans	-67.3	-34.3	174.1	169.2	0	0	0	0	111.4	K727 F729	K727-V731 HydrophobicContact CG-CG2 4.37Å; K727-V731 WeakPolarHBondContact O-CB 3.47Å; K727-V731 WeakPolarHBondContact O-CG2 3.38Å; K727-V731 PolarHBondContact O-N 3.05Å; F729-V731 VanDerWaalsContact C-N 3.34Å; F729-V731 PolarHBondContact O-N 3.03Å
732	K	82.4	Confident	82	Confident	133 Å²	133	67.6 Å²	67.6	58%	0.578	33%	0.333	S	S	*	.	H	α-helix	trans	-80.4	-32.1	180	-73.9	171.5	-177.4	167.4	0	113.2	E728 F729 E730	E728-K732 WeakPolarHBondContact O-CB 3.46Å; E728-K732 VanDerWaalsContact O-CG 3.28Å; E728-K732 WeakPolarHBondContact O-CG 3.44Å; E728-K732 PolarHBondContact O-N 3.35Å; E728-K732 VanDerWaalsContact O-N 3.08Å; E728-K732 IonicContact OE2-NZ 3.82Å; F729-K732 PolarHBondContact O-N 3.17Å; E730-K732 VanDerWaalsContact C-N 3.31Å; E730-K732 PolarHBondContact O-N 3.32Å
733	H	77.1	Confident	82	Confident	70 Å²	70	70.4 Å²	70.4	32%	0.324	35%	0.349	S	S	.	.	H	α-helix	trans	-128.8	-6.9	-167.7	-61.8	-67.3	0	0	0	114.9	I700 R704 F729	I700-H733 HydrophobicContact CD1-CB 4.08Å; I700-H733 WeakPolarHBondContact CD1-ND1 3.27Å; I700-H733 HydrophobicContact CG1-CB 4.38Å; I700-H733 HydrophobicContact CG2-CB 3.53Å; R704-H733 PolarHBondContact NH2-O 3.12Å; F729-H733 AromaticContact CD2-CD2 3.92Å; F729-H733 AromaticContact CE2-CD2 3.86Å; F729-H733 PolarHBondContact O-N 2.93Å
734	G	76.7	Confident	82.2	Confident	23 Å²	23	77.4 Å²	77.4	24%	0.237	38%	0.375	C	S	.	.			trans	-101.4	170.8	-169.5	0	0	0	0	0	115.4	E730 T738	E730-G734 WeakPolarHBondContact O-CA 3.49Å; E730-G734 PolarHBondContact O-N 3.33Å; G734-T738 VanDerWaalsContact CA-OG1 3.3Å; G734-T738 WeakPolarHBondContact CA-OG1 3.47Å
735	N	76.3	Confident	82.3	Confident	113 Å²	113	73.7 Å²	73.7	60%	0.604	36%	0.358	S	S	*	.			trans	-104.3	165.7	171.8	-68	-25	0	0	0	109.2	D737 T738 V739	N735-D737 PolarHBondContact O-N 3.01Å; N735-D737 VanDerWaalsContact O-N 3.1Å; N735-T738 HydrophobicContact CB-CG2 4.47Å; N735-T738 PolarHBondContact N-OG1 3.41Å; N735-T738 PolarHBondContact O-N 3.1Å; N735-T738 PolarHBondContact O-OG1 3.17Å; N735-V739 PolarHBondContact O-N 2.88Å; N735-V739 VanDerWaalsContact O-N 3.13Å
736	E	79.2	Confident	82.3	Confident	150 Å²	150	73.6 Å²	73.6	70%	0.701	36%	0.355	S	S	*	.	H	α-helix	trans	-54.5	-34.2	176.1	-65.7	-172	170.2	0	0	112.8	R740	E736-R740 WeakPolarHBondContact O-CB 3.3Å; E736-R740 WeakPolarHBondContact O-CG 3.41Å; E736-R740 PolarHBondContact O-N 2.59Å; E736-R740 PolarHBondContact O-NE 3.21Å
737	D	81.5	Confident	82.1	Confident	98 Å²	98	81.9 Å²	81.9	52%	0.524	39%	0.386	S	S	.	.	H	α-helix	trans	-64.9	-41.3	176.2	-63.4	-45	0	0	0	112.5	N735 R740 E741	N735-D737 PolarHBondContact O-N 3.01Å; N735-D737 VanDerWaalsContact O-N 3.1Å; D737-R740 PolarHBondContact O-N 2.71Å; D737-R740 IonicContact OD1-CZ 3.06Å; D737-R740 IonicContact OD1-NH1 2.9Å; D737-R740 PolarHBondContact OD1-NH1 3.44Å; D737-R740 IonicContact OD1-NH2 2.81Å; D737-R740 PolarHBondContact OD1-NH2 3Å; D737-E741 PolarHBondContact O-N 2.91Å
738	T	77.9	Confident	82.1	Confident	37 Å²	37	79 Å²	79	23%	0.227	38%	0.382	C	S	.	.	H	α-helix	trans	-73.5	-36.3	-177.6	67.9	0	0	0	0	111.5	E730 G734 N735 E741 M742	E730-T738 VanDerWaalsContact OE2-CB 3.32Å; E730-T738 WeakPolarHBondContact OE2-CB 3.32Å; E730-T738 PolarHBondContact OE2-OG1 2.89Å; G734-T738 VanDerWaalsContact CA-OG1 3.3Å; G734-T738 WeakPolarHBondContact CA-OG1 3.47Å; N735-T738 HydrophobicContact CB-CG2 4.47Å; N735-T738 PolarHBondContact N-OG1 3.41Å; N735-T738 PolarHBondContact O-N 3.1Å; N735-T738 PolarHBondContact O-OG1 3.17Å; T738-E741 PolarHBondContact O-N 2.82Å; T738-M742 PolarHBondContact O-N 3.48Å
739	V	81.3	Confident	81.6	Confident	41 Å²	41	75 Å²	75	25%	0.248	37%	0.365	C	S	.	.	H	α-helix	trans	-64.7	-41.6	171.9	178.3	0	0	0	0	110.8	E730 N735 E741 M742 L743	E730-V739 HydrophobicContact CB-CG2 3.9Å; N735-V739 PolarHBondContact O-N 2.88Å; N735-V739 VanDerWaalsContact O-N 3.13Å; V739-E741 VanDerWaalsContact C-N 3.33Å; V739-M742 HydrophobicContact CG1-CE 4.37Å; V739-M742 PolarHBondContact O-N 3.05Å; V739-L743 WeakPolarHBondContact O-CG 3.3Å; V739-L743 PolarHBondContact O-N 3.17Å
740	R	84.1	Confident	81.3	Confident	113 Å²	113	78 Å²	78	43%	0.426	38%	0.38	S	S	.	.	H	α-helix	trans	-63.1	-40	175.5	-81.6	-173.3	-93.2	108	-5.4	111.7	E736 D737 L743 R744	E736-R740 WeakPolarHBondContact O-CB 3.3Å; E736-R740 WeakPolarHBondContact O-CG 3.41Å; E736-R740 PolarHBondContact O-N 2.59Å; E736-R740 PolarHBondContact O-NE 3.21Å; D737-R740 PolarHBondContact O-N 2.71Å; D737-R740 IonicContact OD1-CZ 3.06Å; D737-R740 IonicContact OD1-NH1 2.9Å; D737-R740 PolarHBondContact OD1-NH1 3.44Å; D737-R740 IonicContact OD1-NH2 2.81Å; D737-R740 PolarHBondContact OD1-NH2 3Å; R740-L743 PolarHBondContact O-N 2.81Å; R740-R744 WeakPolarHBondContact O-CG 3.37Å; R740-R744 PolarHBondContact O-N 2.68Å
741	E	79.8	Confident	81	Confident	86 Å²	86	80.3 Å²	80.3	40%	0.402	40%	0.4	S	S	.	.	H	α-helix	trans	-67	-42.7	177.1	-164.6	56.3	-149.7	0	0	112	D737 T738 V739 L743 R744 I745	D737-E741 PolarHBondContact O-N 2.91Å; T738-E741 PolarHBondContact O-N 2.82Å; V739-E741 VanDerWaalsContact C-N 3.33Å; E741-L743 VanDerWaalsContact C-N 3.28Å; E741-L743 PolarHBondContact O-N 2.86Å; E741-R744 WeakPolarHBondContact O-CB 3.49Å; E741-R744 PolarHBondContact O-N 2.85Å; E741-R744 VanDerWaalsContact OE2-CD 3.27Å; E741-R744 WeakPolarHBondContact OE2-CD 3.28Å; E741-R744 IonicContact OE2-CZ 3.99Å; E741-R744 IonicContact OE2-NE 2.68Å; E741-R744 IonicContact OE2-NH1 2.67Å; E741-R744 PolarHBondContact OE2-NH1 3.12Å; E741-I745 HydrophobicContact CG-CD1 4.33Å; E741-I745 WeakPolarHBondContact O-CG1 3.38Å; E741-I745 PolarHBondContact O-N 2.74Å
742	M	81.6	Confident	80.5	Confident	7 Å²	7	78 Å²	78	3%	0.034	39%	0.388	C	S	.	.	H	α-helix	trans	-55.9	-43.4	171.7	175.6	-83	-69.3	0	0	111.9	W723 W726 K727 T738 V739 R744 I745 K746	W723-M742 HydrophobicContact CE3-SD 4.2Å; W723-M742 HydrophobicContact CZ3-CG 4.48Å; W723-M742 HydrophobicContact CZ3-SD 4.3Å; W726-M742 HydrophobicContact CD2-CB 4.49Å; W726-M742 HydrophobicContact CD2-CG 3.54Å; W726-M742 HydrophobicContact CE3-CG 3.71Å; W726-M742 HydrophobicContact CG-CG 4.13Å; W726-M742 HydrophobicContact CH2-CB 4.32Å; W726-M742 HydrophobicContact CH2-CG 4Å; W726-M742 HydrophobicContact CZ2-CB 3.96Å; W726-M742 HydrophobicContact CZ2-CG 3.84Å; W726-M742 HydrophobicContact CZ3-CG 3.93Å; K727-M742 HydrophobicContact CB-CE 4.25Å; K727-M742 HydrophobicContact CG-CE 4.39Å; T738-M742 PolarHBondContact O-N 3.48Å; V739-M742 HydrophobicContact CG1-CE 4.37Å; V739-M742 PolarHBondContact O-N 3.05Å; M742-R744 VanDerWaalsContact C-N 3.34Å; M742-R744 PolarHBondContact O-N 3.05Å; M742-I745 PolarHBondContact O-N 3.44Å; M742-K746 WeakPolarHBondContact O-CB 3.02Å; M742-K746 PolarHBondContact O-N 3.08Å
743	L	83.3	Confident	79.5	Confident	70 Å²	70	72.6 Å²	72.6	37%	0.366	37%	0.366	S	S	.	.	H	α-helix	trans	-67.6	-32.5	177.1	-71.1	175	0	0	0	112.8	V739 R740 E741 R747	V739-L743 WeakPolarHBondContact O-CG 3.3Å; V739-L743 PolarHBondContact O-N 3.17Å; R740-L743 PolarHBondContact O-N 2.81Å; E741-L743 VanDerWaalsContact C-N 3.28Å; E741-L743 PolarHBondContact O-N 2.86Å; L743-R747 VanDerWaalsContact O-CG 3.31Å; L743-R747 WeakPolarHBondContact O-CG 3.36Å; L743-R747 PolarHBondContact O-N 3.47Å
744	R	86	Confident	79.1	Confident	153 Å²	153	72.6 Å²	72.6	58%	0.577	37%	0.369	S	S	*	.	H	α-helix	trans	-65.9	-47.7	172.9	-74.5	170.1	175.8	179	-3.1	110.9	R740 E741 M742 K746 R747 S748	R740-R744 WeakPolarHBondContact O-CG 3.37Å; R740-R744 PolarHBondContact O-N 2.68Å; E741-R744 WeakPolarHBondContact O-CB 3.49Å; E741-R744 PolarHBondContact O-N 2.85Å; E741-R744 VanDerWaalsContact OE2-CD 3.27Å; E741-R744 WeakPolarHBondContact OE2-CD 3.28Å; E741-R744 IonicContact OE2-CZ 3.99Å; E741-R744 IonicContact OE2-NE 2.68Å; E741-R744 IonicContact OE2-NH1 2.67Å; E741-R744 PolarHBondContact OE2-NH1 3.12Å; M742-R744 VanDerWaalsContact C-N 3.34Å; M742-R744 PolarHBondContact O-N 3.05Å; R744-K746 VanDerWaalsContact C-N 3.28Å; R744-K746 PolarHBondContact O-N 3.31Å; R744-R747 PolarHBondContact O-N 2.75Å; R744-R747 VanDerWaalsContact O-N 3.08Å; R744-S748 PolarHBondContact O-N 3.42Å
745	I	85.2	Confident	78.6	Confident	37 Å²	37	76.4 Å²	76.4	19%	0.19	39%	0.387	C	S	.	.	H	α-helix	trans	-60.5	-41.2	176.3	-63.3	167.4	0	0	0	110.3	S711 W723 W726 E741 M742 R747 S748 V749	S711-I745 WeakPolarHBondContact OG-CG2 3.42Å; W723-I745 HydrophobicContact CH2-CG2 4.46Å; W726-I745 HydrophobicContact CH2-CB 4.23Å; W726-I745 HydrophobicContact CH2-CD1 3.96Å; W726-I745 HydrophobicContact CH2-CG2 4.07Å; W726-I745 HydrophobicContact CZ2-CD1 4.49Å; W726-I745 HydrophobicContact CZ3-CG2 4.31Å; E741-I745 HydrophobicContact CG-CD1 4.33Å; E741-I745 WeakPolarHBondContact O-CG1 3.38Å; E741-I745 PolarHBondContact O-N 2.74Å; M742-I745 PolarHBondContact O-N 3.44Å; I745-R747 VanDerWaalsContact C-N 3.31Å; I745-R747 PolarHBondContact O-N 2.95Å; I745-S748 WeakPolarHBondContact CA-OG 3.33Å; I745-S748 PolarHBondContact O-N 2.9Å; I745-S748 PolarHBondContact O-OG 3.27Å; I745-V749 HydrophobicContact CG2-CG2 4.19Å; I745-V749 WeakPolarHBondContact O-CB 3.2Å; I745-V749 VanDerWaalsContact O-CG2 3.27Å; I745-V749 WeakPolarHBondContact O-CG2 3.31Å; I745-V749 PolarHBondContact O-N 3.26Å
746	K	83.7	Confident	77.7	Confident	68 Å²	68	75.2 Å²	75.2	30%	0.296	38%	0.381	S	S	.	.	H	α-helix	trans	-57.2	-43.8	173.5	-166.8	173.6	-178.3	174.4	0	112.7	P716 W723 M742 R744 M750	P716-K746 HydrophobicContact CB-CG 4.47Å; W723-K746 HydrophobicContact CD2-CD 4.04Å; W723-K746 HydrophobicContact CD2-CG 3.99Å; W723-K746 HydrophobicContact CE3-CB 3.83Å; W723-K746 HydrophobicContact CE3-CD 3.68Å; W723-K746 HydrophobicContact CE3-CG 3.65Å; W723-K746 HydrophobicContact CH2-CB 3.67Å; W723-K746 HydrophobicContact CH2-CG 3.9Å; W723-K746 HydrophobicContact CZ2-CB 4.46Å; W723-K746 HydrophobicContact CZ2-CG 4.22Å; W723-K746 HydrophobicContact CZ3-CB 3.31Å; W723-K746 HydrophobicContact CZ3-CD 4.1Å; W723-K746 HydrophobicContact CZ3-CG 3.6Å; M742-K746 WeakPolarHBondContact O-CB 3.02Å; M742-K746 PolarHBondContact O-N 3.08Å; R744-K746 VanDerWaalsContact C-N 3.28Å; R744-K746 PolarHBondContact O-N 3.31Å; K746-M750 WeakPolarHBondContact O-CB 3.48Å; K746-M750 PolarHBondContact O-N 3.02Å
747	R	82.5	Confident	76.2	Confident	179 Å²	179	73.6 Å²	73.6	68%	0.675	38%	0.381	S	S	*	.	H	α-helix	trans	-71	-38.4	178.5	-70.6	175	-163.1	-179.2	4.5	111.8	L743 R744 I745 M750 A751	L743-R747 VanDerWaalsContact O-CG 3.31Å; L743-R747 WeakPolarHBondContact O-CG 3.36Å; L743-R747 PolarHBondContact O-N 3.47Å; R744-R747 PolarHBondContact O-N 2.75Å; R744-R747 VanDerWaalsContact O-N 3.08Å; I745-R747 VanDerWaalsContact C-N 3.31Å; I745-R747 PolarHBondContact O-N 2.95Å; R747-M750 PolarHBondContact O-N 2.97Å; R747-A751 WeakPolarHBondContact O-CB 3.42Å; R747-A751 PolarHBondContact O-N 3.31Å
748	S	83.6	Confident	74.8	Confident	68 Å²	68	75.5 Å²	75.5	48%	0.476	39%	0.391	S	S	.	.	H	α-helix	trans	-67	-43.8	178.5	65.5	0	0	0	0	111.5	R744 I745 A751 S752	R744-S748 PolarHBondContact O-N 3.42Å; I745-S748 WeakPolarHBondContact CA-OG 3.33Å; I745-S748 PolarHBondContact O-N 2.9Å; I745-S748 PolarHBondContact O-OG 3.27Å; S748-A751 WeakPolarHBondContact O-CB 3.38Å; S748-A751 PolarHBondContact O-N 3.04Å; S748-A751 VanDerWaalsContact O-N 3.17Å; S748-S752 PolarHBondContact O-N 2.6Å; S748-S752 PolarHBondContact O-OG 3.25Å
749	V	78	Confident	73.5	Confident	13 Å²	13	78.1 Å²	78.1	8%	0.079	40%	0.4	C	S	.	.	H	α-helix	trans	-67.6	-38.1	176.1	179.1	0	0	0	0	110.9	S711 P716 I745 A751 S752 T753	S711-V749 WeakPolarHBondContact O-CG2 3.47Å; P716-V749 HydrophobicContact CG-CB 4.28Å; P716-V749 HydrophobicContact CG-CG1 4.01Å; I745-V749 HydrophobicContact CG2-CG2 4.19Å; I745-V749 WeakPolarHBondContact O-CB 3.2Å; I745-V749 VanDerWaalsContact O-CG2 3.27Å; I745-V749 WeakPolarHBondContact O-CG2 3.31Å; I745-V749 PolarHBondContact O-N 3.26Å; V749-A751 VanDerWaalsContact C-N 3.27Å; V749-A751 PolarHBondContact O-N 3.07Å; V749-S752 WeakPolarHBondContact CA-OG 3.42Å; V749-S752 PolarHBondContact O-N 3.14Å; V749-S752 PolarHBondContact O-OG 3.34Å; V749-T753 HydrophobicContact CG1-CG2 4.29Å; V749-T753 WeakPolarHBondContact O-CB 3.49Å; V749-T753 WeakPolarHBondContact O-CG2 3.36Å; V749-T753 PolarHBondContact O-N 2.91Å; V749-T753 PolarHBondContact O-OG1 3.34Å
750	M	78.8	Confident	71.4	Confident	67 Å²	67	81.8 Å²	81.8	33%	0.33	42%	0.416	S	S	.	.	H	α-helix	trans	-63.8	-34.2	172.7	-171.1	179.1	-65	0	0	112.1	P716 K746 R747 T753 N754	P716-M750 HydrophobicContact CB-CE 4.04Å; P716-M750 HydrophobicContact CG-CB 4.25Å; K746-M750 WeakPolarHBondContact O-CB 3.48Å; K746-M750 PolarHBondContact O-N 3.02Å; R747-M750 PolarHBondContact O-N 2.97Å; M750-T753 WeakPolarHBondContact CA-OG1 3.49Å; M750-T753 PolarHBondContact O-OG1 2.88Å; M750-N754 VanDerWaalsContact O-CB 3.3Å; M750-N754 WeakPolarHBondContact O-CB 3.21Å; M750-N754 PolarHBondContact O-N 3.4Å; M750-N754 PolarHBondContact O-ND2 3.02Å; M750-N754 VanDerWaalsContact O-ND2 3.12Å
751	A	77.4	Confident	69.6	Low	54 Å²	54	79.8 Å²	79.8	45%	0.446	42%	0.419	S	S	.	.	H	α-helix	trans	-72.1	-45.7	176.5	0	0	0	0	0	111.8	R747 S748 V749 T753 N754 T755	R747-A751 WeakPolarHBondContact O-CB 3.42Å; R747-A751 PolarHBondContact O-N 3.31Å; S748-A751 WeakPolarHBondContact O-CB 3.38Å; S748-A751 PolarHBondContact O-N 3.04Å; S748-A751 VanDerWaalsContact O-N 3.17Å; V749-A751 VanDerWaalsContact C-N 3.27Å; V749-A751 PolarHBondContact O-N 3.07Å; A751-T753 PolarHBondContact O-N 3.42Å; A751-N754 PolarHBondContact O-N 3.12Å; A751-T755 PolarHBondContact O-N 2.88Å; A751-T755 VanDerWaalsContact O-N 3.09Å; A751-T755 PolarHBondContact O-OG1 2.88Å
752	S	74.9	Confident	68.2	Low	57 Å²	57	77.8 Å²	77.8	40%	0.399	42%	0.417	S	S	.	.	H	α-helix	trans	-62.3	-42.9	178.3	62.7	0	0	0	0	112	S748 V749 N754 T755 D756	S748-S752 PolarHBondContact O-N 2.6Å; S748-S752 PolarHBondContact O-OG 3.25Å; V749-S752 WeakPolarHBondContact CA-OG 3.42Å; V749-S752 PolarHBondContact O-N 3.14Å; V749-S752 PolarHBondContact O-OG 3.34Å; S752-N754 VanDerWaalsContact C-N 3.27Å; S752-N754 PolarHBondContact O-N 3.25Å; S752-T755 WeakPolarHBondContact CA-OG1 3.43Å; S752-T755 PolarHBondContact O-N 3.35Å; S752-T755 PolarHBondContact O-OG1 3.45Å; S752-D756 PolarHBondContact O-N 2.94Å
753	T	61	Low	66.5	Low	21 Å²	21	81.1 Å²	81.1	13%	0.129	43%	0.432	C	S	.	.	H	α-helix	trans	-71	-21.4	177.9	54.6	0	0	0	0	113.5	N715 V749 M750 A751	N715-T753 WeakPolarHBondContact OD1-CG2 3.48Å; V749-T753 HydrophobicContact CG1-CG2 4.29Å; V749-T753 WeakPolarHBondContact O-CB 3.49Å; V749-T753 WeakPolarHBondContact O-CG2 3.36Å; V749-T753 PolarHBondContact O-N 2.91Å; V749-T753 PolarHBondContact O-OG1 3.34Å; M750-T753 WeakPolarHBondContact CA-OG1 3.49Å; M750-T753 PolarHBondContact O-OG1 2.88Å; A751-T753 PolarHBondContact O-N 3.42Å
754	N	67.5	Low	64.8	Low	70 Å²	70	84.8 Å²	84.8	37%	0.374	45%	0.45	S	S	.	.	H	α-helix	trans	-83.4	-22.9	173.2	-80.2	-21.3	0	0	0	112.6	K717 M750 A751 S752	K717-N754 WeakPolarHBondContact CE-OD1 3.48Å; K717-N754 PolarHBondContact NZ-OD1 3.18Å; M750-N754 VanDerWaalsContact O-CB 3.3Å; M750-N754 WeakPolarHBondContact O-CB 3.21Å; M750-N754 PolarHBondContact O-N 3.4Å; M750-N754 PolarHBondContact O-ND2 3.02Å; M750-N754 VanDerWaalsContact O-ND2 3.12Å; A751-N754 PolarHBondContact O-N 3.12Å; S752-N754 VanDerWaalsContact C-N 3.27Å; S752-N754 PolarHBondContact O-N 3.25Å
755	T	66.5	Low	62.9	Low	102 Å²	102	83.3 Å²	83.3	63%	0.626	45%	0.452	S	S	*	.	H	α-helix	trans	-81.2	-21.5	176.8	46.4	0	0	0	0	113.3	A751 S752 V757	A751-T755 PolarHBondContact O-N 2.88Å; A751-T755 VanDerWaalsContact O-N 3.09Å; A751-T755 PolarHBondContact O-OG1 2.88Å; S752-T755 WeakPolarHBondContact CA-OG1 3.43Å; S752-T755 PolarHBondContact O-N 3.35Å; S752-T755 PolarHBondContact O-OG1 3.45Å; T755-V757 PolarHBondContact O-N 3.4Å
756	D	58.1	Low	61.2	Low	89 Å²	89	84.8 Å²	84.8	48%	0.476	47%	0.47	S	S	.	.			trans	-76.2	97.6	177.5	-65.9	-23.7	0	0	0	110.3	S752 N758 F759	S752-D756 PolarHBondContact O-N 2.94Å; D756-N758 PolarHBondContact O-N 3.26Å; D756-N758 VanDerWaalsContact O-N 3.08Å; D756-F759 HydrophobicContact CB-CB 4.48Å; D756-F759 PolarHBondContact O-N 3.35Å
757	V	47	Very low	59.3	Low	115 Å²	115	84.8 Å²	84.8	70%	0.697	49%	0.489	S	S	*	.	H	α-helix	trans	-52.5	-30.8	179.2	-176.7	0	0	0	0	112	T755 F759 M760	T755-V757 PolarHBondContact O-N 3.4Å; V757-F759 PolarHBondContact O-N 2.91Å; V757-M760 PolarHBondContact O-N 2.84Å
758	N	53.5	Low	57.3	Low	139 Å²	139	81.2 Å²	81.2	74%	0.743	49%	0.488	S	S	*	.	H	α-helix	trans	-66	-21.8	176.8	-69.1	-11.2	0	0	0	113.9	D756 S761	D756-N758 PolarHBondContact O-N 3.26Å; D756-N758 VanDerWaalsContact O-N 3.08Å; N758-S761 PolarHBondContact O-OG 3.16Å
759	F	50.8	Low	54.8	Low	91 Å²	91	83.2 Å²	83.2	40%	0.399	50%	0.496	S	S	.	.	H	α-helix	trans	-92.9	-25.8	-179.4	-128.7	-84.2	0	0	0	112.3	N715 D756 V757 A762 Q763	N715-F759 WeakPolarHBondContact ND2-CZ 3.42Å; D756-F759 HydrophobicContact CB-CB 4.48Å; D756-F759 PolarHBondContact O-N 3.35Å; V757-F759 PolarHBondContact O-N 2.91Å; F759-A762 PolarHBondContact O-N 3.35Å; F759-Q763 WeakPolarHBondContact O-CB 3.38Å; F759-Q763 PolarHBondContact O-N 3.27Å
760	M	37.2	Very low	52.6	Low	119 Å²	119	87.8 Å²	87.8	59%	0.586	53%	0.526	S	S	*	.	H	α-helix	trans	-67	-36.9	173.8	-70.6	-167.9	77.4	0	0	111.8	V757 Q763 M764	V757-M760 PolarHBondContact O-N 2.84Å; M760-Q763 PolarHBondContact O-N 3.05Å; M760-M764 WeakPolarHBondContact O-CG 3.38Å; M760-M764 PolarHBondContact O-N 3.08Å
761	S	44.7	Very low	50.1	Low	70 Å²	70	93.2 Å²	93.2	49%	0.49	55%	0.549	S	S	.	.	H	α-helix	trans	-66.5	-42.4	172.6	58.4	0	0	0	0	111.7	N758 Q763 M764 L765	N758-S761 PolarHBondContact O-OG 3.16Å; S761-Q763 VanDerWaalsContact C-N 3.33Å; S761-Q763 PolarHBondContact O-N 3.07Å; S761-M764 PolarHBondContact O-N 3.06Å; S761-L765 PolarHBondContact O-N 3.23Å
762	A	50.2	Low	47.7	Very low	44 Å²	44	97 Å²	97	36%	0.364	57%	0.566	S	S	.	*	H	α-helix	trans	-65.9	-33.2	174.1	0	0	0	0	0	113.1	F759 L765 A766	F759-A762 PolarHBondContact O-N 3.35Å; A762-L765 PolarHBondContact O-N 3.44Å; A762-A766 WeakPolarHBondContact O-CB 3.41Å; A762-A766 PolarHBondContact O-N 3.42Å
763	Q	47.8	Very low	45.3	Very low	78 Å²	78	104.5 Å²	104.5	36%	0.364	59%	0.585	S	S	.	*	H	α-helix	trans	-76.4	-31.9	179.4	-176.1	151.7	41.6	0	0	112.7	K717 F759 M760 S761 L765 A766 G767	K717-Q763 VanDerWaalsContact CD-NE2 3.29Å; K717-Q763 VanDerWaalsContact NZ-OE1 3.15Å; F759-Q763 WeakPolarHBondContact O-CB 3.38Å; F759-Q763 PolarHBondContact O-N 3.27Å; M760-Q763 PolarHBondContact O-N 3.05Å; S761-Q763 VanDerWaalsContact C-N 3.33Å; S761-Q763 PolarHBondContact O-N 3.07Å; Q763-L765 VanDerWaalsContact C-N 3.31Å; Q763-A766 PolarHBondContact O-N 3.46Å; Q763-G767 PolarHBondContact O-N 2.94Å
764	M	46.4	Very low	43.7	Very low	147 Å²	147	107.6 Å²	107.6	72%	0.724	61%	0.613	S	S	*	*	H	α-helix	trans	-68.2	-32.5	169.8	-73.2	-69.6	-71.9	0	0	111.9	M760 S761 T768	M760-M764 WeakPolarHBondContact O-CG 3.38Å; M760-M764 PolarHBondContact O-N 3.08Å; S761-M764 PolarHBondContact O-N 3.06Å; M764-T768 PolarHBondContact O-OG1 2.81Å
765	L	45.7	Very low	41.7	Very low	121 Å²	121	109.7 Å²	109.7	63%	0.634	63%	0.63	S	S	*	*	H	α-helix	trans	-73.7	-33.8	172.2	-76.9	161.8	0	0	0	113	S761 A762 Q763 T768	S761-L765 PolarHBondContact O-N 3.23Å; A762-L765 PolarHBondContact O-N 3.44Å; Q763-L765 VanDerWaalsContact C-N 3.31Å; L765-T768 PolarHBondContact O-OG1 3.42Å
766	A	49.2	Very low	39.9	Very low	69 Å²	69	112.1 Å²	112.1	57%	0.57	64%	0.64	S	S	*	*	H	α-helix	trans	-83.1	-24.3	179.8	0	0	0	0	0	113.9	A762 Q763	A762-A766 WeakPolarHBondContact O-CB 3.41Å; A762-A766 PolarHBondContact O-N 3.42Å; Q763-A766 PolarHBondContact O-N 3.46Å
767	G	45.3	Very low	38.4	Very low	67 Å²	67	116.8 Å²	116.8	69%	0.691	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-14.2	-178.7	0	0	0	0	0	115.2	Q763	Q763-G767 PolarHBondContact O-N 2.94Å
768	T	39.3	Very low	37.5	Very low	105 Å²	105	115.8 Å²	115.8	64%	0.644	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	0.6	-177.9	45.6	0	0	0	0	114	M764 L765 P770	M764-T768 PolarHBondContact O-OG1 2.81Å; L765-T768 PolarHBondContact O-OG1 3.42Å; T768-P770 WeakPolarHBondContact O-CD 3.31Å
769	V	32.7	Very low	36.4	Very low	109 Å²	109	114.8 Å²	114.8	66%	0.661	66%	0.662	S	S	*	*			trans	-111.2	88.4	177.1	-109.8	0	0	0	0	110.5	F771	V769-F771 PolarHBondContact O-N 3.2Å
770	P	30.1	Very low	35.8	Very low	109 Å²	109	115.9 Å²	115.9	71%	0.708	68%	0.68	S	S	*	*			trans	-70	113.6	165.2	27.9	-28.7	0	0	0	109	T768 V772	T768-P770 WeakPolarHBondContact O-CD 3.31Å; P770-V772 PolarHBondContact O-N 3.4Å
771	F	27.1	Very low	36.1	Very low	182 Å²	182	113.7 Å²	113.7	80%	0.798	68%	0.681	S	S	*	*			trans	17.5	87	148.4	-162.6	-93.4	0	0	0	115.9	V769	V769-F771 PolarHBondContact O-N 3.2Å
772	V	27	Very low	36.2	Very low	132 Å²	132	116.3 Å²	116.3	80%	0.8	69%	0.69	S	S	*	*			trans	-124.6	103.5	154.1	-178	0	0	0	0	107.8	P770 A774	P770-V772 PolarHBondContact O-N 3.4Å; V772-A774 PolarHBondContact O-N 2.91Å; V772-A774 VanDerWaalsContact O-N 3.13Å
773	R	24.9	Very low	35.7	Very low	215 Å²	215	117.8 Å²	117.8	81%	0.811	70%	0.697	S	S	*	*			trans	-60.9	103.7	166.8	-161.9	177.4	-168	168.7	2.4	106.8	P775	R773-P775 WeakPolarHBondContact O-CD 3.27Å
774	A	26.4	Very low	35.9	Very low	87 Å²	87	120.7 Å²	120.7	72%	0.719	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-79.1	120.3	177.3	0	0	0	0	0	109.7	V772	V772-A774 PolarHBondContact O-N 2.91Å; V772-A774 VanDerWaalsContact O-N 3.13Å
775	P	26.8	Very low	36.5	Very low	113 Å²	113	116.7 Å²	116.7	73%	0.734	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-72.8	160.3	149.4	34.5	-27.8	0	0	0	108.7	R773	R773-P775 WeakPolarHBondContact O-CD 3.27Å
776	D	27.4	Very low	36.9	Very low	154 Å²	154	115.2 Å²	115.2	82%	0.824	70%	0.699	S	S	*	*	S	Bend	trans	-53.8	151.7	-176.5	-55.8	-59	0	0	0	114
777	E	27.4	Very low	37.5	Very low	186 Å²	186	117.2 Å²	117.2	87%	0.869	70%	0.699	S	S	*	*			trans	93.4	126.7	161.7	-53.9	-176.9	167.1	0	0	120.2
778	A	28.1	Very low	38.6	Very low	95 Å²	95	120 Å²	120	79%	0.785	70%	0.695	S	S	*	*			trans	73.6	129.1	159.4	0	0	0	0	0	117
779	T	31	Very low	39.7	Very low	117 Å²	117	117.6 Å²	117.6	72%	0.718	69%	0.685	S	S	*	*			cis	-165.6	154.8	27.5	35.2	0	0	0	0	110.4	A781	T779-A781 PolarHBondContact O-N 3.35Å
780	S	37.7	Very low	40.3	Very low	114 Å²	114	117.5 Å²	117.5	80%	0.797	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	11.4	-177.4	-173.5	0	0	0	0	117.4
781	A	43	Very low	41.7	Very low	73 Å²	73	114.9 Å²	114.9	60%	0.603	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-17.4	-165.9	0	0	0	0	0	115.2	T779	T779-A781 PolarHBondContact O-N 3.35Å
782	N	46.8	Very low	43.4	Very low	126 Å²	126	112.2 Å²	112.2	67%	0.674	66%	0.655	S	S	*	*	S	Bend	trans	-97.8	-2.3	-170.3	-65.9	-15.5	0	0	0	114.4	V786	N782-V786 WeakPolarHBondContact O-CG2 3.44Å
783	S	39.5	Very low	44.8	Very low	74 Å²	74	110 Å²	110	52%	0.517	64%	0.641	S	S	.	*	H	α-helix	trans	-74.6	-28.9	-178.2	52.3	0	0	0	0	113.4	L787	S783-L787 PolarHBondContact O-N 3.19Å
784	M	51.7	Low	46.1	Very low	140 Å²	140	104.8 Å²	104.8	69%	0.69	63%	0.629	S	S	*	*	H	α-helix	trans	-76.3	-38.4	-176.2	-150.9	-175.8	-68	0	0	112.4	V786 L787 E788	M784-V786 VanDerWaalsContact C-N 3.28Å; M784-V786 PolarHBondContact O-N 2.93Å; M784-L787 PolarHBondContact O-N 2.67Å; M784-E788 PolarHBondContact O-N 3.31Å
785	A	60.1	Low	47.5	Very low	63 Å²	63	104.5 Å²	104.5	52%	0.521	62%	0.619	S	S	.	*	H	α-helix	trans	-67.1	-28.8	178.1	0	0	0	0	0	113	A789	A785-A789 PolarHBondContact O-N 3.48Å
786	V	54.4	Low	48.5	Very low	89 Å²	89	104.3 Å²	104.3	54%	0.539	61%	0.608	S	S	.	*	H	α-helix	trans	-74.1	-33.9	176.4	177.1	0	0	0	0	111.2	N782 M784 Q790	N782-V786 WeakPolarHBondContact O-CG2 3.44Å; M784-V786 VanDerWaalsContact C-N 3.28Å; M784-V786 PolarHBondContact O-N 2.93Å; V786-Q790 PolarHBondContact O-N 3.34Å
787	L	61.2	Low	49.1	Very low	112 Å²	112	103 Å²	103	59%	0.586	60%	0.597	S	S	*	*	H	α-helix	trans	-73.7	-37.6	175.5	-75.2	166.2	0	0	0	112.4	S783 M784 Q790 A791	S783-L787 PolarHBondContact O-N 3.19Å; M784-L787 PolarHBondContact O-N 2.67Å; L787-Q790 PolarHBondContact O-N 2.95Å; L787-A791 PolarHBondContact O-N 3.06Å
788	E	67.1	Low	49.9	Very low	126 Å²	126	99.1 Å²	99.1	59%	0.589	58%	0.581	S	S	*	*	H	α-helix	trans	-65.3	-37.9	174.4	-82.6	-175.8	146.8	0	0	112.7	M784 A791 Q792	M784-E788 PolarHBondContact O-N 3.31Å; E788-A791 PolarHBondContact O-N 2.85Å; E788-Q792 WeakPolarHBondContact O-CG 3.46Å; E788-Q792 PolarHBondContact O-N 3.33Å; E788-Q792 VanDerWaalsContact O-N 3.08Å
789	A	62.8	Low	50.8	Low	53 Å²	53	99.1 Å²	99.1	44%	0.438	57%	0.571	S	S	.	*	H	α-helix	trans	-67	-34.5	176.2	0	0	0	0	0	112.7	A785 V793	A785-A789 PolarHBondContact O-N 3.48Å; A789-V793 WeakPolarHBondContact O-CG2 3.28Å; A789-V793 PolarHBondContact O-N 3.47Å
790	Q	46.2	Very low	51.4	Low	108 Å²	108	100 Å²	100	51%	0.505	57%	0.565	S	S	.	*	H	α-helix	trans	-71	-37.3	174.5	-75.7	179.4	-8	0	0	112.3	V786 L787 L794	V786-Q790 PolarHBondContact O-N 3.34Å; L787-Q790 PolarHBondContact O-N 2.95Å; Q790-L794 PolarHBondContact O-N 2.93Å
791	A	59.6	Low	51.3	Low	54 Å²	54	98.7 Å²	98.7	45%	0.446	56%	0.556	S	S	.	*	H	α-helix	trans	-66.9	-38.5	176.8	0	0	0	0	0	112.5	L787 E788 L794 T795	L787-A791 PolarHBondContact O-N 3.06Å; E788-A791 PolarHBondContact O-N 2.85Å; A791-L794 PolarHBondContact O-N 3.37Å; A791-T795 PolarHBondContact O-N 3Å; A791-T795 VanDerWaalsContact O-N 3.13Å; A791-T795 PolarHBondContact O-OG1 3.43Å
792	Q	62.6	Low	51	Low	125 Å²	125	101.9 Å²	101.9	58%	0.584	56%	0.563	S	S	*	*	H	α-helix	trans	-66.6	-37.9	179	-75.2	177.5	0.3	0	0	113	E788 T795 E796	E788-Q792 WeakPolarHBondContact O-CG 3.46Å; E788-Q792 PolarHBondContact O-N 3.33Å; E788-Q792 VanDerWaalsContact O-N 3.08Å; Q792-T795 VanDerWaalsContact CA-OG1 3.31Å; Q792-T795 WeakPolarHBondContact CA-OG1 3.12Å; Q792-T795 PolarHBondContact O-N 3.08Å; Q792-T795 PolarHBondContact O-OG1 2.75Å; Q792-E796 PolarHBondContact O-N 3.05Å
793	V	56	Low	50.5	Low	85 Å²	85	99.7 Å²	99.7	52%	0.515	56%	0.562	S	S	.	*	H	α-helix	trans	-67.8	-40.6	177.7	175.1	0	0	0	0	111.4	A789 T795 E796 E797	A789-V793 WeakPolarHBondContact O-CG2 3.28Å; A789-V793 PolarHBondContact O-N 3.47Å; V793-T795 VanDerWaalsContact C-N 3.34Å; V793-T795 PolarHBondContact O-N 3.49Å; V793-E796 PolarHBondContact O-N 2.99Å; V793-E797 PolarHBondContact O-N 2.72Å; V793-E797 VanDerWaalsContact O-N 3.09Å
794	L	51.6	Low	50.1	Low	106 Å²	106	102.6 Å²	102.6	56%	0.555	58%	0.577	S	S	*	*	H	α-helix	trans	-62.6	-38.4	174.2	-81.8	161.2	0	0	0	112.2	Q790 A791 E797 I798	Q790-L794 PolarHBondContact O-N 2.93Å; A791-L794 PolarHBondContact O-N 3.37Å; L794-E797 PolarHBondContact O-N 2.99Å; L794-I798 WeakPolarHBondContact O-CD1 3.32Å; L794-I798 VanDerWaalsContact O-CG1 3.3Å; L794-I798 WeakPolarHBondContact O-CG1 3.4Å; L794-I798 PolarHBondContact O-N 3.13Å
795	T	56.6	Low	49	Very low	82 Å²	82	99.4 Å²	99.4	50%	0.503	58%	0.58	S	S	.	*	H	α-helix	trans	-70.3	-29	175.2	49.1	0	0	0	0	113.6	A791 Q792 V793 T799	A791-T795 PolarHBondContact O-N 3Å; A791-T795 VanDerWaalsContact O-N 3.13Å; A791-T795 PolarHBondContact O-OG1 3.43Å; Q792-T795 VanDerWaalsContact CA-OG1 3.31Å; Q792-T795 WeakPolarHBondContact CA-OG1 3.12Å; Q792-T795 PolarHBondContact O-N 3.08Å; Q792-T795 PolarHBondContact O-OG1 2.75Å; V793-T795 VanDerWaalsContact C-N 3.34Å; V793-T795 PolarHBondContact O-N 3.49Å; T795-T799 WeakPolarHBondContact O-CG2 3.33Å; T795-T799 PolarHBondContact O-N 3.23Å; T795-T799 PolarHBondContact O-OG1 3.02Å
796	E	47.5	Very low	47.5	Very low	108 Å²	108	101.4 Å²	101.4	51%	0.505	59%	0.59	S	S	.	*	H	α-helix	trans	-76.5	-25.1	174.4	-77.5	-167.3	-170.7	0	0	113.6	Q792 V793 T799 K800	Q792-E796 PolarHBondContact O-N 3.05Å; V793-E796 PolarHBondContact O-N 2.99Å; E796-T799 WeakPolarHBondContact CA-OG1 3.39Å; E796-T799 PolarHBondContact O-OG1 2.75Å; E796-K800 WeakPolarHBondContact O-CD 3.17Å; E796-K800 WeakPolarHBondContact O-CG 3.3Å; E796-K800 IonicContact OE2-NZ 2.76Å; E796-K800 PolarHBondContact OE2-NZ 3.1Å
797	E	40.7	Very low	46.6	Very low	128 Å²	128	106.2 Å²	106.2	60%	0.598	60%	0.604	S	S	*	*	H	α-helix	trans	-76.4	-39.2	174.6	-73.7	-173.5	163.9	0	0	111.8	V793 L794 T799 K800 S801	V793-E797 PolarHBondContact O-N 2.72Å; V793-E797 VanDerWaalsContact O-N 3.09Å; L794-E797 PolarHBondContact O-N 2.99Å; E797-T799 VanDerWaalsContact C-N 3.31Å; E797-T799 PolarHBondContact O-N 3.47Å; E797-K800 PolarHBondContact O-N 2.88Å; E797-S801 PolarHBondContact O-N 2.98Å; E797-S801 PolarHBondContact O-OG 2.67Å
798	I	43.2	Very low	45.2	Very low	104 Å²	104	109.9 Å²	109.9	53%	0.533	62%	0.615	S	S	.	*	H	α-helix	trans	-65.6	-33.9	176.4	-64.9	164.4	0	0	0	111.5	L794 S801	L794-I798 WeakPolarHBondContact O-CD1 3.32Å; L794-I798 VanDerWaalsContact O-CG1 3.3Å; L794-I798 WeakPolarHBondContact O-CG1 3.4Å; L794-I798 PolarHBondContact O-N 3.13Å; I798-S801 PolarHBondContact O-OG 3Å; I798-S801 VanDerWaalsContact O-OG 3.06Å
799	T	48.5	Very low	43.4	Very low	94 Å²	94	113.6 Å²	113.6	58%	0.577	63%	0.63	S	S	*	*	H	α-helix	trans	-81.9	-16	-178.7	49.6	0	0	0	0	114.1	T795 E796 E797	T795-T799 WeakPolarHBondContact O-CG2 3.33Å; T795-T799 PolarHBondContact O-N 3.23Å; T795-T799 PolarHBondContact O-OG1 3.02Å; E796-T799 WeakPolarHBondContact CA-OG1 3.39Å; E796-T799 PolarHBondContact O-OG1 2.75Å; E797-T799 VanDerWaalsContact C-N 3.31Å; E797-T799 PolarHBondContact O-N 3.47Å
800	K	42.2	Very low	41.8	Very low	136 Å²	136	116.1 Å²	116.1	59%	0.591	64%	0.644	S	S	*	*	H	α-helix	trans	-92.4	-22	177.6	-74.8	170.3	-172.6	151.8	0	113.3	E796 E797	E796-K800 WeakPolarHBondContact O-CD 3.17Å; E796-K800 WeakPolarHBondContact O-CG 3.3Å; E796-K800 IonicContact OE2-NZ 2.76Å; E796-K800 PolarHBondContact OE2-NZ 3.1Å; E797-K800 PolarHBondContact O-N 2.88Å
801	S	36.5	Very low	41	Very low	86 Å²	86	115.3 Å²	115.3	60%	0.601	65%	0.65	S	S	*	*	H	α-helix	trans	-75	-26.1	174.8	48.9	0	0	0	0	113.8	E797 I798	E797-S801 PolarHBondContact O-N 2.98Å; E797-S801 PolarHBondContact O-OG 2.67Å; I798-S801 PolarHBondContact O-OG 3Å; I798-S801 VanDerWaalsContact O-OG 3.06Å
802	D	36.1	Very low	39.7	Very low	140 Å²	140	120.1 Å²	120.1	75%	0.749	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-2.6	-177.8	-74.9	-11.8	0	0	0	114.4
803	A	35.7	Very low	38.3	Very low	81 Å²	81	118.9 Å²	118.9	67%	0.669	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	5	-171.6	0	0	0	0	0	115.6
804	V	33	Very low	37	Very low	134 Å²	134	123.3 Å²	123.3	81%	0.812	68%	0.684	S	S	*	*			trans	-116.4	52.6	-173.1	-165.6	0	0	0	0	112
805	G	28.4	Very low	36.2	Very low	74 Å²	74	124.4 Å²	124.4	76%	0.763	69%	0.689	S	S	*	*			trans	-135.1	38.8	-174.2	0	0	0	0	0	115.2
806	S	27.9	Very low	35.1	Very low	105 Å²	105	130.9 Å²	130.9	73%	0.734	71%	0.705	S	S	*	*			trans	-167.4	100.1	171.5	177.7	0	0	0	0	112.8
807	K	34.9	Very low	34.5	Very low	189 Å²	189	129.4 Å²	129.4	82%	0.822	72%	0.718	S	S	*	*			trans	168.7	107.9	135.1	-90.6	160	-173.8	175	0	113.5
808	K	32.5	Very low	34.1	Very low	189 Å²	189	130.1 Å²	130.1	82%	0.822	72%	0.722	S	S	*	*			trans	70.6	113.5	134.4	-63.2	-176.6	176.6	-176.7	0	121.8
809	F	28.7	Very low	33.7	Very low	205 Å²	205	130.3 Å²	130.3	90%	0.899	73%	0.73	S	S	*	*				23.9	134.3	127.1	-70.9	-87.9	0	0	0	117.6
810	S	30.5	Very low	32.9	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	74%	0.738	S	S	*	*			cis	-174.7	146.6	29.3	53.7	0	0	0	0	106.3
811	S	28.8	Very low	32.5	Very low	90 Å²	90	131.7 Å²	131.7	63%	0.629	75%	0.75	S	S	*	*				147.8	127.9	86.4	168.8	0	0	0	0	110.2
812	I	32.4	Very low	32.1	Very low	155 Å²	155	132 Å²	132	80%	0.795	76%	0.758	S	S	*	*			trans	75.1	134.6	155.6	-60.2	158.8	0	0	0	117.7
813	S	33.9	Very low	32	Very low	99 Å²	99	134.2 Å²	134.2	69%	0.692	76%	0.764	S	S	*	*			cis	175.9	150.2	-24.3	55.9	0	0	0	0	107.3
814	F	27.9	Very low	31.8	Very low	178 Å²	178	140.6 Å²	140.6	78%	0.781	78%	0.776	S	S	*	*				139.5	93.5	129.7	-146.7	-97.7	0	0	0	116.7
815	I	35.5	Very low	31.8	Very low	129 Å²	129	140 Å²	140	66%	0.662	78%	0.778	S	S	*	*			trans	50	108.9	132.8	-48.4	-179.4	0	0	0	118.1
816	R	33.3	Very low	32.1	Very low	218 Å²	218	141.4 Å²	141.4	82%	0.823	78%	0.782	S	S	*	*				77.9	124	57.6	-158.6	176	-175	163.2	0.2	116.4	E818	R816-E818 IonicContact CZ-OE1 2.85Å; R816-E818 IonicContact NE-OE1 3.44Å; R816-E818 PolarHBondContact NE-OE1 3.34Å; R816-E818 IonicContact NH2-OE1 3.85Å; R816-E818 PolarHBondContact NH2-OE1 3.44Å
817	G	33.6	Very low	32.2	Very low	77 Å²	77	142.1 Å²	142.1	79%	0.794	79%	0.787	S	S	*	*			trans	-177.2	116.3	163.1	0	0	0	0	0	112.2
818	E	33.2	Very low	32.1	Very low	144 Å²	144	140 Å²	140	67%	0.673	79%	0.79	S	S	*	*			trans	-77.6	-167.6	-172.3	-61.2	169.3	169.4	0	0	113.1	R816	R816-E818 IonicContact CZ-OE1 2.85Å; R816-E818 IonicContact NE-OE1 3.44Å; R816-E818 PolarHBondContact NE-OE1 3.34Å; R816-E818 IonicContact NH2-OE1 3.85Å; R816-E818 PolarHBondContact NH2-OE1 3.44Å
819	P	34	Very low	32.4	Very low	107 Å²	107	138.3 Å²	138.3	70%	0.695	79%	0.79	S	S	*	*			cis	-143.9	166.6	1.6	39.9	-17.3	0	0	0	118.8
820	T	31.5	Very low	32.8	Very low	123 Å²	123	133.3 Å²	133.3	76%	0.755	78%	0.778	S	S	*	*			trans	23.3	133.1	144.2	62.8	0	0	0	0	125
821	T	34	Very low	33.1	Very low	137 Å²	137	135.8 Å²	135.8	84%	0.84	78%	0.783	S	S	*	*				173.3	106.6	119.6	27.8	0	0	0	0	109.1
822	A	29.5	Very low	33.7	Very low	93 Å²	93	140.6 Å²	140.6	77%	0.769	80%	0.795	S	S	*	*				54.3	127.3	94.4	0	0	0	0	0	113.4
823	E	33.1	Very low	34	Very low	185 Å²	185	140.2 Å²	140.2	86%	0.864	79%	0.794	S	S	*	*			cis	-157.4	127.2	40.9	-66.8	169.4	154.9	0	0	109.4
824	K	31.5	Very low	34.2	Very low	216 Å²	216	141.7 Å²	141.7	94%	0.939	79%	0.794	S	S	*	*				70.1	110	83.4	-82.4	-168.6	-179.8	-178	0	119
825	S	33.7	Very low	34.6	Very low	122 Å²	122	139.1 Å²	139.1	85%	0.853	79%	0.787	S	S	*	*			trans	-169.2	131.5	134.1	59.7	0	0	0	0	108.8
826	A	33	Very low	34.5	Very low	102 Å²	102	141.9 Å²	141.9	84%	0.843	80%	0.797	S	S	*	*			cis	-161.5	134.3	-12.1	0	0	0	0	0	106.3
827	S	30	Very low	34.5	Very low	120 Å²	120	134.8 Å²	134.8	84%	0.839	79%	0.792	S	S	*	*			trans	-104.8	131.8	176.1	50.9	0	0	0	0	109.4
828	V	33	Very low	34.7	Very low	146 Å²	146	140.1 Å²	140.1	89%	0.885	80%	0.796	S	S	*	*			trans	-106	122	171.7	178.7	0	0	0	0	108.2
829	N	39.1	Very low	34.9	Very low	152 Å²	152	137.4 Å²	137.4	81%	0.813	80%	0.798	S	S	*	*			trans	-117.3	130	175.4	-158.5	28.2	0	0	0	107.1
830	P	37.3	Very low	35	Very low	100 Å²	100	140.4 Å²	140.4	65%	0.649	80%	0.803	S	S	*	*			trans	-93.5	118.3	175.8	33.3	-24.4	0	0	0	109.5
831	D	36.2	Very low	35	Very low	159 Å²	159	142.1 Å²	142.1	85%	0.85	80%	0.802	S	S	*	*			trans	153.4	82.7	152	-79.9	-13.6	0	0	0	110.5
832	E	42.5	Very low	35	Very low	190 Å²	190	141.5 Å²	141.5	89%	0.888	80%	0.799	S	S	*	*			trans	-174	90.2	146.8	-119.4	175.4	158.5	0	0	112.7
833	I	37.2	Very low	35.1	Very low	148 Å²	148	141.4 Å²	141.4	76%	0.759	79%	0.792	S	S	*	*				35.4	127.6	126.7	-54.8	175.6	0	0	0	121.8
834	D	38.1	Very low	35.1	Very low	130 Å²	130	141.6 Å²	141.6	70%	0.695	79%	0.793	S	S	*	*			trans	95.6	116	140.8	-80.9	-8.7	0	0	0	126
835	I	36.7	Very low	35.1	Very low	123 Å²	123	138.8 Å²	138.8	63%	0.631	79%	0.788	S	S	*	*				94.2	112	124.9	-66.9	167	0	0	0	119.9
836	E	33.3	Very low	35.2	Very low	188 Å²	188	139.7 Å²	139.7	88%	0.879	79%	0.789	S	S	*	*			trans	71.1	126.9	145.1	-70.4	167.9	-164.5	0	0	121.6
837	G	34.9	Very low	35.2	Very low	69 Å²	69	141.2 Å²	141.2	71%	0.711	79%	0.787	S	S	*	*			trans	142.1	74.8	148.3	0	0	0	0	0	117.4
838	E	35.8	Very low	35.5	Very low	188 Å²	188	142.8 Å²	142.8	88%	0.879	79%	0.785	S	S	*	*			trans	61.9	107.3	141.6	-61.8	-177	165.5	0	0	119.2
839	A	37.8	Very low	35.5	Very low	88 Å²	88	143.1 Å²	143.1	73%	0.727	78%	0.782	S	S	*	*				94.8	125.8	94.3	0	0	0	0	0	109.9
840	E	36	Very low	35.6	Very low	170 Å²	170	144.6 Å²	144.6	79%	0.794	78%	0.784	S	S	*	*			cis	-178.7	155.8	32.4	-105.5	163	-159.5	0	0	103.3
841	E	31.3	Very low	35.7	Very low	158 Å²	158	149.9 Å²	149.9	74%	0.738	80%	0.796	S	S	*	*			cis	-177.5	171.7	-3.8	-123.1	-174.9	-171	0	0	106.1
842	T	34.6	Very low	36	Very low	125 Å²	125	150.1 Å²	150.1	77%	0.767	80%	0.797	S	S	*	*			trans	78.3	124.6	169.1	63.9	0	0	0	0	116.8
843	S	31	Very low	36	Very low	90 Å²	90	146 Å²	146	63%	0.629	79%	0.789	S	S	*	*			cis	157.1	129.6	-7.2	43.1	0	0	0	0	104.1
844	E	35	Very low	36	Very low	190 Å²	190	145.5 Å²	145.5	89%	0.888	79%	0.793	S	S	*	*				164.6	120.7	116.3	-86.2	-178.3	-178.7	0	0	111.4
845	N	31.3	Very low	36.1	Very low	156 Å²	156	144.8 Å²	144.8	83%	0.834	80%	0.795	S	S	*	*			trans	-81.2	138.7	-176.4	-70.6	-41.2	0	0	0	112.1
846	T	34.5	Very low	36.4	Very low	142 Å²	142	144.2 Å²	144.2	87%	0.871	80%	0.802	S	S	*	*			trans	-134.4	103.3	151	46.2	0	0	0	0	109.9
847	V	34	Very low	36.8	Very low	133 Å²	133	143.7 Å²	143.7	81%	0.806	80%	0.8	S	S	*	*			trans	-82.6	128.3	172.6	174.2	0	0	0	0	109.1
848	L	36.8	Very low	37.2	Very low	153 Å²	153	145.8 Å²	145.8	80%	0.801	80%	0.798	S	S	*	*			trans	-136.8	113.9	165.1	-82.9	174.4	0	0	0	111.1
849	L	31.3	Very low	37.2	Very low	154 Å²	154	146.4 Å²	146.4	81%	0.806	80%	0.798	S	S	*	*			trans	71.6	90.8	144.1	-63.8	158.3	0	0	0	119.4
850	E	42.1	Very low	37.2	Very low	182 Å²	182	145.9 Å²	145.9	85%	0.85	80%	0.801	S	S	*	*			trans	-115.5	125.1	152	-78.7	-173.5	161.5	0	0	111	L852	E850-L852 PolarHBondContact O-N 3.02Å
851	K	39.5	Very low	37.3	Very low	212 Å²	212	145.4 Å²	145.4	92%	0.922	80%	0.804	S	S	*	*			trans	-80.7	103.1	167.5	-74.5	176.5	177	175	0	107.9
852	L	41.5	Very low	37.7	Very low	163 Å²	163	146.3 Å²	146.3	85%	0.853	81%	0.813	S	S	*	*			trans	-72.2	126.2	172.3	-83.2	156.2	0	0	0	111.4	E850	E850-L852 PolarHBondContact O-N 3.02Å
853	S	42.8	Very low	37.9	Very low	105 Å²	105	144.5 Å²	144.5	73%	0.734	81%	0.811	S	S	*	*			trans	-85.2	118.6	166.6	49.6	0	0	0	0	110.9
854	V	38.8	Very low	38.5	Very low	137 Å²	137	145.5 Å²	145.5	83%	0.83	82%	0.816	S	S	*	*			trans	4	114.3	158.6	-168.4	0	0	0	0	118
855	P	39.1	Very low	38.6	Very low	114 Å²	114	143.1 Å²	143.1	74%	0.74	81%	0.809	S	S	*	*			trans	-96.1	118.3	160.8	-9.6	28.6	0	0	0	112.9	E857	P855-E857 PolarHBondContact O-N 2.68Å
856	S	43.5	Very low	39.1	Very low	112 Å²	112	143 Å²	143	78%	0.783	81%	0.808	S	S	*	*			trans	4.6	92	151.5	57.3	0	0	0	0	118.2
857	E	41.5	Very low	39.2	Very low	177 Å²	177	147.9 Å²	147.9	83%	0.827	83%	0.829	S	S	*	*			trans	-57.6	162.6	132.3	-74.7	179.5	155.6	0	0	108.9	P855	P855-E857 PolarHBondContact O-N 2.68Å
858	V	43.7	Very low	39.5	Very low	112 Å²	112	148.7 Å²	148.7	68%	0.679	83%	0.83	S	S	*	*			trans	131.5	-16.1	142.3	-176	0	0	0	0	116.3
859	F	36.1	Very low	39.6	Very low	202 Å²	202	148.4 Å²	148.4	89%	0.886	83%	0.832	S	S	*	*			trans	-130.8	111.6	176.5	-69	-74.8	0	0	0	114.2
860	G	38.2	Very low	40.1	Very low	76 Å²	76	148.1 Å²	148.1	78%	0.784	83%	0.833	S	S	*	*			trans	-80.3	170.3	-171.1	0	0	0	0	0	116.6
861	N	36.1	Very low	40	Very low	160 Å²	160	146.1 Å²	146.1	86%	0.856	83%	0.832	S	S	*	*			trans	-21.7	130	165.3	-61.3	-26.3	0	0	0	116
862	L	40	Very low	40	Very low	177 Å²	177	142 Å²	142	93%	0.927	83%	0.827	S	S	*	*			trans	-162.1	107.3	137.9	-98.1	154.3	0	0	0	108.5
863	A	40.2	Very low	39.9	Very low	88 Å²	88	140.6 Å²	140.6	73%	0.727	83%	0.825	S	S	*	*			trans	-57	169.6	163.9	0	0	0	0	0	110.9
864	P	42.2	Very low	39.7	Very low	111 Å²	111	143.1 Å²	143.1	72%	0.721	83%	0.831	S	S	*	*			cis	-145.7	167.6	39.2	38.7	-16.4	0	0	0	118.4
865	D	36.8	Very low	39.8	Very low	140 Å²	140	143.6 Å²	143.6	75%	0.749	83%	0.831	S	S	*	*			trans	14.8	122.8	141.6	-50.3	-26.6	0	0	0	119.3
866	D	42.1	Very low	39.8	Very low	152 Å²	152	146.1 Å²	146.1	81%	0.813	84%	0.839	S	S	*	*				162.7	99.5	122.2	-82.2	-20.2	0	0	0	110.1
867	D	37.8	Very low	39.5	Very low	246 Å²	246	149.2 Å²	149.2	100%	1.316	84%	0.844	S	S	*	*			trans	170	0	137.3	-87.4	-17.7	0	0	0	111.9

Retrieved 867 of 867 residues in 402.8 ms (Link to these results)

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