A0A087XH32_POEFO Loading...

Solute carrier family 4 member 11

AlphaFold DB , UniProt , Accession A0A087XH32, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 852 aa.

						>A0A087XH32_POEFO|A0A087XH32
MNSKKVLHFVPSEAPSTGRSKNGYVFQEMELKDGEKDDSDQDSPTIITDNLYENDIHLSVSDAGDPGYGLLNTTRKYVKPMNFQEEVRAHRDLDSFLSQASILLDEKAATLDEVLRRMIAHMVEDGHGSCNVEEVMNSLFTDAGGRDINVHLLMETIQGVTATSTGIHYQQSWLCILSNVRNLQRRHVCITRLERPQNWGVNCCEARYVILILAPPRTKSTKTAVELGRTFATMFSDIDFRQRLLETKSQEEFKQELVSQRHRLSVTSEKTVVEEVEDSDPRRGKALQCRDFFRAGKGVYDDLRRRLPLYPSDFTDGITGKDRCLLKYTTTAIFLYIAILLPAIAFGSLNDESTRGEIDVQKTIVGQSIGGVIYSLFAGSPLVIPLTTAPLAIFISVIRGICDDYDLDFDAFYACIGLWNSFFLILGGLFNVSLMMKLFKRSTEEVIALFISIAFVGDAVKGTVKIFEHFYHGPTLATTNKTVVLQQINEILDGIENQTTTKLEHKIGTNMSLFEHPEEKTLVFLPETLVESTRERPILCLLLMLGTLWLGYALYLIKRSPYLNGKIREVVSDCALPISVVIFSFIGSYLFIDIQLPVFSVHDGPIFKYPAFENLTGLTSLAAVGLGFLLALLIFIDQNIVISLTHVPEHKLLKGTAFHWDLMLTGFINILMSCLGLPWMHAAFPHSSLHARQLAKVEQHVENGHVYTTIVSVKETRLTSLAANILIGLSAFMLPIPLQWIPKPVLYGLFLYIAATSLDGNQMVDRMTLLLKEQTSYPPTHYIRRVPQRKVHYFTAVQMIQLIILCAFGMYPLPYMKMVFPLLMILLVPIRISLLPRMIDAKYLDIMDSQYM
					

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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	30.7	Very low	24	Very low	238 Å²	238	160.6 Å²	160.6	100%	1.172	83%	0.828	S	S	*	*				0	94.6	0	-81	151.8	80.1	0	0	108.1
2	N	23.7	Very low	23.9	Very low	167 Å²	167	156.9 Å²	156.9	89%	0.893	83%	0.827	S	S	*	*			trans	-136.5	108.2	169.9	-96	-11.9	0	0	0	107.1	K4	N2-K4 PolarHBondContact O-N 3.18Å
3	S	24.1	Very low	23.9	Very low	111 Å²	111	158.8 Å²	158.8	78%	0.776	83%	0.828	S	S	*	*			trans	-80.4	108.7	-173	-160.1	0	0	0	0	109.4	K5	S3-K5 PolarHBondContact O-N 2.69Å; S3-K5 VanDerWaalsContact O-N 3.14Å
4	K	24.9	Very low	24	Very low	200 Å²	200	153.2 Å²	153.2	87%	0.87	82%	0.817	S	S	*	*			trans	-69.1	98.9	164.4	-81.1	-179.6	173.5	179.2	0	107.7	N2 V6	N2-K4 PolarHBondContact O-N 3.18Å; K4-V6 PolarHBondContact O-N 3.12Å
5	K	23.8	Very low	24	Very low	194 Å²	194	149.9 Å²	149.9	84%	0.843	81%	0.808	S	S	*	*			trans	-77.2	109.7	167.2	-83	-177.4	176.4	178.7	0	108.7	S3	S3-K5 PolarHBondContact O-N 2.69Å; S3-K5 VanDerWaalsContact O-N 3.14Å
6	V	23.8	Very low	24	Very low	119 Å²	119	147.9 Å²	147.9	72%	0.721	81%	0.808	S	S	*	*			trans	-73.7	123.6	170.9	175.3	0	0	0	0	107.9	K4 H8	K4-V6 PolarHBondContact O-N 3.12Å; V6-H8 PolarHBondContact O-N 2.92Å
7	L	22.2	Very low	24.3	Very low	153 Å²	153	147.9 Å²	147.9	80%	0.801	81%	0.814	S	S	*	*			trans	-70.2	111.1	170.3	-96.6	127.2	0	0	0	109.1
8	H	20.4	Very low	24.5	Very low	173 Å²	173	143.8 Å²	143.8	80%	0.801	81%	0.811	S	S	*	*			trans	-79.2	115	166.8	-94.8	-89	0	0	0	109.2	V6	V6-H8 PolarHBondContact O-N 2.92Å
9	F	23.1	Very low	24.5	Very low	183 Å²	183	147.2 Å²	147.2	80%	0.803	81%	0.81	S	S	*	*			trans	-85.5	123.4	162.2	-91.5	-92.1	0	0	0	109
10	V	21.4	Very low	24.6	Very low	129 Å²	129	143.9 Å²	143.9	78%	0.782	80%	0.798	S	S	*	*			trans	-95.4	111.2	163.3	178.6	0	0	0	0	106.6	S12	V10-S12 PolarHBondContact O-N 3.48Å
11	P	25.9	Very low	24.7	Very low	100 Å²	100	143.5 Å²	143.5	65%	0.649	79%	0.788	S	S	*	*			trans	-71.3	117.6	174.1	26.6	-28.9	0	0	0	109.1	E13	P11-E13 PolarHBondContact O-N 3.23Å
12	S	22.7	Very low	24.6	Very low	116 Å²	116	137.4 Å²	137.4	81%	0.811	76%	0.76	S	S	*	*	S	Bend	trans	-62	114	161.5	175.1	0	0	0	0	108	V10	V10-S12 PolarHBondContact O-N 3.48Å
13	E	24.6	Very low	24.9	Very low	181 Å²	181	129.5 Å²	129.5	85%	0.846	72%	0.718	S	S	*	*			trans	48	83.4	175.6	-66.2	-173	160.2	0	0	116.9	P11	P11-E13 PolarHBondContact O-N 3.23Å
14	A	24.7	Very low	25.3	Very low	81 Å²	81	124.6 Å²	124.6	67%	0.669	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-57.3	126.9	155.5	0	0	0	0	0	109.9
15	P	24.4	Very low	25.6	Very low	104 Å²	104	115.7 Å²	115.7	68%	0.675	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-65.6	148.4	172.3	26.3	-31.1	0	0	0	110	T17	P15-T17 PolarHBondContact O-N 3.41Å
16	S	23.5	Very low	26	Very low	117 Å²	117	107.1 Å²	107.1	82%	0.818	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-48.4	135.2	-175.2	52.8	0	0	0	0	113.4	G18	S16-G18 PolarHBondContact O-N 2.98Å
17	T	29.4	Very low	26.5	Very low	148 Å²	148	102.6 Å²	102.6	91%	0.908	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.9	117	180	49	0	0	0	0	111.7	P15	P15-T17 PolarHBondContact O-N 3.41Å
18	G	27	Very low	26.8	Very low	74 Å²	74	98.6 Å²	98.6	76%	0.763	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	153.1	-9.9	161.2	0	0	0	0	0	119.4	S16	S16-G18 PolarHBondContact O-N 2.98Å
19	R	24.5	Very low	27.3	Very low	209 Å²	209	91 Å²	91	79%	0.789	52%	0.521	S	S	*	.			trans	-138.3	124.9	179.1	-78.4	-178	171.4	-178.9	-7	112	K21	R19-K21 PolarHBondContact O-N 3.42Å
20	S	26.4	Very low	27.5	Very low	81 Å²	81	88.3 Å²	88.3	57%	0.566	51%	0.511	S	S	*	.			trans	-54.5	125.4	157.6	168.1	0	0	0	0	107.7
21	K	27.4	Very low	27.8	Very low	136 Å²	136	86 Å²	86	59%	0.591	49%	0.494	S	S	*	.			trans	-114.9	123.3	172.3	-75.2	-175.7	179.1	176.4	0	107.8	R19	R19-K21 PolarHBondContact O-N 3.42Å
22	N	28.3	Very low	27.9	Very low	109 Å²	109	90.5 Å²	90.5	58%	0.583	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	140.5	169.2	-67	-11	0	0	0	109.5	Y77	N22-Y77 PolarHBondContact O-OH 3.43Å
23	G	30.1	Very low	28.2	Very low	2 Å²	2	92.1 Å²	92.1	2%	0.021	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	-173	165.5	0	0	0	0	0	112.4	Y77 V160	G23-Y77 VanDerWaalsContact CA-CZ 3.45Å; G23-Y77 WeakPolarHBondContact CA-OH 3.19Å; G23-Y77 PolarHBondContact N-OH 3.23Å; G23-V160 PolarHBondContact N-O 3.27Å; G23-V160 CarbonylContact O-C 3.45Å; G23-V160 PolarHBondContact O-N 2.85Å
24	Y	32	Very low	28.3	Very low	8 Å²	8	87.6 Å²	87.6	3%	0.031	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	147.3	-172.5	-57.1	-65.9	0	0	0	110.1	Y77 V78 P80 I157 W173 A232 T233 S236	Y24-Y77 CarbonylContact O-C 3.25Å; Y24-Y77 VanDerWaalsContact O-CA 3.29Å; Y24-Y77 WeakPolarHBondContact O-CA 3Å; Y24-V78 PolarHBondContact N-O 3.34Å; Y24-V78 PolarHBondContact O-N 2.84Å; Y24-P80 HydrophobicContact CE2-CB 3.86Å; Y24-I157 HydrophobicContact CD1-CG2 4.38Å; Y24-I157 HydrophobicContact CG-CG2 4.39Å; Y24-W173 HydrophobicContact CD1-CH2 4.28Å; Y24-W173 HydrophobicContact CD1-CZ2 4.42Å; Y24-W173 HydrophobicContact CE1-CH2 4.26Å; Y24-W173 HydrophobicContact CE1-CZ2 4.07Å; Y24-A232 HydrophobicContact CD1-CB 3.73Å; Y24-A232 HydrophobicContact CD2-CB 4.29Å; Y24-A232 HydrophobicContact CE1-CB 3.6Å; Y24-A232 WeakPolarHBondContact CE1-O 3.28Å; Y24-A232 HydrophobicContact CE2-CB 4.09Å; Y24-A232 HydrophobicContact CG-CB 4.15Å; Y24-A232 VanDerWaalsContact CZ-C 3.47Å; Y24-A232 PolarHBondContact OH-O 3.16Å; Y24-T233 WeakPolarHBondContact OH-CA 3.39Å; Y24-T233 PolarHBondContact OH-N 3.47Å; Y24-S236 WeakPolarHBondContact OH-CB 3.36Å; Y24-S236 PolarHBondContact OH-OG 3.11Å
25	V	31.5	Very low	28.4	Very low	13 Å²	13	92.6 Å²	92.6	8%	0.079	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	115.1	163.8	174.6	0	0	0	0	106.7	R75 Q158 V160	V25-R75 HydrophobicContact CG1-CB 3.93Å; V25-R75 HydrophobicContact CG1-CG 4.11Å; V25-Q158 PolarHBondContact N-O 2.83Å; V25-Q158 VanDerWaalsContact N-O 3.15Å; V25-Q158 PolarHBondContact O-N 3.39Å; V25-V160 HydrophobicContact CB-CG2 3.84Å; V25-V160 HydrophobicContact CG2-CB 3.92Å; V25-V160 HydrophobicContact CG2-CG1 4.15Å; V25-V160 HydrophobicContact CG2-CG2 3.5Å; V25-V160 VanDerWaalsContact CG2-CG2 3.5Å
26	F	32.3	Very low	28.6	Very low	14 Å²	14	97.4 Å²	97.4	6%	0.061	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	123.6	164.6	176.9	-104.2	0	0	0	107.1	E28 R75 K76 V78 E155 I157 L177 V225	F26-E28 HydrophobicContact CD1-CB 4.41Å; F26-E28 HydrophobicContact CE1-CB 3.72Å; F26-E28 HydrophobicContact CE1-CG 4.39Å; F26-E28 HydrophobicContact CZ-CB 4.17Å; F26-R75 CarbonylContact O-C 3.55Å; F26-R75 WeakPolarHBondContact O-CA 3.45Å; F26-K76 HydrophobicContact CB-CB 4.33Å; F26-K76 WeakPolarHBondContact CB-O 3.45Å; F26-K76 HydrophobicContact CD1-CB 4.21Å; F26-K76 PolarHBondContact N-O 3.43Å; F26-K76 PolarHBondContact O-N 3.19Å; F26-V78 HydrophobicContact CB-CG2 3.63Å; F26-E155 HydrophobicContact CZ-CG 4.44Å; F26-I157 HydrophobicContact CD2-CD1 4.25Å; F26-I157 HydrophobicContact CD2-CG1 3.83Å; F26-L177 HydrophobicContact CD2-CD1 4.27Å; F26-L177 HydrophobicContact CE2-CD1 3.82Å; F26-V225 HydrophobicContact CD2-CG1 4.05Å; F26-V225 HydrophobicContact CD2-CG2 4.14Å; F26-V225 HydrophobicContact CE2-CB 4.46Å; F26-V225 HydrophobicContact CE2-CG1 4.24Å; F26-V225 HydrophobicContact CE2-CG2 3.47Å; F26-V225 VanDerWaalsContact CE2-CG2 3.47Å; F26-V225 HydrophobicContact CZ-CG2 3.78Å
27	Q	34.3	Very low	28.7	Very low	24 Å²	24	99.6 Å²	99.6	11%	0.112	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	124.4	178.2	-173.9	170.3	-28.8	0	0	108.6	M29 T73 T74 R75 T156	Q27-M29 HydrophobicContact CG-CE 4.42Å; Q27-T73 HydrophobicContact CG-CG2 3.6Å; Q27-T74 WeakPolarHBondContact CA-O 3.33Å; Q27-R75 HydrophobicContact CB-CG 4.36Å; Q27-R75 HydrophobicContact CG-CG 3.98Å; Q27-T156 PolarHBondContact N-O 3.37Å; Q27-T156 PolarHBondContact O-N 3.41Å; Q27-T156 VanDerWaalsContact O-N 3.15Å
28	E	29.3	Very low	28.6	Very low	69 Å²	69	100.5 Å²	100.5	32%	0.322	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136	-178.2	178.9	173.7	-148.3	0	0	107.7	F26 T74	F26-E28 HydrophobicContact CD1-CB 4.41Å; F26-E28 HydrophobicContact CE1-CB 3.72Å; F26-E28 HydrophobicContact CE1-CG 4.39Å; F26-E28 HydrophobicContact CZ-CB 4.17Å; E28-T74 WeakPolarHBondContact CB-OG1 3.35Å; E28-T74 PolarHBondContact N-O 3.03Å; E28-T74 PolarHBondContact O-N 3.07Å; E28-T74 PolarHBondContact O-OG1 3.02Å; E28-T74 VanDerWaalsContact O-OG1 3.08Å
29	M	31.5	Very low	28.7	Very low	14 Å²	14	101.5 Å²	101.5	7%	0.069	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.1	-179.5	-65.6	-174.3	-158.9	0	0	110.6	Q27 N72 T73 L152 M154	Q27-M29 HydrophobicContact CG-CE 4.42Å; M29-N72 WeakPolarHBondContact CA-O 3.16Å; M29-T73 HydrophobicContact CE-CG2 4.23Å; M29-T73 HydrophobicContact CG-CG2 4.24Å; M29-L152 HydrophobicContact CE-CD2 3.95Å; M29-L152 HydrophobicContact SD-CB 4.14Å; M29-L152 HydrophobicContact SD-CD2 4.28Å; M29-M154 PolarHBondContact N-O 2.86Å
30	E	27.3	Very low	28.9	Very low	126 Å²	126	98.4 Å²	98.4	59%	0.589	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.5	175.7	-71.4	-172.3	155.4	0	0	110.7	N72	E30-N72 PolarHBondContact N-O 3.23Å; E30-N72 PolarHBondContact O-N 2.98Å
31	L	27	Very low	28.9	Very low	80 Å²	80	102.4 Å²	102.4	42%	0.419	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	122.2	168.2	-102.9	135.4	0	0	0	108.2	L71	L31-L71 HydrophobicContact CD1-CD2 3.97Å; L31-L71 HydrophobicContact CG-CD2 3.99Å
32	K	28.6	Very low	28.8	Very low	194 Å²	194	103.7 Å²	103.7	84%	0.843	54%	0.544	S	S	*	.			trans	-94.6	110.3	169.3	-102.7	-175.3	174.5	-179.9	0	109
33	D	27.8	Very low	28.6	Very low	151 Å²	151	103.6 Å²	103.6	81%	0.807	55%	0.552	S	S	*	*			trans	-80.2	126.9	161.6	-76.4	-30.6	0	0	0	108.5	E35	D33-E35 PolarHBondContact O-N 3.22Å
34	G	26.8	Very low	28.9	Very low	85 Å²	85	108.8 Å²	108.8	88%	0.876	59%	0.585	S	S	*	*			trans	-78.5	100.9	-175.6	0	0	0	0	0	112.3
35	E	26.6	Very low	28.5	Very low	186 Å²	186	114.2 Å²	114.2	87%	0.869	62%	0.619	S	S	*	*			trans	-97.2	130.5	158.5	-80.7	-174.4	151.3	0	0	110.1	D33	D33-E35 PolarHBondContact O-N 3.22Å
36	K	28.1	Very low	28.1	Very low	205 Å²	205	121.9 Å²	121.9	89%	0.891	66%	0.658	S	S	*	*			trans	-83.7	120.5	173.6	-79.9	176.5	173.6	175.7	0	108.3
37	D	27.3	Very low	27.7	Very low	164 Å²	164	127.6 Å²	127.6	88%	0.877	69%	0.688	S	S	*	*			trans	-109.8	127.6	164.7	-86.7	-26.1	0	0	0	110.6
38	D	27	Very low	27.3	Very low	166 Å²	166	133.3 Å²	133.3	89%	0.888	72%	0.724	S	S	*	*			trans	-73.2	152.7	175.2	-82.4	-38.9	0	0	0	112
39	S	28.9	Very low	27.1	Very low	96 Å²	96	136.8 Å²	136.8	67%	0.671	75%	0.745	S	S	*	*			trans	-64.6	140	-179.8	50.1	0	0	0	0	115.4
40	D	27.3	Very low	26.7	Very low	144 Å²	144	142.7 Å²	142.7	77%	0.77	78%	0.777	S	S	*	*				-175.9	147	112.9	-98.7	-25.3	0	0	0	116
41	Q	27.7	Very low	26.6	Very low	164 Å²	164	145 Å²	145	77%	0.766	79%	0.793	S	S	*	*			trans	-8.3	128	168.8	-69	160.8	-0.5	0	0	121.9
42	D	25.4	Very low	26.6	Very low	163 Å²	163	151.7 Å²	151.7	87%	0.872	81%	0.814	S	S	*	*				174.6	144.6	97.8	-102.9	-22.7	0	0	0	112
43	S	24	Very low	26.4	Very low	108 Å²	108	150.7 Å²	150.7	76%	0.755	81%	0.812	S	S	*	*			trans	-113.2	161.3	177.2	67.3	0	0	0	0	109.2
44	P	35.7	Very low	26.3	Very low	111 Å²	111	150.7 Å²	150.7	72%	0.721	81%	0.812	S	S	*	*				-149.2	146.9	55.9	37.4	-14.4	0	0	0	119
45	T	23.8	Very low	26.3	Very low	121 Å²	121	153.1 Å²	153.1	74%	0.742	81%	0.805	S	S	*	*			trans	29.5	128.3	143.9	46.6	0	0	0	0	123.1
46	I	23.6	Very low	26.2	Very low	175 Å²	175	151.1 Å²	151.1	90%	0.897	80%	0.799	S	S	*	*				-136.8	136	124	-60.5	-174	0	0	0	110.6
47	I	23.9	Very low	26	Very low	133 Å²	133	150 Å²	150	68%	0.682	80%	0.797	S	S	*	*			trans	-68.5	137.7	-168.5	-65.8	152	0	0	0	114.3
48	T	25.5	Very low	25.9	Very low	144 Å²	144	149.1 Å²	149.1	88%	0.883	79%	0.791	S	S	*	*			trans	-153.7	139.1	137	25.3	0	0	0	0	110.6
49	D	24.4	Very low	25.8	Very low	142 Å²	142	147 Å²	147	76%	0.759	79%	0.789	S	S	*	*			trans	-70.8	126	-155.3	-69.3	-53	0	0	0	118.1
50	N	24	Very low	25.9	Very low	139 Å²	139	148.6 Å²	148.6	74%	0.743	80%	0.795	S	S	*	*			trans	25.8	112.5	137.2	-60.8	-31.5	0	0	0	121.5
51	L	25.7	Very low	25.9	Very low	175 Å²	175	147 Å²	147	92%	0.916	80%	0.795	S	S	*	*			trans	-139.9	123.3	143.1	-115.6	137.8	0	0	0	108.4	E53	L51-E53 PolarHBondContact O-N 3.35Å
52	Y	26.2	Very low	26.3	Very low	220 Å²	220	147.3 Å²	147.3	86%	0.863	80%	0.802	S	S	*	*			trans	-57.6	113.5	-165.5	-72.7	-93.8	0	0	0	115
53	E	25.2	Very low	26.6	Very low	173 Å²	173	144.2 Å²	144.2	81%	0.808	80%	0.799	S	S	*	*			trans	-77.2	127.2	155.4	-93.5	172.9	153	0	0	109.1	L51	L51-E53 PolarHBondContact O-N 3.35Å
54	N	26	Very low	27.5	Very low	150 Å²	150	143.1 Å²	143.1	80%	0.802	80%	0.804	S	S	*	*			trans	-107.3	90.8	166.2	-95.9	-13.1	0	0	0	108
55	D	25.1	Very low	27.3	Very low	137 Å²	137	144.6 Å²	144.6	73%	0.733	81%	0.806	S	S	*	*			trans	-73	118.5	162.8	-85	-32.5	0	0	0	109.4
56	I	25.4	Very low	27.8	Very low	143 Å²	143	142.7 Å²	142.7	73%	0.733	80%	0.796	S	S	*	*			trans	-101.4	98.9	167.4	-60	178.1	0	0	0	107.6	L58	I56-L58 HydrophobicContact CG2-CD1 4.05Å; I56-L58 PolarHBondContact O-N 2.85Å
57	H	24	Very low	28.3	Very low	183 Å²	183	138.5 Å²	138.5	85%	0.847	80%	0.796	S	S	*	*			trans	-66.2	115.5	164.1	-95.8	-87.4	0	0	0	109.8
58	L	25	Very low	29.1	Very low	144 Å²	144	141.4 Å²	141.4	75%	0.754	80%	0.799	S	S	*	*			trans	-105.9	111.5	164.5	-103.4	127	0	0	0	108.6	I56	I56-L58 HydrophobicContact CG2-CD1 4.05Å; I56-L58 PolarHBondContact O-N 2.85Å
59	S	25.7	Very low	30	Very low	121 Å²	121	137.6 Å²	137.6	85%	0.846	79%	0.789	S	S	*	*			trans	-76.2	121	168.5	47.7	0	0	0	0	109.8
60	V	30.2	Very low	30.9	Very low	131 Å²	131	138.5 Å²	138.5	79%	0.794	79%	0.793	S	S	*	*			trans	-113.2	124.5	169.8	179.4	0	0	0	0	107.6
61	S	26.8	Very low	32.2	Very low	111 Å²	111	134.5 Å²	134.5	78%	0.776	77%	0.771	S	S	*	*			trans	-72.4	138.1	177.8	50.2	0	0	0	0	112
62	D	36	Very low	33.3	Very low	170 Å²	170	130.9 Å²	130.9	91%	0.909	75%	0.753	S	S	*	*			trans	-49.7	125	173.8	-99.6	-31	0	0	0	114.3
63	A	31.8	Very low	34.9	Very low	98 Å²	98	123 Å²	123	81%	0.81	73%	0.728	S	S	*	*			trans	-165.8	124.2	140.7	0	0	0	0	0	108.6
64	G	43.2	Very low	36.7	Very low	84 Å²	84	117.7 Å²	117.7	87%	0.866	71%	0.707	S	S	*	*			trans	-60.6	133.2	-164.6	0	0	0	0	0	116.6
65	D	31	Very low	38.7	Very low	143 Å²	143	117.5 Å²	117.5	77%	0.765	70%	0.695	S	S	*	*			trans	-165.8	171.8	152.3	-134.4	2.4	0	0	0	109.3
66	P	35.7	Very low	41.1	Very low	81 Å²	81	117.9 Å²	117.9	53%	0.526	69%	0.69	S	S	.	*	S	Bend	trans	-59.8	145.3	-142.3	31.4	-37.9	0	0	0	113.9	Y68	P66-Y68 WeakPolarHBondContact O-CD2 3.23Å; P66-Y68 WeakPolarHBondContact O-CE2 3.35Å; P66-Y68 PolarHBondContact O-N 2.81Å
67	G	33.8	Very low	43.3	Very low	87 Å²	87	116 Å²	116	90%	0.897	68%	0.675	S	S	*	*			trans	-48	104.4	-174.8	0	0	0	0	0	113.8
68	Y	39.8	Very low	45.6	Very low	193 Å²	193	108.4 Å²	108.4	76%	0.757	64%	0.641	S	S	*	*			trans	-84.1	111	170.8	-62.9	-84.2	0	0	0	108.4	P66	P66-Y68 WeakPolarHBondContact O-CD2 3.23Å; P66-Y68 WeakPolarHBondContact O-CE2 3.35Å; P66-Y68 PolarHBondContact O-N 2.81Å
69	G	44.9	Very low	48.1	Very low	64 Å²	64	109.2 Å²	109.2	66%	0.66	64%	0.638	S	S	*	*			trans	-79	119	164.9	0	0	0	0	0	109.6	L71	G69-L71 PolarHBondContact O-N 3.41Å
70	L	43.2	Very low	50.5	Low	161 Å²	161	106.2 Å²	106.2	84%	0.843	62%	0.616	S	S	*	*			trans	-77.4	109.2	169.2	-77.1	164.4	0	0	0	108.5	N72	L70-N72 PolarHBondContact O-N 2.99Å
71	L	52.1	Low	52.8	Low	56 Å²	56	100.3 Å²	100.3	29%	0.293	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.6	111	170.4	-77.6	158.9	0	0	0	109	L31 G69 T73 A143 L152	L31-L71 HydrophobicContact CD1-CD2 3.97Å; L31-L71 HydrophobicContact CG-CD2 3.99Å; G69-L71 PolarHBondContact O-N 3.41Å; L71-T73 PolarHBondContact O-N 3.49Å; L71-A143 HydrophobicContact CD1-CB 4.14Å; L71-L152 HydrophobicContact CD1-CD1 3.78Å
72	N	48	Very low	55.3	Low	98 Å²	98	97.1 Å²	97.1	52%	0.524	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.5	120.8	174.1	-169.6	19.1	0	0	0	109.1	M29 E30 L70	M29-N72 WeakPolarHBondContact CA-O 3.16Å; E30-N72 PolarHBondContact N-O 3.23Å; E30-N72 PolarHBondContact O-N 2.98Å; L70-N72 PolarHBondContact O-N 2.99Å
73	T	60.8	Low	57.3	Low	55 Å²	55	89.3 Å²	89.3	34%	0.337	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	109.4	175.6	-62.9	0	0	0	0	108.8	Q27 M29 L71 R75	Q27-T73 HydrophobicContact CG-CG2 3.6Å; M29-T73 HydrophobicContact CE-CG2 4.23Å; M29-T73 HydrophobicContact CG-CG2 4.24Å; L71-T73 PolarHBondContact O-N 3.49Å; T73-R75 HydrophobicContact CG2-CG 4.34Å
74	T	62	Low	59.1	Low	61 Å²	61	87.7 Å²	87.7	37%	0.374	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	135.6	172.8	64.6	0	0	0	0	109.2	Q27 E28	Q27-T74 WeakPolarHBondContact CA-O 3.33Å; E28-T74 WeakPolarHBondContact CB-OG1 3.35Å; E28-T74 PolarHBondContact N-O 3.03Å; E28-T74 PolarHBondContact O-N 3.07Å; E28-T74 PolarHBondContact O-OG1 3.02Å; E28-T74 VanDerWaalsContact O-OG1 3.08Å
75	R	68.8	Low	60.4	Low	147 Å²	147	91 Å²	91	56%	0.555	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	122.9	177.2	-70.5	180	179.5	168.9	5.2	108.8	V25 F26 Q27 T73 Y169	V25-R75 HydrophobicContact CG1-CB 3.93Å; V25-R75 HydrophobicContact CG1-CG 4.11Å; F26-R75 CarbonylContact O-C 3.55Å; F26-R75 WeakPolarHBondContact O-CA 3.45Å; Q27-R75 HydrophobicContact CB-CG 4.36Å; Q27-R75 HydrophobicContact CG-CG 3.98Å; T73-R75 HydrophobicContact CG2-CG 4.34Å; R75-Y169 PolarHBondContact NH1-OH 3.33Å
76	K	74.7	Confident	62.6	Low	144 Å²	144	86.7 Å²	86.7	63%	0.626	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.2	-178.8	-171.9	174.1	-175.6	173.2	0	110.2	F26 V78	F26-K76 HydrophobicContact CB-CB 4.33Å; F26-K76 WeakPolarHBondContact CB-O 3.45Å; F26-K76 HydrophobicContact CD1-CB 4.21Å; F26-K76 PolarHBondContact N-O 3.43Å; F26-K76 PolarHBondContact O-N 3.19Å; K76-V78 PolarHBondContact O-N 3.13Å
77	Y	71.5	Confident	64.4	Low	105 Å²	105	88.2 Å²	88.2	41%	0.412	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	126.6	174	-171.3	-91.3	0	0	0	110.4	N22 G23 Y24 K79	N22-Y77 PolarHBondContact O-OH 3.43Å; G23-Y77 VanDerWaalsContact CA-CZ 3.45Å; G23-Y77 WeakPolarHBondContact CA-OH 3.19Å; G23-Y77 PolarHBondContact N-OH 3.23Å; Y24-Y77 CarbonylContact O-C 3.25Å; Y24-Y77 VanDerWaalsContact O-CA 3.29Å; Y24-Y77 WeakPolarHBondContact O-CA 3Å; Y77-K79 HydrophobicContact CE1-CG 4.42Å
78	V	73.4	Confident	66.3	Low	23 Å²	23	87.8 Å²	87.8	14%	0.139	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.5	178.1	179	0	0	0	0	108.6	Y24 F26 K76 R229	Y24-V78 PolarHBondContact N-O 3.34Å; Y24-V78 PolarHBondContact O-N 2.84Å; F26-V78 HydrophobicContact CB-CG2 3.63Å; K76-V78 PolarHBondContact O-N 3.13Å; V78-R229 HydrophobicContact CG1-CB 4.48Å; V78-R229 HydrophobicContact CG1-CG 3.86Å
79	K	75.8	Confident	67.9	Low	160 Å²	160	78.6 Å²	78.6	70%	0.696	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-68.5	151.7	178.7	-68.8	180	-178.1	174.6	0	110.7	Y77 R229	Y77-K79 HydrophobicContact CE1-CG 4.42Å; K79-R229 WeakPolarHBondContact O-CD 3.44Å
80	P	76	Confident	69.4	Low	58 Å²	58	78.1 Å²	78.1	38%	0.377	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-63.2	153.5	173.2	27.1	-33	0	0	0	113	Y24 R229 T233	Y24-P80 HydrophobicContact CE2-CB 3.86Å; P80-R229 PolarHBondContact O-NH1 3.42Å; P80-T233 HydrophobicContact CB-CG2 4.26Å
81	M	79.4	Confident	71	Confident	8 Å²	8	79 Å²	79	4%	0.039	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-78.9	132.5	-178.7	-158.6	143.4	-178.7	0	0	110.9	F83 E86 R88 A89 R229 T230 T233	M81-F83 HydrophobicContact CB-CE2 4.46Å; M81-F83 PolarHBondContact O-N 3.19Å; M81-E86 HydrophobicContact CE-CB 4.13Å; M81-E86 VanDerWaalsContact CE-OE2 3.23Å; M81-E86 WeakPolarHBondContact CE-OE2 3.49Å; M81-R88 HydrophobicContact CE-CB 3.89Å; M81-R88 HydrophobicContact CE-CG 4.01Å; M81-A89 HydrophobicContact CE-CB 3.97Å; M81-A89 HydrophobicContact CG-CB 4.18Å; M81-A89 HydrophobicContact SD-CB 4.28Å; M81-R229 HydrophobicContact CB-CG 4.22Å; M81-T230 PolarHBondContact SD-OG1 3.12Å; M81-T233 PolarHBondContact N-OG1 3.49Å
82	N	78.7	Confident	72.1	Confident	44 Å²	44	76.9 Å²	76.9	24%	0.235	36%	0.361	C	S	.	.			trans	-87.7	103.9	177.2	-171.7	-13.3	0	0	0	110	Q84 E85 E86	N82-Q84 PolarHBondContact O-N 3.31Å; N82-Q84 VanDerWaalsContact O-N 3.11Å; N82-Q84 PolarHBondContact OD1-N 3.35Å; N82-E85 HydrophobicContact CB-CB 4.48Å; N82-E85 WeakPolarHBondContact ND2-CG 3.4Å; N82-E85 PolarHBondContact ND2-OE2 3.09Å; N82-E86 HydrophobicContact CB-CG 4.32Å; N82-E86 PolarHBondContact N-OE1 3.28Å; N82-E86 WeakPolarHBondContact O-CB 3.48Å; N82-E86 WeakPolarHBondContact O-CG 2.82Å; N82-E86 PolarHBondContact O-N 3.5Å
83	F	78.2	Confident	73.5	Confident	6 Å²	6	72.3 Å²	72.3	3%	0.026	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-0.2	180	-80.1	-97.5	0	0	0	114.4	M81 A89 H90 T230 T233 M234 R261 L264 S265	M81-F83 HydrophobicContact CB-CE2 4.46Å; M81-F83 PolarHBondContact O-N 3.19Å; F83-A89 HydrophobicContact CD1-CB 3.72Å; F83-A89 HydrophobicContact CE1-CB 3.74Å; F83-A89 HydrophobicContact CG-CB 4.22Å; F83-A89 HydrophobicContact CZ-CB 4.24Å; F83-H90 PolarHBondContact O-CE1 3.4Å; F83-H90 PolarHBondContact O-NE2 3.13Å; F83-T230 HydrophobicContact CE1-CG2 4.18Å; F83-T230 HydrophobicContact CZ-CG2 3.85Å; F83-T233 HydrophobicContact CD2-CG2 4.14Å; F83-T233 HydrophobicContact CE2-CG2 3.65Å; F83-M234 HydrophobicContact CE1-CG 4.4Å; F83-M234 HydrophobicContact CE2-CG 4.4Å; F83-M234 HydrophobicContact CZ-CG 3.72Å; F83-M234 HydrophobicContact CZ-SD 4.33Å; F83-R261 HydrophobicContact CD1-CG 4.25Å; F83-R261 HydrophobicContact CE1-CG 4.42Å; F83-L264 HydrophobicContact CB-CB 3.98Å; F83-L264 HydrophobicContact CD1-CB 4.38Å; F83-L264 HydrophobicContact CD2-CB 3.97Å; F83-L264 HydrophobicContact CD2-CD1 3.92Å; F83-L264 HydrophobicContact CE1-CD1 4.5Å; F83-L264 HydrophobicContact CE2-CD1 3.72Å; F83-L264 HydrophobicContact CG-CB 3.86Å; F83-L264 HydrophobicContact CG-CD1 4.41Å; F83-L264 HydrophobicContact CZ-CD1 4.04Å; F83-S265 PolarHBondContact O-OG 3.25Å
84	Q	69.1	Low	74.2	Confident	63 Å²	63	73.6 Å²	73.6	29%	0.294	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-54.4	173.5	-58.3	-162.4	-49.4	0	0	112.3	N82 S265 S268 E269	N82-Q84 PolarHBondContact O-N 3.31Å; N82-Q84 VanDerWaalsContact O-N 3.11Å; N82-Q84 PolarHBondContact OD1-N 3.35Å; Q84-S265 PolarHBondContact NE2-O 2.88Å; Q84-S268 VanDerWaalsContact OE1-CB 3.29Å; Q84-E269 VanDerWaalsContact NE2-CB 3.32Å
85	E	70.8	Confident	74.6	Confident	155 Å²	155	72.8 Å²	72.8	72%	0.724	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-33.1	-175.2	-65.8	175.1	163.3	0	0	111.2	N82 V87	N82-E85 HydrophobicContact CB-CB 4.48Å; N82-E85 WeakPolarHBondContact ND2-CG 3.4Å; N82-E85 PolarHBondContact ND2-OE2 3.09Å; E85-V87 PolarHBondContact O-N 3Å
86	E	76.9	Confident	74.7	Confident	51 Å²	51	66.1 Å²	66.1	24%	0.238	31%	0.313	C	S	.	.			trans	-93.3	93.6	-174.1	-54.1	-167.6	-129.9	0	0	111.7	M81 N82 R88 A89 R229	M81-E86 HydrophobicContact CE-CB 4.13Å; M81-E86 VanDerWaalsContact CE-OE2 3.23Å; M81-E86 WeakPolarHBondContact CE-OE2 3.49Å; N82-E86 HydrophobicContact CB-CG 4.32Å; N82-E86 PolarHBondContact N-OE1 3.28Å; N82-E86 WeakPolarHBondContact O-CB 3.48Å; N82-E86 WeakPolarHBondContact O-CG 2.82Å; N82-E86 PolarHBondContact O-N 3.5Å; E86-R88 PolarHBondContact O-N 3.13Å; E86-A89 PolarHBondContact O-N 3.32Å; E86-A89 VanDerWaalsContact O-N 3.09Å; E86-R229 VanDerWaalsContact CD-NH2 3.33Å; E86-R229 IonicContact OE1-CZ 3.4Å; E86-R229 IonicContact OE1-NH1 2.89Å; E86-R229 PolarHBondContact OE1-NH1 3.26Å; E86-R229 IonicContact OE1-NH2 2.81Å; E86-R229 PolarHBondContact OE1-NH2 3.14Å; E86-R229 IonicContact OE2-CZ 3.87Å; E86-R229 IonicContact OE2-NH1 3.18Å; E86-R229 IonicContact OE2-NH2 3.16Å; E86-R229 PolarHBondContact OE2-NH2 2.99Å
87	V	73.6	Confident	74.4	Confident	113 Å²	113	61.2 Å²	61.2	69%	0.685	29%	0.293	S	S	*	.	H	α-helix	trans	-54.2	-23.3	172	-175.5	0	0	0	0	112.2	E85 A89 H90 R91	E85-V87 PolarHBondContact O-N 3Å; V87-A89 PolarHBondContact O-N 3.16Å; V87-H90 PolarHBondContact O-N 2.87Å; V87-R91 PolarHBondContact O-N 3.35Å
88	R	75.5	Confident	74.1	Confident	79 Å²	79	60.5 Å²	60.5	30%	0.298	30%	0.303	S	S	.	.	H	α-helix	trans	-61.1	-40.9	177.1	-177.1	174.3	-59.9	155.1	12.2	113	M81 E86 H90 R91 D92 T221	M81-R88 HydrophobicContact CE-CB 3.89Å; M81-R88 HydrophobicContact CE-CG 4.01Å; E86-R88 PolarHBondContact O-N 3.13Å; R88-H90 PolarHBondContact O-N 3.16Å; R88-R91 PolarHBondContact O-N 3.07Å; R88-R91 VanDerWaalsContact O-N 3.14Å; R88-D92 WeakPolarHBondContact CG-OD2 3.41Å; R88-D92 WeakPolarHBondContact O-CB 3.31Å; R88-D92 PolarHBondContact O-N 3.44Å; R88-T221 PolarHBondContact NE-O 2.76Å; R88-T221 VanDerWaalsContact NE-O 3.15Å; R88-T221 PolarHBondContact NH1-O 3.5Å; R88-T221 VanDerWaalsContact NH2-CG2 3.35Å; R88-T221 PolarHBondContact NH2-O 3.49Å
89	A	73.3	Confident	73.8	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.3	-38	-178.5	0	0	0	0	0	111.7	M81 F83 E86 V87 L93 T230	M81-A89 HydrophobicContact CE-CB 3.97Å; M81-A89 HydrophobicContact CG-CB 4.18Å; M81-A89 HydrophobicContact SD-CB 4.28Å; F83-A89 HydrophobicContact CD1-CB 3.72Å; F83-A89 HydrophobicContact CE1-CB 3.74Å; F83-A89 HydrophobicContact CG-CB 4.22Å; F83-A89 HydrophobicContact CZ-CB 4.24Å; E86-A89 PolarHBondContact O-N 3.32Å; E86-A89 VanDerWaalsContact O-N 3.09Å; V87-A89 PolarHBondContact O-N 3.16Å; A89-L93 PolarHBondContact O-N 3.12Å; A89-T230 HydrophobicContact CB-CG2 4.2Å
90	H	76.1	Confident	73.5	Confident	54 Å²	54	56.1 Å²	56.1	25%	0.25	29%	0.285	C	S	.	.	H	α-helix	trans	-67.8	-48.4	175.9	-58.4	87.9	0	0	0	111.7	F83 V87 R88 D92 L93 D94 S265	F83-H90 PolarHBondContact O-CE1 3.4Å; F83-H90 PolarHBondContact O-NE2 3.13Å; V87-H90 PolarHBondContact O-N 2.87Å; R88-H90 PolarHBondContact O-N 3.16Å; H90-D92 PolarHBondContact O-N 3.33Å; H90-L93 PolarHBondContact O-N 3.41Å; H90-D94 PolarHBondContact O-N 3.42Å; H90-S265 PolarHBondContact NE2-OG 2.53Å; H90-S265 VanDerWaalsContact NE2-OG 3.1Å
91	R	77.3	Confident	73.6	Confident	178 Å²	178	53.7 Å²	53.7	67%	0.672	27%	0.27	S	S	*	.	H	α-helix	trans	-67.5	-36.4	-176.5	-169.1	179.5	-178.8	173.1	5.3	112.7	V87 R88 L93 S95	V87-R91 PolarHBondContact O-N 3.35Å; R88-R91 PolarHBondContact O-N 3.07Å; R88-R91 VanDerWaalsContact O-N 3.14Å; R91-L93 VanDerWaalsContact C-N 3.34Å; R91-S95 WeakPolarHBondContact O-CB 3.28Å; R91-S95 PolarHBondContact O-N 3.18Å
92	D	75.1	Confident	73.9	Confident	13 Å²	13	53.6 Å²	53.6	7%	0.07	27%	0.269	C	S	.	.	H	α-helix	trans	-67.3	-36.6	175.9	-80.9	-24.6	0	0	0	110.8	R88 H90 F96 R186 L227	R88-D92 WeakPolarHBondContact CG-OD2 3.41Å; R88-D92 WeakPolarHBondContact O-CB 3.31Å; R88-D92 PolarHBondContact O-N 3.44Å; H90-D92 PolarHBondContact O-N 3.33Å; D92-F96 WeakPolarHBondContact O-CB 3.35Å; D92-F96 PolarHBondContact O-N 3.23Å; D92-R186 IonicContact OD1-NH1 2.93Å; D92-R186 IonicContact OD1-NH2 3.77Å; D92-R186 PolarHBondContact OD1-NH2 3.22Å; D92-L227 HydrophobicContact CB-CD1 3.69Å
93	L	76.4	Confident	74.2	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-70.7	-39.5	174	-164.3	68.3	0	0	0	113.1	A89 H90 R91 S95 F96 L97 F231 M234 R261	A89-L93 PolarHBondContact O-N 3.12Å; H90-L93 PolarHBondContact O-N 3.41Å; R91-L93 VanDerWaalsContact C-N 3.34Å; L93-S95 VanDerWaalsContact C-N 3.33Å; L93-F96 HydrophobicContact CD1-CD1 3.85Å; L93-F96 HydrophobicContact CD1-CE1 4.49Å; L93-F96 HydrophobicContact CD1-CG 4.41Å; L93-F96 CarbonylContact O-C 3.6Å; L93-F96 WeakPolarHBondContact O-CA 3.49Å; L93-F96 WeakPolarHBondContact O-CB 3.25Å; L93-F96 PolarHBondContact O-N 2.96Å; L93-F96 VanDerWaalsContact O-N 3.12Å; L93-L97 HydrophobicContact CG-CD1 4.4Å; L93-L97 WeakPolarHBondContact O-CG 3.39Å; L93-L97 PolarHBondContact O-N 3.02Å; L93-F231 HydrophobicContact CD1-CE1 4.25Å; L93-F231 HydrophobicContact CD1-CZ 4.42Å; L93-M234 HydrophobicContact CD1-CE 4Å; L93-M234 HydrophobicContact CD1-SD 4.47Å; L93-R261 HydrophobicContact CD2-CB 3.65Å; L93-R261 HydrophobicContact CD2-CG 4.14Å
94	D	75.1	Confident	74.6	Confident	83 Å²	83	54.3 Å²	54.3	44%	0.444	27%	0.273	S	S	.	.	H	α-helix	trans	-65.4	-39.1	176	-68.1	-33.7	0	0	0	111.5	H90 F96 S98 R261	H90-D94 PolarHBondContact O-N 3.42Å; D94-F96 VanDerWaalsContact C-N 3.28Å; D94-F96 PolarHBondContact O-N 2.77Å; D94-S98 PolarHBondContact O-OG 3.44Å; D94-R261 IonicContact OD1-CZ 3.8Å; D94-R261 IonicContact OD1-NH1 2.66Å; D94-R261 PolarHBondContact OD1-NH1 2.62Å; D94-R261 IonicContact OD1-NH2 3.58Å; D94-R261 IonicContact OD2-NH1 3.77Å
95	S	71.1	Confident	75.2	Confident	43 Å²	43	54.9 Å²	54.9	30%	0.301	28%	0.278	S	S	.	.	H	α-helix	trans	-64.9	-33.2	171.5	-168.4	0	0	0	0	111.9	R91 L93 S98	R91-S95 WeakPolarHBondContact O-CB 3.28Å; R91-S95 PolarHBondContact O-N 3.18Å; L93-S95 VanDerWaalsContact C-N 3.33Å; S95-S98 PolarHBondContact O-OG 2.91Å
96	F	71.4	Confident	75.8	Confident	8 Å²	8	48.5 Å²	48.5	4%	0.035	25%	0.248	C	C	.	.	H	α-helix	trans	-70.2	-48.7	175.8	162.5	-88	0	0	0	112.4	D92 L93 D94 S98 Q99 A100 I102 V188 I190 F231 L257	D92-F96 WeakPolarHBondContact O-CB 3.35Å; D92-F96 PolarHBondContact O-N 3.23Å; L93-F96 HydrophobicContact CD1-CD1 3.85Å; L93-F96 HydrophobicContact CD1-CE1 4.49Å; L93-F96 HydrophobicContact CD1-CG 4.41Å; L93-F96 CarbonylContact O-C 3.6Å; L93-F96 WeakPolarHBondContact O-CA 3.49Å; L93-F96 WeakPolarHBondContact O-CB 3.25Å; L93-F96 PolarHBondContact O-N 2.96Å; L93-F96 VanDerWaalsContact O-N 3.12Å; D94-F96 VanDerWaalsContact C-N 3.28Å; D94-F96 PolarHBondContact O-N 2.77Å; F96-S98 PolarHBondContact O-N 3.45Å; F96-Q99 CarbonylContact O-C 3.57Å; F96-Q99 PolarHBondContact O-N 3.04Å; F96-A100 HydrophobicContact CD1-CB 4.03Å; F96-A100 HydrophobicContact CD2-CB 3.48Å; F96-A100 VanDerWaalsContact CD2-CB 3.48Å; F96-A100 HydrophobicContact CE1-CB 3.67Å; F96-A100 HydrophobicContact CE2-CB 3.13Å; F96-A100 HydrophobicContact CG-CB 3.92Å; F96-A100 HydrophobicContact CZ-CB 3.22Å; F96-A100 VanDerWaalsContact O-CB 3.23Å; F96-A100 WeakPolarHBondContact O-CB 3.4Å; F96-A100 PolarHBondContact O-N 3.21Å; F96-I102 HydrophobicContact CZ-CD1 4.39Å; F96-V188 HydrophobicContact CD2-CB 3.82Å; F96-V188 HydrophobicContact CD2-CG1 3.94Å; F96-V188 HydrophobicContact CD2-CG2 4.35Å; F96-V188 HydrophobicContact CE2-CB 4.07Å; F96-V188 HydrophobicContact CE2-CG1 3.82Å; F96-I190 HydrophobicContact CE2-CD1 3.8Å; F96-I190 HydrophobicContact CE2-CG1 4.24Å; F96-I190 HydrophobicContact CZ-CD1 3.7Å; F96-I190 HydrophobicContact CZ-CG1 4.44Å; F96-F231 HydrophobicContact CB-CZ 4.15Å; F96-F231 HydrophobicContact CD1-CZ 4.29Å; F96-F231 HydrophobicContact CD2-CE1 4.13Å; F96-F231 HydrophobicContact CD2-CE2 4.23Å; F96-F231 AromaticContact CD2-CZ 3.39Å; F96-F231 HydrophobicContact CD2-CZ 3.39Å; F96-F231 HydrophobicContact CE2-CE1 4.07Å; F96-F231 AromaticContact CE2-CZ 3.76Å; F96-F231 HydrophobicContact CE2-CZ 3.76Å; F96-F231 HydrophobicContact CG-CE1 4.38Å; F96-F231 AromaticContact CG-CZ 3.69Å; F96-F231 HydrophobicContact CG-CZ 3.69Å; F96-F231 HydrophobicContact CZ-CE1 4.33Å; F96-F231 HydrophobicContact CZ-CZ 4.38Å; F96-L257 HydrophobicContact CE1-CD1 3.57Å; F96-L257 HydrophobicContact CZ-CD1 3.85Å
97	L	67.5	Low	76.1	Confident	40 Å²	40	53.4 Å²	53.4	21%	0.209	27%	0.269	C	S	.	.	H	α-helix	trans	-59.1	-29.7	-173.7	-72.4	163.4	0	0	0	112.7	L93 K254 V258	L93-L97 HydrophobicContact CG-CD1 4.4Å; L93-L97 WeakPolarHBondContact O-CG 3.39Å; L93-L97 PolarHBondContact O-N 3.02Å; L97-K254 HydrophobicContact CD2-CB 3.9Å; L97-K254 HydrophobicContact CD2-CG 4.19Å; L97-V258 HydrophobicContact CD1-CG2 3.3Å; L97-V258 HydrophobicContact CD2-CG2 3.97Å; L97-V258 HydrophobicContact CG-CG2 4.27Å
98	S	65.3	Low	76.5	Confident	90 Å²	90	48.1 Å²	48.1	63%	0.629	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-15.2	175.7	56.9	0	0	0	0	114.7	D94 S95 F96	D94-S98 PolarHBondContact O-OG 3.44Å; S95-S98 PolarHBondContact O-OG 2.91Å; F96-S98 PolarHBondContact O-N 3.45Å
99	Q	67	Low	76.6	Confident	82 Å²	82	46.9 Å²	46.9	38%	0.383	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.9	-3.7	-166.9	-65.5	173	6.3	0	0	114.8	F96	F96-Q99 CarbonylContact O-C 3.57Å; F96-Q99 PolarHBondContact O-N 3.04Å
100	A	68.9	Low	77.1	Confident	9 Å²	9	50.4 Å²	50.4	7%	0.074	27%	0.266	C	S	.	.			trans	-80.8	127.8	-171.6	0	0	0	0	0	114.1	F96 I102	F96-A100 HydrophobicContact CD1-CB 4.03Å; F96-A100 HydrophobicContact CD2-CB 3.48Å; F96-A100 VanDerWaalsContact CD2-CB 3.48Å; F96-A100 HydrophobicContact CE1-CB 3.67Å; F96-A100 HydrophobicContact CE2-CB 3.13Å; F96-A100 HydrophobicContact CG-CB 3.92Å; F96-A100 HydrophobicContact CZ-CB 3.22Å; F96-A100 VanDerWaalsContact O-CB 3.23Å; F96-A100 WeakPolarHBondContact O-CB 3.4Å; F96-A100 PolarHBondContact O-N 3.21Å; A100-I102 HydrophobicContact CB-CG1 4.39Å
101	S	78.4	Confident	77.5	Confident	7 Å²	7	49.1 Å²	49.1	5%	0.049	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129.3	160.8	55.8	0	0	0	0	109.1	M122 C189 I190	S101-M122 VanDerWaalsContact OG-CG 3.28Å; S101-M122 WeakPolarHBondContact OG-CG 3.11Å; S101-C189 WeakPolarHBondContact O-CA 3.47Å; S101-C189 VanDerWaalsContact OG-CB 3.29Å; S101-C189 WeakPolarHBondContact OG-CB 3.16Å; S101-C189 PolarHBondContact OG-SG 2.86Å; S101-I190 PolarHBondContact O-N 3.07Å; S101-I190 VanDerWaalsContact O-N 3.15Å
102	I	85.7	Confident	77.8	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	117.5	-179.7	-60.6	164.2	0	0	0	107.2	F96 A100 L104 I190 Q250 F253 K254	F96-I102 HydrophobicContact CZ-CD1 4.39Å; A100-I102 HydrophobicContact CB-CG1 4.39Å; I102-L104 HydrophobicContact CG2-CD2 3.95Å; I102-L104 HydrophobicContact CG2-CG 4.34Å; I102-I190 WeakPolarHBondContact CA-O 3.47Å; I102-Q250 HydrophobicContact CB-CG 3.93Å; I102-Q250 HydrophobicContact CD1-CG 4.11Å; I102-Q250 HydrophobicContact CG2-CG 4.39Å; I102-F253 HydrophobicContact CD1-CD1 3.86Å; I102-F253 HydrophobicContact CD1-CE1 4.43Å; I102-F253 HydrophobicContact CG2-CD1 3.96Å; I102-F253 HydrophobicContact CG2-CE1 4.17Å; I102-F253 HydrophobicContact CG2-CG 4.14Å; I102-K254 HydrophobicContact CD1-CD 4.26Å; I102-K254 HydrophobicContact CD1-CG 3.54Å
103	L	86	Confident	78.2	Confident	20 Å²	20	46.2 Å²	46.2	11%	0.105	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	125.1	173.4	-66.9	104.5	0	0	0	109.4	M118 H121 C189 I190 T191 R192	L103-M118 HydrophobicContact CD1-CG 4.24Å; L103-H121 HydrophobicContact CD1-CB 4.07Å; L103-H121 HydrophobicContact CD2-CB 4.1Å; L103-H121 HydrophobicContact CG-CB 4.41Å; L103-C189 WeakPolarHBondContact CD1-SG 3.45Å; L103-I190 PolarHBondContact N-O 3.12Å; L103-T191 HydrophobicContact CB-CG2 4.12Å; L103-T191 WeakPolarHBondContact O-CA 3.38Å; L103-R192 PolarHBondContact O-N 3.44Å
104	L	85.6	Confident	78.7	Confident	46 Å²	46	46.2 Å²	46.2	24%	0.241	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.3	177.3	-61.3	178.1	0	0	0	110	I102 R192 S249 F253	I102-L104 HydrophobicContact CG2-CD2 3.95Å; I102-L104 HydrophobicContact CG2-CG 4.34Å; L104-R192 HydrophobicContact CD2-CB 4.46Å; L104-S249 VanDerWaalsContact CD1-C 3.48Å; L104-F253 HydrophobicContact CD2-CB 4.47Å; L104-F253 HydrophobicContact CD2-CD2 3.62Å; L104-F253 HydrophobicContact CD2-CE2 4.13Å; L104-F253 HydrophobicContact CD2-CG 4.23Å
105	D	81.6	Confident	79.3	Confident	74 Å²	74	42.2 Å²	42.2	40%	0.396	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	58	51.5	171.3	-54.6	-38	0	0	0	114.5	R192 E194	D105-R192 WeakPolarHBondContact CA-O 3.29Å; D105-R192 PolarHBondContact N-O 2.94Å; D105-R192 IonicContact OD1-CZ 3.68Å; D105-R192 IonicContact OD1-NE 3.82Å; D105-R192 PolarHBondContact OD1-NE 3.49Å; D105-R192 IonicContact OD1-NH2 2.94Å; D105-R192 PolarHBondContact OD1-NH2 3.48Å; D105-R192 IonicContact OD2-CZ 3.39Å; D105-R192 IonicContact OD2-NH2 3.55Å; D105-R192 PolarHBondContact OD2-NH2 3.33Å; D105-E194 HydrophobicContact CB-CB 4.49Å
106	E	83.3	Confident	80	Confident	21 Å²	21	45.8 Å²	45.8	10%	0.098	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	136	176.5	-175.2	50	-110.3	0	0	111.2	A108 V114 R117 T191 R192 L193 E194	E106-A108 HydrophobicContact CG-CB 4.09Å; E106-A108 PolarHBondContact OE1-N 3.07Å; E106-V114 HydrophobicContact CG-CG2 4.5Å; E106-R117 VanDerWaalsContact OE1-CD 3.25Å; E106-R117 WeakPolarHBondContact OE1-CD 3.34Å; E106-R117 IonicContact OE1-CZ 2.77Å; E106-R117 IonicContact OE1-NE 2.62Å; E106-R117 IonicContact OE1-NH1 3.65Å; E106-R117 PolarHBondContact OE1-NH1 2.91Å; E106-R117 WeakPolarHBondContact OE2-CD 3.44Å; E106-R117 IonicContact OE2-NH1 3.57Å; E106-T191 HydrophobicContact CB-CG2 3.51Å; E106-T191 HydrophobicContact CG-CG2 4.04Å; E106-R192 PolarHBondContact N-O 3.12Å; E106-L193 HydrophobicContact CB-CD2 4.22Å; E106-L193 HydrophobicContact CG-CD2 4.49Å; E106-E194 PolarHBondContact O-N 3.49Å
107	K	83.6	Confident	80.7	Confident	154 Å²	154	50 Å²	50	67%	0.67	26%	0.257	S	S	*	.			trans	-97.9	-12.5	-173.6	-64.4	-172.7	179.8	174.8	0	113.7	A109 E194	K107-A109 PolarHBondContact O-N 3.5Å; K107-E194 WeakPolarHBondContact CE-OE2 3.38Å; K107-E194 WeakPolarHBondContact CG-OE2 3.19Å
108	A	81.5	Confident	81.6	Confident	2 Å²	2	48.1 Å²	48.1	2%	0.017	25%	0.247	C	C	.	.			trans	-55.9	135.7	178.8	0	0	0	0	0	111.4	E106 E113 V114	E106-A108 HydrophobicContact CG-CB 4.09Å; E106-A108 PolarHBondContact OE1-N 3.07Å; A108-E113 HydrophobicContact CB-CB 3.93Å; A108-E113 HydrophobicContact CB-CG 3.66Å; A108-V114 HydrophobicContact CB-CG2 3.63Å
109	A	79	Confident	82.6	Confident	53 Å²	53	44 Å²	44	44%	0.438	22%	0.218	S	C	.	.			trans	-95	-29.8	-176.5	0	0	0	0	0	112.7	K107 W199	K107-A109 PolarHBondContact O-N 3.5Å; A109-W199 PolarHBondContact O-NE1 3.4Å; A109-W199 VanDerWaalsContact O-NE1 3.16Å
110	T	83.4	Confident	83.4	Confident	75 Å²	75	42 Å²	42	46%	0.46	22%	0.215	S	C	.	.	S	Bend	trans	-96.4	145.6	-179.4	66.1	0	0	0	0	110.9	D112 E113 V114	T110-D112 VanDerWaalsContact C-N 3.25Å; T110-D112 PolarHBondContact O-N 3.34Å; T110-E113 PolarHBondContact O-N 2.91Å; T110-E113 VanDerWaalsContact OG1-CB 3.23Å; T110-E113 WeakPolarHBondContact OG1-CB 3.42Å; T110-E113 PolarHBondContact OG1-N 2.94Å; T110-V114 WeakPolarHBondContact O-CG2 3.28Å; T110-V114 PolarHBondContact O-N 3.43Å; T110-V114 VanDerWaalsContact O-N 3.12Å
111	L	83.6	Confident	84	Confident	27 Å²	27	44.1 Å²	44.1	14%	0.141	22%	0.223	C	C	.	.	H	α-helix	trans	-59.4	-38.7	176.2	178.4	65.2	0	0	0	111.7	V114 L115 L153 I176 W199	L111-V114 PolarHBondContact O-N 3.16Å; L111-L115 HydrophobicContact CD1-CD1 4.25Å; L111-L115 HydrophobicContact CD1-CG 4.25Å; L111-L115 HydrophobicContact CG-CD1 4Å; L111-L115 HydrophobicContact CG-CG 4.41Å; L111-L115 WeakPolarHBondContact O-CG 3.25Å; L111-L115 PolarHBondContact O-N 2.82Å; L111-L153 HydrophobicContact CD2-CD1 3.9Å; L111-L153 HydrophobicContact CD2-CD2 4.27Å; L111-L153 HydrophobicContact CD2-CG 4.38Å; L111-I176 HydrophobicContact CD1-CD1 4.14Å; L111-W199 HydrophobicContact CB-CD2 4.09Å; L111-W199 HydrophobicContact CB-CE3 4.43Å; L111-W199 HydrophobicContact CB-CG 4.47Å; L111-W199 HydrophobicContact CB-CZ2 4.28Å; L111-W199 HydrophobicContact CD1-CD2 4.44Å; L111-W199 HydrophobicContact CD1-CE3 3.96Å; L111-W199 HydrophobicContact CD1-CH2 3.8Å; L111-W199 HydrophobicContact CD1-CZ2 4.31Å; L111-W199 HydrophobicContact CD1-CZ3 3.62Å
112	D	83.6	Confident	84	Confident	59 Å²	59	45 Å²	45	32%	0.316	23%	0.227	S	C	.	.	H	α-helix	trans	-58.6	-47.7	177.5	-174.1	73.4	0	0	0	111.8	T110 V114 L115 R116 M136	T110-D112 VanDerWaalsContact C-N 3.25Å; T110-D112 PolarHBondContact O-N 3.34Å; D112-V114 PolarHBondContact O-N 3.38Å; D112-L115 PolarHBondContact O-N 2.84Å; D112-R116 WeakPolarHBondContact O-CG 3.34Å; D112-R116 PolarHBondContact O-N 3.13Å; D112-R116 IonicContact OD1-NE 2.84Å; D112-R116 IonicContact OD2-CZ 3.68Å; D112-R116 IonicContact OD2-NE 3.79Å; D112-R116 PolarHBondContact OD2-NE 3.47Å; D112-R116 IonicContact OD2-NH2 3.7Å; D112-M136 WeakPolarHBondContact OD1-CE 3.38Å
113	E	84.5	Confident	83.5	Confident	71 Å²	71	47.7 Å²	47.7	33%	0.332	24%	0.244	S	C	.	.	H	α-helix	trans	-66.8	-38.4	179.4	-171.8	-174.7	178.7	0	0	112.1	A108 T110 R116 R117	A108-E113 HydrophobicContact CB-CB 3.93Å; A108-E113 HydrophobicContact CB-CG 3.66Å; T110-E113 PolarHBondContact O-N 2.91Å; T110-E113 VanDerWaalsContact OG1-CB 3.23Å; T110-E113 WeakPolarHBondContact OG1-CB 3.42Å; T110-E113 PolarHBondContact OG1-N 2.94Å; E113-R116 PolarHBondContact O-N 3.29Å; E113-R117 WeakPolarHBondContact O-CG 3.19Å; E113-R117 PolarHBondContact O-N 2.94Å; E113-R117 VanDerWaalsContact O-N 3.07Å; E113-R117 IonicContact OE1-CZ 3.17Å; E113-R117 IonicContact OE1-NE 3.5Å; E113-R117 IonicContact OE1-NH2 2.81Å; E113-R117 PolarHBondContact OE1-NH2 3.3Å
114	V	86.6	Confident	82.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-47.7	173.8	174.3	0	0	0	0	110.4	E106 A108 T110 L111 D112 R117 M118 T191 L193 W199 V209	E106-V114 HydrophobicContact CG-CG2 4.5Å; A108-V114 HydrophobicContact CB-CG2 3.63Å; T110-V114 WeakPolarHBondContact O-CG2 3.28Å; T110-V114 PolarHBondContact O-N 3.43Å; T110-V114 VanDerWaalsContact O-N 3.12Å; L111-V114 PolarHBondContact O-N 3.16Å; D112-V114 PolarHBondContact O-N 3.38Å; V114-R117 PolarHBondContact O-N 3.34Å; V114-M118 HydrophobicContact CG1-CG 4.47Å; V114-M118 HydrophobicContact CG1-SD 3.95Å; V114-M118 VanDerWaalsContact O-CG 3.25Å; V114-M118 WeakPolarHBondContact O-CG 3.35Å; V114-M118 PolarHBondContact O-N 3.43Å; V114-T191 HydrophobicContact CG1-CG2 4.25Å; V114-L193 HydrophobicContact CG1-CD2 4.23Å; V114-L193 HydrophobicContact CG2-CD2 3.76Å; V114-W199 HydrophobicContact CG2-CH2 4.48Å; V114-W199 HydrophobicContact CG2-CZ2 4.23Å; V114-V209 HydrophobicContact CG1-CB 4.43Å; V114-V209 HydrophobicContact CG1-CG2 4.24Å
115	L	86.8	Confident	81.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.6	-43.1	179.9	-73.2	172.7	0	0	0	112.3	L111 D112 R117 M118 I119 M136 F140 L153 I176 L211	L111-L115 HydrophobicContact CD1-CD1 4.25Å; L111-L115 HydrophobicContact CD1-CG 4.25Å; L111-L115 HydrophobicContact CG-CD1 4Å; L111-L115 HydrophobicContact CG-CG 4.41Å; L111-L115 WeakPolarHBondContact O-CG 3.25Å; L111-L115 PolarHBondContact O-N 2.82Å; D112-L115 PolarHBondContact O-N 2.84Å; L115-R117 VanDerWaalsContact C-N 3.32Å; L115-R117 PolarHBondContact O-N 3.39Å; L115-M118 HydrophobicContact CD2-SD 4.34Å; L115-M118 WeakPolarHBondContact O-CB 3.26Å; L115-M118 PolarHBondContact O-N 3.04Å; L115-I119 VanDerWaalsContact O-CG1 3.29Å; L115-I119 WeakPolarHBondContact O-CG1 3.43Å; L115-I119 PolarHBondContact O-N 3.03Å; L115-M136 HydrophobicContact CB-CE 4.34Å; L115-M136 HydrophobicContact CB-SD 4.01Å; L115-F140 HydrophobicContact CD1-CE2 4.16Å; L115-F140 HydrophobicContact CD1-CZ 3.84Å; L115-L153 HydrophobicContact CD1-CD2 4.45Å; L115-I176 HydrophobicContact CD1-CD1 4.24Å; L115-I176 HydrophobicContact CD2-CD1 3.94Å; L115-L211 HydrophobicContact CD2-CD1 4.09Å; L115-L211 HydrophobicContact CD2-CD2 4.23Å
116	R	86.9	Confident	80.3	Confident	117 Å²	117	55.5 Å²	55.5	44%	0.442	29%	0.29	S	S	.	.	H	α-helix	trans	-58.9	-43	175.5	-73.7	177.9	-174.8	-105.1	-3.2	111.9	D112 E113 I119 A120 M136	D112-R116 WeakPolarHBondContact O-CG 3.34Å; D112-R116 PolarHBondContact O-N 3.13Å; D112-R116 IonicContact OD1-NE 2.84Å; D112-R116 IonicContact OD2-CZ 3.68Å; D112-R116 IonicContact OD2-NE 3.79Å; D112-R116 PolarHBondContact OD2-NE 3.47Å; D112-R116 IonicContact OD2-NH2 3.7Å; E113-R116 PolarHBondContact O-N 3.29Å; R116-I119 PolarHBondContact O-N 3.25Å; R116-A120 WeakPolarHBondContact O-CB 3.29Å; R116-A120 PolarHBondContact O-N 3.44Å; R116-M136 HydrophobicContact CG-CE 3.82Å; R116-M136 HydrophobicContact CG-CG 4.41Å; R116-M136 HydrophobicContact CG-SD 4.14Å
117	R	85.6	Confident	78.7	Confident	98 Å²	98	63.9 Å²	63.9	37%	0.37	33%	0.328	S	S	.	.	H	α-helix	trans	-67.3	-39.5	176.6	-72.2	-176.2	-171.4	-158.8	14.9	112.5	E106 E113 V114 L115 A120 H121	E106-R117 VanDerWaalsContact OE1-CD 3.25Å; E106-R117 WeakPolarHBondContact OE1-CD 3.34Å; E106-R117 IonicContact OE1-CZ 2.77Å; E106-R117 IonicContact OE1-NE 2.62Å; E106-R117 IonicContact OE1-NH1 3.65Å; E106-R117 PolarHBondContact OE1-NH1 2.91Å; E106-R117 WeakPolarHBondContact OE2-CD 3.44Å; E106-R117 IonicContact OE2-NH1 3.57Å; E113-R117 WeakPolarHBondContact O-CG 3.19Å; E113-R117 PolarHBondContact O-N 2.94Å; E113-R117 VanDerWaalsContact O-N 3.07Å; E113-R117 IonicContact OE1-CZ 3.17Å; E113-R117 IonicContact OE1-NE 3.5Å; E113-R117 IonicContact OE1-NH2 2.81Å; E113-R117 PolarHBondContact OE1-NH2 3.3Å; V114-R117 PolarHBondContact O-N 3.34Å; L115-R117 VanDerWaalsContact C-N 3.32Å; L115-R117 PolarHBondContact O-N 3.39Å; R117-A120 PolarHBondContact O-N 2.97Å; R117-H121 WeakPolarHBondContact O-CB 3.42Å; R117-H121 PolarHBondContact O-N 2.93Å
118	M	87	Confident	77.2	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-58	-49.3	173.6	-72.6	175.1	84.6	0	0	111.1	L103 V114 L115 H121 M122 C189 T191 V209 L211	L103-M118 HydrophobicContact CD1-CG 4.24Å; V114-M118 HydrophobicContact CG1-CG 4.47Å; V114-M118 HydrophobicContact CG1-SD 3.95Å; V114-M118 VanDerWaalsContact O-CG 3.25Å; V114-M118 WeakPolarHBondContact O-CG 3.35Å; V114-M118 PolarHBondContact O-N 3.43Å; L115-M118 HydrophobicContact CD2-SD 4.34Å; L115-M118 WeakPolarHBondContact O-CB 3.26Å; L115-M118 PolarHBondContact O-N 3.04Å; M118-H121 PolarHBondContact O-N 2.86Å; M118-M122 WeakPolarHBondContact O-CG 3.46Å; M118-M122 PolarHBondContact O-N 2.9Å; M118-C189 HydrophobicContact CB-CB 4.49Å; M118-C189 HydrophobicContact CE-CB 3.77Å; M118-C189 WeakPolarHBondContact CE-O 3.28Å; M118-T191 WeakPolarHBondContact CE-OG1 3.49Å; M118-T191 WeakPolarHBondContact CG-OG1 3.34Å; M118-T191 PolarHBondContact SD-OG1 2.98Å; M118-T191 VanDerWaalsContact SD-OG1 3.32Å; M118-V209 HydrophobicContact CE-CG1 4.28Å; M118-V209 HydrophobicContact SD-CB 4.22Å; M118-V209 HydrophobicContact SD-CG1 3.89Å; M118-L211 HydrophobicContact CB-CD2 4.15Å; M118-L211 HydrophobicContact CE-CB 3.44Å; M118-L211 VanDerWaalsContact CE-CB 3.44Å; M118-L211 HydrophobicContact SD-CB 4.28Å
119	I	85.4	Confident	75.9	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-67.3	-42.8	-179	-62	162.3	0	0	0	110.9	L115 R116 H121 M122 V123 V132 V135 M136 L139 L211	L115-I119 VanDerWaalsContact O-CG1 3.29Å; L115-I119 WeakPolarHBondContact O-CG1 3.43Å; L115-I119 PolarHBondContact O-N 3.03Å; R116-I119 PolarHBondContact O-N 3.25Å; I119-H121 PolarHBondContact O-N 2.88Å; I119-M122 WeakPolarHBondContact O-CB 3.05Å; I119-M122 PolarHBondContact O-N 3.02Å; I119-V123 WeakPolarHBondContact O-CG2 3.46Å; I119-V123 PolarHBondContact O-N 2.96Å; I119-V132 HydrophobicContact CB-CG1 4.4Å; I119-V132 HydrophobicContact CG2-CB 4.37Å; I119-V132 HydrophobicContact CG2-CG1 4.13Å; I119-V132 HydrophobicContact CG2-CG2 4.09Å; I119-V135 HydrophobicContact CD1-CB 4.15Å; I119-V135 HydrophobicContact CD1-CG1 3.7Å; I119-V135 HydrophobicContact CG1-CG1 4.28Å; I119-M136 HydrophobicContact CD1-CG 4.1Å; I119-M136 HydrophobicContact CD1-SD 3.63Å; I119-L139 HydrophobicContact CD1-CD1 3.96Å; I119-L211 HydrophobicContact CG1-CD2 3.9Å
120	A	84.2	Confident	75	Confident	39 Å²	39	63 Å²	63	32%	0.322	35%	0.346	S	S	.	.	H	α-helix	trans	-58.9	-46.1	177.8	0	0	0	0	0	112	R116 R117 M122 V123 E124	R116-A120 WeakPolarHBondContact O-CB 3.29Å; R116-A120 PolarHBondContact O-N 3.44Å; R117-A120 PolarHBondContact O-N 2.97Å; A120-M122 VanDerWaalsContact C-N 3.32Å; A120-M122 PolarHBondContact O-N 2.96Å; A120-V123 WeakPolarHBondContact O-CB 3.43Å; A120-V123 PolarHBondContact O-N 3.32Å; A120-V123 VanDerWaalsContact O-N 3.12Å; A120-E124 PolarHBondContact O-N 3.48Å
121	H	82.1	Confident	74.6	Confident	53 Å²	53	64 Å²	64	25%	0.245	35%	0.348	C	S	.	.	H	α-helix	trans	-65.1	-35.5	177.5	-166.3	-64.7	0	0	0	112.5	L103 R117 M118 I119 V123 E124 D125	L103-H121 HydrophobicContact CD1-CB 4.07Å; L103-H121 HydrophobicContact CD2-CB 4.1Å; L103-H121 HydrophobicContact CG-CB 4.41Å; R117-H121 WeakPolarHBondContact O-CB 3.42Å; R117-H121 PolarHBondContact O-N 2.93Å; M118-H121 PolarHBondContact O-N 2.86Å; I119-H121 PolarHBondContact O-N 2.88Å; H121-V123 VanDerWaalsContact C-N 3.28Å; H121-V123 PolarHBondContact O-N 2.89Å; H121-E124 PolarHBondContact O-N 3.34Å; H121-D125 IonicContact CE1-OD1 2.97Å; H121-D125 IonicContact CE1-OD2 3.62Å; H121-D125 PolarHBondContact CE1-OD2 2.93Å; H121-D125 IonicContact ND1-OD2 3.97Å; H121-D125 PolarHBondContact ND1-OD2 3.02Å; H121-D125 PolarHBondContact O-N 2.86Å; H121-D125 VanDerWaalsContact O-N 3.13Å
122	M	77.4	Confident	74.2	Confident	27 Å²	27	64.6 Å²	64.6	13%	0.133	35%	0.353	C	S	.	.	H	α-helix	trans	-65.6	-31.4	174.1	-69.6	168.9	83.4	0	0	112.5	S101 M118 I119 A120 H187 C189 L211 L213	S101-M122 VanDerWaalsContact OG-CG 3.28Å; S101-M122 WeakPolarHBondContact OG-CG 3.11Å; M118-M122 WeakPolarHBondContact O-CG 3.46Å; M118-M122 PolarHBondContact O-N 2.9Å; I119-M122 WeakPolarHBondContact O-CB 3.05Å; I119-M122 PolarHBondContact O-N 3.02Å; A120-M122 VanDerWaalsContact C-N 3.32Å; A120-M122 PolarHBondContact O-N 2.96Å; M122-H187 HydrophobicContact CE-CB 3.22Å; M122-C189 HydrophobicContact CE-CB 4.2Å; M122-C189 HydrophobicContact CG-CB 3.91Å; M122-C189 HydrophobicContact SD-CB 3.46Å; M122-C189 WeakPolarHBondContact SD-CB 3.36Å; M122-L211 HydrophobicContact SD-CD2 4.29Å; M122-L213 HydrophobicContact CE-CD1 3.77Å; M122-L213 HydrophobicContact CE-CG 4.24Å; M122-L213 HydrophobicContact SD-CD1 4.18Å
123	V	75.4	Confident	73.8	Confident	61 Å²	61	67.9 Å²	67.9	37%	0.37	37%	0.366	S	S	.	.	H	α-helix	trans	-75	-34.6	176.6	173.2	0	0	0	0	111.1	I119 A120 H121 C130	I119-V123 WeakPolarHBondContact O-CG2 3.46Å; I119-V123 PolarHBondContact O-N 2.96Å; A120-V123 WeakPolarHBondContact O-CB 3.43Å; A120-V123 PolarHBondContact O-N 3.32Å; A120-V123 VanDerWaalsContact O-N 3.12Å; H121-V123 VanDerWaalsContact C-N 3.28Å; H121-V123 PolarHBondContact O-N 2.89Å; V123-C130 HydrophobicContact CG2-CB 4.4Å
124	E	70	Confident	73.4	Confident	160 Å²	160	68.4 Å²	68.4	75%	0.748	37%	0.369	S	S	*	.	H	α-helix	trans	-71.5	-36.6	177.9	-72.3	178.6	179.2	0	0	113.5	A120 H121 G126	A120-E124 PolarHBondContact O-N 3.48Å; H121-E124 PolarHBondContact O-N 3.34Å; E124-G126 VanDerWaalsContact C-N 3.35Å; E124-G126 PolarHBondContact O-N 2.91Å
125	D	62.2	Low	72.9	Confident	107 Å²	107	68.4 Å²	68.4	57%	0.572	37%	0.369	S	S	*	.	S	Bend	trans	-75.1	-13.6	-176.9	-81.2	-25.3	0	0	0	115	H121	H121-D125 IonicContact CE1-OD1 2.97Å; H121-D125 IonicContact CE1-OD2 3.62Å; H121-D125 PolarHBondContact CE1-OD2 2.93Å; H121-D125 IonicContact ND1-OD2 3.97Å; H121-D125 PolarHBondContact ND1-OD2 3.02Å; H121-D125 PolarHBondContact O-N 2.86Å; H121-D125 VanDerWaalsContact O-N 3.13Å
126	G	54.8	Low	72.5	Confident	38 Å²	38	68.7 Å²	68.7	39%	0.392	37%	0.371	S	S	.	.	S	Bend	trans	130.2	133.7	160.6	0	0	0	0	0	118.8	E124	E124-G126 VanDerWaalsContact C-N 3.35Å; E124-G126 PolarHBondContact O-N 2.91Å
127	H	49	Very low	71.9	Confident	196 Å²	196	68.4 Å²	68.4	91%	0.907	38%	0.377	S	S	*	.	S	Bend	trans	72.1	66	163.1	-63.8	-61.5	0	0	0	119.7
128	G	52.2	Low	71.4	Confident	48 Å²	48	65.2 Å²	65.2	50%	0.495	37%	0.37	S	S	.	.			trans	-174.6	132.2	150.9	0	0	0	0	0	112	C130	G128-C130 PolarHBondContact O-N 3.33Å
129	S	53.7	Low	70.8	Confident	124 Å²	124	65.2 Å²	65.2	87%	0.867	37%	0.37	S	S	*	.			trans	-72.6	69.7	168	58.9	0	0	0	0	109.2
130	C	61.4	Low	70.4	Confident	20 Å²	20	66.1 Å²	66.1	14%	0.135	37%	0.374	C	S	.	.			trans	-90.7	115.3	176.4	-137.5	0	0	0	0	108	V123 G128 V132 V135 L183	V123-C130 HydrophobicContact CG2-CB 4.4Å; G128-C130 PolarHBondContact O-N 3.33Å; C130-V132 PolarHBondContact O-N 3.34Å; C130-V135 WeakPolarHBondContact SG-CG2 3.49Å; C130-L183 VanDerWaalsContact SG-CD1 3.54Å
131	N	73.6	Confident	69.5	Low	94 Å²	94	64.8 Å²	64.8	50%	0.503	36%	0.362	S	S	.	.			trans	-72.4	121.2	176.2	-169.1	-4.9	0	0	0	108.5	E133 E134 V135	N131-E133 PolarHBondContact O-N 3.26Å; N131-E133 PolarHBondContact OD1-N 3.08Å; N131-E134 HydrophobicContact CB-CB 4.04Å; N131-E134 WeakPolarHBondContact O-CB 3.27Å; N131-E134 PolarHBondContact O-N 3.27Å; N131-E134 VanDerWaalsContact O-N 3.07Å; N131-V135 PolarHBondContact O-N 2.96Å
132	V	75.9	Confident	68.3	Low	41 Å²	41	66.1 Å²	66.1	25%	0.248	37%	0.371	C	S	.	.	H	α-helix	trans	-56.1	-39.6	-176.9	-177.3	0	0	0	0	110.5	I119 C130 E134 V135 M136	I119-V132 HydrophobicContact CB-CG1 4.4Å; I119-V132 HydrophobicContact CG2-CB 4.37Å; I119-V132 HydrophobicContact CG2-CG1 4.13Å; I119-V132 HydrophobicContact CG2-CG2 4.09Å; C130-V132 PolarHBondContact O-N 3.34Å; V132-E134 PolarHBondContact O-N 3.13Å; V132-V135 PolarHBondContact O-N 3.01Å; V132-M136 HydrophobicContact CG1-CG 4.26Å; V132-M136 WeakPolarHBondContact O-CB 3.27Å; V132-M136 WeakPolarHBondContact O-CG 3.42Å; V132-M136 PolarHBondContact O-N 3.15Å
133	E	74.9	Confident	66.8	Low	127 Å²	127	66.5 Å²	66.5	59%	0.593	38%	0.378	S	S	*	.	H	α-helix	trans	-67.6	-35.4	179.8	-64.4	-173	163.8	0	0	113	N131 M136 N137	N131-E133 PolarHBondContact O-N 3.26Å; N131-E133 PolarHBondContact OD1-N 3.08Å; E133-M136 PolarHBondContact O-N 2.83Å; E133-N137 WeakPolarHBondContact O-CB 3.41Å; E133-N137 PolarHBondContact O-N 2.96Å; E133-N137 PolarHBondContact O-ND2 3.34Å; E133-N137 PolarHBondContact O-OD1 2.97Å
134	E	75.7	Confident	64.9	Low	82 Å²	82	66.8 Å²	66.8	38%	0.383	39%	0.393	S	S	.	.	H	α-helix	trans	-66.2	-41.4	177.6	-172.3	-174.5	180	0	0	111.2	N131 V132 S138 N182	N131-E134 HydrophobicContact CB-CB 4.04Å; N131-E134 WeakPolarHBondContact O-CB 3.27Å; N131-E134 PolarHBondContact O-N 3.27Å; N131-E134 VanDerWaalsContact O-N 3.07Å; V132-E134 PolarHBondContact O-N 3.13Å; E134-S138 PolarHBondContact O-N 3.14Å; E134-S138 VanDerWaalsContact O-N 3.16Å; E134-N182 PolarHBondContact OE1-ND2 3.33Å; E134-N182 VanDerWaalsContact OE1-ND2 3.13Å; E134-N182 PolarHBondContact OE2-ND2 3.03Å
135	V	76.6	Confident	63.2	Low	0 Å²	0	61.3 Å²	61.3	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-69.6	-40.3	177.2	-179	0	0	0	0	110.9	I119 C130 N131 V132 N137 S138 L139 V180 L213	I119-V135 HydrophobicContact CD1-CB 4.15Å; I119-V135 HydrophobicContact CD1-CG1 3.7Å; I119-V135 HydrophobicContact CG1-CG1 4.28Å; C130-V135 WeakPolarHBondContact SG-CG2 3.49Å; N131-V135 PolarHBondContact O-N 2.96Å; V132-V135 PolarHBondContact O-N 3.01Å; V135-N137 PolarHBondContact O-N 2.94Å; V135-S138 WeakPolarHBondContact O-CB 3.42Å; V135-S138 PolarHBondContact O-N 2.79Å; V135-S138 VanDerWaalsContact O-N 3.13Å; V135-L139 HydrophobicContact CG1-CD1 3.97Å; V135-L139 HydrophobicContact CG1-CG 4.43Å; V135-L139 VanDerWaalsContact O-CG 3.31Å; V135-L139 WeakPolarHBondContact O-CG 3.43Å; V135-L139 PolarHBondContact O-N 2.83Å; V135-V180 HydrophobicContact CG1-CG2 4.26Å; V135-V180 HydrophobicContact CG2-CG1 4.23Å; V135-V180 HydrophobicContact CG2-CG2 4.2Å; V135-L213 HydrophobicContact CG1-CD1 4.26Å; V135-L213 HydrophobicContact CG1-CD2 3.95Å
136	M	78.6	Confident	62.3	Low	7 Å²	7	68.2 Å²	68.2	3%	0.034	40%	0.398	C	S	.	.	H	α-helix	trans	-63.2	-41.6	177.4	-70.6	-63.9	-70.8	0	0	112	D112 L115 R116 I119 V132 E133 S138 L139 F140	D112-M136 WeakPolarHBondContact OD1-CE 3.38Å; L115-M136 HydrophobicContact CB-CE 4.34Å; L115-M136 HydrophobicContact CB-SD 4.01Å; R116-M136 HydrophobicContact CG-CE 3.82Å; R116-M136 HydrophobicContact CG-CG 4.41Å; R116-M136 HydrophobicContact CG-SD 4.14Å; I119-M136 HydrophobicContact CD1-CG 4.1Å; I119-M136 HydrophobicContact CD1-SD 3.63Å; V132-M136 HydrophobicContact CG1-CG 4.26Å; V132-M136 WeakPolarHBondContact O-CB 3.27Å; V132-M136 WeakPolarHBondContact O-CG 3.42Å; V132-M136 PolarHBondContact O-N 3.15Å; E133-M136 PolarHBondContact O-N 2.83Å; M136-S138 PolarHBondContact O-N 2.89Å; M136-L139 PolarHBondContact O-N 2.77Å; M136-L139 VanDerWaalsContact O-N 3.09Å; M136-L139 HydrophobicContact SD-CD1 4.1Å; M136-F140 HydrophobicContact CE-CD2 4.32Å; M136-F140 HydrophobicContact CE-CE2 3.63Å; M136-F140 WeakPolarHBondContact O-CD2 3.39Å; M136-F140 PolarHBondContact O-N 3Å
137	N	75.1	Confident	61.6	Low	110 Å²	110	74.1 Å²	74.1	59%	0.588	42%	0.421	S	S	*	.	H	α-helix	trans	-68.2	-23.4	174.8	-66.1	-8.5	0	0	0	112.9	E133 V135 F140	E133-N137 WeakPolarHBondContact O-CB 3.41Å; E133-N137 PolarHBondContact O-N 2.96Å; E133-N137 PolarHBondContact O-ND2 3.34Å; E133-N137 PolarHBondContact O-OD1 2.97Å; V135-N137 PolarHBondContact O-N 2.94Å; N137-F140 VanDerWaalsContact O-O 3.05Å
138	S	73.8	Confident	61.2	Low	31 Å²	31	70.9 Å²	70.9	22%	0.217	41%	0.409	C	S	.	.	H	α-helix	trans	-78.3	-27	170.9	161.6	0	0	0	0	112.9	E134 V135 M136 S178	E134-S138 PolarHBondContact O-N 3.14Å; E134-S138 VanDerWaalsContact O-N 3.16Å; V135-S138 WeakPolarHBondContact O-CB 3.42Å; V135-S138 PolarHBondContact O-N 2.79Å; V135-S138 VanDerWaalsContact O-N 3.13Å; M136-S138 PolarHBondContact O-N 2.89Å; S138-S178 PolarHBondContact OG-OG 3.22Å
139	L	74.6	Confident	60.8	Low	1 Å²	1	73.5 Å²	73.5	1%	0.005	41%	0.412	C	S	.	.	H	α-helix	trans	-80.3	-31.2	-177.2	-76.1	164.3	0	0	0	111.9	I119 V135 M136 L153 M154 I176 S178 L211	I119-L139 HydrophobicContact CD1-CD1 3.96Å; V135-L139 HydrophobicContact CG1-CD1 3.97Å; V135-L139 HydrophobicContact CG1-CG 4.43Å; V135-L139 VanDerWaalsContact O-CG 3.31Å; V135-L139 WeakPolarHBondContact O-CG 3.43Å; V135-L139 PolarHBondContact O-N 2.83Å; M136-L139 PolarHBondContact O-N 2.77Å; M136-L139 VanDerWaalsContact O-N 3.09Å; M136-L139 HydrophobicContact SD-CD1 4.1Å; L139-L153 WeakPolarHBondContact O-CA 3.33Å; L139-M154 PolarHBondContact O-N 3.15Å; L139-I176 HydrophobicContact CD2-CG2 3.58Å; L139-S178 VanDerWaalsContact CD2-CB 3.44Å; L139-L211 HydrophobicContact CD1-CD1 4.35Å; L139-L211 HydrophobicContact CD2-CD1 3.82Å
140	F	76.4	Confident	60.6	Low	22 Å²	22	71 Å²	71	10%	0.096	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.3	-179.4	-64.3	-71.8	0	0	0	111.8	L115 M136 N137 D142 H151 L152 L153	L115-F140 HydrophobicContact CD1-CE2 4.16Å; L115-F140 HydrophobicContact CD1-CZ 3.84Å; M136-F140 HydrophobicContact CE-CD2 4.32Å; M136-F140 HydrophobicContact CE-CE2 3.63Å; M136-F140 WeakPolarHBondContact O-CD2 3.39Å; M136-F140 PolarHBondContact O-N 3Å; N137-F140 VanDerWaalsContact O-O 3.05Å; F140-D142 PolarHBondContact O-N 2.82Å; F140-H151 HydrophobicContact CB-CB 4.44Å; F140-H151 HydrophobicContact CD1-CB 3.72Å; F140-H151 HydrophobicContact CE1-CB 4.21Å; F140-H151 HydrophobicContact CG-CB 4.18Å; F140-L152 CarbonylContact C-O 3.53Å; F140-L152 VanDerWaalsContact CA-O 3.28Å; F140-L152 WeakPolarHBondContact CA-O 3.37Å; F140-L153 HydrophobicContact CD1-CD2 4.09Å; F140-L153 HydrophobicContact CE1-CD2 3.6Å; F140-L153 HydrophobicContact CE1-CG 4.24Å; F140-L153 HydrophobicContact CZ-CD2 4.1Å
141	T	65.8	Low	60.5	Low	11 Å²	11	75 Å²	75	7%	0.067	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	100.3	165.3	38.2	0	0	0	0	108.6	A143 L152 M154	T141-A143 PolarHBondContact O-N 3.03Å; T141-L152 PolarHBondContact N-O 3.42Å; T141-L152 PolarHBondContact OG1-O 2.79Å; T141-L152 VanDerWaalsContact OG1-O 3.13Å; T141-M154 HydrophobicContact CG2-CB 4.45Å; T141-M154 HydrophobicContact CG2-CG 4.22Å
142	D	56.7	Low	60	Low	82 Å²	82	73.1 Å²	73.1	44%	0.439	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	91.6	173.1	-78.3	-13.6	0	0	0	109.7	F140 G144 H151	F140-D142 PolarHBondContact O-N 2.82Å; D142-G144 PolarHBondContact O-N 3.37Å; D142-H151 IonicContact OD1-CE1 3.23Å; D142-H151 PolarHBondContact OD1-CE1 3.29Å; D142-H151 VanDerWaalsContact OD1-CE1 3.23Å; D142-H151 IonicContact OD1-ND1 3.08Å; D142-H151 PolarHBondContact OD1-ND1 2.93Å
143	A	45.9	Very low	59.7	Low	34 Å²	34	72.5 Å²	72.5	28%	0.281	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	77.1	163.7	0	0	0	0	0	108.8	L71 T141 G145	L71-A143 HydrophobicContact CD1-CB 4.14Å; T141-A143 PolarHBondContact O-N 3.03Å; A143-G145 PolarHBondContact O-N 2.88Å; A143-G145 VanDerWaalsContact O-N 3.12Å
144	G	36.9	Very low	59.2	Low	67 Å²	67	70 Å²	70	69%	0.691	38%	0.381	S	S	*	.			trans	-74.4	95	-176.4	0	0	0	0	0	113.3	D142	D142-G144 PolarHBondContact O-N 3.37Å
145	G	34.4	Very low	59.3	Low	46 Å²	46	67 Å²	67	47%	0.474	37%	0.367	S	S	.	.			trans	-109.6	130	155.5	0	0	0	0	0	109.1	A143 D147 I148	A143-G145 PolarHBondContact O-N 2.88Å; A143-G145 VanDerWaalsContact O-N 3.12Å; G145-D147 PolarHBondContact O-N 2.83Å; G145-I148 PolarHBondContact O-N 3.27Å
146	R	41.5	Very low	59.6	Low	252 Å²	252	67.7 Å²	67.7	95%	0.951	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.2	-1.2	-160.1	-84.2	179.9	175.2	169.4	-0.8	120.7
147	D	40.5	Very low	59.8	Low	161 Å²	161	67.5 Å²	67.5	86%	0.861	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.6	-3.7	179.4	-71.4	-54.2	0	0	0	115.7	G145	G145-D147 PolarHBondContact O-N 2.83Å
148	I	40.5	Very low	60.1	Low	128 Å²	128	63.1 Å²	63.1	66%	0.656	35%	0.347	S	S	*	.			trans	-145.2	97.5	176.4	-51.1	176.3	0	0	0	110.2	G145 V150	G145-I148 PolarHBondContact O-N 3.27Å; I148-V150 HydrophobicContact CG2-CG2 3.92Å; I148-V150 PolarHBondContact O-N 2.97Å
149	N	43.8	Very low	60.2	Low	103 Å²	103	61.7 Å²	61.7	55%	0.551	34%	0.337	S	S	*	.			trans	-75.1	103.8	169	-74.7	-3.8	0	0	0	109.1	H151	N149-H151 PolarHBondContact O-N 2.84Å
150	V	49.4	Very low	60.1	Low	72 Å²	72	61.9 Å²	61.9	44%	0.436	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	97.1	168.2	-173.8	0	0	0	0	107.8	I148 L152	I148-V150 HydrophobicContact CG2-CG2 3.92Å; I148-V150 PolarHBondContact O-N 2.97Å; V150-L152 HydrophobicContact CB-CD1 4.5Å; V150-L152 HydrophobicContact CG1-CD1 3.57Å; V150-L152 HydrophobicContact CG1-CG 3.86Å; V150-L152 PolarHBondContact O-N 2.87Å; V150-L152 VanDerWaalsContact O-N 3.16Å
151	H	59.7	Low	59.5	Low	104 Å²	104	62.7 Å²	62.7	48%	0.481	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	96.4	173.9	-63.1	-65.7	0	0	0	109.7	F140 D142 N149	F140-H151 HydrophobicContact CB-CB 4.44Å; F140-H151 HydrophobicContact CD1-CB 3.72Å; F140-H151 HydrophobicContact CE1-CB 4.21Å; F140-H151 HydrophobicContact CG-CB 4.18Å; D142-H151 IonicContact OD1-CE1 3.23Å; D142-H151 PolarHBondContact OD1-CE1 3.29Å; D142-H151 VanDerWaalsContact OD1-CE1 3.23Å; D142-H151 IonicContact OD1-ND1 3.08Å; D142-H151 PolarHBondContact OD1-ND1 2.93Å; N149-H151 PolarHBondContact O-N 2.84Å
152	L	63.1	Low	58.7	Low	54 Å²	54	64.3 Å²	64.3	28%	0.283	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	141.6	174.2	-80.8	145	0	0	0	110.1	M29 L71 F140 T141 V150	M29-L152 HydrophobicContact CE-CD2 3.95Å; M29-L152 HydrophobicContact SD-CB 4.14Å; M29-L152 HydrophobicContact SD-CD2 4.28Å; L71-L152 HydrophobicContact CD1-CD1 3.78Å; F140-L152 CarbonylContact C-O 3.53Å; F140-L152 VanDerWaalsContact CA-O 3.28Å; F140-L152 WeakPolarHBondContact CA-O 3.37Å; T141-L152 PolarHBondContact N-O 3.42Å; T141-L152 PolarHBondContact OG1-O 2.79Å; T141-L152 VanDerWaalsContact OG1-O 3.13Å; V150-L152 HydrophobicContact CB-CD1 4.5Å; V150-L152 HydrophobicContact CG1-CD1 3.57Å; V150-L152 HydrophobicContact CG1-CG 3.86Å; V150-L152 PolarHBondContact O-N 2.87Å; V150-L152 VanDerWaalsContact O-N 3.16Å
153	L	69.9	Low	58.4	Low	28 Å²	28	63.1 Å²	63.1	15%	0.147	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	134.5	176.1	-67	166.1	0	0	0	110.4	L111 L115 L139 F140 T156 L174 I176	L111-L153 HydrophobicContact CD2-CD1 3.9Å; L111-L153 HydrophobicContact CD2-CD2 4.27Å; L111-L153 HydrophobicContact CD2-CG 4.38Å; L115-L153 HydrophobicContact CD1-CD2 4.45Å; L139-L153 WeakPolarHBondContact O-CA 3.33Å; F140-L153 HydrophobicContact CD1-CD2 4.09Å; F140-L153 HydrophobicContact CE1-CD2 3.6Å; F140-L153 HydrophobicContact CE1-CG 4.24Å; F140-L153 HydrophobicContact CZ-CD2 4.1Å; L153-T156 HydrophobicContact CB-CG2 3.58Å; L153-T156 HydrophobicContact CD1-CG2 3.64Å; L153-T156 HydrophobicContact CG-CG2 4.26Å; L153-L174 HydrophobicContact CD1-CD2 4.04Å; L153-I176 HydrophobicContact CD1-CD1 4.02Å; L153-I176 HydrophobicContact CD1-CG1 4.2Å; L153-I176 HydrophobicContact CD2-CD1 4.1Å; L153-I176 HydrophobicContact CD2-CG2 4.21Å
154	M	63.3	Low	57.9	Low	74 Å²	74	66.8 Å²	66.8	37%	0.365	38%	0.379	S	S	.	.	S	Bend	trans	-69.1	-51.4	-174.2	-165.5	175	-150.5	0	0	113.4	M29 L139 T141	M29-M154 PolarHBondContact N-O 2.86Å; L139-M154 PolarHBondContact O-N 3.15Å; T141-M154 HydrophobicContact CG2-CB 4.45Å; T141-M154 HydrophobicContact CG2-CG 4.22Å
155	E	78.5	Confident	57.9	Low	20 Å²	20	67.4 Å²	67.4	9%	0.093	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	122.2	179	-69.3	179.2	-153.8	0	0	110.7	F26 L177 N179	F26-E155 HydrophobicContact CZ-CG 4.44Å; E155-L177 HydrophobicContact CB-CB 3.81Å; E155-L177 HydrophobicContact CB-CD1 4.44Å; E155-L177 PolarHBondContact O-N 2.99Å; E155-N179 PolarHBondContact OE1-ND2 3.23Å
156	T	82.3	Confident	58.9	Low	14 Å²	14	66.9 Å²	66.9	9%	0.086	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	145.3	177.7	59.2	0	0	0	0	112.5	Q27 L153 L174 C175 I176	Q27-T156 PolarHBondContact N-O 3.37Å; Q27-T156 PolarHBondContact O-N 3.41Å; Q27-T156 VanDerWaalsContact O-N 3.15Å; L153-T156 HydrophobicContact CB-CG2 3.58Å; L153-T156 HydrophobicContact CD1-CG2 3.64Å; L153-T156 HydrophobicContact CG-CG2 4.26Å; T156-L174 HydrophobicContact CG2-CD1 4.41Å; T156-C175 WeakPolarHBondContact CA-O 3.48Å; T156-I176 HydrophobicContact CG2-CG1 4.47Å
157	I	84.6	Confident	59.8	Low	3 Å²	3	59.5 Å²	59.5	2%	0.015	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	125.5	168.8	-67.2	176.6	0	0	0	108.3	Y24 F26 W173 C175 L177 V225 A232	Y24-I157 HydrophobicContact CD1-CG2 4.38Å; Y24-I157 HydrophobicContact CG-CG2 4.39Å; F26-I157 HydrophobicContact CD2-CD1 4.25Å; F26-I157 HydrophobicContact CD2-CG1 3.83Å; I157-W173 HydrophobicContact CG2-CH2 4.26Å; I157-W173 WeakPolarHBondContact O-CZ3 3.23Å; I157-C175 HydrophobicContact CB-CB 4.1Å; I157-C175 PolarHBondContact N-O 3.34Å; I157-C175 PolarHBondContact O-N 3.09Å; I157-L177 HydrophobicContact CD1-CD1 3.64Å; I157-L177 HydrophobicContact CG1-CD1 3.72Å; I157-V225 HydrophobicContact CD1-CG1 4.35Å; I157-A232 HydrophobicContact CG2-CB 3.86Å
158	Q	81.5	Confident	60.9	Low	18 Å²	18	55.6 Å²	55.6	8%	0.084	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.4	172	-67.8	-177.9	-5	0	0	110.6	V25 Y169 L174 C203	V25-Q158 PolarHBondContact N-O 2.83Å; V25-Q158 VanDerWaalsContact N-O 3.15Å; V25-Q158 PolarHBondContact O-N 3.39Å; Q158-Y169 HydrophobicContact CB-CD1 4.26Å; Q158-Y169 VanDerWaalsContact OE1-CD1 3.25Å; Q158-L174 HydrophobicContact CG-CD1 3.74Å; Q158-C203 PolarHBondContact NE2-SG 3.35Å
159	G	75.8	Confident	62.4	Low	1 Å²	1	51.4 Å²	51.4	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	136.1	169.7	0	0	0	0	0	110.7	Y169 Q170	G159-Y169 CarbonylContact O-C 3.55Å; G159-Q170 PolarHBondContact O-N 3.42Å
160	V	70.8	Confident	63.8	Low	5 Å²	5	48.3 Å²	48.3	3%	0.03	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136.9	177	165.9	0	0	0	0	110.7	G23 V25 I167 H168 Y169	G23-V160 PolarHBondContact N-O 3.27Å; G23-V160 CarbonylContact O-C 3.45Å; G23-V160 PolarHBondContact O-N 2.85Å; V25-V160 HydrophobicContact CB-CG2 3.84Å; V25-V160 HydrophobicContact CG2-CB 3.92Å; V25-V160 HydrophobicContact CG2-CG1 4.15Å; V25-V160 HydrophobicContact CG2-CG2 3.5Å; V25-V160 VanDerWaalsContact CG2-CG2 3.5Å; V160-I167 HydrophobicContact CB-CG2 4.34Å; V160-I167 HydrophobicContact CG1-CB 4.21Å; V160-I167 HydrophobicContact CG1-CG1 4.49Å; V160-I167 HydrophobicContact CG1-CG2 3.33Å; V160-I167 HydrophobicContact CG2-CG2 4.04Å; V160-H168 CarbonylContact C-O 3.6Å; V160-H168 VanDerWaalsContact CA-O 3.24Å; V160-H168 WeakPolarHBondContact CA-O 3.48Å; V160-Y169 HydrophobicContact CG2-CD1 3.58Å; V160-Y169 HydrophobicContact CG2-CE1 3.75Å; V160-Y169 HydrophobicContact CG2-CG 4.31Å
161	T	63.8	Low	65.1	Low	40 Å²	40	47 Å²	47	25%	0.245	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	110.8	170.5	-50.9	0	0	0	0	108.5	T163 H168	T161-T163 HydrophobicContact CG2-CG2 4.46Å; T161-T163 PolarHBondContact O-N 3.17Å; T161-H168 PolarHBondContact N-O 2.74Å; T161-H168 PolarHBondContact O-N 3.27Å
162	A	50.8	Low	66	Low	44 Å²	44	43 Å²	43	36%	0.364	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	110.8	176.5	0	0	0	0	0	109.3
163	T	49.6	Very low	67.1	Low	58 Å²	58	40.4 Å²	40.4	36%	0.356	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	164.9	172.5	63.8	0	0	0	0	110.1	T161 T165 G166 H168	T161-T163 HydrophobicContact CG2-CG2 4.46Å; T161-T163 PolarHBondContact O-N 3.17Å; T163-T165 PolarHBondContact O-N 3.23Å; T163-T165 PolarHBondContact OG1-OG1 2.87Å; T163-G166 PolarHBondContact N-O 3.04Å; T163-G166 PolarHBondContact O-N 3.4Å; T163-G166 VanDerWaalsContact O-N 3.07Å; T163-G166 VanDerWaalsContact O-O 3.11Å; T163-G166 PolarHBondContact OG1-O 3.12Å; T163-H168 PolarHBondContact OG1-CD2 3.33Å; T163-H168 PolarHBondContact OG1-NE2 3.28Å
164	S	34.2	Very low	68	Low	110 Å²	110	39.3 Å²	39.3	77%	0.769	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-12.8	175.4	58.2	0	0	0	0	114.1
165	T	37.7	Very low	69.1	Low	80 Å²	80	35.8 Å²	35.8	49%	0.491	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-6.1	179.2	50.7	0	0	0	0	114	T163 H168	T163-T165 PolarHBondContact O-N 3.23Å; T163-T165 PolarHBondContact OG1-OG1 2.87Å; T165-H168 PolarHBondContact OG1-NE2 3.3Å
166	G	55.3	Low	69.6	Low	35 Å²	35	34.9 Å²	34.9	36%	0.361	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	140.2	179.3	-176.1	0	0	0	0	0	113.6	T163	T163-G166 PolarHBondContact N-O 3.04Å; T163-G166 PolarHBondContact O-N 3.4Å; T163-G166 VanDerWaalsContact O-N 3.07Å; T163-G166 VanDerWaalsContact O-O 3.11Å; T163-G166 PolarHBondContact OG1-O 3.12Å
167	I	61.8	Low	69.8	Low	97 Å²	97	34.3 Å²	34.3	50%	0.497	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	115.2	174.7	-70.7	172	0	0	0	107.5	V160 Y169	V160-I167 HydrophobicContact CB-CG2 4.34Å; V160-I167 HydrophobicContact CG1-CB 4.21Å; V160-I167 HydrophobicContact CG1-CG1 4.49Å; V160-I167 HydrophobicContact CG1-CG2 3.33Å; V160-I167 HydrophobicContact CG2-CG2 4.04Å; I167-Y169 HydrophobicContact CG2-CE1 4.48Å; I167-Y169 HydrophobicContact CG2-CE2 3.99Å
168	H	62.9	Low	69.8	Low	79 Å²	79	34.4 Å²	34.4	37%	0.366	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	132.3	172.9	-66.7	-79.2	0	0	0	110.2	V160 T161 T163 T165	V160-H168 CarbonylContact C-O 3.6Å; V160-H168 VanDerWaalsContact CA-O 3.24Å; V160-H168 WeakPolarHBondContact CA-O 3.48Å; T161-H168 PolarHBondContact N-O 2.74Å; T161-H168 PolarHBondContact O-N 3.27Å; T163-H168 PolarHBondContact OG1-CD2 3.33Å; T163-H168 PolarHBondContact OG1-NE2 3.28Å; T165-H168 PolarHBondContact OG1-NE2 3.3Å
169	Y	71.9	Confident	69.8	Low	40 Å²	40	36.7 Å²	36.7	16%	0.157	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	137	177.8	-65.4	-89.4	0	0	0	110.4	R75 Q158 G159 V160 I167 Q171 N202	R75-Y169 PolarHBondContact NH1-OH 3.33Å; Q158-Y169 HydrophobicContact CB-CD1 4.26Å; Q158-Y169 VanDerWaalsContact OE1-CD1 3.25Å; G159-Y169 CarbonylContact O-C 3.55Å; V160-Y169 HydrophobicContact CG2-CD1 3.58Å; V160-Y169 HydrophobicContact CG2-CE1 3.75Å; V160-Y169 HydrophobicContact CG2-CG 4.31Å; I167-Y169 HydrophobicContact CG2-CE1 4.48Å; I167-Y169 HydrophobicContact CG2-CE2 3.99Å; Y169-Q171 PolarHBondContact O-N 3.03Å; Y169-N202 HydrophobicContact CG-CB 4.39Å
170	Q	72.3	Confident	70	Confident	39 Å²	39	37 Å²	37	18%	0.182	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-71.6	116.9	169.2	-71.1	-171	-23.6	0	0	109	G159	G159-Q170 PolarHBondContact O-N 3.42Å
171	Q	77.9	Confident	70.1	Confident	45 Å²	45	46.8 Å²	46.8	21%	0.21	26%	0.257	C	S	.	.			trans	-88.8	-8.4	-169	-62	-179.4	-17.9	0	0	114.7	Y169 E205 A206 V701	Y169-Q171 PolarHBondContact O-N 3.03Å; Q171-E205 CarbonylContact O-C 3.53Å; Q171-E205 VanDerWaalsContact O-C 3.25Å; Q171-A206 PolarHBondContact O-N 3.45Å; Q171-V701 PolarHBondContact OE1-O 2.94Å
172	S	77.9	Confident	70.6	Confident	19 Å²	19	49.5 Å²	49.5	13%	0.133	27%	0.27	C	S	.	.	S	Bend	trans	-84.9	-22.2	-167.7	74.5	0	0	0	0	115.3	E205 R207 Y208 R241	S172-E205 WeakPolarHBondContact CA-O 3.33Å; S172-R207 PolarHBondContact O-N 3.36Å; S172-Y208 PolarHBondContact O-N 3.12Å; S172-R241 WeakPolarHBondContact OG-CD 3.44Å; S172-R241 PolarHBondContact OG-NH1 2.71Å
173	W	87.1	Confident	71.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	149.4	-172.8	66.9	-95.3	0	0	0	110.4	Y24 I157 C175 Y208 I210 A232 F235	Y24-W173 HydrophobicContact CD1-CH2 4.28Å; Y24-W173 HydrophobicContact CD1-CZ2 4.42Å; Y24-W173 HydrophobicContact CE1-CH2 4.26Å; Y24-W173 HydrophobicContact CE1-CZ2 4.07Å; I157-W173 HydrophobicContact CG2-CH2 4.26Å; I157-W173 WeakPolarHBondContact O-CZ3 3.23Å; W173-C175 HydrophobicContact CE3-CB 4.26Å; W173-C175 HydrophobicContact CZ3-CB 3.73Å; W173-Y208 VanDerWaalsContact CA-O 3.3Å; W173-Y208 WeakPolarHBondContact CA-O 3.49Å; W173-I210 HydrophobicContact CE3-CD1 4.39Å; W173-A232 HydrophobicContact CH2-CB 3.41Å; W173-A232 VanDerWaalsContact CH2-CB 3.41Å; W173-A232 HydrophobicContact CZ2-CB 4.16Å; W173-A232 HydrophobicContact CZ3-CB 4.08Å; W173-F235 HydrophobicContact CB-CD1 4.48Å; W173-F235 HydrophobicContact CD2-CB 3.97Å; W173-F235 HydrophobicContact CG-CB 4.02Å; W173-F235 PolarHBondContact NE1-O 3.2Å
174	L	87.8	Confident	72.7	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.026	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127	179.7	-177.7	61.6	0	0	0	109.8	L153 T156 Q158 I176 Y208 V209 I210	L153-L174 HydrophobicContact CD1-CD2 4.04Å; T156-L174 HydrophobicContact CG2-CD1 4.41Å; Q158-L174 HydrophobicContact CG-CD1 3.74Å; L174-I176 HydrophobicContact CD2-CD1 3.9Å; L174-I176 HydrophobicContact CD2-CG1 4.04Å; L174-I176 HydrophobicContact CG-CD1 4.27Å; L174-I176 HydrophobicContact CG-CG1 3.91Å; L174-Y208 PolarHBondContact N-O 3.35Å; L174-V209 WeakPolarHBondContact O-CA 3.48Å; L174-I210 PolarHBondContact O-N 3.15Å
175	C	87.8	Confident	74.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.4	171.6	-176.8	0	0	0	0	109.7	T156 I157 W173 I210	T156-C175 WeakPolarHBondContact CA-O 3.48Å; I157-C175 HydrophobicContact CB-CB 4.1Å; I157-C175 PolarHBondContact N-O 3.34Å; I157-C175 PolarHBondContact O-N 3.09Å; W173-C175 HydrophobicContact CE3-CB 4.26Å; W173-C175 HydrophobicContact CZ3-CB 3.73Å; C175-I210 CarbonylContact C-O 3.59Å; C175-I210 WeakPolarHBondContact CA-O 3.27Å; C175-I210 HydrophobicContact CB-CB 4.25Å
176	I	88.9	Confident	76.6	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.5	-177.9	-56.3	171.3	0	0	0	108	L111 L115 L139 L153 T156 L174 V209 I210 L211 I212	L111-I176 HydrophobicContact CD1-CD1 4.14Å; L115-I176 HydrophobicContact CD1-CD1 4.24Å; L115-I176 HydrophobicContact CD2-CD1 3.94Å; L139-I176 HydrophobicContact CD2-CG2 3.58Å; L153-I176 HydrophobicContact CD1-CD1 4.02Å; L153-I176 HydrophobicContact CD1-CG1 4.2Å; L153-I176 HydrophobicContact CD2-CD1 4.1Å; L153-I176 HydrophobicContact CD2-CG2 4.21Å; T156-I176 HydrophobicContact CG2-CG1 4.47Å; L174-I176 HydrophobicContact CD2-CD1 3.9Å; L174-I176 HydrophobicContact CD2-CG1 4.04Å; L174-I176 HydrophobicContact CG-CD1 4.27Å; L174-I176 HydrophobicContact CG-CG1 3.91Å; I176-V209 HydrophobicContact CD1-CG1 4.15Å; I176-I210 PolarHBondContact N-O 3.43Å; I176-L211 HydrophobicContact CB-CD1 4.2Å; I176-L211 HydrophobicContact CG2-CD1 4.15Å; I176-I212 PolarHBondContact O-N 2.81Å
177	L	86.3	Confident	77.9	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	140.5	-178.5	-62.1	152.6	0	0	0	108.5	F26 E155 I157 I212 A224	F26-L177 HydrophobicContact CD2-CD1 4.27Å; F26-L177 HydrophobicContact CE2-CD1 3.82Å; E155-L177 HydrophobicContact CB-CB 3.81Å; E155-L177 HydrophobicContact CB-CD1 4.44Å; E155-L177 PolarHBondContact O-N 2.99Å; I157-L177 HydrophobicContact CD1-CD1 3.64Å; I157-L177 HydrophobicContact CG1-CD1 3.72Å; L177-I212 HydrophobicContact CD2-CB 3.89Å; L177-I212 HydrophobicContact CD2-CD1 4.02Å; L177-I212 HydrophobicContact CD2-CG1 4.48Å; L177-I212 HydrophobicContact CD2-CG2 4.07Å; L177-A224 HydrophobicContact CD2-CB 3.61Å; L177-A224 VanDerWaalsContact CD2-O 3.3Å; L177-A224 WeakPolarHBondContact CD2-O 3.32Å
178	S	83.8	Confident	79	Confident	4 Å²	4	52.3 Å²	52.3	3%	0.028	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	140.1	170.3	157.2	0	0	0	0	110.9	S138 L139 I212 L213 A214	S138-S178 PolarHBondContact OG-OG 3.22Å; L139-S178 VanDerWaalsContact CD2-CB 3.44Å; S178-I212 PolarHBondContact N-O 3.46Å; S178-L213 WeakPolarHBondContact O-CA 3.2Å; S178-A214 PolarHBondContact O-N 3.48Å
179	N	81.5	Confident	80.1	Confident	67 Å²	67	48.6 Å²	48.6	36%	0.358	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	109.6	176.4	-67.5	-48.8	0	0	0	109.9	E155 A214	E155-N179 PolarHBondContact OE1-ND2 3.23Å; N179-A214 CarbonylContact C-O 3.51Å; N179-A214 VanDerWaalsContact CA-O 3.26Å; N179-A214 WeakPolarHBondContact CA-O 3.34Å
180	V	79.4	Confident	81	Confident	6 Å²	6	46.7 Å²	46.7	4%	0.036	21%	0.209	C	C	.	.			trans	-109	124.2	-176	-176.5	0	0	0	0	110.1	V135 N182 L183 L213 A214 P216	V135-V180 HydrophobicContact CG1-CG2 4.26Å; V135-V180 HydrophobicContact CG2-CG1 4.23Å; V135-V180 HydrophobicContact CG2-CG2 4.2Å; V180-N182 VanDerWaalsContact C-N 3.3Å; V180-N182 PolarHBondContact O-N 3.06Å; V180-L183 HydrophobicContact CB-CD1 4.01Å; V180-L183 HydrophobicContact CG1-CD1 3.88Å; V180-L183 PolarHBondContact O-N 3.47Å; V180-L213 HydrophobicContact CG2-CD2 4.18Å; V180-A214 PolarHBondContact N-O 3.34Å; V180-P216 VanDerWaalsContact O-CD 3.28Å; V180-P216 WeakPolarHBondContact O-CD 3.3Å
181	R	74	Confident	81.9	Confident	212 Å²	212	44.8 Å²	44.8	80%	0.8	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-32.3	-175.5	-63.2	-178.6	-178.7	-175.9	1.9	113.4	P216	R181-P216 HydrophobicContact CG-CG 4.18Å
182	N	73.4	Confident	82.5	Confident	97 Å²	97	43 Å²	43	52%	0.519	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	0.6	-173.8	-65.2	-22.4	0	0	0	114.1	E134 V180	E134-N182 PolarHBondContact OE1-ND2 3.33Å; E134-N182 VanDerWaalsContact OE1-ND2 3.13Å; E134-N182 PolarHBondContact OE2-ND2 3.03Å; V180-N182 VanDerWaalsContact C-N 3.3Å; V180-N182 PolarHBondContact O-N 3.06Å
183	L	73.4	Confident	82.9	Confident	21 Å²	21	42.4 Å²	42.4	11%	0.11	19%	0.187	C	C	.	.			trans	-84	134.4	177	-108	72.5	0	0	0	111.2	C130 V180 R185 H187 L213 P215	C130-L183 VanDerWaalsContact SG-CD1 3.54Å; V180-L183 HydrophobicContact CB-CD1 4.01Å; V180-L183 HydrophobicContact CG1-CD1 3.88Å; V180-L183 PolarHBondContact O-N 3.47Å; L183-R185 VanDerWaalsContact CD2-O 3.27Å; L183-R185 WeakPolarHBondContact CD2-O 3.36Å; L183-H187 WeakPolarHBondContact CD2-ND1 3.3Å; L183-L213 HydrophobicContact CD2-CB 3.55Å; L183-P215 WeakPolarHBondContact O-CB 3.49Å
184	Q	70.9	Confident	82.7	Confident	185 Å²	185	46.7 Å²	46.7	86%	0.864	21%	0.207	S	C	*	.	S	Bend	trans	-88.6	-25.5	171.6	-65.8	-161.6	0.6	0	0	113.2
185	R	74.3	Confident	82.3	Confident	168 Å²	168	54.4 Å²	54.4	63%	0.634	24%	0.236	S	C	*	.	S	Bend	trans	-139	159	-176	-63.8	-176.1	-179.6	178.6	1.9	109.5	L183 H187	L183-R185 VanDerWaalsContact CD2-O 3.27Å; L183-R185 WeakPolarHBondContact CD2-O 3.36Å; R185-H187 PolarHBondContact O-CE1 3.47Å; R185-H187 PolarHBondContact O-ND1 2.75Å
186	R	79.4	Confident	82	Confident	45 Å²	45	57.2 Å²	57.2	17%	0.17	25%	0.254	C	S	.	.			trans	-74.9	137.2	176.1	-62.5	172.6	-65.2	171.7	11.6	109.2	D92 L213 A214 K222	D92-R186 IonicContact OD1-NH1 2.93Å; D92-R186 IonicContact OD1-NH2 3.77Å; D92-R186 PolarHBondContact OD1-NH2 3.22Å; R186-L213 CarbonylContact C-O 3.49Å; R186-L213 VanDerWaalsContact CA-O 3.27Å; R186-L213 WeakPolarHBondContact CA-O 3.38Å; R186-A214 HydrophobicContact CG-CB 4.06Å; R186-K222 PolarHBondContact NH1-O 3.37Å
187	H	82.3	Confident	81.7	Confident	54 Å²	54	59.3 Å²	59.3	25%	0.25	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.7	175.1	-63	82.7	0	0	0	109.6	M122 L183 R185 L213	M122-H187 HydrophobicContact CE-CB 3.22Å; L183-H187 WeakPolarHBondContact CD2-ND1 3.3Å; R185-H187 PolarHBondContact O-CE1 3.47Å; R185-H187 PolarHBondContact O-ND1 2.75Å; H187-L213 PolarHBondContact N-O 2.81Å; H187-L213 PolarHBondContact O-N 2.88Å
188	V	84.9	Confident	81.5	Confident	10 Å²	10	64.4 Å²	64.4	6%	0.061	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	127.5	177.7	-177.1	0	0	0	0	107.7	F96 I190 I210 L211 I212 L227 F231	F96-V188 HydrophobicContact CD2-CB 3.82Å; F96-V188 HydrophobicContact CD2-CG1 3.94Å; F96-V188 HydrophobicContact CD2-CG2 4.35Å; F96-V188 HydrophobicContact CE2-CB 4.07Å; F96-V188 HydrophobicContact CE2-CG1 3.82Å; V188-I190 HydrophobicContact CG1-CG1 4.22Å; V188-I210 HydrophobicContact CG1-CG2 4.27Å; V188-L211 CarbonylContact C-O 3.55Å; V188-L211 WeakPolarHBondContact CA-O 3.46Å; V188-I212 HydrophobicContact CG1-CG1 4.17Å; V188-I212 HydrophobicContact CG2-CG1 4.19Å; V188-L227 HydrophobicContact CG2-CD2 3.5Å; V188-L227 HydrophobicContact CG2-CG 4.24Å; V188-F231 HydrophobicContact CG1-CD2 4.49Å; V188-F231 HydrophobicContact CG1-CE2 3.96Å; V188-F231 HydrophobicContact CG1-CZ 4.2Å; V188-F231 HydrophobicContact CG2-CE2 4.22Å
189	C	87.4	Confident	81.3	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.4	173.8	-174.8	0	0	0	0	108.9	S101 L103 M118 M122 L211	S101-C189 WeakPolarHBondContact O-CA 3.47Å; S101-C189 VanDerWaalsContact OG-CB 3.29Å; S101-C189 WeakPolarHBondContact OG-CB 3.16Å; S101-C189 PolarHBondContact OG-SG 2.86Å; L103-C189 WeakPolarHBondContact CD1-SG 3.45Å; M118-C189 HydrophobicContact CB-CB 4.49Å; M118-C189 HydrophobicContact CE-CB 3.77Å; M118-C189 WeakPolarHBondContact CE-O 3.28Å; M122-C189 HydrophobicContact CE-CB 4.2Å; M122-C189 HydrophobicContact CG-CB 3.91Å; M122-C189 HydrophobicContact SD-CB 3.46Å; M122-C189 WeakPolarHBondContact SD-CB 3.36Å; C189-L211 HydrophobicContact CB-CB 4.38Å; C189-L211 PolarHBondContact N-O 3.34Å; C189-L211 PolarHBondContact O-N 2.76Å
190	I	90.3	Very high	81	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.6	176.6	-57.3	180	0	0	0	108.1	F96 S101 I102 L103 V188 I210 F231 F235 F253	F96-I190 HydrophobicContact CE2-CD1 3.8Å; F96-I190 HydrophobicContact CE2-CG1 4.24Å; F96-I190 HydrophobicContact CZ-CD1 3.7Å; F96-I190 HydrophobicContact CZ-CG1 4.44Å; S101-I190 PolarHBondContact O-N 3.07Å; S101-I190 VanDerWaalsContact O-N 3.15Å; I102-I190 WeakPolarHBondContact CA-O 3.47Å; L103-I190 PolarHBondContact N-O 3.12Å; V188-I190 HydrophobicContact CG1-CG1 4.22Å; I190-I210 HydrophobicContact CG1-CG1 4.41Å; I190-I210 HydrophobicContact CG1-CG2 4.33Å; I190-I210 HydrophobicContact CG2-CG1 4.46Å; I190-F231 HydrophobicContact CD1-CD1 4.15Å; I190-F231 HydrophobicContact CD1-CE1 3.93Å; I190-F235 HydrophobicContact CD1-CE2 4.35Å; I190-F235 HydrophobicContact CD1-CZ 4.43Å; I190-F235 HydrophobicContact CG2-CZ 4.17Å; I190-F253 HydrophobicContact CG2-CE1 4.16Å; I190-F253 HydrophobicContact CG2-CZ 3.9Å
191	T	90.6	Very high	80.4	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.5	177.1	-60.7	0	0	0	0	110.3	L103 E106 V114 M118 L193 Y208 V209	L103-T191 HydrophobicContact CB-CG2 4.12Å; L103-T191 WeakPolarHBondContact O-CA 3.38Å; E106-T191 HydrophobicContact CB-CG2 3.51Å; E106-T191 HydrophobicContact CG-CG2 4.04Å; V114-T191 HydrophobicContact CG1-CG2 4.25Å; M118-T191 WeakPolarHBondContact CE-OG1 3.49Å; M118-T191 WeakPolarHBondContact CG-OG1 3.34Å; M118-T191 PolarHBondContact SD-OG1 2.98Å; M118-T191 VanDerWaalsContact SD-OG1 3.32Å; T191-L193 HydrophobicContact CG2-CD2 4.31Å; T191-Y208 WeakPolarHBondContact O-CA 3.38Å; T191-V209 PolarHBondContact N-O 3.05Å; T191-V209 PolarHBondContact O-N 2.94Å
192	R	90.6	Very high	80.3	Confident	8 Å²	8	63.9 Å²	63.9	3%	0.03	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126.9	166	-178.5	178.4	75.8	-166.5	4.1	109.3	L103 L104 D105 E106 Y208 L244 L245 T247	L103-R192 PolarHBondContact O-N 3.44Å; L104-R192 HydrophobicContact CD2-CB 4.46Å; D105-R192 WeakPolarHBondContact CA-O 3.29Å; D105-R192 PolarHBondContact N-O 2.94Å; D105-R192 IonicContact OD1-CZ 3.68Å; D105-R192 IonicContact OD1-NE 3.82Å; D105-R192 PolarHBondContact OD1-NE 3.49Å; D105-R192 IonicContact OD1-NH2 2.94Å; D105-R192 PolarHBondContact OD1-NH2 3.48Å; D105-R192 IonicContact OD2-CZ 3.39Å; D105-R192 IonicContact OD2-NH2 3.55Å; D105-R192 PolarHBondContact OD2-NH2 3.33Å; E106-R192 PolarHBondContact N-O 3.12Å; R192-Y208 HydrophobicContact CB-CD1 4.28Å; R192-Y208 HydrophobicContact CB-CE1 4.04Å; R192-Y208 HydrophobicContact CG-CD1 4.4Å; R192-Y208 HydrophobicContact CG-CE1 3.85Å; R192-L244 PolarHBondContact NH1-O 2.97Å; R192-L245 HydrophobicContact CG-CD2 4.4Å; R192-L245 PolarHBondContact NH1-O 2.86Å; R192-T247 PolarHBondContact NH1-O 3.22Å; R192-T247 PolarHBondContact NH1-OG1 3.12Å; R192-T247 PolarHBondContact NH2-O 3.21Å
193	L	87.8	Confident	80.3	Confident	5 Å²	5	59.7 Å²	59.7	3%	0.026	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	142.4	176	-55.6	173.7	0	0	0	110.7	E106 V114 T191 R195 Q197 W199 A206 R207	E106-L193 HydrophobicContact CB-CD2 4.22Å; E106-L193 HydrophobicContact CG-CD2 4.49Å; V114-L193 HydrophobicContact CG1-CD2 4.23Å; V114-L193 HydrophobicContact CG2-CD2 3.76Å; T191-L193 HydrophobicContact CG2-CD2 4.31Å; L193-R195 VanDerWaalsContact C-N 3.27Å; L193-R195 WeakPolarHBondContact CB-O 3.45Å; L193-R195 PolarHBondContact O-N 2.68Å; L193-Q197 HydrophobicContact CD1-CB 4.27Å; L193-Q197 HydrophobicContact CD1-CG 3.96Å; L193-W199 HydrophobicContact CD1-CH2 3.67Å; L193-W199 HydrophobicContact CD1-CZ2 3.98Å; L193-A206 WeakPolarHBondContact CD1-O 3.4Å; L193-R207 PolarHBondContact N-O 3.4Å
194	E	81	Confident	80.3	Confident	90 Å²	90	60.9 Å²	60.9	42%	0.421	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	-35.4	176.9	-170.1	-168.3	141.8	0	0	111.5	D105 E106 K107	D105-E194 HydrophobicContact CB-CB 4.49Å; E106-E194 PolarHBondContact O-N 3.49Å; K107-E194 WeakPolarHBondContact CE-OE2 3.38Å; K107-E194 WeakPolarHBondContact CG-OE2 3.19Å
195	R	79.4	Confident	80.7	Confident	167 Å²	167	53.5 Å²	53.5	63%	0.63	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	146.9	-178.6	-62	-178.6	-170.5	168.8	3.7	110.1	L193 Q197	L193-R195 VanDerWaalsContact C-N 3.27Å; L193-R195 WeakPolarHBondContact CB-O 3.45Å; L193-R195 PolarHBondContact O-N 2.68Å; R195-Q197 PolarHBondContact O-N 3.41Å
196	P	81.8	Confident	81.2	Confident	59 Å²	59	45.5 Å²	45.5	38%	0.383	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	130.5	171.9	26.3	-33	0	0	0	110.2	E205 A206 R207	P196-E205 HydrophobicContact CB-CG 3.39Å; P196-E205 HydrophobicContact CG-CG 4.31Å; P196-A206 WeakPolarHBondContact CA-O 3.43Å; P196-R207 HydrophobicContact CB-CG 4.03Å
197	Q	82.8	Confident	81.6	Confident	46 Å²	46	46.2 Å²	46.2	22%	0.215	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	145.4	178.9	-62.7	-63.5	-11.6	0	0	110.7	L193 R195 W199 A206	L193-Q197 HydrophobicContact CD1-CB 4.27Å; L193-Q197 HydrophobicContact CD1-CG 3.96Å; R195-Q197 PolarHBondContact O-N 3.41Å; Q197-W199 HydrophobicContact CB-CD2 4.46Å; Q197-W199 HydrophobicContact CB-CZ2 3.97Å; Q197-W199 HydrophobicContact CG-CZ2 4.3Å; Q197-A206 PolarHBondContact N-O 3.33Å; Q197-A206 PolarHBondContact O-N 3.45Å
198	N	82.5	Confident	81.9	Confident	108 Å²	108	43.7 Å²	43.7	58%	0.578	23%	0.225	S	C	*	.			trans	-102.7	114.2	174.8	-177.6	-5.7	0	0	0	109.5	G200 C204	N198-G200 PolarHBondContact OD1-N 2.99Å; N198-C204 WeakPolarHBondContact CA-O 3.43Å; N198-C204 WeakPolarHBondContact CB-O 3.34Å
199	W	80.1	Confident	82.1	Confident	61 Å²	61	43.2 Å²	43.2	23%	0.231	22%	0.223	C	C	.	.			trans	-115.5	20.8	178.3	-60.6	-32.8	0	0	0	113	A109 L111 V114 L193 Q197 C203 A206 V209	A109-W199 PolarHBondContact O-NE1 3.4Å; A109-W199 VanDerWaalsContact O-NE1 3.16Å; L111-W199 HydrophobicContact CB-CD2 4.09Å; L111-W199 HydrophobicContact CB-CE3 4.43Å; L111-W199 HydrophobicContact CB-CG 4.47Å; L111-W199 HydrophobicContact CB-CZ2 4.28Å; L111-W199 HydrophobicContact CD1-CD2 4.44Å; L111-W199 HydrophobicContact CD1-CE3 3.96Å; L111-W199 HydrophobicContact CD1-CH2 3.8Å; L111-W199 HydrophobicContact CD1-CZ2 4.31Å; L111-W199 HydrophobicContact CD1-CZ3 3.62Å; V114-W199 HydrophobicContact CG2-CH2 4.48Å; V114-W199 HydrophobicContact CG2-CZ2 4.23Å; L193-W199 HydrophobicContact CD1-CH2 3.67Å; L193-W199 HydrophobicContact CD1-CZ2 3.98Å; Q197-W199 HydrophobicContact CB-CD2 4.46Å; Q197-W199 HydrophobicContact CB-CZ2 3.97Å; Q197-W199 HydrophobicContact CG-CZ2 4.3Å; W199-C203 HydrophobicContact CB-CB 4.38Å; W199-C203 PolarHBondContact N-O 2.78Å; W199-A206 HydrophobicContact CD2-CB 4.29Å; W199-A206 HydrophobicContact CE3-CB 3.57Å; W199-A206 HydrophobicContact CH2-CB 4.35Å; W199-A206 HydrophobicContact CZ3-CB 3.6Å; W199-V209 HydrophobicContact CH2-CG2 3.49Å; W199-V209 VanDerWaalsContact CH2-CG2 3.49Å; W199-V209 HydrophobicContact CZ3-CG2 3.55Å
200	G	74	Confident	82.3	Confident	33 Å²	33	43.2 Å²	43.2	34%	0.34	22%	0.223	S	C	.	.	S	Bend	trans	123.6	-175.8	173.7	0	0	0	0	0	113.8	N198 N202 C203 C204	N198-G200 PolarHBondContact OD1-N 2.99Å; G200-N202 PolarHBondContact O-N 2.77Å; G200-N202 VanDerWaalsContact O-N 3.13Å; G200-C203 CarbonylContact O-C 3.55Å; G200-C203 PolarHBondContact O-N 2.79Å; G200-C204 PolarHBondContact O-N 3.16Å; G200-C204 PolarHBondContact O-SG 2.67Å; G200-C204 VanDerWaalsContact O-SG 3.34Å
201	V	67.5	Low	82.2	Confident	127 Å²	127	43.2 Å²	43.2	77%	0.77	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-31.6	-169.1	-176.3	0	0	0	0	113.5
202	N	71.2	Confident	82.1	Confident	58 Å²	58	43.2 Å²	43.2	31%	0.31	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-11.6	180	-61.8	-9.4	0	0	0	113	Y169 G200	Y169-N202 HydrophobicContact CG-CB 4.39Å; G200-N202 PolarHBondContact O-N 2.77Å; G200-N202 VanDerWaalsContact O-N 3.13Å
203	C	74.4	Confident	81.8	Confident	9 Å²	9	43.1 Å²	43.1	6%	0.061	22%	0.223	C	C	.	.			trans	-140	60.2	-176.3	-69.7	0	0	0	0	111.3	Q158 W199 G200	Q158-C203 PolarHBondContact NE2-SG 3.35Å; W199-C203 HydrophobicContact CB-CB 4.38Å; W199-C203 PolarHBondContact N-O 2.78Å; G200-C203 CarbonylContact O-C 3.55Å; G200-C203 PolarHBondContact O-N 2.79Å
204	C	73.6	Confident	81.6	Confident	45 Å²	45	42.9 Å²	42.9	30%	0.304	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-24.6	-177.6	-60.7	0	0	0	0	114.2	N198 G200	N198-C204 WeakPolarHBondContact CA-O 3.43Å; N198-C204 WeakPolarHBondContact CB-O 3.34Å; G200-C204 PolarHBondContact O-N 3.16Å; G200-C204 PolarHBondContact O-SG 2.67Å; G200-C204 VanDerWaalsContact O-SG 3.34Å
205	E	79.6	Confident	81.7	Confident	30 Å²	30	39.5 Å²	39.5	14%	0.14	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.9	46.1	-175	-157.1	-167	159	0	0	112	Q171 S172 P196 R207	Q171-E205 CarbonylContact O-C 3.53Å; Q171-E205 VanDerWaalsContact O-C 3.25Å; S172-E205 WeakPolarHBondContact CA-O 3.33Å; P196-E205 HydrophobicContact CB-CG 3.39Å; P196-E205 HydrophobicContact CG-CG 4.31Å; E205-R207 PolarHBondContact O-N 3.15Å; E205-R207 IonicContact OE1-CZ 3.81Å; E205-R207 IonicContact OE1-NE 2.67Å; E205-R207 PolarHBondContact OE1-NE 3.18Å; E205-R207 VanDerWaalsContact OE1-NE 3.16Å; E205-R207 IonicContact OE1-NH2 2.79Å; E205-R207 PolarHBondContact OE1-NH2 3.14Å
206	A	83.8	Confident	81.3	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	126	-179.8	0	0	0	0	0	110.5	Q171 L193 P196 Q197 W199	Q171-A206 PolarHBondContact O-N 3.45Å; L193-A206 WeakPolarHBondContact CD1-O 3.4Å; P196-A206 WeakPolarHBondContact CA-O 3.43Å; Q197-A206 PolarHBondContact N-O 3.33Å; Q197-A206 PolarHBondContact O-N 3.45Å; W199-A206 HydrophobicContact CD2-CB 4.29Å; W199-A206 HydrophobicContact CE3-CB 3.57Å; W199-A206 HydrophobicContact CH2-CB 4.35Å; W199-A206 HydrophobicContact CZ3-CB 3.6Å
207	R	86.9	Confident	80.5	Confident	60 Å²	60	43.8 Å²	43.8	23%	0.226	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	-24.3	175.4	-67.6	-169	-174.8	-151.7	5.8	113.3	S172 L193 P196 E205	S172-R207 PolarHBondContact O-N 3.36Å; L193-R207 PolarHBondContact N-O 3.4Å; P196-R207 HydrophobicContact CB-CG 4.03Å; E205-R207 PolarHBondContact O-N 3.15Å; E205-R207 IonicContact OE1-CZ 3.81Å; E205-R207 IonicContact OE1-NE 2.67Å; E205-R207 PolarHBondContact OE1-NE 3.18Å; E205-R207 VanDerWaalsContact OE1-NE 3.16Å; E205-R207 IonicContact OE1-NH2 2.79Å; E205-R207 PolarHBondContact OE1-NH2 3.14Å
208	Y	89.9	Confident	79.7	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.008	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.5	-178.7	-63.3	-73.9	0	0	0	110.6	S172 W173 L174 T191 R192 F235 R241 L244 L245 F253	S172-Y208 PolarHBondContact O-N 3.12Å; W173-Y208 VanDerWaalsContact CA-O 3.3Å; W173-Y208 WeakPolarHBondContact CA-O 3.49Å; L174-Y208 PolarHBondContact N-O 3.35Å; T191-Y208 WeakPolarHBondContact O-CA 3.38Å; R192-Y208 HydrophobicContact CB-CD1 4.28Å; R192-Y208 HydrophobicContact CB-CE1 4.04Å; R192-Y208 HydrophobicContact CG-CD1 4.4Å; R192-Y208 HydrophobicContact CG-CE1 3.85Å; Y208-F235 AromaticContact CD1-CE1 3.95Å; Y208-F235 HydrophobicContact CD1-CE1 3.95Å; Y208-F235 HydrophobicContact CD2-CD1 4.37Å; Y208-F235 HydrophobicContact CD2-CE1 4.23Å; Y208-F235 HydrophobicContact CE1-CE1 4.47Å; Y208-F235 HydrophobicContact CG-CD1 4.28Å; Y208-F235 AromaticContact CG-CE1 3.8Å; Y208-F235 HydrophobicContact CG-CE1 3.8Å; Y208-R241 HydrophobicContact CE2-CB 4.01Å; Y208-R241 HydrophobicContact CE2-CG 4.32Å; Y208-R241 PolarHBondContact OH-O 3.44Å; Y208-L244 HydrophobicContact CE1-CB 4.15Å; Y208-L244 HydrophobicContact CE1-CD1 4.29Å; Y208-L244 WeakPolarHBondContact OH-CB 3.38Å; Y208-L245 HydrophobicContact CE2-CD2 4.35Å; Y208-L245 VanDerWaalsContact OH-CD2 3.27Å; Y208-L245 WeakPolarHBondContact OH-CD2 3.49Å; Y208-L245 WeakPolarHBondContact OH-CG 3.27Å; Y208-L245 PolarHBondContact OH-N 3.49Å; Y208-L245 VanDerWaalsContact OH-N 3.12Å; Y208-F253 HydrophobicContact CE1-CE2 4.47Å
209	V	89.9	Confident	78.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.2	171.5	-175.1	0	0	0	0	108.5	V114 M118 L174 I176 T191 W199	V114-V209 HydrophobicContact CG1-CB 4.43Å; V114-V209 HydrophobicContact CG1-CG2 4.24Å; M118-V209 HydrophobicContact CE-CG1 4.28Å; M118-V209 HydrophobicContact SD-CB 4.22Å; M118-V209 HydrophobicContact SD-CG1 3.89Å; L174-V209 WeakPolarHBondContact O-CA 3.48Å; I176-V209 HydrophobicContact CD1-CG1 4.15Å; T191-V209 PolarHBondContact N-O 3.05Å; T191-V209 PolarHBondContact O-N 2.94Å; W199-V209 HydrophobicContact CH2-CG2 3.49Å; W199-V209 VanDerWaalsContact CH2-CG2 3.49Å; W199-V209 HydrophobicContact CZ3-CG2 3.55Å
210	I	90.1	Very high	77.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	113.8	178.9	-55.3	166.8	0	0	0	106.3	W173 L174 C175 I176 V188 I190 I212 F231 F235	W173-I210 HydrophobicContact CE3-CD1 4.39Å; L174-I210 PolarHBondContact O-N 3.15Å; C175-I210 CarbonylContact C-O 3.59Å; C175-I210 WeakPolarHBondContact CA-O 3.27Å; C175-I210 HydrophobicContact CB-CB 4.25Å; I176-I210 PolarHBondContact N-O 3.43Å; V188-I210 HydrophobicContact CG1-CG2 4.27Å; I190-I210 HydrophobicContact CG1-CG1 4.41Å; I190-I210 HydrophobicContact CG1-CG2 4.33Å; I190-I210 HydrophobicContact CG2-CG1 4.46Å; I210-I212 HydrophobicContact CG2-CD1 4.35Å; I210-I212 HydrophobicContact CG2-CG1 4.14Å; I210-F231 HydrophobicContact CD1-CB 4.17Å; I210-F235 HydrophobicContact CD1-CD1 4.34Å; I210-F235 HydrophobicContact CD1-CD2 3.52Å; I210-F235 HydrophobicContact CD1-CE1 4.41Å; I210-F235 HydrophobicContact CD1-CE2 3.6Å; I210-F235 HydrophobicContact CD1-CG 3.91Å; I210-F235 HydrophobicContact CD1-CZ 4.06Å; I210-F235 HydrophobicContact CG1-CE2 4.36Å; I210-F235 HydrophobicContact CG1-CZ 4.48Å
211	L	88.8	Confident	77.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.4	176.8	-179.7	63.5	0	0	0	108.8	L115 M118 I119 M122 L139 I176 V188 C189 L213	L115-L211 HydrophobicContact CD2-CD1 4.09Å; L115-L211 HydrophobicContact CD2-CD2 4.23Å; M118-L211 HydrophobicContact CB-CD2 4.15Å; M118-L211 HydrophobicContact CE-CB 3.44Å; M118-L211 VanDerWaalsContact CE-CB 3.44Å; M118-L211 HydrophobicContact SD-CB 4.28Å; I119-L211 HydrophobicContact CG1-CD2 3.9Å; M122-L211 HydrophobicContact SD-CD2 4.29Å; L139-L211 HydrophobicContact CD1-CD1 4.35Å; L139-L211 HydrophobicContact CD2-CD1 3.82Å; I176-L211 HydrophobicContact CB-CD1 4.2Å; I176-L211 HydrophobicContact CG2-CD1 4.15Å; V188-L211 CarbonylContact C-O 3.55Å; V188-L211 WeakPolarHBondContact CA-O 3.46Å; C189-L211 HydrophobicContact CB-CB 4.38Å; C189-L211 PolarHBondContact N-O 3.34Å; C189-L211 PolarHBondContact O-N 2.76Å; L211-L213 HydrophobicContact CD1-CD2 4.06Å; L211-L213 HydrophobicContact CD2-CD2 4.43Å; L211-L213 HydrophobicContact CD2-CG 4.49Å; L211-L213 HydrophobicContact CG-CD2 4.16Å; L211-L213 HydrophobicContact CG-CG 4.28Å
212	I	87.3	Confident	77.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	115.7	177.7	-60.2	175.4	0	0	0	108.4	I176 L177 S178 V188 I210 A224 L227 G228 F231	I176-I212 PolarHBondContact O-N 2.81Å; L177-I212 HydrophobicContact CD2-CB 3.89Å; L177-I212 HydrophobicContact CD2-CD1 4.02Å; L177-I212 HydrophobicContact CD2-CG1 4.48Å; L177-I212 HydrophobicContact CD2-CG2 4.07Å; S178-I212 PolarHBondContact N-O 3.46Å; V188-I212 HydrophobicContact CG1-CG1 4.17Å; V188-I212 HydrophobicContact CG2-CG1 4.19Å; I210-I212 HydrophobicContact CG2-CD1 4.35Å; I210-I212 HydrophobicContact CG2-CG1 4.14Å; I212-A224 HydrophobicContact CG2-CB 4.25Å; I212-L227 HydrophobicContact CD1-CB 4.44Å; I212-L227 HydrophobicContact CD1-CG 4.19Å; I212-L227 HydrophobicContact CG2-CD2 3.95Å; I212-G228 VanDerWaalsContact CD1-CA 3.5Å; I212-F231 HydrophobicContact CD1-CD2 4.32Å
213	L	85.4	Confident	77.8	Confident	6 Å²	6	47.9 Å²	47.9	3%	0.031	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124.3	175.3	-56.9	-179.7	0	0	0	109.3	M122 V135 S178 V180 L183 R186 H187 L211	M122-L213 HydrophobicContact CE-CD1 3.77Å; M122-L213 HydrophobicContact CE-CG 4.24Å; M122-L213 HydrophobicContact SD-CD1 4.18Å; V135-L213 HydrophobicContact CG1-CD1 4.26Å; V135-L213 HydrophobicContact CG1-CD2 3.95Å; S178-L213 WeakPolarHBondContact O-CA 3.2Å; V180-L213 HydrophobicContact CG2-CD2 4.18Å; L183-L213 HydrophobicContact CD2-CB 3.55Å; R186-L213 CarbonylContact C-O 3.49Å; R186-L213 VanDerWaalsContact CA-O 3.27Å; R186-L213 WeakPolarHBondContact CA-O 3.38Å; H187-L213 PolarHBondContact N-O 2.81Å; H187-L213 PolarHBondContact O-N 2.88Å; L211-L213 HydrophobicContact CD1-CD2 4.06Å; L211-L213 HydrophobicContact CD2-CD2 4.43Å; L211-L213 HydrophobicContact CD2-CG 4.49Å; L211-L213 HydrophobicContact CG-CD2 4.16Å; L211-L213 HydrophobicContact CG-CG 4.28Å
214	A	83.4	Confident	78.1	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	150.8	-178.7	0	0	0	0	0	112.4	S178 N179 V180 R186 A224	S178-A214 PolarHBondContact O-N 3.48Å; N179-A214 CarbonylContact C-O 3.51Å; N179-A214 VanDerWaalsContact CA-O 3.26Å; N179-A214 WeakPolarHBondContact CA-O 3.34Å; V180-A214 PolarHBondContact N-O 3.34Å; R186-A214 HydrophobicContact CG-CB 4.06Å; A214-A224 HydrophobicContact CB-CB 3.73Å
215	P	82.7	Confident	78.5	Confident	19 Å²	19	47.2 Å²	47.2	12%	0.123	24%	0.238	C	C	.	.			trans	-73	146.8	170.3	25.4	-27.5	0	0	0	111.5	L183 R217 T218	L183-P215 WeakPolarHBondContact O-CB 3.49Å; P215-R217 VanDerWaalsContact C-N 3.32Å; P215-R217 PolarHBondContact O-N 3.34Å; P215-T218 HydrophobicContact CG-CG2 3.9Å; P215-T218 WeakPolarHBondContact O-CG2 3.21Å
216	P	72.4	Confident	78.6	Confident	73 Å²	73	48 Å²	48	47%	0.474	24%	0.242	S	C	.	.	S	Bend	trans	-68.5	-27.3	-176.8	26.9	-36.4	0	0	0	113.4	V180 R181 T218	V180-P216 VanDerWaalsContact O-CD 3.28Å; V180-P216 WeakPolarHBondContact O-CD 3.3Å; R181-P216 HydrophobicContact CG-CG 4.18Å; P216-T218 PolarHBondContact O-N 2.78Å
217	R	64.4	Low	78.6	Confident	242 Å²	242	48.3 Å²	48.3	91%	0.913	24%	0.244	S	C	*	.	S	Bend	trans	-98.3	86.3	177.9	-74.6	-174.1	167.9	173.9	-2.3	110.8	P215	P215-R217 VanDerWaalsContact C-N 3.32Å; P215-R217 PolarHBondContact O-N 3.34Å
218	T	64.9	Low	78.6	Confident	54 Å²	54	45.4 Å²	45.4	33%	0.331	23%	0.233	S	C	.	.			trans	-116.7	154.7	173.4	51.8	0	0	0	0	111.6	P215 P216	P215-T218 HydrophobicContact CG-CG2 3.9Å; P215-T218 WeakPolarHBondContact O-CG2 3.21Å; P216-T218 PolarHBondContact O-N 2.78Å
219	K	64.4	Low	78.3	Confident	156 Å²	156	46.5 Å²	46.5	68%	0.678	24%	0.237	S	C	*	.			trans	-61.2	146.3	168	-65.1	-173.6	177.8	-172.5	0	108.4	T221 K222	K219-T221 PolarHBondContact O-N 3.15Å; K219-K222 PolarHBondContact O-N 2.76Å
220	S	60.3	Low	78.2	Confident	110 Å²	110	46.5 Å²	46.5	77%	0.769	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-23.5	-178.5	61.9	0	0	0	0	114.6
221	T	61.7	Low	78	Confident	62 Å²	62	46.6 Å²	46.6	38%	0.38	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	2	179.6	45.4	0	0	0	0	115.2	R88 K219	R88-T221 PolarHBondContact NE-O 2.76Å; R88-T221 VanDerWaalsContact NE-O 3.15Å; R88-T221 PolarHBondContact NH1-O 3.5Å; R88-T221 VanDerWaalsContact NH2-CG2 3.35Å; R88-T221 PolarHBondContact NH2-O 3.49Å; K219-T221 PolarHBondContact O-N 3.15Å
222	K	70.6	Confident	77.8	Confident	92 Å²	92	46.6 Å²	46.6	40%	0.4	24%	0.237	S	C	.	.	S	Bend	trans	-129.2	31.3	-175.1	-66.6	-170.4	177.5	-173.6	0	113.3	R186 K219	R186-K222 PolarHBondContact NH1-O 3.37Å; K219-K222 PolarHBondContact O-N 2.76Å
223	T	78.9	Confident	77.7	Confident	46 Å²	46	47.1 Å²	47.1	28%	0.282	24%	0.241	S	C	.	.			trans	-68.3	156	-179.7	55.3	0	0	0	0	112	V225 E226	T223-V225 PolarHBondContact O-N 2.9Å; T223-E226 PolarHBondContact O-N 2.84Å; T223-E226 WeakPolarHBondContact OG1-CG 3.34Å
224	A	80.3	Confident	77.7	Confident	5 Å²	5	46.9 Å²	46.9	4%	0.041	24%	0.24	C	C	.	.	H	α-helix	trans	-60.3	-35.5	174.8	0	0	0	0	0	111.5	L177 I212 A214 E226 L227 G228	L177-A224 HydrophobicContact CD2-CB 3.61Å; L177-A224 VanDerWaalsContact CD2-O 3.3Å; L177-A224 WeakPolarHBondContact CD2-O 3.32Å; I212-A224 HydrophobicContact CG2-CB 4.25Å; A214-A224 HydrophobicContact CB-CB 3.73Å; A224-E226 PolarHBondContact O-N 3Å; A224-L227 PolarHBondContact O-N 3.29Å; A224-G228 PolarHBondContact O-N 3.28Å
225	V	82.1	Confident	77.7	Confident	34 Å²	34	46.9 Å²	46.9	21%	0.206	24%	0.24	C	C	.	.	H	α-helix	trans	-59.6	-41.2	178.8	-175.3	0	0	0	0	112.6	F26 I157 T223 G228 R229	F26-V225 HydrophobicContact CD2-CG1 4.05Å; F26-V225 HydrophobicContact CD2-CG2 4.14Å; F26-V225 HydrophobicContact CE2-CB 4.46Å; F26-V225 HydrophobicContact CE2-CG1 4.24Å; F26-V225 HydrophobicContact CE2-CG2 3.47Å; F26-V225 VanDerWaalsContact CE2-CG2 3.47Å; F26-V225 HydrophobicContact CZ-CG2 3.78Å; I157-V225 HydrophobicContact CD1-CG1 4.35Å; T223-V225 PolarHBondContact O-N 2.9Å; V225-G228 PolarHBondContact O-N 2.87Å; V225-R229 WeakPolarHBondContact O-CB 3.36Å; V225-R229 PolarHBondContact O-N 3.17Å
226	E	82.7	Confident	77.6	Confident	47 Å²	47	47.8 Å²	47.8	22%	0.22	25%	0.246	C	C	.	.	H	α-helix	trans	-67.4	-38	178.4	-71.5	-66	163	0	0	112.3	T223 A224 R229 T230	T223-E226 PolarHBondContact O-N 2.84Å; T223-E226 WeakPolarHBondContact OG1-CG 3.34Å; A224-E226 PolarHBondContact O-N 3Å; E226-R229 WeakPolarHBondContact O-CB 3.38Å; E226-R229 PolarHBondContact O-N 2.81Å; E226-R229 IonicContact OE2-CZ 3.41Å; E226-R229 VanDerWaalsContact OE2-CZ 3.3Å; E226-R229 IonicContact OE2-NE 2.77Å; E226-R229 PolarHBondContact OE2-NE 3.38Å; E226-R229 IonicContact OE2-NH2 2.79Å; E226-R229 PolarHBondContact OE2-NH2 3.23Å; E226-T230 PolarHBondContact O-N 2.92Å; E226-T230 VanDerWaalsContact O-N 3.12Å; E226-T230 PolarHBondContact O-OG1 3.39Å
227	L	84.1	Confident	77.7	Confident	6 Å²	6	46.4 Å²	46.4	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-67.4	-44	174.3	-173.3	59.1	0	0	0	110.6	D92 V188 I212 A224 R229 T230 F231	D92-L227 HydrophobicContact CB-CD1 3.69Å; V188-L227 HydrophobicContact CG2-CD2 3.5Å; V188-L227 HydrophobicContact CG2-CG 4.24Å; I212-L227 HydrophobicContact CD1-CB 4.44Å; I212-L227 HydrophobicContact CD1-CG 4.19Å; I212-L227 HydrophobicContact CG2-CD2 3.95Å; A224-L227 PolarHBondContact O-N 3.29Å; L227-R229 VanDerWaalsContact C-N 3.29Å; L227-R229 PolarHBondContact O-N 3.46Å; L227-T230 WeakPolarHBondContact O-CB 3.32Å; L227-T230 PolarHBondContact O-N 3.3Å; L227-T230 VanDerWaalsContact O-N 3.15Å; L227-F231 HydrophobicContact CD1-CD2 4.27Å; L227-F231 HydrophobicContact CD1-CE2 3.73Å; L227-F231 HydrophobicContact CG-CD2 4.26Å; L227-F231 HydrophobicContact CG-CE2 4Å; L227-F231 WeakPolarHBondContact O-CD2 3.18Å; L227-F231 PolarHBondContact O-N 3.39Å
228	G	85.4	Confident	78	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.8	-40.1	172.5	0	0	0	0	0	112.3	I212 A224 V225 T230 F231 A232	I212-G228 VanDerWaalsContact CD1-CA 3.5Å; A224-G228 PolarHBondContact O-N 3.28Å; V225-G228 PolarHBondContact O-N 2.87Å; G228-T230 VanDerWaalsContact C-N 3.34Å; G228-T230 PolarHBondContact O-N 3.45Å; G228-F231 PolarHBondContact O-N 2.93Å; G228-A232 WeakPolarHBondContact O-CB 3.09Å; G228-A232 PolarHBondContact O-N 3.33Å
229	R	85.1	Confident	78.3	Confident	24 Å²	24	36.8 Å²	36.8	9%	0.091	20%	0.199	C	C	.	.	H	α-helix	trans	-62.2	-38.8	175.3	-166.9	175.2	68.4	111	-7.2	112.3	V78 K79 P80 M81 E86 V225 E226 L227 T233	V78-R229 HydrophobicContact CG1-CB 4.48Å; V78-R229 HydrophobicContact CG1-CG 3.86Å; K79-R229 WeakPolarHBondContact O-CD 3.44Å; P80-R229 PolarHBondContact O-NH1 3.42Å; M81-R229 HydrophobicContact CB-CG 4.22Å; E86-R229 VanDerWaalsContact CD-NH2 3.33Å; E86-R229 IonicContact OE1-CZ 3.4Å; E86-R229 IonicContact OE1-NH1 2.89Å; E86-R229 PolarHBondContact OE1-NH1 3.26Å; E86-R229 IonicContact OE1-NH2 2.81Å; E86-R229 PolarHBondContact OE1-NH2 3.14Å; E86-R229 IonicContact OE2-CZ 3.87Å; E86-R229 IonicContact OE2-NH1 3.18Å; E86-R229 IonicContact OE2-NH2 3.16Å; E86-R229 PolarHBondContact OE2-NH2 2.99Å; V225-R229 WeakPolarHBondContact O-CB 3.36Å; V225-R229 PolarHBondContact O-N 3.17Å; E226-R229 WeakPolarHBondContact O-CB 3.38Å; E226-R229 PolarHBondContact O-N 2.81Å; E226-R229 IonicContact OE2-CZ 3.41Å; E226-R229 VanDerWaalsContact OE2-CZ 3.3Å; E226-R229 IonicContact OE2-NE 2.77Å; E226-R229 PolarHBondContact OE2-NE 3.38Å; E226-R229 IonicContact OE2-NH2 2.79Å; E226-R229 PolarHBondContact OE2-NH2 3.23Å; L227-R229 VanDerWaalsContact C-N 3.29Å; L227-R229 PolarHBondContact O-N 3.46Å; R229-T233 WeakPolarHBondContact O-CB 3.35Å; R229-T233 PolarHBondContact O-N 3.13Å; R229-T233 PolarHBondContact O-OG1 3.24Å
230	T	86.2	Confident	79.2	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-61.7	-51	175.8	-55.1	0	0	0	0	110.8	M81 F83 A89 E226 L227 G228 T233 M234	M81-T230 PolarHBondContact SD-OG1 3.12Å; F83-T230 HydrophobicContact CE1-CG2 4.18Å; F83-T230 HydrophobicContact CZ-CG2 3.85Å; A89-T230 HydrophobicContact CB-CG2 4.2Å; E226-T230 PolarHBondContact O-N 2.92Å; E226-T230 VanDerWaalsContact O-N 3.12Å; E226-T230 PolarHBondContact O-OG1 3.39Å; L227-T230 WeakPolarHBondContact O-CB 3.32Å; L227-T230 PolarHBondContact O-N 3.3Å; L227-T230 VanDerWaalsContact O-N 3.15Å; G228-T230 VanDerWaalsContact C-N 3.34Å; G228-T230 PolarHBondContact O-N 3.45Å; T230-T233 PolarHBondContact O-N 3.41Å; T230-M234 HydrophobicContact CG2-CE 4.4Å; T230-M234 PolarHBondContact O-N 3.39Å
231	F	87.1	Confident	80.3	Confident	1 Å²	1	25.5 Å²	25.5	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-68.3	-43.5	178.9	-74.3	-71.4	0	0	0	112.5	L93 F96 V188 I190 I210 I212 L227 G228 T233 M234 F235	L93-F231 HydrophobicContact CD1-CE1 4.25Å; L93-F231 HydrophobicContact CD1-CZ 4.42Å; F96-F231 HydrophobicContact CB-CZ 4.15Å; F96-F231 HydrophobicContact CD1-CZ 4.29Å; F96-F231 HydrophobicContact CD2-CE1 4.13Å; F96-F231 HydrophobicContact CD2-CE2 4.23Å; F96-F231 AromaticContact CD2-CZ 3.39Å; F96-F231 HydrophobicContact CD2-CZ 3.39Å; F96-F231 HydrophobicContact CE2-CE1 4.07Å; F96-F231 AromaticContact CE2-CZ 3.76Å; F96-F231 HydrophobicContact CE2-CZ 3.76Å; F96-F231 HydrophobicContact CG-CE1 4.38Å; F96-F231 AromaticContact CG-CZ 3.69Å; F96-F231 HydrophobicContact CG-CZ 3.69Å; F96-F231 HydrophobicContact CZ-CE1 4.33Å; F96-F231 HydrophobicContact CZ-CZ 4.38Å; V188-F231 HydrophobicContact CG1-CD2 4.49Å; V188-F231 HydrophobicContact CG1-CE2 3.96Å; V188-F231 HydrophobicContact CG1-CZ 4.2Å; V188-F231 HydrophobicContact CG2-CE2 4.22Å; I190-F231 HydrophobicContact CD1-CD1 4.15Å; I190-F231 HydrophobicContact CD1-CE1 3.93Å; I210-F231 HydrophobicContact CD1-CB 4.17Å; I212-F231 HydrophobicContact CD1-CD2 4.32Å; L227-F231 HydrophobicContact CD1-CD2 4.27Å; L227-F231 HydrophobicContact CD1-CE2 3.73Å; L227-F231 HydrophobicContact CG-CD2 4.26Å; L227-F231 HydrophobicContact CG-CE2 4Å; L227-F231 WeakPolarHBondContact O-CD2 3.18Å; L227-F231 PolarHBondContact O-N 3.39Å; G228-F231 PolarHBondContact O-N 2.93Å; F231-T233 PolarHBondContact O-N 2.68Å; F231-M234 HydrophobicContact CD1-CE 3.38Å; F231-M234 HydrophobicContact CE1-CE 3.64Å; F231-M234 HydrophobicContact CG-CE 4.14Å; F231-M234 PolarHBondContact O-N 3.05Å; F231-F235 HydrophobicContact CB-CD2 4.46Å; F231-F235 HydrophobicContact CD1-CE2 4.25Å; F231-F235 VanDerWaalsContact O-CD2 3.32Å; F231-F235 WeakPolarHBondContact O-CD2 3.27Å; F231-F235 PolarHBondContact O-N 3.28Å
232	A	84.8	Confident	80.8	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-55.4	-37	175.1	0	0	0	0	0	112.1	Y24 I157 W173 G228 S236	Y24-A232 HydrophobicContact CD1-CB 3.73Å; Y24-A232 HydrophobicContact CD2-CB 4.29Å; Y24-A232 HydrophobicContact CE1-CB 3.6Å; Y24-A232 WeakPolarHBondContact CE1-O 3.28Å; Y24-A232 HydrophobicContact CE2-CB 4.09Å; Y24-A232 HydrophobicContact CG-CB 4.15Å; Y24-A232 VanDerWaalsContact CZ-C 3.47Å; Y24-A232 PolarHBondContact OH-O 3.16Å; I157-A232 HydrophobicContact CG2-CB 3.86Å; W173-A232 HydrophobicContact CH2-CB 3.41Å; W173-A232 VanDerWaalsContact CH2-CB 3.41Å; W173-A232 HydrophobicContact CZ2-CB 4.16Å; W173-A232 HydrophobicContact CZ3-CB 4.08Å; G228-A232 WeakPolarHBondContact O-CB 3.09Å; G228-A232 PolarHBondContact O-N 3.33Å; A232-S236 WeakPolarHBondContact O-CB 3.29Å; A232-S236 PolarHBondContact O-N 3.15Å
233	T	85.5	Confident	81.2	Confident	12 Å²	12	21.5 Å²	21.5	7%	0.074	11%	0.111	C	C	.	.	H	α-helix	trans	-66.9	-44.3	175.2	-51.3	0	0	0	0	112.5	Y24 P80 M81 F83 R229 T230 F231 S236	Y24-T233 WeakPolarHBondContact OH-CA 3.39Å; Y24-T233 PolarHBondContact OH-N 3.47Å; P80-T233 HydrophobicContact CB-CG2 4.26Å; M81-T233 PolarHBondContact N-OG1 3.49Å; F83-T233 HydrophobicContact CD2-CG2 4.14Å; F83-T233 HydrophobicContact CE2-CG2 3.65Å; R229-T233 WeakPolarHBondContact O-CB 3.35Å; R229-T233 PolarHBondContact O-N 3.13Å; R229-T233 PolarHBondContact O-OG1 3.24Å; T230-T233 PolarHBondContact O-N 3.41Å; F231-T233 PolarHBondContact O-N 2.68Å; T233-S236 PolarHBondContact O-N 3.15Å; T233-S236 PolarHBondContact O-OG 2.98Å
234	M	84	Confident	81.4	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-64.7	-50	174.4	-66.6	-174.8	-69.7	0	0	112.3	F83 L93 T230 F231 S236 D237 F240 L257 L264	F83-M234 HydrophobicContact CE1-CG 4.4Å; F83-M234 HydrophobicContact CE2-CG 4.4Å; F83-M234 HydrophobicContact CZ-CG 3.72Å; F83-M234 HydrophobicContact CZ-SD 4.33Å; L93-M234 HydrophobicContact CD1-CE 4Å; L93-M234 HydrophobicContact CD1-SD 4.47Å; T230-M234 HydrophobicContact CG2-CE 4.4Å; T230-M234 PolarHBondContact O-N 3.39Å; F231-M234 HydrophobicContact CD1-CE 3.38Å; F231-M234 HydrophobicContact CE1-CE 3.64Å; F231-M234 HydrophobicContact CG-CE 4.14Å; F231-M234 PolarHBondContact O-N 3.05Å; M234-S236 PolarHBondContact O-N 3.09Å; M234-D237 PolarHBondContact O-N 2.86Å; M234-D237 VanDerWaalsContact O-N 3.14Å; M234-F240 HydrophobicContact CB-CD1 4.22Å; M234-F240 HydrophobicContact CB-CE1 3.88Å; M234-F240 VanDerWaalsContact O-CD1 3.22Å; M234-F240 WeakPolarHBondContact O-CD1 3.33Å; M234-L257 HydrophobicContact CE-CD2 4.04Å; M234-L257 HydrophobicContact SD-CD2 4.18Å; M234-L264 HydrophobicContact CB-CD1 4.47Å; M234-L264 HydrophobicContact CG-CD1 3.8Å
235	F	85	Confident	81.5	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-70.9	-9.9	-177.3	-80	-93.6	0	0	0	113.9	W173 I190 Y208 I210 F231 D237 F240 R241 L244	W173-F235 HydrophobicContact CB-CD1 4.48Å; W173-F235 HydrophobicContact CD2-CB 3.97Å; W173-F235 HydrophobicContact CG-CB 4.02Å; W173-F235 PolarHBondContact NE1-O 3.2Å; I190-F235 HydrophobicContact CD1-CE2 4.35Å; I190-F235 HydrophobicContact CD1-CZ 4.43Å; I190-F235 HydrophobicContact CG2-CZ 4.17Å; Y208-F235 AromaticContact CD1-CE1 3.95Å; Y208-F235 HydrophobicContact CD1-CE1 3.95Å; Y208-F235 HydrophobicContact CD2-CD1 4.37Å; Y208-F235 HydrophobicContact CD2-CE1 4.23Å; Y208-F235 HydrophobicContact CE1-CE1 4.47Å; Y208-F235 HydrophobicContact CG-CD1 4.28Å; Y208-F235 AromaticContact CG-CE1 3.8Å; Y208-F235 HydrophobicContact CG-CE1 3.8Å; I210-F235 HydrophobicContact CD1-CD1 4.34Å; I210-F235 HydrophobicContact CD1-CD2 3.52Å; I210-F235 HydrophobicContact CD1-CE1 4.41Å; I210-F235 HydrophobicContact CD1-CE2 3.6Å; I210-F235 HydrophobicContact CD1-CG 3.91Å; I210-F235 HydrophobicContact CD1-CZ 4.06Å; I210-F235 HydrophobicContact CG1-CE2 4.36Å; I210-F235 HydrophobicContact CG1-CZ 4.48Å; F231-F235 HydrophobicContact CB-CD2 4.46Å; F231-F235 HydrophobicContact CD1-CE2 4.25Å; F231-F235 VanDerWaalsContact O-CD2 3.32Å; F231-F235 WeakPolarHBondContact O-CD2 3.27Å; F231-F235 PolarHBondContact O-N 3.28Å; F235-D237 VanDerWaalsContact C-N 3.26Å; F235-D237 PolarHBondContact O-N 3.5Å; F235-F240 HydrophobicContact CD1-CE1 4.31Å; F235-F240 AromaticContact CD2-CE1 3.95Å; F235-F240 HydrophobicContact CD2-CE1 3.95Å; F235-F240 HydrophobicContact CE1-CE1 4.31Å; F235-F240 AromaticContact CE2-CE1 3.96Å; F235-F240 HydrophobicContact CE2-CE1 3.96Å; F235-F240 HydrophobicContact CG-CE1 4.14Å; F235-F240 HydrophobicContact CZ-CE1 4.14Å; F235-R241 HydrophobicContact CD1-CG 4.31Å; F235-R241 VanDerWaalsContact O-CD 3.29Å; F235-R241 WeakPolarHBondContact O-CD 3.48Å; F235-L244 HydrophobicContact CD1-CD1 4.37Å; F235-L244 HydrophobicContact CE1-CD1 3.48Å; F235-L244 VanDerWaalsContact CE1-CD1 3.48Å; F235-L244 HydrophobicContact CZ-CD1 3.6Å
236	S	79.3	Confident	81.3	Confident	38 Å²	38	23.5 Å²	23.5	27%	0.266	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-24	170.4	73.9	0	0	0	0	113.2	Y24 A232 T233 M234 I238	Y24-S236 WeakPolarHBondContact OH-CB 3.36Å; Y24-S236 PolarHBondContact OH-OG 3.11Å; A232-S236 WeakPolarHBondContact O-CB 3.29Å; A232-S236 PolarHBondContact O-N 3.15Å; T233-S236 PolarHBondContact O-N 3.15Å; T233-S236 PolarHBondContact O-OG 2.98Å; M234-S236 PolarHBondContact O-N 3.09Å; S236-I238 PolarHBondContact O-N 3.23Å
237	D	74.8	Confident	81.2	Confident	43 Å²	43	21.9 Å²	21.9	23%	0.23	11%	0.109	C	C	.	.			trans	-76.6	120.7	174.8	-176.9	10.2	0	0	0	110.6	M234 F235 D239 F240 R241 R243	M234-D237 PolarHBondContact O-N 2.86Å; M234-D237 VanDerWaalsContact O-N 3.14Å; F235-D237 VanDerWaalsContact C-N 3.26Å; F235-D237 PolarHBondContact O-N 3.5Å; D237-D239 VanDerWaalsContact C-N 3.3Å; D237-D239 PolarHBondContact O-N 3.26Å; D237-D239 PolarHBondContact OD1-N 3.31Å; D237-F240 HydrophobicContact CB-CB 4.01Å; D237-F240 PolarHBondContact O-N 2.84Å; D237-R241 WeakPolarHBondContact O-CG 3.46Å; D237-R241 PolarHBondContact O-N 3.24Å; D237-R243 IonicContact OD2-NH2 3.61Å
238	I	71.8	Confident	81	Confident	57 Å²	57	29.6 Å²	29.6	29%	0.292	14%	0.143	S	C	.	.	H	α-helix	trans	-61.4	-42.6	177.8	-48.9	-169.3	0	0	0	110.3	S236 F240 R241 Q242 V711	S236-I238 PolarHBondContact O-N 3.23Å; I238-F240 VanDerWaalsContact C-N 3.27Å; I238-F240 PolarHBondContact O-N 3.14Å; I238-R241 PolarHBondContact O-N 3.48Å; I238-Q242 PolarHBondContact O-N 3.09Å; I238-Q242 VanDerWaalsContact O-N 3.15Å; I238-V711 HydrophobicContact CG2-CG1 4.25Å
239	D	70.2	Confident	81	Confident	37 Å²	37	31.9 Å²	31.9	20%	0.198	16%	0.159	C	C	.	.	H	α-helix	trans	-68.9	-33.6	-173.4	-58.8	-10.6	0	0	0	110.4	D237 Q242 R243 K651	D237-D239 VanDerWaalsContact C-N 3.3Å; D237-D239 PolarHBondContact O-N 3.26Å; D237-D239 PolarHBondContact OD1-N 3.31Å; D239-Q242 PolarHBondContact O-N 3.26Å; D239-R243 WeakPolarHBondContact O-CG 3.49Å; D239-R243 PolarHBondContact O-N 3.05Å; D239-R243 VanDerWaalsContact O-N 3.11Å; D239-R243 PolarHBondContact O-NH1 3.02Å; D239-K651 IonicContact OD1-NZ 2.89Å
240	F	82.9	Confident	81	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.4	-49.6	173.5	170.4	-128.5	0	0	0	112.1	M234 F235 D237 I238 Q242 R243 L244 E256 L257 Q260	M234-F240 HydrophobicContact CB-CD1 4.22Å; M234-F240 HydrophobicContact CB-CE1 3.88Å; M234-F240 VanDerWaalsContact O-CD1 3.22Å; M234-F240 WeakPolarHBondContact O-CD1 3.33Å; F235-F240 HydrophobicContact CD1-CE1 4.31Å; F235-F240 AromaticContact CD2-CE1 3.95Å; F235-F240 HydrophobicContact CD2-CE1 3.95Å; F235-F240 HydrophobicContact CE1-CE1 4.31Å; F235-F240 AromaticContact CE2-CE1 3.96Å; F235-F240 HydrophobicContact CE2-CE1 3.96Å; F235-F240 HydrophobicContact CG-CE1 4.14Å; F235-F240 HydrophobicContact CZ-CE1 4.14Å; D237-F240 HydrophobicContact CB-CB 4.01Å; D237-F240 PolarHBondContact O-N 2.84Å; I238-F240 VanDerWaalsContact C-N 3.27Å; I238-F240 PolarHBondContact O-N 3.14Å; F240-Q242 PolarHBondContact O-N 3.32Å; F240-Q242 VanDerWaalsContact O-N 3.15Å; F240-R243 PolarHBondContact O-N 3.22Å; F240-R243 VanDerWaalsContact O-N 3.09Å; F240-L244 HydrophobicContact CD1-CD1 4.17Å; F240-L244 HydrophobicContact CD2-CD1 4.24Å; F240-L244 HydrophobicContact CD2-CD2 4.27Å; F240-L244 HydrophobicContact CD2-CG 3.82Å; F240-L244 HydrophobicContact CE1-CD1 3.54Å; F240-L244 HydrophobicContact CE1-CG 4.19Å; F240-L244 HydrophobicContact CE2-CD1 3.7Å; F240-L244 HydrophobicContact CE2-CD2 3.49Å; F240-L244 VanDerWaalsContact CE2-CD2 3.49Å; F240-L244 HydrophobicContact CE2-CG 3.41Å; F240-L244 VanDerWaalsContact CE2-CG 3.41Å; F240-L244 HydrophobicContact CG-CG 4.47Å; F240-L244 HydrophobicContact CZ-CD1 3.3Å; F240-L244 HydrophobicContact CZ-CD2 3.8Å; F240-L244 HydrophobicContact CZ-CG 3.62Å; F240-L244 PolarHBondContact O-N 3.2Å; F240-E256 HydrophobicContact CD2-CG 4.24Å; F240-E256 HydrophobicContact CE2-CG 4.09Å; F240-L257 HydrophobicContact CE1-CD2 4.32Å; F240-L257 HydrophobicContact CE2-CD2 4.32Å; F240-L257 HydrophobicContact CZ-CD2 3.48Å; F240-L257 VanDerWaalsContact CZ-CD2 3.48Å; F240-L257 HydrophobicContact CZ-CG 4.05Å; F240-Q260 HydrophobicContact CB-CG 3.8Å; F240-Q260 HydrophobicContact CD1-CG 4.25Å; F240-Q260 HydrophobicContact CD2-CB 4.15Å; F240-Q260 HydrophobicContact CD2-CG 2.92Å; F240-Q260 HydrophobicContact CE2-CB 4.17Å; F240-Q260 HydrophobicContact CE2-CG 3.31Å; F240-Q260 HydrophobicContact CG-CG 3.4Å; F240-Q260 HydrophobicContact CZ-CG 4.14Å
241	R	83.1	Confident	80.9	Confident	30 Å²	30	41 Å²	41	11%	0.113	20%	0.203	C	C	.	.	H	α-helix	trans	-54.8	-36	178	-68.3	-177.4	-55.4	-165.1	5.2	111.4	S172 Y208 F235 D237 I238 L245	S172-R241 WeakPolarHBondContact OG-CD 3.44Å; S172-R241 PolarHBondContact OG-NH1 2.71Å; Y208-R241 HydrophobicContact CE2-CB 4.01Å; Y208-R241 HydrophobicContact CE2-CG 4.32Å; Y208-R241 PolarHBondContact OH-O 3.44Å; F235-R241 HydrophobicContact CD1-CG 4.31Å; F235-R241 VanDerWaalsContact O-CD 3.29Å; F235-R241 WeakPolarHBondContact O-CD 3.48Å; D237-R241 WeakPolarHBondContact O-CG 3.46Å; D237-R241 PolarHBondContact O-N 3.24Å; I238-R241 PolarHBondContact O-N 3.48Å; R241-L245 WeakPolarHBondContact O-CG 3.41Å; R241-L245 PolarHBondContact O-N 3.01Å
242	Q	73.1	Confident	80.8	Confident	23 Å²	23	43.6 Å²	43.6	11%	0.107	21%	0.214	C	C	.	.	H	α-helix	trans	-71.7	-45.1	177.6	-174.7	170.8	67.8	0	0	112.7	I238 D239 F240 L244 L245 E246 K696	I238-Q242 PolarHBondContact O-N 3.09Å; I238-Q242 VanDerWaalsContact O-N 3.15Å; D239-Q242 PolarHBondContact O-N 3.26Å; F240-Q242 PolarHBondContact O-N 3.32Å; F240-Q242 VanDerWaalsContact O-N 3.15Å; Q242-L244 PolarHBondContact O-N 3.46Å; Q242-L245 WeakPolarHBondContact O-CB 3.38Å; Q242-L245 PolarHBondContact O-N 3.5Å; Q242-E246 PolarHBondContact O-N 3.14Å; Q242-K696 VanDerWaalsContact CD-CE 3.49Å; Q242-K696 HydrophobicContact CG-CD 4.48Å; Q242-K696 VanDerWaalsContact NE2-CD 3.3Å
243	R	78.7	Confident	81	Confident	46 Å²	46	43.6 Å²	43.6	17%	0.174	21%	0.214	C	C	.	.	H	α-helix	trans	-58.6	-38.7	174.7	-72.4	-175.1	-68.5	-85.7	-3.8	111.2	D237 D239 F240 L245 E246 T247 E256 R263	D237-R243 IonicContact OD2-NH2 3.61Å; D239-R243 WeakPolarHBondContact O-CG 3.49Å; D239-R243 PolarHBondContact O-N 3.05Å; D239-R243 VanDerWaalsContact O-N 3.11Å; D239-R243 PolarHBondContact O-NH1 3.02Å; F240-R243 PolarHBondContact O-N 3.22Å; F240-R243 VanDerWaalsContact O-N 3.09Å; R243-L245 VanDerWaalsContact C-N 3.31Å; R243-L245 PolarHBondContact O-N 3.25Å; R243-E246 PolarHBondContact O-N 2.7Å; R243-E246 VanDerWaalsContact O-N 3.14Å; R243-T247 PolarHBondContact O-N 3.07Å; R243-E256 HydrophobicContact CB-CG 3.86Å; R243-E256 WeakPolarHBondContact CD-OE1 3.4Å; R243-E256 IonicContact CZ-OE1 3.48Å; R243-E256 IonicContact NE-OE1 3.16Å; R243-E256 PolarHBondContact NE-OE1 3.38Å; R243-R263 VanDerWaalsContact CZ-NH1 3.29Å
244	L	84.4	Confident	81	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-33.6	172.9	-72	-174.1	0	0	0	113.5	R192 Y208 F235 F240 Q242 E246 T247 F253 E256	R192-L244 PolarHBondContact NH1-O 2.97Å; Y208-L244 HydrophobicContact CE1-CB 4.15Å; Y208-L244 HydrophobicContact CE1-CD1 4.29Å; Y208-L244 WeakPolarHBondContact OH-CB 3.38Å; F235-L244 HydrophobicContact CD1-CD1 4.37Å; F235-L244 HydrophobicContact CE1-CD1 3.48Å; F235-L244 VanDerWaalsContact CE1-CD1 3.48Å; F235-L244 HydrophobicContact CZ-CD1 3.6Å; F240-L244 HydrophobicContact CD1-CD1 4.17Å; F240-L244 HydrophobicContact CD2-CD1 4.24Å; F240-L244 HydrophobicContact CD2-CD2 4.27Å; F240-L244 HydrophobicContact CD2-CG 3.82Å; F240-L244 HydrophobicContact CE1-CD1 3.54Å; F240-L244 HydrophobicContact CE1-CG 4.19Å; F240-L244 HydrophobicContact CE2-CD1 3.7Å; F240-L244 HydrophobicContact CE2-CD2 3.49Å; F240-L244 VanDerWaalsContact CE2-CD2 3.49Å; F240-L244 HydrophobicContact CE2-CG 3.41Å; F240-L244 VanDerWaalsContact CE2-CG 3.41Å; F240-L244 HydrophobicContact CG-CG 4.47Å; F240-L244 HydrophobicContact CZ-CD1 3.3Å; F240-L244 HydrophobicContact CZ-CD2 3.8Å; F240-L244 HydrophobicContact CZ-CG 3.62Å; F240-L244 PolarHBondContact O-N 3.2Å; Q242-L244 PolarHBondContact O-N 3.46Å; L244-E246 VanDerWaalsContact C-N 3.29Å; L244-E246 PolarHBondContact O-N 3.19Å; L244-T247 PolarHBondContact O-OG1 3.36Å; L244-F253 HydrophobicContact CB-CE2 3.97Å; L244-F253 HydrophobicContact CB-CZ 4.47Å; L244-F253 HydrophobicContact CD1-CE1 4.43Å; L244-F253 HydrophobicContact CD1-CE2 4.07Å; L244-F253 HydrophobicContact CD1-CZ 3.74Å; L244-F253 HydrophobicContact CD2-CD1 4.1Å; L244-F253 HydrophobicContact CD2-CD2 3.82Å; L244-F253 HydrophobicContact CD2-CE1 3.96Å; L244-F253 HydrophobicContact CD2-CE2 3.66Å; L244-F253 HydrophobicContact CD2-CG 4.04Å; L244-F253 HydrophobicContact CD2-CZ 3.73Å; L244-F253 HydrophobicContact CG-CE2 4.11Å; L244-F253 HydrophobicContact CG-CZ 4.19Å; L244-E256 HydrophobicContact CD2-CB 4.14Å; L244-E256 HydrophobicContact CD2-CG 4Å
245	L	81.1	Confident	81.1	Confident	55 Å²	55	51.4 Å²	51.4	29%	0.288	25%	0.249	S	C	.	.	H	α-helix	trans	-68.4	-29.2	175.1	-69.5	174.7	0	0	0	112.2	R192 Y208 R241 Q242 R243	R192-L245 HydrophobicContact CG-CD2 4.4Å; R192-L245 PolarHBondContact NH1-O 2.86Å; Y208-L245 HydrophobicContact CE2-CD2 4.35Å; Y208-L245 VanDerWaalsContact OH-CD2 3.27Å; Y208-L245 WeakPolarHBondContact OH-CD2 3.49Å; Y208-L245 WeakPolarHBondContact OH-CG 3.27Å; Y208-L245 PolarHBondContact OH-N 3.49Å; Y208-L245 VanDerWaalsContact OH-N 3.12Å; R241-L245 WeakPolarHBondContact O-CG 3.41Å; R241-L245 PolarHBondContact O-N 3.01Å; Q242-L245 WeakPolarHBondContact O-CB 3.38Å; Q242-L245 PolarHBondContact O-N 3.5Å; R243-L245 VanDerWaalsContact C-N 3.31Å; R243-L245 PolarHBondContact O-N 3.25Å
246	E	77.3	Confident	81.1	Confident	73 Å²	73	53 Å²	53	34%	0.341	26%	0.256	S	S	.	.	H	α-helix	trans	-77.7	-22	-178.3	-67.1	169.1	-164.1	0	0	113	Q242 R243 L244 K696	Q242-E246 PolarHBondContact O-N 3.14Å; R243-E246 PolarHBondContact O-N 2.7Å; R243-E246 VanDerWaalsContact O-N 3.14Å; L244-E246 VanDerWaalsContact C-N 3.29Å; L244-E246 PolarHBondContact O-N 3.19Å; E246-K696 IonicContact OE1-NZ 2.68Å; E246-K696 PolarHBondContact OE1-NZ 3.24Å
247	T	82.4	Confident	81.4	Confident	12 Å²	12	51.1 Å²	51.1	7%	0.074	24%	0.244	C	C	.	.			trans	-64.9	136.1	-178.4	60.8	0	0	0	0	111.7	R192 R243 L244 E252 F253 E256	R192-T247 PolarHBondContact NH1-O 3.22Å; R192-T247 PolarHBondContact NH1-OG1 3.12Å; R192-T247 PolarHBondContact NH2-O 3.21Å; R243-T247 PolarHBondContact O-N 3.07Å; L244-T247 PolarHBondContact O-OG1 3.36Å; T247-E252 HydrophobicContact CG2-CB 4.13Å; T247-F253 WeakPolarHBondContact OG1-CD2 3.25Å; T247-E256 HydrophobicContact CG2-CB 4.38Å
248	K	79.8	Confident	81.9	Confident	168 Å²	168	50.9 Å²	50.9	73%	0.73	24%	0.244	S	C	*	.			trans	-107	-20.6	-179.6	-66.1	179.6	-174.6	166.9	0	113.1	E252	K248-E252 PolarHBondContact N-OE2 2.84Å
249	S	85.5	Confident	82.5	Confident	49 Å²	49	50.5 Å²	50.5	34%	0.343	25%	0.246	S	C	.	.	S	Bend	trans	-121.6	154.9	-178.8	65.1	0	0	0	0	111.1	L104 E251 E252 F253	L104-S249 VanDerWaalsContact CD1-C 3.48Å; S249-E251 VanDerWaalsContact C-N 3.28Å; S249-E251 PolarHBondContact O-N 3.17Å; S249-E252 PolarHBondContact O-N 2.99Å; S249-E252 WeakPolarHBondContact OG-CB 3.22Å; S249-E252 WeakPolarHBondContact OG-CG 3.4Å; S249-E252 PolarHBondContact OG-N 3.11Å; S249-E252 PolarHBondContact OG-OE2 3.13Å; S249-F253 PolarHBondContact O-N 3.38Å; S249-F253 VanDerWaalsContact O-N 3.09Å
250	Q	84.9	Confident	83.1	Confident	72 Å²	72	48.8 Å²	48.8	34%	0.336	24%	0.237	S	C	.	.	H	α-helix	trans	-63.1	-35.5	178.1	-171.9	178.1	1.6	0	0	112.1	I102 F253 K254	I102-Q250 HydrophobicContact CB-CG 3.93Å; I102-Q250 HydrophobicContact CD1-CG 4.11Å; I102-Q250 HydrophobicContact CG2-CG 4.39Å; Q250-F253 WeakPolarHBondContact O-CB 3.05Å; Q250-F253 PolarHBondContact O-N 3.35Å; Q250-K254 WeakPolarHBondContact O-CG 3.46Å; Q250-K254 PolarHBondContact O-N 3.5Å
251	E	84.3	Confident	83.1	Confident	145 Å²	145	50 Å²	50	68%	0.678	24%	0.241	S	C	*	.	H	α-helix	trans	-66.5	-42.5	177.5	-64	-170.7	176.9	0	0	112	S249 F253 K254 Q255	S249-E251 VanDerWaalsContact C-N 3.28Å; S249-E251 PolarHBondContact O-N 3.17Å; E251-F253 VanDerWaalsContact C-N 3.3Å; E251-F253 PolarHBondContact O-N 2.91Å; E251-K254 PolarHBondContact O-N 2.86Å; E251-Q255 WeakPolarHBondContact O-CG 3.43Å; E251-Q255 PolarHBondContact O-N 2.98Å
252	E	85.1	Confident	83	Confident	54 Å²	54	53.4 Å²	53.4	25%	0.252	26%	0.258	S	S	.	.	H	α-helix	trans	-62.4	-39.3	173.9	-74.9	179.7	144.2	0	0	111.5	T247 K248 S249 K254 Q255 E256 K321	T247-E252 HydrophobicContact CG2-CB 4.13Å; K248-E252 PolarHBondContact N-OE2 2.84Å; S249-E252 PolarHBondContact O-N 2.99Å; S249-E252 WeakPolarHBondContact OG-CB 3.22Å; S249-E252 WeakPolarHBondContact OG-CG 3.4Å; S249-E252 PolarHBondContact OG-N 3.11Å; S249-E252 PolarHBondContact OG-OE2 3.13Å; E252-K254 VanDerWaalsContact C-N 3.34Å; E252-K254 PolarHBondContact O-N 3.37Å; E252-Q255 PolarHBondContact O-N 3.49Å; E252-E256 WeakPolarHBondContact O-CB 3.43Å; E252-E256 PolarHBondContact O-N 2.72Å; E252-K321 IonicContact OE1-NZ 3.57Å; E252-K321 PolarHBondContact OE1-NZ 2.97Å
253	F	87.6	Confident	83.2	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.5	-43.5	174.4	-165.2	-76.8	0	0	0	111.7	I102 L104 I190 Y208 L244 T247 S249 Q250 E251 E256 L257	I102-F253 HydrophobicContact CD1-CD1 3.86Å; I102-F253 HydrophobicContact CD1-CE1 4.43Å; I102-F253 HydrophobicContact CG2-CD1 3.96Å; I102-F253 HydrophobicContact CG2-CE1 4.17Å; I102-F253 HydrophobicContact CG2-CG 4.14Å; L104-F253 HydrophobicContact CD2-CB 4.47Å; L104-F253 HydrophobicContact CD2-CD2 3.62Å; L104-F253 HydrophobicContact CD2-CE2 4.13Å; L104-F253 HydrophobicContact CD2-CG 4.23Å; I190-F253 HydrophobicContact CG2-CE1 4.16Å; I190-F253 HydrophobicContact CG2-CZ 3.9Å; Y208-F253 HydrophobicContact CE1-CE2 4.47Å; L244-F253 HydrophobicContact CB-CE2 3.97Å; L244-F253 HydrophobicContact CB-CZ 4.47Å; L244-F253 HydrophobicContact CD1-CE1 4.43Å; L244-F253 HydrophobicContact CD1-CE2 4.07Å; L244-F253 HydrophobicContact CD1-CZ 3.74Å; L244-F253 HydrophobicContact CD2-CD1 4.1Å; L244-F253 HydrophobicContact CD2-CD2 3.82Å; L244-F253 HydrophobicContact CD2-CE1 3.96Å; L244-F253 HydrophobicContact CD2-CE2 3.66Å; L244-F253 HydrophobicContact CD2-CG 4.04Å; L244-F253 HydrophobicContact CD2-CZ 3.73Å; L244-F253 HydrophobicContact CG-CE2 4.11Å; L244-F253 HydrophobicContact CG-CZ 4.19Å; T247-F253 WeakPolarHBondContact OG1-CD2 3.25Å; S249-F253 PolarHBondContact O-N 3.38Å; S249-F253 VanDerWaalsContact O-N 3.09Å; Q250-F253 WeakPolarHBondContact O-CB 3.05Å; Q250-F253 PolarHBondContact O-N 3.35Å; E251-F253 VanDerWaalsContact C-N 3.3Å; E251-F253 PolarHBondContact O-N 2.91Å; F253-E256 PolarHBondContact O-N 2.66Å; F253-L257 HydrophobicContact CD1-CD1 3.82Å; F253-L257 HydrophobicContact CD1-CG 4.46Å; F253-L257 HydrophobicContact CE1-CD1 3.75Å; F253-L257 HydrophobicContact CE1-CG 4.36Å; F253-L257 PolarHBondContact O-N 2.84Å; F253-L257 VanDerWaalsContact O-N 3.16Å
254	K	86.8	Confident	83.1	Confident	55 Å²	55	56.9 Å²	56.9	24%	0.239	27%	0.273	C	S	.	.	H	α-helix	trans	-64.9	-42.1	175.4	-72.3	-177.5	-178.8	-172.6	0	112.2	L97 I102 Q250 E251 E252 E256 L257 V258	L97-K254 HydrophobicContact CD2-CB 3.9Å; L97-K254 HydrophobicContact CD2-CG 4.19Å; I102-K254 HydrophobicContact CD1-CD 4.26Å; I102-K254 HydrophobicContact CD1-CG 3.54Å; Q250-K254 WeakPolarHBondContact O-CG 3.46Å; Q250-K254 PolarHBondContact O-N 3.5Å; E251-K254 PolarHBondContact O-N 2.86Å; E252-K254 VanDerWaalsContact C-N 3.34Å; E252-K254 PolarHBondContact O-N 3.37Å; K254-E256 VanDerWaalsContact C-N 3.31Å; K254-E256 PolarHBondContact O-N 3.22Å; K254-L257 WeakPolarHBondContact O-CB 3.48Å; K254-L257 PolarHBondContact O-N 3.01Å; K254-V258 WeakPolarHBondContact O-CG2 3.48Å; K254-V258 PolarHBondContact O-N 2.68Å
255	Q	86.2	Confident	82.5	Confident	122 Å²	122	57.9 Å²	57.9	57%	0.57	28%	0.28	S	S	*	.	H	α-helix	trans	-62.4	-39.2	176.3	-73.2	174.6	5.5	0	0	111.8	E251 E252 V258 S259	E251-Q255 WeakPolarHBondContact O-CG 3.43Å; E251-Q255 PolarHBondContact O-N 2.98Å; E252-Q255 PolarHBondContact O-N 3.49Å; Q255-V258 WeakPolarHBondContact O-CB 3.25Å; Q255-V258 PolarHBondContact O-N 2.89Å; Q255-S259 WeakPolarHBondContact O-CB 3.23Å; Q255-S259 PolarHBondContact O-N 2.98Å
256	E	84.6	Confident	81.9	Confident	33 Å²	33	59 Å²	59	15%	0.154	29%	0.289	C	S	.	.	H	α-helix	trans	-68.4	-37.5	179.3	-173.1	51.9	-142.4	0	0	112.2	F240 R243 L244 T247 E252 F253 K254 V258 S259 Q260	F240-E256 HydrophobicContact CD2-CG 4.24Å; F240-E256 HydrophobicContact CE2-CG 4.09Å; R243-E256 HydrophobicContact CB-CG 3.86Å; R243-E256 WeakPolarHBondContact CD-OE1 3.4Å; R243-E256 IonicContact CZ-OE1 3.48Å; R243-E256 IonicContact NE-OE1 3.16Å; R243-E256 PolarHBondContact NE-OE1 3.38Å; L244-E256 HydrophobicContact CD2-CB 4.14Å; L244-E256 HydrophobicContact CD2-CG 4Å; T247-E256 HydrophobicContact CG2-CB 4.38Å; E252-E256 WeakPolarHBondContact O-CB 3.43Å; E252-E256 PolarHBondContact O-N 2.72Å; F253-E256 PolarHBondContact O-N 2.66Å; K254-E256 VanDerWaalsContact C-N 3.31Å; K254-E256 PolarHBondContact O-N 3.22Å; E256-V258 VanDerWaalsContact C-N 3.34Å; E256-V258 PolarHBondContact O-N 3.02Å; E256-S259 WeakPolarHBondContact O-CB 3.37Å; E256-S259 PolarHBondContact O-N 3.24Å; E256-Q260 PolarHBondContact O-N 2.96Å; E256-Q260 PolarHBondContact OE1-NE2 2.93Å
257	L	85.7	Confident	80.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.7	-43.6	170.4	-82.6	163.6	0	0	0	112.2	F96 M234 F240 F253 K254 Q260 R261	F96-L257 HydrophobicContact CE1-CD1 3.57Å; F96-L257 HydrophobicContact CZ-CD1 3.85Å; M234-L257 HydrophobicContact CE-CD2 4.04Å; M234-L257 HydrophobicContact SD-CD2 4.18Å; F240-L257 HydrophobicContact CE1-CD2 4.32Å; F240-L257 HydrophobicContact CE2-CD2 4.32Å; F240-L257 HydrophobicContact CZ-CD2 3.48Å; F240-L257 VanDerWaalsContact CZ-CD2 3.48Å; F240-L257 HydrophobicContact CZ-CG 4.05Å; F253-L257 HydrophobicContact CD1-CD1 3.82Å; F253-L257 HydrophobicContact CD1-CG 4.46Å; F253-L257 HydrophobicContact CE1-CD1 3.75Å; F253-L257 HydrophobicContact CE1-CG 4.36Å; F253-L257 PolarHBondContact O-N 2.84Å; F253-L257 VanDerWaalsContact O-N 3.16Å; K254-L257 WeakPolarHBondContact O-CB 3.48Å; K254-L257 PolarHBondContact O-N 3.01Å; L257-Q260 PolarHBondContact O-N 3.06Å; L257-R261 PolarHBondContact O-N 3.48Å; L257-R261 VanDerWaalsContact O-N 3.13Å
258	V	84.8	Confident	79.1	Confident	38 Å²	38	60.8 Å²	60.8	23%	0.23	31%	0.307	C	S	.	.	H	α-helix	trans	-64.2	-45.1	175.9	172.4	0	0	0	0	111.2	L97 K254 Q255 E256 Q260 R261 H262	L97-V258 HydrophobicContact CD1-CG2 3.3Å; L97-V258 HydrophobicContact CD2-CG2 3.97Å; L97-V258 HydrophobicContact CG-CG2 4.27Å; K254-V258 WeakPolarHBondContact O-CG2 3.48Å; K254-V258 PolarHBondContact O-N 2.68Å; Q255-V258 WeakPolarHBondContact O-CB 3.25Å; Q255-V258 PolarHBondContact O-N 2.89Å; E256-V258 VanDerWaalsContact C-N 3.34Å; E256-V258 PolarHBondContact O-N 3.02Å; V258-Q260 VanDerWaalsContact C-N 3.3Å; V258-Q260 PolarHBondContact O-N 3.07Å; V258-R261 WeakPolarHBondContact O-CB 3.29Å; V258-R261 PolarHBondContact O-N 3.03Å; V258-H262 PolarHBondContact O-CD2 2.7Å; V258-H262 PolarHBondContact O-N 3.32Å; V258-H262 VanDerWaalsContact O-N 3.15Å
259	S	83.4	Confident	77	Confident	48 Å²	48	59 Å²	59	34%	0.336	30%	0.301	S	S	.	.	H	α-helix	trans	-57	-43.7	176.6	-179.6	0	0	0	0	111.3	Q255 E256 H262 R263	Q255-S259 WeakPolarHBondContact O-CB 3.23Å; Q255-S259 PolarHBondContact O-N 2.98Å; E256-S259 WeakPolarHBondContact O-CB 3.37Å; E256-S259 PolarHBondContact O-N 3.24Å; S259-H262 PolarHBondContact O-N 2.93Å; S259-R263 WeakPolarHBondContact O-CG 3.12Å; S259-R263 PolarHBondContact O-N 2.95Å
260	Q	84.1	Confident	74.6	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.009	31%	0.31	C	S	.	.	H	α-helix	trans	-64.2	-41.4	175.4	-77.3	-35.4	-61.4	0	0	114.7	F240 E256 L257 V258 H262 R263 L264	F240-Q260 HydrophobicContact CB-CG 3.8Å; F240-Q260 HydrophobicContact CD1-CG 4.25Å; F240-Q260 HydrophobicContact CD2-CB 4.15Å; F240-Q260 HydrophobicContact CD2-CG 2.92Å; F240-Q260 HydrophobicContact CE2-CB 4.17Å; F240-Q260 HydrophobicContact CE2-CG 3.31Å; F240-Q260 HydrophobicContact CG-CG 3.4Å; F240-Q260 HydrophobicContact CZ-CG 4.14Å; E256-Q260 PolarHBondContact O-N 2.96Å; E256-Q260 PolarHBondContact OE1-NE2 2.93Å; L257-Q260 PolarHBondContact O-N 3.06Å; V258-Q260 VanDerWaalsContact C-N 3.3Å; V258-Q260 PolarHBondContact O-N 3.07Å; Q260-H262 VanDerWaalsContact C-N 3.27Å; Q260-H262 PolarHBondContact O-N 2.99Å; Q260-R263 CarbonylContact O-C 3.58Å; Q260-R263 WeakPolarHBondContact O-CB 3.23Å; Q260-R263 PolarHBondContact O-N 3Å; Q260-R263 VanDerWaalsContact O-N 3.11Å; Q260-L264 WeakPolarHBondContact O-CG 3.24Å; Q260-L264 PolarHBondContact O-N 3.44Å
261	R	82.5	Confident	72	Confident	24 Å²	24	61.5 Å²	61.5	9%	0.091	31%	0.309	C	S	.	.	H	α-helix	trans	-54.9	-49.6	174.7	176.4	-172.1	61	-177.7	1.8	110.2	F83 L93 D94 L257 V258 R263 L264 S265	F83-R261 HydrophobicContact CD1-CG 4.25Å; F83-R261 HydrophobicContact CE1-CG 4.42Å; L93-R261 HydrophobicContact CD2-CB 3.65Å; L93-R261 HydrophobicContact CD2-CG 4.14Å; D94-R261 IonicContact OD1-CZ 3.8Å; D94-R261 IonicContact OD1-NH1 2.66Å; D94-R261 PolarHBondContact OD1-NH1 2.62Å; D94-R261 IonicContact OD1-NH2 3.58Å; D94-R261 IonicContact OD2-NH1 3.77Å; L257-R261 PolarHBondContact O-N 3.48Å; L257-R261 VanDerWaalsContact O-N 3.13Å; V258-R261 WeakPolarHBondContact O-CB 3.29Å; V258-R261 PolarHBondContact O-N 3.03Å; R261-R263 VanDerWaalsContact C-N 3.28Å; R261-R263 PolarHBondContact O-N 2.76Å; R261-L264 PolarHBondContact O-N 3.32Å; R261-S265 PolarHBondContact O-N 3.19Å; R261-S265 PolarHBondContact O-OG 3.36Å
262	H	80.4	Confident	69.5	Low	102 Å²	102	60.4 Å²	60.4	47%	0.472	31%	0.312	S	S	.	.	H	α-helix	trans	-59.4	-40	177.7	-73.3	-65.1	0	0	0	112.1	V258 S259 Q260 S265 V266	V258-H262 PolarHBondContact O-CD2 2.7Å; V258-H262 PolarHBondContact O-N 3.32Å; V258-H262 VanDerWaalsContact O-N 3.15Å; S259-H262 PolarHBondContact O-N 2.93Å; Q260-H262 VanDerWaalsContact C-N 3.27Å; Q260-H262 PolarHBondContact O-N 2.99Å; H262-S265 PolarHBondContact O-N 3.28Å; H262-V266 WeakPolarHBondContact O-CB 3.46Å; H262-V266 VanDerWaalsContact O-CG2 3.22Å; H262-V266 WeakPolarHBondContact O-CG2 3.3Å; H262-V266 PolarHBondContact O-N 2.78Å
263	R	78.3	Confident	66.9	Low	103 Å²	103	64 Å²	64	39%	0.389	34%	0.338	S	S	.	.	H	α-helix	trans	-63.7	-49.4	175.6	-70.7	170.7	63.9	142.4	2.4	112	R243 S259 Q260 R261 S265 V266 T267	R243-R263 VanDerWaalsContact CZ-NH1 3.29Å; S259-R263 WeakPolarHBondContact O-CG 3.12Å; S259-R263 PolarHBondContact O-N 2.95Å; Q260-R263 CarbonylContact O-C 3.58Å; Q260-R263 WeakPolarHBondContact O-CB 3.23Å; Q260-R263 PolarHBondContact O-N 3Å; Q260-R263 VanDerWaalsContact O-N 3.11Å; R261-R263 VanDerWaalsContact C-N 3.28Å; R261-R263 PolarHBondContact O-N 2.76Å; R263-S265 VanDerWaalsContact C-N 3.26Å; R263-S265 PolarHBondContact O-N 2.61Å; R263-V266 PolarHBondContact O-N 2.72Å; R263-V266 VanDerWaalsContact O-N 3.13Å; R263-T267 WeakPolarHBondContact O-CB 3.29Å; R263-T267 PolarHBondContact O-N 3.19Å; R263-T267 PolarHBondContact O-OG1 3.22Å
264	L	75.9	Confident	64.1	Low	40 Å²	40	69.4 Å²	69.4	21%	0.209	36%	0.363	C	S	.	.	H	α-helix	trans	-63.6	-32.5	179.4	-68.3	173.2	0	0	0	112.4	F83 M234 Q260 R261	F83-L264 HydrophobicContact CB-CB 3.98Å; F83-L264 HydrophobicContact CD1-CB 4.38Å; F83-L264 HydrophobicContact CD2-CB 3.97Å; F83-L264 HydrophobicContact CD2-CD1 3.92Å; F83-L264 HydrophobicContact CE1-CD1 4.5Å; F83-L264 HydrophobicContact CE2-CD1 3.72Å; F83-L264 HydrophobicContact CG-CB 3.86Å; F83-L264 HydrophobicContact CG-CD1 4.41Å; F83-L264 HydrophobicContact CZ-CD1 4.04Å; M234-L264 HydrophobicContact CB-CD1 4.47Å; M234-L264 HydrophobicContact CG-CD1 3.8Å; Q260-L264 WeakPolarHBondContact O-CG 3.24Å; Q260-L264 PolarHBondContact O-N 3.44Å; R261-L264 PolarHBondContact O-N 3.32Å
265	S	73.1	Confident	61.4	Low	21 Å²	21	73.4 Å²	73.4	15%	0.147	38%	0.382	C	S	.	.	H	α-helix	trans	-69.5	-37.7	172.9	-56.5	0	0	0	0	112.9	F83 Q84 H90 R261 H262 R263	F83-S265 PolarHBondContact O-OG 3.25Å; Q84-S265 PolarHBondContact NE2-O 2.88Å; H90-S265 PolarHBondContact NE2-OG 2.53Å; H90-S265 VanDerWaalsContact NE2-OG 3.1Å; R261-S265 PolarHBondContact O-N 3.19Å; R261-S265 PolarHBondContact O-OG 3.36Å; H262-S265 PolarHBondContact O-N 3.28Å; R263-S265 VanDerWaalsContact C-N 3.26Å; R263-S265 PolarHBondContact O-N 2.61Å
266	V	67.5	Low	58.9	Low	78 Å²	78	72.8 Å²	72.8	47%	0.473	39%	0.387	S	S	.	.	H	α-helix	trans	-84.9	-36.3	-178.2	173.7	0	0	0	0	112.6	H262 R263 S268 E269 K270	H262-V266 WeakPolarHBondContact O-CB 3.46Å; H262-V266 VanDerWaalsContact O-CG2 3.22Å; H262-V266 WeakPolarHBondContact O-CG2 3.3Å; H262-V266 PolarHBondContact O-N 2.78Å; R263-V266 PolarHBondContact O-N 2.72Å; R263-V266 VanDerWaalsContact O-N 3.13Å; V266-S268 VanDerWaalsContact C-N 3.33Å; V266-S268 PolarHBondContact O-N 2.92Å; V266-E269 WeakPolarHBondContact O-CB 3.36Å; V266-E269 PolarHBondContact O-N 3.41Å; V266-K270 PolarHBondContact O-N 3.31Å
267	T	54.5	Low	56.5	Low	80 Å²	80	79.9 Å²	79.9	49%	0.491	42%	0.42	S	S	.	.	H	α-helix	trans	-61.5	-38.9	-177.5	-67.2	0	0	0	0	111.1	R263 E269 K270 T271	R263-T267 WeakPolarHBondContact O-CB 3.29Å; R263-T267 PolarHBondContact O-N 3.19Å; R263-T267 PolarHBondContact O-OG1 3.22Å; T267-E269 VanDerWaalsContact C-N 3.32Å; T267-E269 PolarHBondContact O-N 3.15Å; T267-K270 PolarHBondContact O-N 3.3Å; T267-T271 PolarHBondContact O-N 3.42Å; T267-T271 PolarHBondContact O-OG1 3Å
268	S	46.8	Very low	54.1	Low	42 Å²	42	82.3 Å²	82.3	29%	0.294	43%	0.433	S	S	.	.	H	α-helix	trans	-71.2	-21.2	174.7	-89.1	0	0	0	0	114.4	Q84 V266 K270 T271 V272	Q84-S268 VanDerWaalsContact OE1-CB 3.29Å; V266-S268 VanDerWaalsContact C-N 3.33Å; V266-S268 PolarHBondContact O-N 2.92Å; S268-K270 VanDerWaalsContact C-N 3.34Å; S268-T271 WeakPolarHBondContact CA-OG1 3.41Å; S268-T271 PolarHBondContact O-N 2.93Å; S268-T271 VanDerWaalsContact O-N 3.09Å; S268-V272 PolarHBondContact O-N 3.16Å; S268-V272 VanDerWaalsContact O-N 3.12Å
269	E	34.9	Very low	52	Low	131 Å²	131	86 Å²	86	61%	0.612	46%	0.461	S	S	*	.	H	α-helix	trans	-74	-36	-179.9	-131.1	174.8	-163.8	0	0	109.7	Q84 V266 T267	Q84-E269 VanDerWaalsContact NE2-CB 3.32Å; V266-E269 WeakPolarHBondContact O-CB 3.36Å; V266-E269 PolarHBondContact O-N 3.41Å; T267-E269 VanDerWaalsContact C-N 3.32Å; T267-E269 PolarHBondContact O-N 3.15Å
270	K	35.4	Very low	50.1	Low	121 Å²	121	85.9 Å²	85.9	53%	0.526	46%	0.456	S	S	.	.	H	α-helix	trans	-72	-33.7	164.8	-77.5	-176.8	167.8	-161.4	0	112.6	V266 T267 S268 V272 V273 E274	V266-K270 PolarHBondContact O-N 3.31Å; T267-K270 PolarHBondContact O-N 3.3Å; S268-K270 VanDerWaalsContact C-N 3.34Å; K270-V272 VanDerWaalsContact C-N 3.28Å; K270-V272 PolarHBondContact O-N 3.23Å; K270-V273 PolarHBondContact O-N 3.05Å; K270-E274 WeakPolarHBondContact CB-OE2 3.16Å; K270-E274 WeakPolarHBondContact CD-OE2 3.21Å; K270-E274 WeakPolarHBondContact CG-OE2 3.03Å; K270-E274 VanDerWaalsContact O-CA 3.25Å; K270-E274 WeakPolarHBondContact O-CA 3.43Å; K270-E274 WeakPolarHBondContact O-CB 3.24Å; K270-E274 PolarHBondContact O-N 3.26Å
271	T	29.4	Very low	48.3	Very low	52 Å²	52	87.2 Å²	87.2	32%	0.319	47%	0.465	S	S	.	.	H	α-helix	trans	-67.7	-26.6	-178.2	-41.9	0	0	0	0	112.6	T267 S268 E275	T267-T271 PolarHBondContact O-N 3.42Å; T267-T271 PolarHBondContact O-OG1 3Å; S268-T271 WeakPolarHBondContact CA-OG1 3.41Å; S268-T271 PolarHBondContact O-N 2.93Å; S268-T271 VanDerWaalsContact O-N 3.09Å; T271-E275 HydrophobicContact CG2-CG 3.93Å; T271-E275 VanDerWaalsContact O-CB 3.27Å; T271-E275 WeakPolarHBondContact O-CB 3.28Å; T271-E275 WeakPolarHBondContact O-CG 3.43Å; T271-E275 PolarHBondContact O-N 2.89Å
272	V	31.8	Very low	46.7	Very low	122 Å²	122	88.3 Å²	88.3	74%	0.739	47%	0.469	S	S	*	.	H	α-helix	trans	-88.5	-18.5	178.5	-178.9	0	0	0	0	113.5	S268 K270	S268-V272 PolarHBondContact O-N 3.16Å; S268-V272 VanDerWaalsContact O-N 3.12Å; K270-V272 VanDerWaalsContact C-N 3.28Å; K270-V272 PolarHBondContact O-N 3.23Å
273	V	30.8	Very low	44.9	Very low	131 Å²	131	92.7 Å²	92.7	79%	0.794	48%	0.481	S	S	*	.	H	α-helix	trans	-108.6	-21.5	176.7	-176.8	0	0	0	0	113	K270	K270-V273 PolarHBondContact O-N 3.05Å
274	E	29.5	Very low	43.5	Very low	113 Å²	113	89.2 Å²	89.2	53%	0.528	48%	0.478	S	S	.	.			trans	-119	16.4	-179.1	-57.4	-179.4	148.5	0	0	113.4	K270 V276	K270-E274 WeakPolarHBondContact CB-OE2 3.16Å; K270-E274 WeakPolarHBondContact CD-OE2 3.21Å; K270-E274 WeakPolarHBondContact CG-OE2 3.03Å; K270-E274 VanDerWaalsContact O-CA 3.25Å; K270-E274 WeakPolarHBondContact O-CA 3.43Å; K270-E274 WeakPolarHBondContact O-CB 3.24Å; K270-E274 PolarHBondContact O-N 3.26Å; E274-V276 VanDerWaalsContact C-N 3.25Å; E274-V276 PolarHBondContact O-N 3.44Å
275	E	30	Very low	42.2	Very low	138 Å²	138	96.6 Å²	96.6	65%	0.645	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	96.6	158.1	-99.4	-173.5	-164.4	0	0	107.8	T271	T271-E275 HydrophobicContact CG2-CG 3.93Å; T271-E275 VanDerWaalsContact O-CB 3.27Å; T271-E275 WeakPolarHBondContact O-CB 3.28Å; T271-E275 WeakPolarHBondContact O-CG 3.43Å; T271-E275 PolarHBondContact O-N 2.89Å
276	V	34.6	Very low	41.3	Very low	110 Å²	110	99.8 Å²	99.8	67%	0.667	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	55	178.9	-156.1	0	0	0	0	116.3	E274	E274-V276 VanDerWaalsContact C-N 3.25Å; E274-V276 PolarHBondContact O-N 3.44Å
277	E	32.8	Very low	40.8	Very low	181 Å²	181	98.8 Å²	98.8	85%	0.846	53%	0.527	S	S	*	.	S	Bend	trans	-119.7	58.3	136.1	-92.4	-165.3	167.2	0	0	110.6
278	D	36.1	Very low	41.2	Very low	51 Å²	51	100.8 Å²	100.8	27%	0.273	53%	0.531	S	S	.	.			trans	23	97.1	147	-111.7	-3.4	0	0	0	119	D280 R283 G284	D278-D280 VanDerWaalsContact CB-O 3.27Å; D278-D280 WeakPolarHBondContact CB-O 3.29Å; D278-D280 PolarHBondContact O-N 3.31Å; D278-R283 WeakPolarHBondContact OD1-CB 3.16Å; D278-R283 WeakPolarHBondContact OD2-CA 3.46Å; D278-R283 WeakPolarHBondContact OD2-CB 3.46Å; D278-R283 PolarHBondContact OD2-N 3.37Å; D278-R283 VanDerWaalsContact OD2-N 3.07Å; D278-G284 WeakPolarHBondContact OD2-CA 3.46Å; D278-G284 PolarHBondContact OD2-N 2.81Å
279	S	39.6	Very low	41.8	Very low	117 Å²	117	103.1 Å²	103.1	82%	0.818	55%	0.546	S	S	*	.	S	Bend	trans	-67.4	-10.4	154	47.4	0	0	0	0	113
280	D	44.8	Very low	43.1	Very low	45 Å²	45	106.3 Å²	106.3	24%	0.241	55%	0.553	C	S	.	*	S	Bend	trans	-107.2	114.2	169.3	-174.9	0.8	0	0	0	109.4	D278 R282 R283	D278-D280 VanDerWaalsContact CB-O 3.27Å; D278-D280 WeakPolarHBondContact CB-O 3.29Å; D278-D280 PolarHBondContact O-N 3.31Å; D280-R282 PolarHBondContact O-N 3Å; D280-R282 VanDerWaalsContact OD1-CB 3.24Å; D280-R282 WeakPolarHBondContact OD1-CB 3.42Å; D280-R282 VanDerWaalsContact OD1-CD 3.3Å; D280-R282 WeakPolarHBondContact OD1-CD 3.38Å; D280-R282 WeakPolarHBondContact OD1-CG 3.48Å; D280-R282 PolarHBondContact OD1-N 3.4Å; D280-R282 IonicContact OD1-NE 3.91Å; D280-R282 PolarHBondContact OD1-NE 2.89Å; D280-R283 PolarHBondContact O-N 3.42Å
281	P	45.2	Very low	44.6	Very low	29 Å²	29	103.2 Å²	103.2	19%	0.188	54%	0.542	C	S	.	.	G	3₁₀ helix	trans	-56.4	-18.1	176.9	23.1	-33.3	0	0	0	113	K437 F658	P281-K437 HydrophobicContact CB-CG 4.46Å; P281-K437 WeakPolarHBondContact O-CD 3.17Å; P281-K437 WeakPolarHBondContact O-CE 3.29Å; P281-K437 WeakPolarHBondContact O-CG 3.46Å; P281-F658 HydrophobicContact CB-CE2 4.4Å; P281-F658 HydrophobicContact CG-CE2 3.81Å; P281-F658 HydrophobicContact CG-CZ 3.98Å
282	R	50.4	Low	46.5	Very low	47 Å²	47	103.5 Å²	103.5	18%	0.177	54%	0.539	C	S	.	.	G	3₁₀ helix	trans	-78.6	-13.3	-172.9	-55.9	168.8	-151.4	-139.2	-10	115.7	D280 E444 S643	D280-R282 PolarHBondContact O-N 3Å; D280-R282 VanDerWaalsContact OD1-CB 3.24Å; D280-R282 WeakPolarHBondContact OD1-CB 3.42Å; D280-R282 VanDerWaalsContact OD1-CD 3.3Å; D280-R282 WeakPolarHBondContact OD1-CD 3.38Å; D280-R282 WeakPolarHBondContact OD1-CG 3.48Å; D280-R282 PolarHBondContact OD1-N 3.4Å; D280-R282 IonicContact OD1-NE 3.91Å; D280-R282 PolarHBondContact OD1-NE 2.89Å; R282-E444 IonicContact CZ-OE1 3.49Å; R282-E444 IonicContact CZ-OE2 2.7Å; R282-E444 IonicContact NH1-OE1 2.66Å; R282-E444 IonicContact NH1-OE2 3.47Å; R282-E444 IonicContact NH2-OE1 2.72Å; R282-E444 PolarHBondContact NH2-OE1 3.24Å; R282-E444 IonicContact NH2-OE2 2.94Å; R282-E444 PolarHBondContact NH2-OE2 3.33Å; R282-S643 PolarHBondContact NH2-OG 3.4Å
283	R	42.7	Very low	48.2	Very low	194 Å²	194	105.3 Å²	105.3	73%	0.732	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-105.9	-1.5	-170.4	-113.6	-179.6	175.7	-170.6	0.5	114.8	D278 D280	D278-R283 WeakPolarHBondContact OD1-CB 3.16Å; D278-R283 WeakPolarHBondContact OD2-CA 3.46Å; D278-R283 WeakPolarHBondContact OD2-CB 3.46Å; D278-R283 PolarHBondContact OD2-N 3.37Å; D278-R283 VanDerWaalsContact OD2-N 3.07Å; D280-R283 PolarHBondContact O-N 3.42Å
284	G	47.8	Very low	50.2	Low	30 Å²	30	105.8 Å²	105.8	31%	0.309	53%	0.525	S	S	.	.	S	Bend	trans	-76.2	172.1	-176.4	0	0	0	0	0	113.8	D278	D278-G284 WeakPolarHBondContact OD2-CA 3.46Å; D278-G284 PolarHBondContact OD2-N 2.81Å
285	K	48.1	Very low	52.6	Low	196 Å²	196	103.5 Å²	103.5	85%	0.852	53%	0.525	S	S	*	.	S	Bend	trans	-44.9	143.9	175	-75.7	174.4	180	168.8	0	112	L287	K285-L287 PolarHBondContact O-N 3.11Å
286	A	54.3	Low	55	Low	88 Å²	88	98.1 Å²	98.1	73%	0.727	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-51	130.9	177.5	0	0	0	0	0	111	Q288	A286-Q288 PolarHBondContact O-N 2.89Å
287	L	58.4	Low	57.3	Low	57 Å²	57	97.7 Å²	97.7	30%	0.298	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-55.5	124.4	-178.3	-88.2	94.1	0	0	0	110.4	K285 F292 L434 K437	K285-L287 PolarHBondContact O-N 3.11Å; L287-F292 HydrophobicContact CD2-CE1 4.33Å; L287-F292 HydrophobicContact CD2-CE2 3.63Å; L287-F292 HydrophobicContact CD2-CZ 3.31Å; L287-L434 HydrophobicContact CD2-CB 3.86Å; L287-K437 HydrophobicContact CD1-CB 3.82Å; L287-K437 HydrophobicContact CD1-CD 3.71Å; L287-K437 HydrophobicContact CD1-CG 4.17Å
288	Q	62.5	Low	59.7	Low	121 Å²	121	89.4 Å²	89.4	57%	0.565	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-99.9	140.3	166.8	-62.9	-171.4	-1.3	0	0	109.2	A286 R290 D291	A286-Q288 PolarHBondContact O-N 2.89Å; Q288-R290 PolarHBondContact O-N 2.99Å; Q288-D291 PolarHBondContact N-OD2 2.91Å; Q288-D291 WeakPolarHBondContact O-CB 3.4Å; Q288-D291 PolarHBondContact O-N 3.42Å
289	C	58.5	Low	62.1	Low	91 Å²	91	87.8 Å²	87.8	62%	0.615	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-56.5	-26.7	179.2	-160	0	0	0	0	112.3	D291 F292 F293	C289-D291 PolarHBondContact O-N 3.39Å; C289-F292 PolarHBondContact O-N 2.96Å; C289-F293 WeakPolarHBondContact O-CD2 3.44Å
290	R	61.6	Low	64.3	Low	199 Å²	199	89.1 Å²	89.1	75%	0.751	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-65.5	-20.1	177.1	-57.6	-175.2	88	169.1	6	114	Q288	Q288-R290 PolarHBondContact O-N 2.99Å
291	D	67.9	Low	66.3	Low	56 Å²	56	89.4 Å²	89.4	30%	0.299	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-76.1	-24.8	-179.9	-63	-39.1	0	0	0	112.5	Q288 C289 N431 L434	Q288-D291 PolarHBondContact N-OD2 2.91Å; Q288-D291 WeakPolarHBondContact O-CB 3.4Å; Q288-D291 PolarHBondContact O-N 3.42Å; C289-D291 PolarHBondContact O-N 3.39Å; D291-N431 PolarHBondContact O-ND2 2.61Å; D291-N431 VanDerWaalsContact O-ND2 3.08Å; D291-L434 HydrophobicContact CB-CD1 4.09Å
292	F	68.1	Low	68.3	Low	57 Å²	57	88.3 Å²	88.3	25%	0.25	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-32.3	174.7	-65.6	-81.1	0	0	0	112.9	L287 C289 R294 F430 N431 L434	L287-F292 HydrophobicContact CD2-CE1 4.33Å; L287-F292 HydrophobicContact CD2-CE2 3.63Å; L287-F292 HydrophobicContact CD2-CZ 3.31Å; C289-F292 PolarHBondContact O-N 2.96Å; F292-R294 VanDerWaalsContact C-N 3.25Å; F292-R294 PolarHBondContact O-N 3.02Å; F292-F430 WeakPolarHBondContact CA-O 3.36Å; F292-F430 CarbonylContact O-C 3.58Å; F292-N431 WeakPolarHBondContact CD1-O 3.44Å; F292-L434 HydrophobicContact CE1-CB 4.02Å; F292-L434 HydrophobicContact CZ-CB 4.29Å
293	F	67.6	Low	70	Confident	161 Å²	161	89 Å²	89	71%	0.706	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-4.8	-177.2	-72.1	-79.4	0	0	0	114.2	C289 A295	C289-F293 WeakPolarHBondContact O-CD2 3.44Å; F293-A295 PolarHBondContact O-N 3.4Å; F293-A295 VanDerWaalsContact O-N 3.11Å
294	R	74.6	Confident	72.1	Confident	141 Å²	141	87.8 Å²	87.8	53%	0.532	44%	0.435	S	S	.	.	S	Bend	trans	-84.5	79.1	174.8	-72.8	179.8	173.2	170	-3.8	110.6	F292 G296 K297 N431	F292-R294 VanDerWaalsContact C-N 3.25Å; F292-R294 PolarHBondContact O-N 3.02Å; R294-G296 PolarHBondContact O-N 2.99Å; R294-K297 HydrophobicContact CB-CB 4.33Å; R294-K297 PolarHBondContact O-N 3.32Å; R294-N431 PolarHBondContact O-ND2 3.38Å
295	A	79.9	Confident	73.8	Confident	65 Å²	65	93.6 Å²	93.6	54%	0.537	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	133.1	-178.5	0	0	0	0	0	112.3	F293 K297 L429 F430	F293-A295 PolarHBondContact O-N 3.4Å; F293-A295 VanDerWaalsContact O-N 3.11Å; A295-K297 PolarHBondContact O-N 3.48Å; A295-K297 VanDerWaalsContact O-N 3.15Å; A295-L429 CarbonylContact C-O 3.6Å; A295-L429 VanDerWaalsContact CA-O 3.31Å; A295-L429 WeakPolarHBondContact CA-O 3.5Å; A295-F430 HydrophobicContact CB-CD1 4.35Å; A295-F430 HydrophobicContact CB-CE1 4.22Å
296	G	79.8	Confident	75.6	Confident	25 Å²	25	84.9 Å²	84.9	26%	0.258	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	-10.9	172.6	0	0	0	0	0	116.1	R294 Y300 L429	R294-G296 PolarHBondContact O-N 2.99Å; G296-Y300 WeakPolarHBondContact O-CB 3.34Å; G296-Y300 PolarHBondContact O-N 3.42Å; G296-L429 PolarHBondContact N-O 3Å
297	K	83.4	Confident	77.1	Confident	101 Å²	101	86.6 Å²	86.6	44%	0.439	41%	0.406	S	S	.	.	H	α-helix	trans	-64.4	-45	-178.5	-171.2	-177.2	175	-171.2	0	112.4	R294 A295 Y300 D301	R294-K297 HydrophobicContact CB-CB 4.33Å; R294-K297 PolarHBondContact O-N 3.32Å; A295-K297 PolarHBondContact O-N 3.48Å; A295-K297 VanDerWaalsContact O-N 3.15Å; K297-Y300 PolarHBondContact O-N 3.42Å; K297-D301 WeakPolarHBondContact CE-OD2 3.25Å; K297-D301 WeakPolarHBondContact O-CB 3.27Å; K297-D301 VanDerWaalsContact O-CG 3.27Å; K297-D301 PolarHBondContact O-N 2.85Å
298	G	82.4	Confident	78.4	Confident	7 Å²	7	88.4 Å²	88.4	7%	0.072	42%	0.421	C	S	.	.	H	α-helix	trans	-64.8	-41.6	-178.7	0	0	0	0	0	113	D301 D302 N431	G298-D301 PolarHBondContact O-N 2.89Å; G298-D302 WeakPolarHBondContact O-CB 3.39Å; G298-D302 VanDerWaalsContact O-CG 3.29Å; G298-D302 PolarHBondContact O-N 3.46Å; G298-N431 WeakPolarHBondContact CA-OD1 3.45Å; G298-N431 PolarHBondContact N-OD1 3.36Å
299	V	86.1	Confident	79.5	Confident	17 Å²	17	85.8 Å²	85.8	10%	0.103	41%	0.411	C	S	.	.	H	α-helix	trans	-62.1	-45.4	173.7	177.6	0	0	0	0	110.6	D301 D302 L303 G428 H659 W660 M663	V299-D301 PolarHBondContact O-N 3.46Å; V299-D302 PolarHBondContact O-N 3.4Å; V299-L303 HydrophobicContact CG1-CD1 3.52Å; V299-L303 WeakPolarHBondContact O-CD1 3.18Å; V299-L303 PolarHBondContact O-N 2.93Å; V299-G428 WeakPolarHBondContact CG2-O 3.49Å; V299-H659 HydrophobicContact CB-CB 4.5Å; V299-H659 HydrophobicContact CG2-CB 3.74Å; V299-W660 HydrophobicContact CG1-CE3 3.98Å; V299-M663 HydrophobicContact CG1-SD 4.25Å; V299-M663 HydrophobicContact CG2-SD 4.28Å
300	Y	87.2	Confident	80.8	Confident	145 Å²	145	85 Å²	85	57%	0.569	40%	0.395	S	S	*	.	H	α-helix	trans	-61	-44	177.4	178	-97.6	0	0	0	112.5	G296 K297 L303 R304	G296-Y300 WeakPolarHBondContact O-CB 3.34Å; G296-Y300 PolarHBondContact O-N 3.42Å; K297-Y300 PolarHBondContact O-N 3.42Å; Y300-L303 PolarHBondContact O-N 3.25Å; Y300-R304 WeakPolarHBondContact O-CB 3.36Å; Y300-R304 PolarHBondContact O-N 3.5Å
301	D	85.1	Confident	81.9	Confident	51 Å²	51	79.4 Å²	79.4	27%	0.273	39%	0.385	S	S	.	.	H	α-helix	trans	-66.2	-37.6	178.7	-68.9	-21.6	0	0	0	111.4	K297 G298 V299 R305	K297-D301 WeakPolarHBondContact CE-OD2 3.25Å; K297-D301 WeakPolarHBondContact O-CB 3.27Å; K297-D301 VanDerWaalsContact O-CG 3.27Å; K297-D301 PolarHBondContact O-N 2.85Å; G298-D301 PolarHBondContact O-N 2.89Å; V299-D301 PolarHBondContact O-N 3.46Å; D301-R305 WeakPolarHBondContact O-CB 3.41Å; D301-R305 VanDerWaalsContact O-CG 3.27Å; D301-R305 WeakPolarHBondContact O-CG 3.38Å; D301-R305 PolarHBondContact O-N 2.86Å; D301-R305 PolarHBondContact O-NE 2.97Å
302	D	87.1	Confident	82.7	Confident	5 Å²	5	78 Å²	78	3%	0.027	38%	0.379	C	S	.	.	H	α-helix	trans	-64.5	-48.5	174.2	-74.5	-4.4	0	0	0	111.6	G298 V299 R305 R306 A657 F658 H659 W660	G298-D302 WeakPolarHBondContact O-CB 3.39Å; G298-D302 VanDerWaalsContact O-CG 3.29Å; G298-D302 PolarHBondContact O-N 3.46Å; V299-D302 PolarHBondContact O-N 3.4Å; D302-R305 PolarHBondContact O-N 3.11Å; D302-R305 IonicContact OD1-CZ 3.84Å; D302-R305 IonicContact OD1-NH2 2.78Å; D302-R305 PolarHBondContact OD1-NH2 2.94Å; D302-R306 PolarHBondContact O-N 3.31Å; D302-R306 VanDerWaalsContact O-N 3.1Å; D302-A657 HydrophobicContact CB-CB 4.17Å; D302-F658 PolarHBondContact OD2-N 3.29Å; D302-H659 IonicContact OD1-ND1 2.64Å; D302-H659 VanDerWaalsContact OD2-CB 3.29Å; D302-H659 WeakPolarHBondContact OD2-CB 3.38Å; D302-H659 IonicContact OD2-CG 3.97Å; D302-H659 PolarHBondContact OD2-N 3.01Å; D302-H659 IonicContact OD2-ND1 3.53Å; D302-H659 PolarHBondContact OD2-ND1 3.32Å; D302-W660 HydrophobicContact CB-CB 4.31Å
303	L	86.2	Confident	83.5	Confident	62 Å²	62	75.2 Å²	75.2	33%	0.325	37%	0.367	S	S	.	.	H	α-helix	trans	-65	-44	177	-87	90.2	0	0	0	112.1	V299 Y300 R305 R306 L307 W660	V299-L303 HydrophobicContact CG1-CD1 3.52Å; V299-L303 WeakPolarHBondContact O-CD1 3.18Å; V299-L303 PolarHBondContact O-N 2.93Å; Y300-L303 PolarHBondContact O-N 3.25Å; L303-R305 PolarHBondContact O-N 3.43Å; L303-R306 PolarHBondContact O-N 2.89Å; L303-L307 WeakPolarHBondContact O-CB 3.46Å; L303-L307 PolarHBondContact O-N 3.36Å; L303-W660 HydrophobicContact CD1-CB 4.08Å; L303-W660 HydrophobicContact CD1-CD2 3.69Å; L303-W660 HydrophobicContact CD1-CE3 3.61Å; L303-W660 HydrophobicContact CD1-CG 3.9Å; L303-W660 HydrophobicContact CD1-CZ3 4.29Å; L303-W660 HydrophobicContact CG-CD2 4.44Å
304	R	87.6	Confident	84.3	Confident	168 Å²	168	70.4 Å²	70.4	63%	0.634	35%	0.346	S	S	*	.	H	α-helix	trans	-59.9	-35.6	-178.7	-177.6	177.6	177.7	-166.8	-0	111.9	Y300 P308	Y300-R304 WeakPolarHBondContact O-CB 3.36Å; Y300-R304 PolarHBondContact O-N 3.5Å; R304-P308 WeakPolarHBondContact O-CD 3.49Å
305	R	84.4	Confident	84.5	Confident	152 Å²	152	67.1 Å²	67.1	57%	0.574	34%	0.341	S	S	*	.	H	α-helix	trans	-75.5	-40.5	176.3	-71.2	-178	-63.1	-163.7	6	112.7	D301 D302 L303	D301-R305 WeakPolarHBondContact O-CB 3.41Å; D301-R305 VanDerWaalsContact O-CG 3.27Å; D301-R305 WeakPolarHBondContact O-CG 3.38Å; D301-R305 PolarHBondContact O-N 2.86Å; D301-R305 PolarHBondContact O-NE 2.97Å; D302-R305 PolarHBondContact O-N 3.11Å; D302-R305 IonicContact OD1-CZ 3.84Å; D302-R305 IonicContact OD1-NH2 2.78Å; D302-R305 PolarHBondContact OD1-NH2 2.94Å; L303-R305 PolarHBondContact O-N 3.43Å
306	R	85.1	Confident	84.2	Confident	14 Å²	14	67 Å²	67	5%	0.053	33%	0.332	C	S	.	.	H	α-helix	trans	-86.3	-33.9	-173.1	-163.5	73.5	-168.9	-162.3	3.8	114.1	D302 L303 P308 L309 Y310 D313 G379 K654 G655 E715	D302-R306 PolarHBondContact O-N 3.31Å; D302-R306 VanDerWaalsContact O-N 3.1Å; L303-R306 PolarHBondContact O-N 2.89Å; R306-P308 VanDerWaalsContact C-CD 3.48Å; R306-L309 PolarHBondContact O-N 2.89Å; R306-Y310 PolarHBondContact O-N 3.31Å; R306-Y310 VanDerWaalsContact O-N 3.16Å; R306-D313 IonicContact CZ-OD2 3.9Å; R306-D313 IonicContact NE-OD2 3.08Å; R306-D313 IonicContact NH2-OD1 3.45Å; R306-D313 PolarHBondContact NH2-OD1 3.35Å; R306-D313 IonicContact NH2-OD2 3.92Å; R306-D313 PolarHBondContact NH2-OD2 3.35Å; R306-D313 VanDerWaalsContact NH2-OD2 3.08Å; R306-G379 WeakPolarHBondContact CD-O 3.23Å; R306-G379 VanDerWaalsContact CZ-O 3.25Å; R306-G379 PolarHBondContact NE-O 2.88Å; R306-G379 VanDerWaalsContact NE-O 3.15Å; R306-G379 PolarHBondContact NH1-O 3.35Å; R306-K654 PolarHBondContact NH1-O 2.85Å; R306-G655 PolarHBondContact NH1-O 2.92Å; R306-E715 IonicContact CZ-OE2 3.91Å; R306-E715 IonicContact NH1-OE2 3.29Å; R306-E715 PolarHBondContact NH1-OE2 2.94Å; R306-E715 VanDerWaalsContact NH1-OE2 3.08Å; R306-E715 IonicContact NH2-OE2 3.52Å; R306-E715 PolarHBondContact NH2-OE2 3.04Å
307	L	85.4	Confident	83.6	Confident	124 Å²	124	65.8 Å²	65.8	65%	0.649	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-56.2	-41.6	-174	-165.4	74.3	0	0	0	113.8	L303 L309 Y310	L303-L307 WeakPolarHBondContact O-CB 3.46Å; L303-L307 PolarHBondContact O-N 3.36Å; L307-L309 VanDerWaalsContact C-N 3.27Å; L307-L309 PolarHBondContact O-N 2.79Å; L307-Y310 VanDerWaalsContact O-CB 3.28Å; L307-Y310 WeakPolarHBondContact O-CB 3.38Å; L307-Y310 PolarHBondContact O-N 3.3Å
308	P	86.9	Confident	82.9	Confident	94 Å²	94	65.7 Å²	65.7	61%	0.61	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-65.4	-28.6	177.1	-21.3	34.3	0	0	0	113.8	R304 R306	R304-P308 WeakPolarHBondContact O-CD 3.49Å; R306-P308 VanDerWaalsContact C-CD 3.48Å
309	L	84.8	Confident	81.7	Confident	66 Å²	66	70.8 Å²	70.8	35%	0.346	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-87.4	-11.1	-179.1	-63.9	169.7	0	0	0	112.4	R306 L307 S312 D313 K654	R306-L309 PolarHBondContact O-N 2.89Å; L307-L309 VanDerWaalsContact C-N 3.27Å; L307-L309 PolarHBondContact O-N 2.79Å; L309-S312 WeakPolarHBondContact O-CB 3.49Å; L309-S312 PolarHBondContact O-N 3.26Å; L309-S312 PolarHBondContact O-OG 3.08Å; L309-D313 PolarHBondContact O-N 3.36Å; L309-K654 HydrophobicContact CD1-CB 3.92Å; L309-K654 HydrophobicContact CD1-CG 4.26Å
310	Y	85.4	Confident	80.3	Confident	75 Å²	75	71.5 Å²	71.5	29%	0.294	36%	0.364	S	S	.	.	H	α-helix	trans	-52.6	-47.3	-178.6	-170.4	-94.1	0	0	0	115.2	R306 L307 S312 D313 F314 L376 R717	R306-Y310 PolarHBondContact O-N 3.31Å; R306-Y310 VanDerWaalsContact O-N 3.16Å; L307-Y310 VanDerWaalsContact O-CB 3.28Å; L307-Y310 WeakPolarHBondContact O-CB 3.38Å; L307-Y310 PolarHBondContact O-N 3.3Å; Y310-S312 PolarHBondContact O-N 3.4Å; Y310-D313 WeakPolarHBondContact O-CB 3.04Å; Y310-D313 PolarHBondContact O-N 3.44Å; Y310-D313 VanDerWaalsContact O-N 3.16Å; Y310-F314 HydrophobicContact CD1-CE2 4.38Å; Y310-F314 HydrophobicContact CE1-CD2 4.33Å; Y310-F314 AromaticContact CE1-CE2 3.67Å; Y310-F314 HydrophobicContact CE1-CE2 3.67Å; Y310-F314 HydrophobicContact CE2-CE2 4.42Å; Y310-F314 AromaticContact CZ-CE2 3.69Å; Y310-L376 WeakPolarHBondContact CE2-O 3.33Å; Y310-L376 PolarHBondContact OH-O 3.46Å; Y310-R717 VanDerWaalsContact CE2-CZ 3.46Å
311	P	85.6	Confident	78.5	Confident	81 Å²	81	72.7 Å²	72.7	53%	0.526	37%	0.372	S	S	.	.	H	α-helix	trans	-64.1	-30.3	178	24.8	-34.1	0	0	0	112.4	D313 F314 T315	P311-D313 PolarHBondContact O-N 3.14Å; P311-F314 PolarHBondContact O-N 2.89Å; P311-T315 PolarHBondContact O-N 2.99Å; P311-T315 PolarHBondContact O-OG1 3.4Å
312	S	83.9	Confident	76.9	Confident	26 Å²	26	73.3 Å²	73.3	18%	0.182	38%	0.375	C	S	.	.	H	α-helix	trans	-63.8	-30.1	177.4	77.7	0	0	0	0	112.5	L309 Y310 F314 T315 D316 K654	L309-S312 WeakPolarHBondContact O-CB 3.49Å; L309-S312 PolarHBondContact O-N 3.26Å; L309-S312 PolarHBondContact O-OG 3.08Å; Y310-S312 PolarHBondContact O-N 3.4Å; S312-F314 PolarHBondContact O-N 3.36Å; S312-T315 WeakPolarHBondContact CA-OG1 3.42Å; S312-T315 PolarHBondContact O-N 2.68Å; S312-T315 PolarHBondContact O-OG1 2.86Å; S312-D316 WeakPolarHBondContact O-CB 3.47Å; S312-D316 PolarHBondContact O-N 3.43Å; S312-K654 WeakPolarHBondContact OG-CE 3.24Å; S312-K654 PolarHBondContact OG-NZ 2.77Å
313	D	85	Confident	75.2	Confident	0 Å²	0	84.5 Å²	84.5	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-65.7	-23.9	179.8	-67.7	-11.7	0	0	0	113.3	R306 L309 Y310 P311 K654 R717	R306-D313 IonicContact CZ-OD2 3.9Å; R306-D313 IonicContact NE-OD2 3.08Å; R306-D313 IonicContact NH2-OD1 3.45Å; R306-D313 PolarHBondContact NH2-OD1 3.35Å; R306-D313 IonicContact NH2-OD2 3.92Å; R306-D313 PolarHBondContact NH2-OD2 3.35Å; R306-D313 VanDerWaalsContact NH2-OD2 3.08Å; L309-D313 PolarHBondContact O-N 3.36Å; Y310-D313 WeakPolarHBondContact O-CB 3.04Å; Y310-D313 PolarHBondContact O-N 3.44Å; Y310-D313 VanDerWaalsContact O-N 3.16Å; P311-D313 PolarHBondContact O-N 3.14Å; D313-K654 WeakPolarHBondContact OD1-CD 3.31Å; D313-K654 WeakPolarHBondContact OD1-CE 3.41Å; D313-K654 IonicContact OD1-NZ 2.78Å; D313-K654 PolarHBondContact OD1-NZ 2.93Å; D313-R717 HydrophobicContact CB-CG 3.94Å; D313-R717 PolarHBondContact O-N 3.25Å; D313-R717 IonicContact OD2-CZ 3.22Å; D313-R717 IonicContact OD2-NE 3.57Å; D313-R717 PolarHBondContact OD2-NE 3.47Å; D313-R717 IonicContact OD2-NH2 3.24Å; D313-R717 PolarHBondContact OD2-NH2 3.39Å; D313-R717 VanDerWaalsContact OD2-NH2 3.16Å
314	F	83.9	Confident	73.9	Confident	60 Å²	60	82.3 Å²	82.3	26%	0.263	41%	0.407	S	S	.	.	H	α-helix	trans	-92.8	-35	175	-70.4	-84.1	0	0	0	112.1	Y310 P311 S312 R717	Y310-F314 HydrophobicContact CD1-CE2 4.38Å; Y310-F314 HydrophobicContact CE1-CD2 4.33Å; Y310-F314 AromaticContact CE1-CE2 3.67Å; Y310-F314 HydrophobicContact CE1-CE2 3.67Å; Y310-F314 HydrophobicContact CE2-CE2 4.42Å; Y310-F314 AromaticContact CZ-CE2 3.69Å; P311-F314 PolarHBondContact O-N 2.89Å; S312-F314 PolarHBondContact O-N 3.36Å; F314-R717 HydrophobicContact CE1-CB 4.21Å; F314-R717 HydrophobicContact CZ-CB 4.13Å
315	T	79.6	Confident	72.9	Confident	71 Å²	71	79.6 Å²	79.6	44%	0.436	40%	0.404	S	S	.	.	H	α-helix	trans	-76.1	-36.3	178.6	58.1	0	0	0	0	112.6	P311 S312 G317 I318 T319	P311-T315 PolarHBondContact O-N 2.99Å; P311-T315 PolarHBondContact O-OG1 3.4Å; S312-T315 WeakPolarHBondContact CA-OG1 3.42Å; S312-T315 PolarHBondContact O-N 2.68Å; S312-T315 PolarHBondContact O-OG1 2.86Å; T315-G317 PolarHBondContact O-N 2.95Å; T315-I318 PolarHBondContact O-N 3.31Å; T315-T319 PolarHBondContact O-N 2.77Å
316	D	73.9	Confident	72.2	Confident	62 Å²	62	78.4 Å²	78.4	33%	0.332	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.3	179.4	-69.6	-7.7	0	0	0	112.1	S312 Y328 K654	S312-D316 WeakPolarHBondContact O-CB 3.47Å; S312-D316 PolarHBondContact O-N 3.43Å; D316-Y328 PolarHBondContact O-OH 3.46Å; D316-K654 VanDerWaalsContact OD2-CE 3.29Å; D316-K654 WeakPolarHBondContact OD2-CE 3.32Å; D316-K654 IonicContact OD2-NZ 3.83Å; D316-K654 PolarHBondContact OD2-NZ 2.9Å
317	G	66.7	Low	71.6	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.01	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-15	175.4	0	0	0	0	0	115.1	T315 Y328	T315-G317 PolarHBondContact O-N 2.95Å; G317-Y328 VanDerWaalsContact C-CE2 3.42Å; G317-Y328 WeakPolarHBondContact O-CD2 3.39Å; G317-Y328 WeakPolarHBondContact O-CE2 3.23Å
318	I	69	Low	71.3	Confident	98 Å²	98	76.1 Å²	76.1	50%	0.503	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	-43.1	-173.2	-57.8	174.7	0	0	0	111.1	T315 G320 L718	T315-I318 PolarHBondContact O-N 3.31Å; I318-G320 PolarHBondContact O-N 3.25Å; I318-L718 HydrophobicContact CD1-CD2 4.06Å; I318-L718 HydrophobicContact CG1-CD2 3.78Å
319	T	56.3	Low	71	Confident	114 Å²	114	75 Å²	75	70%	0.699	39%	0.385	S	S	*	.			trans	-97.5	81.2	-172.7	-50.9	0	0	0	0	110	T315	T315-T319 PolarHBondContact O-N 2.77Å
320	G	58.3	Low	70.6	Confident	33 Å²	33	75 Å²	75	34%	0.34	39%	0.388	S	S	.	.			trans	-131.5	134	173.2	0	0	0	0	0	111.9	I318 D322	I318-G320 PolarHBondContact O-N 3.25Å; G320-D322 PolarHBondContact O-N 3.22Å
321	K	49.3	Very low	70.4	Confident	169 Å²	169	71.7 Å²	71.7	74%	0.735	38%	0.375	S	S	*	.	S	Bend	trans	-62.2	-26.4	177.5	-88.2	-171.8	172.7	-169.6	0	113.4	E252	E252-K321 IonicContact OE1-NZ 3.57Å; E252-K321 PolarHBondContact OE1-NZ 2.97Å
322	D	50.9	Low	70.5	Confident	64 Å²	64	68.3 Å²	68.3	34%	0.342	35%	0.354	S	S	.	.	S	Bend	trans	-89.8	129.5	173	-82.8	-11.8	0	0	0	110.4	G320 C324	G320-D322 PolarHBondContact O-N 3.22Å; D322-C324 VanDerWaalsContact O-CA 3.29Å; D322-C324 WeakPolarHBondContact O-CA 3.47Å; D322-C324 WeakPolarHBondContact O-CB 3.2Å; D322-C324 PolarHBondContact O-N 2.89Å
323	R	51	Low	70.5	Confident	241 Å²	241	71.5 Å²	71.5	91%	0.909	37%	0.368	S	S	*	.			trans	-33.1	71.5	178.9	-59.9	-168.5	-168.4	-172.4	4.6	115.6
324	C	58.5	Low	70.5	Confident	15 Å²	15	72 Å²	72	10%	0.101	37%	0.371	C	S	.	.	H	α-helix	trans	-87.1	-31.5	-162	-125.3	0	0	0	0	112.3	D322 L326 K327 Y328 K714	D322-C324 VanDerWaalsContact O-CA 3.29Å; D322-C324 WeakPolarHBondContact O-CA 3.47Å; D322-C324 WeakPolarHBondContact O-CB 3.2Å; D322-C324 PolarHBondContact O-N 2.89Å; C324-L326 VanDerWaalsContact C-N 3.3Å; C324-L326 PolarHBondContact O-N 2.88Å; C324-K327 PolarHBondContact O-N 2.82Å; C324-Y328 VanDerWaalsContact C-CD2 3.45Å; C324-Y328 HydrophobicContact CB-CD2 3.74Å; C324-Y328 HydrophobicContact CB-CE2 3.35Å; C324-Y328 WeakPolarHBondContact O-CD2 3.23Å; C324-Y328 VanDerWaalsContact O-CG 3.32Å; C324-Y328 PolarHBondContact O-N 3.16Å; C324-Y328 WeakPolarHBondContact SG-CE2 3.4Å; C324-Y328 PolarHBondContact SG-OH 2.89Å; C324-K714 PolarHBondContact SG-NZ 3.49Å
325	L	66	Low	70.6	Confident	112 Å²	112	69.2 Å²	69.2	59%	0.586	36%	0.358	S	S	*	.	H	α-helix	trans	-59.2	-38.9	-178.1	-66.7	178.1	0	0	0	112.6	T329	L325-T329 VanDerWaalsContact O-CB 3.3Å; L325-T329 WeakPolarHBondContact O-CB 3.22Å; L325-T329 VanDerWaalsContact O-CG2 3.22Å; L325-T329 WeakPolarHBondContact O-CG2 3.47Å; L325-T329 PolarHBondContact O-N 2.88Å; L325-T329 PolarHBondContact O-OG1 2.84Å
326	L	69.7	Low	71.1	Confident	126 Å²	126	68 Å²	68	66%	0.66	35%	0.346	S	S	*	.	H	α-helix	trans	-65.8	-48.8	177.8	-174.9	65.7	0	0	0	110.8	C324 Y328 T329 T330	C324-L326 VanDerWaalsContact C-N 3.3Å; C324-L326 PolarHBondContact O-N 2.88Å; L326-Y328 PolarHBondContact O-N 3.05Å; L326-T329 WeakPolarHBondContact CA-OG1 3.32Å; L326-T329 PolarHBondContact O-N 3.28Å; L326-T329 PolarHBondContact O-OG1 3.01Å; L326-T330 HydrophobicContact CD1-CG2 4.31Å; L326-T330 HydrophobicContact CG-CG2 4.49Å; L326-T330 WeakPolarHBondContact O-CB 3.29Å; L326-T330 VanDerWaalsContact O-CG2 3.29Å; L326-T330 WeakPolarHBondContact O-CG2 3.23Å; L326-T330 PolarHBondContact O-N 2.99Å; L326-T330 PolarHBondContact O-OG1 2.91Å
327	K	74.4	Confident	71.5	Confident	75 Å²	75	67.2 Å²	67.2	33%	0.326	34%	0.341	S	S	.	.	H	α-helix	trans	-60.2	-46.3	179	-171.1	172.4	179.1	178.5	0	110.9	C324 T330 T331 Q693 A695	C324-K327 PolarHBondContact O-N 2.82Å; K327-T330 WeakPolarHBondContact CA-OG1 3.49Å; K327-T330 PolarHBondContact O-N 3.49Å; K327-T330 PolarHBondContact O-OG1 2.65Å; K327-T331 WeakPolarHBondContact O-CB 3.47Å; K327-T331 PolarHBondContact O-N 3.38Å; K327-T331 PolarHBondContact O-OG1 3.05Å; K327-Q693 WeakPolarHBondContact CE-O 3.35Å; K327-Q693 PolarHBondContact NZ-O 2.73Å; K327-A695 PolarHBondContact NZ-O 3.39Å
328	Y	78.5	Confident	72.3	Confident	15 Å²	15	67.3 Å²	67.3	6%	0.059	34%	0.342	C	S	.	.	H	α-helix	trans	-67.5	-40.6	179.6	-63.4	-50	0	0	0	113.8	D316 G317 C324 L326 T330 T331 A332 L694 K714 T716 T719	D316-Y328 PolarHBondContact O-OH 3.46Å; G317-Y328 VanDerWaalsContact C-CE2 3.42Å; G317-Y328 WeakPolarHBondContact O-CD2 3.39Å; G317-Y328 WeakPolarHBondContact O-CE2 3.23Å; C324-Y328 VanDerWaalsContact C-CD2 3.45Å; C324-Y328 HydrophobicContact CB-CD2 3.74Å; C324-Y328 HydrophobicContact CB-CE2 3.35Å; C324-Y328 WeakPolarHBondContact O-CD2 3.23Å; C324-Y328 VanDerWaalsContact O-CG 3.32Å; C324-Y328 PolarHBondContact O-N 3.16Å; C324-Y328 WeakPolarHBondContact SG-CE2 3.4Å; C324-Y328 PolarHBondContact SG-OH 2.89Å; L326-Y328 PolarHBondContact O-N 3.05Å; Y328-T330 VanDerWaalsContact C-N 3.35Å; Y328-T331 PolarHBondContact O-N 3.47Å; Y328-A332 WeakPolarHBondContact O-CB 3.3Å; Y328-A332 PolarHBondContact O-N 2.92Å; Y328-L694 HydrophobicContact CD1-CD2 3.83Å; Y328-L694 HydrophobicContact CE1-CD2 3.73Å; Y328-K714 WeakPolarHBondContact OH-CD 3.29Å; Y328-T716 HydrophobicContact CE1-CG2 3.87Å; Y328-T719 HydrophobicContact CD1-CG2 4.09Å
329	T	79.3	Confident	73.2	Confident	70 Å²	70	62.6 Å²	62.6	43%	0.429	32%	0.318	S	S	.	.	H	α-helix	trans	-65.5	-40.7	174.9	50.3	0	0	0	0	110.8	L325 L326 A332 I333	L325-T329 VanDerWaalsContact O-CB 3.3Å; L325-T329 WeakPolarHBondContact O-CB 3.22Å; L325-T329 VanDerWaalsContact O-CG2 3.22Å; L325-T329 WeakPolarHBondContact O-CG2 3.47Å; L325-T329 PolarHBondContact O-N 2.88Å; L325-T329 PolarHBondContact O-OG1 2.84Å; L326-T329 WeakPolarHBondContact CA-OG1 3.32Å; L326-T329 PolarHBondContact O-N 3.28Å; L326-T329 PolarHBondContact O-OG1 3.01Å; T329-A332 PolarHBondContact O-N 2.91Å; T329-I333 WeakPolarHBondContact O-CB 3.35Å; T329-I333 WeakPolarHBondContact O-CD1 2.88Å; T329-I333 VanDerWaalsContact O-CG1 3.23Å; T329-I333 WeakPolarHBondContact O-CG1 3.45Å; T329-I333 PolarHBondContact O-N 3.29Å
330	T	78	Confident	74.8	Confident	67 Å²	67	57.7 Å²	57.7	41%	0.411	29%	0.287	S	S	.	.	H	α-helix	trans	-63.8	-40.5	173	54.9	0	0	0	0	112.3	L326 K327 Y328 F334	L326-T330 HydrophobicContact CD1-CG2 4.31Å; L326-T330 HydrophobicContact CG-CG2 4.49Å; L326-T330 WeakPolarHBondContact O-CB 3.29Å; L326-T330 VanDerWaalsContact O-CG2 3.29Å; L326-T330 WeakPolarHBondContact O-CG2 3.23Å; L326-T330 PolarHBondContact O-N 2.99Å; L326-T330 PolarHBondContact O-OG1 2.91Å; K327-T330 WeakPolarHBondContact CA-OG1 3.49Å; K327-T330 PolarHBondContact O-N 3.49Å; K327-T330 PolarHBondContact O-OG1 2.65Å; Y328-T330 VanDerWaalsContact C-N 3.35Å; T330-F334 VanDerWaalsContact O-CB 3.23Å; T330-F334 WeakPolarHBondContact O-CB 3.03Å; T330-F334 PolarHBondContact O-N 3.01Å
331	T	81.6	Confident	76.1	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-65.1	-42.4	175.2	-60.9	0	0	0	0	111.2	K327 Y328 F334 L335 Q693 L694 T719	K327-T331 WeakPolarHBondContact O-CB 3.47Å; K327-T331 PolarHBondContact O-N 3.38Å; K327-T331 PolarHBondContact O-OG1 3.05Å; Y328-T331 PolarHBondContact O-N 3.47Å; T331-F334 PolarHBondContact O-N 3.13Å; T331-L335 WeakPolarHBondContact O-CB 2.95Å; T331-L335 PolarHBondContact O-N 3.05Å; T331-Q693 HydrophobicContact CG2-CB 4.03Å; T331-L694 HydrophobicContact CG2-CD2 4.25Å; T331-L694 HydrophobicContact CG2-CG 4.33Å; T331-T719 HydrophobicContact CG2-CG2 4.12Å
332	A	87.4	Confident	77.9	Confident	10 Å²	10	48.4 Å²	48.4	8%	0.083	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-42.4	178.3	0	0	0	0	0	112.2	Y328 T329 L335 Y336 A722	Y328-A332 WeakPolarHBondContact O-CB 3.3Å; Y328-A332 PolarHBondContact O-N 2.92Å; T329-A332 PolarHBondContact O-N 2.91Å; A332-L335 PolarHBondContact O-N 3.3Å; A332-Y336 WeakPolarHBondContact O-CB 3.49Å; A332-Y336 PolarHBondContact O-N 3.43Å; A332-A722 HydrophobicContact CB-CB 4.18Å
333	I	84.1	Confident	79.7	Confident	93 Å²	93	45.4 Å²	45.4	48%	0.477	22%	0.222	S	C	.	.	H	α-helix	trans	-65.1	-45.2	175.4	-68.1	164.5	0	0	0	110.5	T329 L335 Y336 I337	T329-I333 WeakPolarHBondContact O-CB 3.35Å; T329-I333 WeakPolarHBondContact O-CD1 2.88Å; T329-I333 VanDerWaalsContact O-CG1 3.23Å; T329-I333 WeakPolarHBondContact O-CG1 3.45Å; T329-I333 PolarHBondContact O-N 3.29Å; I333-L335 VanDerWaalsContact C-N 3.29Å; I333-L335 PolarHBondContact O-N 3.4Å; I333-Y336 WeakPolarHBondContact O-CB 3.33Å; I333-Y336 PolarHBondContact O-N 3.18Å; I333-I337 HydrophobicContact CG2-CD1 4.47Å; I333-I337 WeakPolarHBondContact O-CG1 3.23Å; I333-I337 PolarHBondContact O-N 3.31Å
334	F	83.3	Confident	81.5	Confident	12 Å²	12	33.9 Å²	33.9	5%	0.053	18%	0.178	C	C	.	.	H	α-helix	trans	-56.4	-48.9	174.5	168.6	-90.2	0	0	0	110.7	T330 T331 Y336 I337 A338 D573 L689	T330-F334 VanDerWaalsContact O-CB 3.23Å; T330-F334 WeakPolarHBondContact O-CB 3.03Å; T330-F334 PolarHBondContact O-N 3.01Å; T331-F334 PolarHBondContact O-N 3.13Å; F334-Y336 VanDerWaalsContact C-N 3.32Å; F334-Y336 PolarHBondContact O-N 3.03Å; F334-I337 PolarHBondContact O-N 3.24Å; F334-A338 HydrophobicContact CD1-CB 4.3Å; F334-A338 HydrophobicContact CE1-CB 3.72Å; F334-A338 HydrophobicContact CE2-CB 4.31Å; F334-A338 HydrophobicContact CZ-CB 3.71Å; F334-A338 VanDerWaalsContact O-CB 3.31Å; F334-A338 WeakPolarHBondContact O-CB 2.97Å; F334-A338 PolarHBondContact O-N 3.34Å; F334-D573 VanDerWaalsContact CD2-O 3.24Å; F334-D573 WeakPolarHBondContact CD2-O 3.49Å; F334-D573 WeakPolarHBondContact CE2-O 3.31Å; F334-L689 HydrophobicContact CE1-CD2 3.67Å; F334-L689 HydrophobicContact CE1-CG 3.77Å; F334-L689 HydrophobicContact CZ-CD2 3.35Å; F334-L689 HydrophobicContact CZ-CG 3.86Å
335	L	86.6	Confident	82.8	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-65	-38.9	-176.2	-164.2	68.5	0	0	0	111.6	T331 A332 I333 I337 A338 I339 I384 H690 A723	T331-L335 WeakPolarHBondContact O-CB 2.95Å; T331-L335 PolarHBondContact O-N 3.05Å; A332-L335 PolarHBondContact O-N 3.3Å; I333-L335 VanDerWaalsContact C-N 3.29Å; I333-L335 PolarHBondContact O-N 3.4Å; L335-I337 PolarHBondContact O-N 2.8Å; L335-A338 PolarHBondContact O-N 3.34Å; L335-I339 HydrophobicContact CD1-CD1 4.24Å; L335-I339 HydrophobicContact CD1-CG1 4.45Å; L335-I339 HydrophobicContact CD2-CD1 4.21Å; L335-I339 HydrophobicContact CG-CD1 3.71Å; L335-I339 HydrophobicContact CG-CG1 4.3Å; L335-I339 WeakPolarHBondContact O-CB 3.08Å; L335-I339 WeakPolarHBondContact O-CG1 3.2Å; L335-I339 PolarHBondContact O-N 2.99Å; L335-I384 HydrophobicContact CD1-CD1 3.25Å; L335-I384 HydrophobicContact CD2-CD1 3.83Å; L335-I384 HydrophobicContact CD2-CG1 4.5Å; L335-I384 HydrophobicContact CG-CD1 3.93Å; L335-H690 HydrophobicContact CD1-CB 4.07Å; L335-A723 HydrophobicContact CB-CB 3.94Å; L335-A723 HydrophobicContact CD2-CB 3.83Å; L335-A723 HydrophobicContact CG-CB 4.01Å
336	Y	89.3	Confident	83.8	Confident	46 Å²	46	28.3 Å²	28.3	18%	0.18	15%	0.148	C	C	.	.	H	α-helix	trans	-52.6	-52.4	171.1	158.8	-108.2	0	0	0	111.5	A332 I333 F334 I339 L340 L726 I727 S730	A332-Y336 WeakPolarHBondContact O-CB 3.49Å; A332-Y336 PolarHBondContact O-N 3.43Å; I333-Y336 WeakPolarHBondContact O-CB 3.33Å; I333-Y336 PolarHBondContact O-N 3.18Å; F334-Y336 VanDerWaalsContact C-N 3.32Å; F334-Y336 PolarHBondContact O-N 3.03Å; Y336-I339 PolarHBondContact O-N 3.26Å; Y336-L340 HydrophobicContact CE1-CD2 4.46Å; Y336-L340 HydrophobicContact CE2-CD2 3.88Å; Y336-L340 WeakPolarHBondContact O-CB 3.38Å; Y336-L340 PolarHBondContact O-N 3.28Å; Y336-L340 WeakPolarHBondContact OH-CD2 3.33Å; Y336-L726 HydrophobicContact CD2-CB 3.5Å; Y336-L726 HydrophobicContact CE2-CB 4.05Å; Y336-L726 WeakPolarHBondContact CE2-O 3.37Å; Y336-L726 HydrophobicContact CG-CB 3.94Å; Y336-L726 HydrophobicContact CG-CD1 4.38Å; Y336-I727 HydrophobicContact CD2-CG1 3.83Å; Y336-I727 HydrophobicContact CE2-CG1 4.33Å; Y336-S730 WeakPolarHBondContact OH-CB 3.49Å
337	I	83.8	Confident	84.7	Confident	45 Å²	45	22.3 Å²	22.3	23%	0.231	12%	0.117	C	C	.	.	H	α-helix	trans	-70.2	-39.7	-178.8	-52.7	171.4	0	0	0	111.2	I333 F334 L335 I339 L340 L341 P577	I333-I337 HydrophobicContact CG2-CD1 4.47Å; I333-I337 WeakPolarHBondContact O-CG1 3.23Å; I333-I337 PolarHBondContact O-N 3.31Å; F334-I337 PolarHBondContact O-N 3.24Å; L335-I337 PolarHBondContact O-N 2.8Å; I337-I339 VanDerWaalsContact C-N 3.26Å; I337-I339 PolarHBondContact O-N 3.13Å; I337-L340 PolarHBondContact O-N 3.02Å; I337-L341 HydrophobicContact CG2-CD1 3.7Å; I337-L341 HydrophobicContact CG2-CG 4Å; I337-L341 WeakPolarHBondContact O-CG 3.43Å; I337-L341 PolarHBondContact O-N 3.33Å; I337-P577 HydrophobicContact CB-CB 4.2Å; I337-P577 HydrophobicContact CB-CG 3.83Å; I337-P577 HydrophobicContact CD1-CB 3.82Å; I337-P577 HydrophobicContact CD1-CG 4.12Å; I337-P577 HydrophobicContact CG2-CB 3.62Å; I337-P577 HydrophobicContact CG2-CG 3.56Å
338	A	82.8	Confident	85.3	Confident	2 Å²	2	19 Å²	19	2%	0.017	10%	0.103	C	C	.	.	H	α-helix	trans	-64.3	-28.7	-179.2	0	0	0	0	0	113.2	F334 L335 P342 H686	F334-A338 HydrophobicContact CD1-CB 4.3Å; F334-A338 HydrophobicContact CE1-CB 3.72Å; F334-A338 HydrophobicContact CE2-CB 4.31Å; F334-A338 HydrophobicContact CZ-CB 3.71Å; F334-A338 VanDerWaalsContact O-CB 3.31Å; F334-A338 WeakPolarHBondContact O-CB 2.97Å; F334-A338 PolarHBondContact O-N 3.34Å; L335-A338 PolarHBondContact O-N 3.34Å; A338-P342 WeakPolarHBondContact O-CD 3.15Å; A338-P342 VanDerWaalsContact O-CG 3.26Å; A338-P342 WeakPolarHBondContact O-CG 3.4Å; A338-H686 PolarHBondContact O-CE1 2.95Å; A338-H686 PolarHBondContact O-ND1 3.46Å
339	I	89	Confident	85.6	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-90.2	-40.2	176.3	-60.2	168	0	0	0	111.1	L335 Y336 I337 L341 P342 A343 Q367 I384 L386 I727	L335-I339 HydrophobicContact CD1-CD1 4.24Å; L335-I339 HydrophobicContact CD1-CG1 4.45Å; L335-I339 HydrophobicContact CD2-CD1 4.21Å; L335-I339 HydrophobicContact CG-CD1 3.71Å; L335-I339 HydrophobicContact CG-CG1 4.3Å; L335-I339 WeakPolarHBondContact O-CB 3.08Å; L335-I339 WeakPolarHBondContact O-CG1 3.2Å; L335-I339 PolarHBondContact O-N 2.99Å; Y336-I339 PolarHBondContact O-N 3.26Å; I337-I339 VanDerWaalsContact C-N 3.26Å; I337-I339 PolarHBondContact O-N 3.13Å; I339-L341 PolarHBondContact O-N 3.34Å; I339-P342 WeakPolarHBondContact O-CD 3.49Å; I339-A343 WeakPolarHBondContact O-CB 2.93Å; I339-A343 PolarHBondContact O-N 3.26Å; I339-A343 VanDerWaalsContact O-N 3.09Å; I339-Q367 HydrophobicContact CG2-CG 3.87Å; I339-I384 HydrophobicContact CD1-CD1 4.22Å; I339-I384 HydrophobicContact CD1-CG2 3.55Å; I339-I384 HydrophobicContact CG1-CG2 3.94Å; I339-L386 HydrophobicContact CG2-CD1 4.07Å; I339-I727 HydrophobicContact CB-CD1 3.63Å; I339-I727 HydrophobicContact CD1-CD1 4.2Å; I339-I727 HydrophobicContact CG2-CD1 3.37Å
340	L	89.1	Confident	86	Confident	11 Å²	11	16.8 Å²	16.8	6%	0.058	9%	0.089	C	C	.	.	H	α-helix	trans	-60.2	-44	-177.4	178.8	63	0	0	0	112.3	Y336 I337 A343 I344 I364 S730 L738	Y336-L340 HydrophobicContact CE1-CD2 4.46Å; Y336-L340 HydrophobicContact CE2-CD2 3.88Å; Y336-L340 WeakPolarHBondContact O-CB 3.38Å; Y336-L340 PolarHBondContact O-N 3.28Å; Y336-L340 WeakPolarHBondContact OH-CD2 3.33Å; I337-L340 PolarHBondContact O-N 3.02Å; L340-A343 WeakPolarHBondContact O-CB 3.38Å; L340-A343 PolarHBondContact O-N 2.74Å; L340-I344 HydrophobicContact CD1-CD1 3.99Å; L340-I344 HydrophobicContact CD1-CG1 4.22Å; L340-I344 HydrophobicContact CG-CD1 3.86Å; L340-I344 HydrophobicContact CG-CG1 4.49Å; L340-I344 WeakPolarHBondContact O-CG1 3.24Å; L340-I344 PolarHBondContact O-N 2.9Å; L340-I364 HydrophobicContact CD1-CD1 4.08Å; L340-I364 HydrophobicContact CD1-CG1 4.32Å; L340-S730 WeakPolarHBondContact CD1-OG 3.44Å; L340-L738 HydrophobicContact CD1-CD2 4.39Å
341	L	86.4	Confident	86.4	Confident	7 Å²	7	14.1 Å²	14.1	4%	0.037	7%	0.073	C	C	.	.	H	α-helix	trans	-62.8	-51.6	-176.2	-71.6	176.7	0	0	0	113	I337 I339 A343 I344 A345 L576 V580 I741 L749	I337-L341 HydrophobicContact CG2-CD1 3.7Å; I337-L341 HydrophobicContact CG2-CG 4Å; I337-L341 WeakPolarHBondContact O-CG 3.43Å; I337-L341 PolarHBondContact O-N 3.33Å; I339-L341 PolarHBondContact O-N 3.34Å; L341-A343 VanDerWaalsContact C-N 3.33Å; L341-A343 PolarHBondContact O-N 3Å; L341-I344 PolarHBondContact O-N 3.1Å; L341-A345 PolarHBondContact O-N 3.31Å; L341-L576 HydrophobicContact CD1-CG 4.28Å; L341-V580 HydrophobicContact CD1-CB 4.08Å; L341-V580 HydrophobicContact CD1-CG1 4.3Å; L341-V580 HydrophobicContact CD1-CG2 3.9Å; L341-V580 HydrophobicContact CD2-CB 4.37Å; L341-V580 HydrophobicContact CD2-CG1 3.68Å; L341-I741 HydrophobicContact CD2-CD1 4.33Å; L341-L749 HydrophobicContact CB-CD1 4.44Å; L341-L749 HydrophobicContact CB-CD2 3.86Å
342	P	85.8	Confident	86.5	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-58.8	-38.3	169.6	-25.8	32.3	0	0	0	114	A338 I339 I344 A345 F346 L386 H686 I753	A338-P342 WeakPolarHBondContact O-CD 3.15Å; A338-P342 VanDerWaalsContact O-CG 3.26Å; A338-P342 WeakPolarHBondContact O-CG 3.4Å; I339-P342 WeakPolarHBondContact O-CD 3.49Å; P342-I344 VanDerWaalsContact C-N 3.29Å; P342-I344 PolarHBondContact O-N 3.45Å; P342-A345 PolarHBondContact O-N 2.67Å; P342-F346 HydrophobicContact CB-CD2 4.18Å; P342-F346 HydrophobicContact CB-CE2 4.15Å; P342-F346 WeakPolarHBondContact O-CB 3.42Å; P342-F346 WeakPolarHBondContact O-CD2 3.2Å; P342-F346 PolarHBondContact O-N 3.04Å; P342-L386 HydrophobicContact CB-CD2 3.81Å; P342-L386 HydrophobicContact CG-CD2 4.4Å; P342-H686 VanDerWaalsContact CG-CE1 3.48Å; P342-H686 WeakPolarHBondContact CG-CE1 3.26Å; P342-I753 HydrophobicContact CG-CD1 4.28Å
343	A	89.6	Confident	86.3	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.5	-39.5	178.3	0	0	0	0	0	111.5	I339 L340 L341 G347 T363 L386	I339-A343 WeakPolarHBondContact O-CB 2.93Å; I339-A343 PolarHBondContact O-N 3.26Å; I339-A343 VanDerWaalsContact O-N 3.09Å; L340-A343 WeakPolarHBondContact O-CB 3.38Å; L340-A343 PolarHBondContact O-N 2.74Å; L341-A343 VanDerWaalsContact C-N 3.33Å; L341-A343 PolarHBondContact O-N 3Å; A343-G347 PolarHBondContact O-N 3.31Å; A343-T363 WeakPolarHBondContact O-CG2 3.36Å; A343-L386 HydrophobicContact CB-CD1 4.22Å
344	I	89.1	Confident	86.4	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-67.3	-45.3	173.1	-65	165.7	0	0	0	110.9	L340 L341 P342 G347 S348 V360 I364 F599 L738 I741 L746	L340-I344 HydrophobicContact CD1-CD1 3.99Å; L340-I344 HydrophobicContact CD1-CG1 4.22Å; L340-I344 HydrophobicContact CG-CD1 3.86Å; L340-I344 HydrophobicContact CG-CG1 4.49Å; L340-I344 WeakPolarHBondContact O-CG1 3.24Å; L340-I344 PolarHBondContact O-N 2.9Å; L341-I344 PolarHBondContact O-N 3.1Å; P342-I344 VanDerWaalsContact C-N 3.29Å; P342-I344 PolarHBondContact O-N 3.45Å; I344-G347 PolarHBondContact O-N 2.98Å; I344-S348 WeakPolarHBondContact O-CB 2.83Å; I344-S348 PolarHBondContact O-N 3.38Å; I344-V360 HydrophobicContact CB-CG1 4.45Å; I344-V360 HydrophobicContact CG1-CG1 4.26Å; I344-V360 HydrophobicContact CG2-CG1 4.28Å; I344-I364 HydrophobicContact CG1-CD1 4.06Å; I344-F599 HydrophobicContact CG2-CD1 3.94Å; I344-F599 HydrophobicContact CG2-CE1 3.7Å; I344-F599 HydrophobicContact CG2-CZ 4.1Å; I344-L738 HydrophobicContact CD1-CD2 3.88Å; I344-L738 HydrophobicContact CD1-CG 4.27Å; I344-I741 HydrophobicContact CD1-CD1 4.33Å; I344-L746 HydrophobicContact CG2-CD1 3.93Å; I344-L746 HydrophobicContact CG2-CD2 4.29Å
345	A	86.1	Confident	86.5	Confident	4 Å²	4	21.9 Å²	21.9	3%	0.033	10%	0.101	C	C	.	.	H	α-helix	trans	-62.5	-46.8	-178.6	0	0	0	0	0	112.6	L341 P342 S348 L349 L746 L749 F750	L341-A345 PolarHBondContact O-N 3.31Å; P342-A345 PolarHBondContact O-N 2.67Å; A345-S348 PolarHBondContact O-N 2.85Å; A345-L349 PolarHBondContact O-N 2.7Å; A345-L746 HydrophobicContact CB-CB 4.04Å; A345-L746 HydrophobicContact CB-CD2 4.28Å; A345-L749 HydrophobicContact CB-CD2 4.08Å; A345-F750 HydrophobicContact CB-CD1 4.47Å; A345-F750 HydrophobicContact CB-CE1 3.54Å; A345-F750 HydrophobicContact CB-CE2 4.46Å; A345-F750 HydrophobicContact CB-CZ 3.53Å
346	F	86.6	Confident	86.3	Confident	6 Å²	6	22.8 Å²	22.8	3%	0.026	11%	0.11	C	C	.	.	H	α-helix	trans	-71.8	-34.1	175.6	-69.1	-57.1	0	0	0	112.7	P342 S348 L349 N350 T387 A389 F455 F750	P342-F346 HydrophobicContact CB-CD2 4.18Å; P342-F346 HydrophobicContact CB-CE2 4.15Å; P342-F346 WeakPolarHBondContact O-CB 3.42Å; P342-F346 WeakPolarHBondContact O-CD2 3.2Å; P342-F346 PolarHBondContact O-N 3.04Å; F346-S348 VanDerWaalsContact C-N 3.34Å; F346-L349 PolarHBondContact O-N 3.3Å; F346-N350 WeakPolarHBondContact O-CB 3.3Å; F346-N350 VanDerWaalsContact O-CG 3.24Å; F346-N350 PolarHBondContact O-N 3.41Å; F346-N350 PolarHBondContact O-ND2 3.47Å; F346-T387 WeakPolarHBondContact CD2-O 3.22Å; F346-T387 WeakPolarHBondContact CE2-O 3.45Å; F346-A389 HydrophobicContact CE1-CB 3.79Å; F346-A389 HydrophobicContact CZ-CB 4.22Å; F346-F455 AromaticContact CE1-CE1 3.85Å; F346-F455 HydrophobicContact CE1-CE1 3.85Å; F346-F455 AromaticContact CZ-CE1 3.45Å; F346-F455 HydrophobicContact CZ-CE1 3.45Å; F346-F455 VanDerWaalsContact CZ-CE1 3.45Å; F346-F455 AromaticContact CZ-CZ 3.77Å; F346-F455 HydrophobicContact CZ-CZ 3.77Å; F346-F750 HydrophobicContact CD1-CE1 4.39Å; F346-F750 HydrophobicContact CD1-CZ 4.26Å; F346-F750 HydrophobicContact CE1-CE1 4.1Å; F346-F750 HydrophobicContact CE1-CZ 4.26Å; F346-F750 HydrophobicContact CZ-CE1 4.32Å
347	G	89.1	Confident	86.1	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.4	-45.7	171.5	0	0	0	0	0	111.5	A343 I344 L349 N350 D351 T363	A343-G347 PolarHBondContact O-N 3.31Å; I344-G347 PolarHBondContact O-N 2.98Å; G347-L349 VanDerWaalsContact C-N 3.32Å; G347-L349 PolarHBondContact O-N 3.01Å; G347-N350 PolarHBondContact O-N 3.2Å; G347-D351 WeakPolarHBondContact O-CB 3.08Å; G347-D351 PolarHBondContact O-N 2.95Å; G347-T363 WeakPolarHBondContact CA-OG1 3.44Å
348	S	86.1	Confident	86.3	Confident	6 Å²	6	21.6 Å²	21.6	4%	0.042	11%	0.106	C	C	.	.	H	α-helix	trans	-67.1	-33.8	177.3	178.9	0	0	0	0	112.4	I344 A345 F346 E352 K743	I344-S348 WeakPolarHBondContact O-CB 2.83Å; I344-S348 PolarHBondContact O-N 3.38Å; A345-S348 PolarHBondContact O-N 2.85Å; F346-S348 VanDerWaalsContact C-N 3.34Å; S348-E352 PolarHBondContact O-N 3.23Å; S348-K743 VanDerWaalsContact OG-CE 3.28Å; S348-K743 WeakPolarHBondContact OG-CE 3.49Å
349	L	83.7	Confident	86.6	Confident	37 Å²	37	21.8 Å²	21.8	19%	0.194	11%	0.106	C	C	.	.	H	α-helix	trans	-70.6	-40	176.1	-176.6	62.7	0	0	0	111.5	A345 F346 G347 S353 A392	A345-L349 PolarHBondContact O-N 2.7Å; F346-L349 PolarHBondContact O-N 3.3Å; G347-L349 VanDerWaalsContact C-N 3.32Å; G347-L349 PolarHBondContact O-N 3.01Å; L349-S353 WeakPolarHBondContact O-CB 3.46Å; L349-S353 PolarHBondContact O-N 2.8Å; L349-S353 PolarHBondContact O-OG 2.98Å; L349-A392 HydrophobicContact CD2-CB 4.34Å
350	N	87.6	Confident	86.6	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-67.8	-39.8	175.9	-74.4	-20	0	0	0	111.4	F346 G347 E352 S353 T354 I358 A392	F346-N350 WeakPolarHBondContact O-CB 3.3Å; F346-N350 VanDerWaalsContact O-CG 3.24Å; F346-N350 PolarHBondContact O-N 3.41Å; F346-N350 PolarHBondContact O-ND2 3.47Å; G347-N350 PolarHBondContact O-N 3.2Å; N350-E352 PolarHBondContact O-N 3.48Å; N350-S353 PolarHBondContact O-N 2.6Å; N350-S353 VanDerWaalsContact O-N 3.17Å; N350-T354 VanDerWaalsContact O-CB 3.3Å; N350-T354 WeakPolarHBondContact O-CB 3.38Å; N350-T354 WeakPolarHBondContact O-CG2 3.14Å; N350-T354 PolarHBondContact O-N 3.43Å; N350-T354 PolarHBondContact O-OG1 3.37Å; N350-I358 CarbonylContact C-O 3.53Å; N350-I358 HydrophobicContact CB-CB 4.24Å; N350-I358 HydrophobicContact CB-CG2 3.88Å; N350-A392 WeakPolarHBondContact OD1-CA 3.35Å; N350-A392 VanDerWaalsContact OD1-CB 3.26Å; N350-A392 WeakPolarHBondContact OD1-CB 3.34Å
351	D	88.3	Confident	86.6	Confident	11 Å²	11	23.5 Å²	23.5	6%	0.059	11%	0.114	C	C	.	.	H	α-helix	trans	-56.3	-51.4	175.8	176.5	53.7	0	0	0	110.9	G347 S353 T354 R355 G356 I358 H602	G347-D351 WeakPolarHBondContact O-CB 3.08Å; G347-D351 PolarHBondContact O-N 2.95Å; D351-S353 VanDerWaalsContact C-N 3.31Å; D351-S353 PolarHBondContact O-N 2.92Å; D351-T354 PolarHBondContact O-N 2.86Å; D351-R355 WeakPolarHBondContact O-CA 3.26Å; D351-R355 PolarHBondContact O-N 3.26Å; D351-G356 PolarHBondContact O-N 3.2Å; D351-G356 VanDerWaalsContact O-N 3.11Å; D351-G356 VanDerWaalsContact OD1-CA 3.24Å; D351-G356 WeakPolarHBondContact OD1-CA 3.41Å; D351-I358 VanDerWaalsContact CA-O 3.27Å; D351-I358 WeakPolarHBondContact CA-O 3.34Å; D351-I358 PolarHBondContact N-O 2.84Å; D351-H602 IonicContact OD1-CE1 2.99Å; D351-H602 PolarHBondContact OD1-CE1 3.41Å; D351-H602 VanDerWaalsContact OD1-CE1 3.29Å; D351-H602 IonicContact OD1-ND1 3.85Å
352	E	83.3	Confident	86.7	Confident	61 Å²	61	24.2 Å²	24.2	29%	0.285	12%	0.117	S	C	.	.	H	α-helix	trans	-63.9	-34.9	176.8	-73.8	-170.8	-157.4	0	0	113.4	S348 N350 K465 K743	S348-E352 PolarHBondContact O-N 3.23Å; N350-E352 PolarHBondContact O-N 3.48Å; E352-K465 IonicContact OE2-NZ 3.68Å; E352-K465 PolarHBondContact OE2-NZ 3.47Å; E352-K743 IonicContact OE1-NZ 2.53Å; E352-K743 PolarHBondContact OE1-NZ 3.28Å
353	S	83.4	Confident	87	Confident	36 Å²	36	24.3 Å²	24.3	25%	0.252	12%	0.117	S	C	.	.	H	α-helix	trans	-80.8	-26.3	-177.6	-59.3	0	0	0	0	113	L349 N350 D351	L349-S353 WeakPolarHBondContact O-CB 3.46Å; L349-S353 PolarHBondContact O-N 2.8Å; L349-S353 PolarHBondContact O-OG 2.98Å; N350-S353 PolarHBondContact O-N 2.6Å; N350-S353 VanDerWaalsContact O-N 3.17Å; D351-S353 VanDerWaalsContact C-N 3.31Å; D351-S353 PolarHBondContact O-N 2.92Å
354	T	86.1	Confident	87.1	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-105.5	-3.1	-176.2	62.4	0	0	0	0	113.6	N350 D351 I358 I395 R399 F409	N350-T354 VanDerWaalsContact O-CB 3.3Å; N350-T354 WeakPolarHBondContact O-CB 3.38Å; N350-T354 WeakPolarHBondContact O-CG2 3.14Å; N350-T354 PolarHBondContact O-N 3.43Å; N350-T354 PolarHBondContact O-OG1 3.37Å; D351-T354 PolarHBondContact O-N 2.86Å; T354-I358 HydrophobicContact CG2-CB 4.29Å; T354-I358 HydrophobicContact CG2-CD1 4.36Å; T354-I358 HydrophobicContact CG2-CG1 4.35Å; T354-I358 PolarHBondContact OG1-N 2.82Å; T354-I395 HydrophobicContact CG2-CG2 3.6Å; T354-R399 PolarHBondContact O-NE 2.97Å; T354-F409 HydrophobicContact CG2-CZ 3.99Å
355	R	84.5	Confident	87.2	Confident	187 Å²	187	25.4 Å²	25.4	71%	0.706	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.9	40.4	-177.4	-47.2	178.2	-169.7	-123.5	9.2	112.9	D351 D403	D351-R355 WeakPolarHBondContact O-CA 3.26Å; D351-R355 PolarHBondContact O-N 3.26Å; R355-D403 IonicContact CZ-OD2 3.99Å; R355-D403 IonicContact NE-OD2 2.61Å; R355-D403 IonicContact NH2-OD2 2.8Å; R355-D403 PolarHBondContact NH2-OD2 3.33Å
356	G	83.6	Confident	87.5	Confident	19 Å²	19	25.2 Å²	25.2	20%	0.196	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.8	-6.9	177.7	0	0	0	0	0	116.3	D351	D351-G356 PolarHBondContact O-N 3.2Å; D351-G356 VanDerWaalsContact O-N 3.11Å; D351-G356 VanDerWaalsContact OD1-CA 3.24Å; D351-G356 WeakPolarHBondContact OD1-CA 3.41Å
357	E	84.9	Confident	87.9	Confident	64 Å²	64	25 Å²	25	30%	0.299	12%	0.121	S	C	.	.	S	Bend	trans	-71.9	-39.2	-179.2	-67.3	-63.5	167.3	0	0	112.4	K362 F409 K608	E357-K362 WeakPolarHBondContact O-CD 3.46Å; E357-K362 PolarHBondContact O-NZ 3.49Å; E357-F409 HydrophobicContact CB-CD1 3.81Å; E357-F409 HydrophobicContact CB-CE1 3.81Å; E357-F409 HydrophobicContact CG-CD1 4.05Å; E357-K608 IonicContact OE2-NZ 2.73Å
358	I	88.3	Confident	88.1	Confident	3 Å²	3	25.8 Å²	25.8	2%	0.015	13%	0.127	C	C	.	.	S	Bend	trans	-113.3	93.3	173.8	-59.9	-178.8	0	0	0	109.2	N350 D351 T354 I395 F409 Y413 P678	N350-I358 CarbonylContact C-O 3.53Å; N350-I358 HydrophobicContact CB-CB 4.24Å; N350-I358 HydrophobicContact CB-CG2 3.88Å; D351-I358 VanDerWaalsContact CA-O 3.27Å; D351-I358 WeakPolarHBondContact CA-O 3.34Å; D351-I358 PolarHBondContact N-O 2.84Å; T354-I358 HydrophobicContact CG2-CB 4.29Å; T354-I358 HydrophobicContact CG2-CD1 4.36Å; T354-I358 HydrophobicContact CG2-CG1 4.35Å; T354-I358 PolarHBondContact OG1-N 2.82Å; I358-I395 HydrophobicContact CD1-CD1 4.38Å; I358-I395 HydrophobicContact CD1-CG2 3.73Å; I358-F409 HydrophobicContact CD1-CE1 4.1Å; I358-F409 HydrophobicContact CD1-CZ 3.92Å; I358-F409 HydrophobicContact CG1-CE1 4.08Å; I358-F409 HydrophobicContact CG1-CZ 4.32Å; I358-Y413 HydrophobicContact CD1-CE2 3.99Å; I358-P678 HydrophobicContact CG2-CB 4.23Å; I358-P678 HydrophobicContact CG2-CG 4.33Å
359	D	88.8	Confident	88.5	Confident	6 Å²	6	28 Å²	28	3%	0.032	14%	0.138	C	C	.	.			trans	-90.8	169.8	-177.2	-156.4	0.1	0	0	0	113.4	Q361 K362 T363 S600 H602	D359-Q361 VanDerWaalsContact C-N 3.27Å; D359-Q361 PolarHBondContact O-N 3.46Å; D359-K362 PolarHBondContact O-N 2.88Å; D359-T363 PolarHBondContact O-N 3.05Å; D359-T363 PolarHBondContact O-OG1 3.2Å; D359-S600 VanDerWaalsContact OD1-O 3.13Å; D359-H602 IonicContact OD1-ND1 2.89Å; D359-H602 IonicContact OD2-CE1 3.69Å; D359-H602 IonicContact OD2-CG 3.96Å; D359-H602 PolarHBondContact OD2-N 2.88Å; D359-H602 IonicContact OD2-ND1 2.88Å; D359-H602 PolarHBondContact OD2-ND1 3.25Å
360	V	88.4	Confident	89	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-56.3	-41.2	176	177.8	0	0	0	0	111.4	I344 T363 I364 F599 L734	I344-V360 HydrophobicContact CB-CG1 4.45Å; I344-V360 HydrophobicContact CG1-CG1 4.26Å; I344-V360 HydrophobicContact CG2-CG1 4.28Å; V360-T363 WeakPolarHBondContact O-CB 3.47Å; V360-T363 PolarHBondContact O-N 3.38Å; V360-I364 HydrophobicContact CG1-CD1 3.99Å; V360-I364 HydrophobicContact CG1-CG1 4.47Å; V360-I364 WeakPolarHBondContact O-CG1 3.39Å; V360-I364 PolarHBondContact O-N 2.86Å; V360-F599 HydrophobicContact CB-CD2 4.09Å; V360-F599 HydrophobicContact CB-CE2 4.45Å; V360-F599 HydrophobicContact CG1-CD2 4.12Å; V360-F599 HydrophobicContact CG1-CE2 4.05Å; V360-F599 HydrophobicContact CG2-CB 4.03Å; V360-F599 HydrophobicContact CG2-CD2 3.74Å; V360-F599 HydrophobicContact CG2-CE2 4.49Å; V360-F599 HydrophobicContact CG2-CG 4.04Å; V360-L734 HydrophobicContact CG1-CD2 4.23Å
361	Q	88.9	Confident	89.3	Confident	46 Å²	46	26.2 Å²	26.2	22%	0.215	13%	0.128	C	C	.	.	H	α-helix	trans	-62.1	-46.4	178.8	-173.6	178.4	18.1	0	0	112	D359 T363 I364 V365 I606 L734	D359-Q361 VanDerWaalsContact C-N 3.27Å; D359-Q361 PolarHBondContact O-N 3.46Å; Q361-T363 PolarHBondContact O-N 3.23Å; Q361-I364 PolarHBondContact O-N 3.28Å; Q361-V365 WeakPolarHBondContact O-CG2 3.47Å; Q361-V365 PolarHBondContact O-N 3.38Å; Q361-I606 HydrophobicContact CG-CD1 4.39Å; Q361-I606 HydrophobicContact CG-CG1 4.44Å; Q361-L734 HydrophobicContact CB-CD1 3.9Å; Q361-L734 HydrophobicContact CG-CD1 3.77Å
362	K	89.7	Confident	89.6	Confident	22 Å²	22	27.3 Å²	27.3	10%	0.096	14%	0.136	C	C	.	.	H	α-helix	trans	-61.3	-36.6	175.7	-70.5	-175.3	-179.4	177.5	0	111.1	E357 D359 G366 L677	E357-K362 WeakPolarHBondContact O-CD 3.46Å; E357-K362 PolarHBondContact O-NZ 3.49Å; D359-K362 PolarHBondContact O-N 2.88Å; K362-G366 PolarHBondContact O-N 3.41Å; K362-L677 HydrophobicContact CB-CD2 3.99Å; K362-L677 HydrophobicContact CG-CD2 4.32Å
363	T	90.6	Very high	90.1	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-67.3	-43.2	177.8	-52.3	0	0	0	0	112.5	A343 G347 D359 V360 Q361 Q367 P678	A343-T363 WeakPolarHBondContact O-CG2 3.36Å; G347-T363 WeakPolarHBondContact CA-OG1 3.44Å; D359-T363 PolarHBondContact O-N 3.05Å; D359-T363 PolarHBondContact O-OG1 3.2Å; V360-T363 WeakPolarHBondContact O-CB 3.47Å; V360-T363 PolarHBondContact O-N 3.38Å; Q361-T363 PolarHBondContact O-N 3.23Å; T363-Q367 VanDerWaalsContact O-CB 3.22Å; T363-Q367 WeakPolarHBondContact O-CB 3.36Å; T363-Q367 PolarHBondContact O-N 3.42Å; T363-P678 HydrophobicContact CG2-CG 4.13Å
364	I	92	Very high	90.6	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67.4	-43.8	177.3	-68.4	173.4	0	0	0	111.5	L340 I344 V360 Q361 Q367 S368 I727 A731 L734 L738	L340-I364 HydrophobicContact CD1-CD1 4.08Å; L340-I364 HydrophobicContact CD1-CG1 4.32Å; I344-I364 HydrophobicContact CG1-CD1 4.06Å; V360-I364 HydrophobicContact CG1-CD1 3.99Å; V360-I364 HydrophobicContact CG1-CG1 4.47Å; V360-I364 WeakPolarHBondContact O-CG1 3.39Å; V360-I364 PolarHBondContact O-N 2.86Å; Q361-I364 PolarHBondContact O-N 3.28Å; I364-Q367 PolarHBondContact O-N 3.06Å; I364-S368 PolarHBondContact O-N 3.07Å; I364-I727 HydrophobicContact CG2-CG2 3.91Å; I364-A731 HydrophobicContact CG2-CB 4.05Å; I364-L734 HydrophobicContact CD1-CD1 4.13Å; I364-L734 HydrophobicContact CD1-CD2 3.84Å; I364-L734 HydrophobicContact CD1-CG 4.15Å; I364-L738 HydrophobicContact CD1-CD2 4.19Å
365	V	91.9	Very high	90.9	Very high	23 Å²	23	25.1 Å²	25.1	14%	0.139	12%	0.122	C	C	.	.	H	α-helix	trans	-65.2	-44.8	177.8	172.6	0	0	0	0	110.6	Q361 S368 I369 I606 F607 A731	Q361-V365 WeakPolarHBondContact O-CG2 3.47Å; Q361-V365 PolarHBondContact O-N 3.38Å; V365-S368 PolarHBondContact O-N 3.13Å; V365-I369 HydrophobicContact CG1-CD1 3.79Å; V365-I369 HydrophobicContact CG1-CG1 4.49Å; V365-I369 WeakPolarHBondContact O-CG1 3.4Å; V365-I369 PolarHBondContact O-N 3.12Å; V365-I606 HydrophobicContact CB-CG2 4.27Å; V365-I606 HydrophobicContact CG1-CG2 4.14Å; V365-I606 HydrophobicContact CG2-CG2 4.24Å; V365-F607 HydrophobicContact CG1-CE1 4.38Å; V365-F607 HydrophobicContact CG1-CZ 4.23Å; V365-A731 HydrophobicContact CG2-CB 4.34Å
366	G	92.4	Very high	91.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-54.6	-53.3	172.6	0	0	0	0	0	111.3	K362 S368 I369 G370 M680	K362-G366 PolarHBondContact O-N 3.41Å; G366-S368 VanDerWaalsContact C-N 3.31Å; G366-S368 PolarHBondContact O-N 3.37Å; G366-I369 PolarHBondContact O-N 3.09Å; G366-G370 PolarHBondContact O-N 3.23Å; G366-M680 VanDerWaalsContact C-CE 3.44Å; G366-M680 WeakPolarHBondContact O-CE 3.44Å
367	Q	94.3	Very high	91.6	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.009	12%	0.117	C	C	.	.	H	α-helix	trans	-53.7	-44.8	177.9	-179.2	57.4	35.7	0	0	112.7	I339 T363 I364 G371 P385 L386 I727	I339-Q367 HydrophobicContact CG2-CG 3.87Å; T363-Q367 VanDerWaalsContact O-CB 3.22Å; T363-Q367 WeakPolarHBondContact O-CB 3.36Å; T363-Q367 PolarHBondContact O-N 3.42Å; I364-Q367 PolarHBondContact O-N 3.06Å; Q367-G371 WeakPolarHBondContact O-CA 3.42Å; Q367-G371 PolarHBondContact O-N 3.26Å; Q367-P385 PolarHBondContact NE2-O 3.02Å; Q367-P385 PolarHBondContact OE1-O 3.28Å; Q367-L386 HydrophobicContact CG-CD1 4.44Å; Q367-L386 VanDerWaalsContact OE1-CD1 3.26Å; Q367-I727 HydrophobicContact CB-CG2 4.45Å; Q367-I727 HydrophobicContact CG-CD1 4.16Å; Q367-I727 HydrophobicContact CG-CG2 4.16Å
368	S	94.4	Very high	91.9	Very high	16 Å²	16	20.4 Å²	20.4	11%	0.112	10%	0.103	C	C	.	.	H	α-helix	trans	-65.3	-50.6	178.8	-176.1	0	0	0	0	111.7	I364 V365 G366 G371 V372 N724 G728	I364-S368 PolarHBondContact O-N 3.07Å; V365-S368 PolarHBondContact O-N 3.13Å; G366-S368 VanDerWaalsContact C-N 3.31Å; G366-S368 PolarHBondContact O-N 3.37Å; S368-G371 PolarHBondContact O-N 3.27Å; S368-V372 WeakPolarHBondContact O-CB 3.4Å; S368-V372 VanDerWaalsContact O-CG2 3.26Å; S368-V372 WeakPolarHBondContact O-CG2 3.32Å; S368-V372 PolarHBondContact O-N 2.92Å; S368-N724 PolarHBondContact OG-O 3.25Å; S368-G728 WeakPolarHBondContact OG-CA 3.43Å; S368-G728 PolarHBondContact OG-N 3.28Å
369	I	94.1	Very high	91.7	Very high	52 Å²	52	20.4 Å²	20.4	27%	0.267	10%	0.104	S	C	.	.	H	α-helix	trans	-62.4	-54	-176.6	-65.6	169.6	0	0	0	110.7	V365 G366 V372 I373 F607 L671 M672 L677	V365-I369 HydrophobicContact CG1-CD1 3.79Å; V365-I369 HydrophobicContact CG1-CG1 4.49Å; V365-I369 WeakPolarHBondContact O-CG1 3.4Å; V365-I369 PolarHBondContact O-N 3.12Å; G366-I369 PolarHBondContact O-N 3.09Å; I369-V372 PolarHBondContact O-N 3.39Å; I369-I373 HydrophobicContact CG2-CD1 3.89Å; I369-I373 VanDerWaalsContact O-CG1 3.3Å; I369-I373 WeakPolarHBondContact O-CG1 3.39Å; I369-I373 PolarHBondContact O-N 2.82Å; I369-I373 VanDerWaalsContact O-N 3.07Å; I369-F607 HydrophobicContact CD1-CE1 4.26Å; I369-F607 HydrophobicContact CD1-CZ 4.39Å; I369-L671 HydrophobicContact CG2-CD2 3.81Å; I369-M672 HydrophobicContact CB-CE 4.07Å; I369-M672 HydrophobicContact CG2-CE 3.73Å; I369-L677 HydrophobicContact CD1-CD1 4.25Å
370	G	93.4	Very high	91.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-71.9	-30.9	-177.4	0	0	0	0	0	112.9	G366 Y374 M680	G366-G370 PolarHBondContact O-N 3.23Å; G370-Y374 VanDerWaalsContact O-CB 3.24Å; G370-Y374 WeakPolarHBondContact O-CB 3.39Å; G370-Y374 PolarHBondContact O-N 3.06Å; G370-M680 VanDerWaalsContact C-SD 3.57Å; G370-M680 WeakPolarHBondContact CA-SD 3.46Å
371	G	93.3	Very high	91.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.6	-42.7	171.5	0	0	0	0	0	113.6	Q367 S368 Y374 S375 N724	Q367-G371 WeakPolarHBondContact O-CA 3.42Å; Q367-G371 PolarHBondContact O-N 3.26Å; S368-G371 PolarHBondContact O-N 3.27Å; G371-Y374 PolarHBondContact O-N 3Å; G371-S375 WeakPolarHBondContact O-CB 3.45Å; G371-S375 PolarHBondContact O-N 2.82Å; G371-S375 PolarHBondContact O-OG 2.77Å; G371-N724 PolarHBondContact O-ND2 3.31Å
372	V	95.2	Very high	91.3	Very high	35 Å²	35	18.1 Å²	18.1	21%	0.212	9%	0.093	C	C	.	.	H	α-helix	trans	-63.2	-49.3	174.8	167.9	0	0	0	0	110.5	S368 I369 Y374 S375 L376 L721 N724 I725	S368-V372 WeakPolarHBondContact O-CB 3.4Å; S368-V372 VanDerWaalsContact O-CG2 3.26Å; S368-V372 WeakPolarHBondContact O-CG2 3.32Å; S368-V372 PolarHBondContact O-N 2.92Å; I369-V372 PolarHBondContact O-N 3.39Å; V372-Y374 VanDerWaalsContact C-N 3.33Å; V372-Y374 PolarHBondContact O-N 3.37Å; V372-S375 PolarHBondContact O-N 2.92Å; V372-S375 PolarHBondContact O-OG 3.48Å; V372-L376 HydrophobicContact CG1-CD1 4.05Å; V372-L376 WeakPolarHBondContact O-CG 3.4Å; V372-L376 PolarHBondContact O-N 3.14Å; V372-L376 VanDerWaalsContact O-N 3.08Å; V372-L721 HydrophobicContact CG1-CD1 4.04Å; V372-L721 HydrophobicContact CG2-CD1 4.4Å; V372-N724 HydrophobicContact CG2-CB 3.95Å; V372-I725 HydrophobicContact CG2-CG1 4.07Å
373	I	94.9	Very high	91.3	Very high	48 Å²	48	17 Å²	17	25%	0.246	9%	0.089	C	C	.	.	H	α-helix	trans	-59.6	-45.7	178.6	-65.8	168	0	0	0	110.6	I369 L376 F377 L664 I668 L671	I369-I373 HydrophobicContact CG2-CD1 3.89Å; I369-I373 VanDerWaalsContact O-CG1 3.3Å; I369-I373 WeakPolarHBondContact O-CG1 3.39Å; I369-I373 PolarHBondContact O-N 2.82Å; I369-I373 VanDerWaalsContact O-N 3.07Å; I373-L376 PolarHBondContact O-N 2.8Å; I373-F377 HydrophobicContact CG2-CD2 4.12Å; I373-F377 WeakPolarHBondContact O-CD2 3.18Å; I373-F377 PolarHBondContact O-N 3.32Å; I373-L664 HydrophobicContact CG2-CD1 4.42Å; I373-I668 HydrophobicContact CB-CD1 4.47Å; I373-I668 HydrophobicContact CB-CG1 4.31Å; I373-I668 HydrophobicContact CG2-CD1 4.11Å; I373-I668 HydrophobicContact CG2-CG1 3.77Å; I373-L671 HydrophobicContact CD1-CD2 3.46Å; I373-L671 VanDerWaalsContact CD1-CD2 3.46Å
374	Y	93.8	Very high	91.3	Very high	1 Å²	1	17 Å²	17	0%	0.004	9%	0.088	C	C	.	.	H	α-helix	trans	-62.5	-46.7	177.9	-164.6	-87.5	0	0	0	111.4	G370 G371 V372 L376 F377 A378 V383 P385 Q638 L664 I668	G370-Y374 VanDerWaalsContact O-CB 3.24Å; G370-Y374 WeakPolarHBondContact O-CB 3.39Å; G370-Y374 PolarHBondContact O-N 3.06Å; G371-Y374 PolarHBondContact O-N 3Å; V372-Y374 VanDerWaalsContact C-N 3.33Å; V372-Y374 PolarHBondContact O-N 3.37Å; Y374-L376 VanDerWaalsContact C-N 3.26Å; Y374-L376 PolarHBondContact O-N 3.18Å; Y374-F377 PolarHBondContact O-N 3.37Å; Y374-A378 HydrophobicContact CD1-CB 3.63Å; Y374-A378 HydrophobicContact CD2-CB 4.47Å; Y374-A378 HydrophobicContact CE1-CB 3.45Å; Y374-A378 VanDerWaalsContact CE1-CB 3.45Å; Y374-A378 HydrophobicContact CE2-CB 4.34Å; Y374-A378 HydrophobicContact CG-CB 4.14Å; Y374-A378 WeakPolarHBondContact O-CA 3.33Å; Y374-A378 WeakPolarHBondContact O-CB 3.13Å; Y374-A378 PolarHBondContact O-N 3.44Å; Y374-V383 HydrophobicContact CE1-CB 4.03Å; Y374-V383 HydrophobicContact CE1-CG1 4.14Å; Y374-V383 VanDerWaalsContact CE1-O 3.29Å; Y374-V383 WeakPolarHBondContact CE1-O 3.16Å; Y374-P385 HydrophobicContact CD1-CG 4.19Å; Y374-P385 HydrophobicContact CD2-CB 4.45Å; Y374-P385 HydrophobicContact CD2-CG 4.43Å; Y374-P385 HydrophobicContact CG-CB 4.35Å; Y374-P385 HydrophobicContact CG-CG 3.86Å; Y374-Q638 PolarHBondContact OH-NE2 3.22Å; Y374-L664 HydrophobicContact CD2-CD2 4.08Å; Y374-L664 HydrophobicContact CD2-CG 4.47Å; Y374-L664 HydrophobicContact CE2-CD2 4.43Å; Y374-I668 HydrophobicContact CD2-CD1 3.81Å; Y374-I668 HydrophobicContact CG-CD1 4.33Å
375	S	92.3	Very high	91.3	Very high	1 Å²	1	17 Å²	17	1%	0.007	9%	0.089	C	C	.	.	H	α-helix	trans	-61.5	-32.3	-179.6	70.3	0	0	0	0	113.6	G371 V372 R717 L721	G371-S375 WeakPolarHBondContact O-CB 3.45Å; G371-S375 PolarHBondContact O-N 2.82Å; G371-S375 PolarHBondContact O-OG 2.77Å; V372-S375 PolarHBondContact O-N 2.92Å; V372-S375 PolarHBondContact O-OG 3.48Å; S375-R717 PolarHBondContact O-NH1 3.39Å; S375-L721 VanDerWaalsContact OG-CD1 3.31Å; S375-L721 WeakPolarHBondContact OG-CD1 3.45Å
376	L	91.6	Very high	91.3	Very high	53 Å²	53	16.1 Å²	16.1	28%	0.277	8%	0.083	S	C	.	.	H	α-helix	trans	-76.7	-48.5	177.1	-68.6	173.3	0	0	0	111.6	Y310 V372 I373 Y374 R717 L721	Y310-L376 WeakPolarHBondContact CE2-O 3.33Å; Y310-L376 PolarHBondContact OH-O 3.46Å; V372-L376 HydrophobicContact CG1-CD1 4.05Å; V372-L376 WeakPolarHBondContact O-CG 3.4Å; V372-L376 PolarHBondContact O-N 3.14Å; V372-L376 VanDerWaalsContact O-N 3.08Å; I373-L376 PolarHBondContact O-N 2.8Å; Y374-L376 VanDerWaalsContact C-N 3.26Å; Y374-L376 PolarHBondContact O-N 3.18Å; L376-R717 PolarHBondContact O-NH1 3.18Å; L376-L721 HydrophobicContact CD2-CD1 4.14Å; L376-L721 HydrophobicContact CD2-CD2 4.2Å; L376-L721 HydrophobicContact CG-CD1 4.21Å
377	F	91.6	Very high	91.1	Very high	117 Å²	117	16.2 Å²	16.2	51%	0.513	8%	0.083	S	C	.	.	H	α-helix	trans	-101.3	-12.3	-168.6	-64.2	-73.9	0	0	0	115	I373 Y374 W660 L664	I373-F377 HydrophobicContact CG2-CD2 4.12Å; I373-F377 WeakPolarHBondContact O-CD2 3.18Å; I373-F377 PolarHBondContact O-N 3.32Å; Y374-F377 PolarHBondContact O-N 3.37Å; F377-W660 PolarHBondContact O-NE1 3.43Å; F377-L664 VanDerWaalsContact C-CD2 3.49Å; F377-L664 HydrophobicContact CB-CD1 3.78Å; F377-L664 HydrophobicContact CB-CD2 3.89Å
378	A	89.8	Confident	90.6	Very high	1 Å²	1	17 Å²	17	1%	0.008	9%	0.089	C	C	.	.			trans	-62.2	145.1	-176.2	0	0	0	0	0	112.3	Y374 L664 R717	Y374-A378 HydrophobicContact CD1-CB 3.63Å; Y374-A378 HydrophobicContact CD2-CB 4.47Å; Y374-A378 HydrophobicContact CE1-CB 3.45Å; Y374-A378 VanDerWaalsContact CE1-CB 3.45Å; Y374-A378 HydrophobicContact CE2-CB 4.34Å; Y374-A378 HydrophobicContact CG-CB 4.14Å; Y374-A378 WeakPolarHBondContact O-CA 3.33Å; Y374-A378 WeakPolarHBondContact O-CB 3.13Å; Y374-A378 PolarHBondContact O-N 3.44Å; A378-L664 VanDerWaalsContact CA-CD2 3.44Å; A378-L664 HydrophobicContact CB-CD2 3.98Å; A378-L664 VanDerWaalsContact N-CD2 3.32Å; A378-R717 PolarHBondContact O-NH1 2.89Å; A378-R717 PolarHBondContact O-NH2 3.01Å
379	G	84.7	Confident	89.9	Confident	3 Å²	3	16.4 Å²	16.4	3%	0.031	8%	0.084	C	C	.	.	S	Bend	trans	-76.3	-31.4	168.4	0	0	0	0	0	112.1	R306 P381 D661	R306-G379 WeakPolarHBondContact CD-O 3.23Å; R306-G379 VanDerWaalsContact CZ-O 3.25Å; R306-G379 PolarHBondContact NE-O 2.88Å; R306-G379 VanDerWaalsContact NE-O 3.15Å; R306-G379 PolarHBondContact NH1-O 3.35Å; G379-P381 VanDerWaalsContact O-CD 3.27Å; G379-P381 WeakPolarHBondContact O-CD 3.38Å; G379-D661 WeakPolarHBondContact CA-OD1 3.41Å; G379-D661 PolarHBondContact N-OD1 3.46Å
380	S	86.4	Confident	89.3	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.075	C	C	.	.	S	Bend	trans	-106.6	89.4	172.7	-50.3	0	0	0	0	112	L382 V383 H646 D661	S380-L382 PolarHBondContact O-N 2.83Å; S380-V383 PolarHBondContact O-N 3.27Å; S380-H646 WeakPolarHBondContact CB-NE2 3.49Å; S380-H646 PolarHBondContact OG-NE2 3.18Å; S380-H646 VanDerWaalsContact OG-NE2 3.15Å; S380-D661 WeakPolarHBondContact CB-OD2 3.43Å; S380-D661 PolarHBondContact N-OD1 2.83Å; S380-D661 PolarHBondContact N-OD2 2.86Å; S380-D661 VanDerWaalsContact N-OD2 3.1Å; S380-D661 PolarHBondContact OG-OD2 3.44Å
381	P	83.6	Confident	88.9	Confident	3 Å²	3	14.5 Å²	14.5	2%	0.019	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-13.3	-171.9	30.3	-37.8	0	0	0	114.9	G379 V383 R717	G379-P381 VanDerWaalsContact O-CD 3.27Å; G379-P381 WeakPolarHBondContact O-CD 3.38Å; P381-V383 VanDerWaalsContact C-N 3.28Å; P381-R717 HydrophobicContact CB-CB 4.48Å; P381-R717 HydrophobicContact CB-CG 3.42Å; P381-R717 VanDerWaalsContact CB-CG 3.42Å; P381-R717 HydrophobicContact CG-CG 4.21Å
382	L	87.6	Confident	88.5	Confident	1 Å²	1	14.6 Å²	14.6	1%	0.005	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-22	175.2	-68	176.2	0	0	0	112.8	S380 T645 L652 H690 A691 L694 V713 E715	S380-L382 PolarHBondContact O-N 2.83Å; L382-T645 HydrophobicContact CB-CG2 3.98Å; L382-L652 HydrophobicContact CD1-CD1 4.04Å; L382-L652 HydrophobicContact CD1-CD2 3.65Å; L382-H690 PolarHBondContact O-ND1 2.86Å; L382-A691 HydrophobicContact CD1-CB 4.18Å; L382-L694 HydrophobicContact CD2-CD1 3.52Å; L382-V713 HydrophobicContact CD1-CG1 4.31Å; L382-E715 HydrophobicContact CD1-CG 4.21Å
383	V	90.1	Very high	87.9	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.076	C	C	.	.			trans	-79.1	137.1	-176.8	177.4	0	0	0	0	110.1	Y374 S380 P381 V641 I642 T645 A682	Y374-V383 HydrophobicContact CE1-CB 4.03Å; Y374-V383 HydrophobicContact CE1-CG1 4.14Å; Y374-V383 VanDerWaalsContact CE1-O 3.29Å; Y374-V383 WeakPolarHBondContact CE1-O 3.16Å; S380-V383 PolarHBondContact O-N 3.27Å; P381-V383 VanDerWaalsContact C-N 3.28Å; V383-V641 HydrophobicContact CG1-CG1 4.31Å; V383-I642 HydrophobicContact CG2-CG1 4.16Å; V383-T645 HydrophobicContact CG2-CG2 4.35Å; V383-A682 HydrophobicContact CG1-CB 3.26Å
384	I	90.8	Very high	87.5	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.066	C	C	.	.			trans	-113.9	122.1	-177.4	-65	161.9	0	0	0	109	L335 I339 A683 H686 S687 H690	L335-I384 HydrophobicContact CD1-CD1 3.25Å; L335-I384 HydrophobicContact CD2-CD1 3.83Å; L335-I384 HydrophobicContact CD2-CG1 4.5Å; L335-I384 HydrophobicContact CG-CD1 3.93Å; I339-I384 HydrophobicContact CD1-CD1 4.22Å; I339-I384 HydrophobicContact CD1-CG2 3.55Å; I339-I384 HydrophobicContact CG1-CG2 3.94Å; I384-A683 PolarHBondContact O-N 3.3Å; I384-H686 HydrophobicContact CD1-CB 4.26Å; I384-S687 PolarHBondContact N-OG 2.68Å; I384-H690 HydrophobicContact CD1-CB 3.75Å
385	P	91.8	Very high	87.2	Confident	2 Å²	2	12.9 Å²	12.9	1%	0.013	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	138.3	172.4	34.3	-35.8	0	0	0	110	Q367 Y374 M680 H681	Q367-P385 PolarHBondContact NE2-O 3.02Å; Q367-P385 PolarHBondContact OE1-O 3.28Å; Y374-P385 HydrophobicContact CD1-CG 4.19Å; Y374-P385 HydrophobicContact CD2-CB 4.45Å; Y374-P385 HydrophobicContact CD2-CG 4.43Å; Y374-P385 HydrophobicContact CG-CB 4.35Å; Y374-P385 HydrophobicContact CG-CG 3.86Å; P385-M680 HydrophobicContact CB-CB 4.44Å; P385-M680 HydrophobicContact CB-CG 4.43Å; P385-M680 HydrophobicContact CB-SD 3.89Å; P385-M680 HydrophobicContact CG-SD 4.2Å; P385-H681 CarbonylContact C-O 3.47Å; P385-H681 VanDerWaalsContact CA-O 3.25Å; P385-H681 WeakPolarHBondContact CA-O 3.31Å
386	L	90.6	Very high	86.9	Confident	3 Å²	3	14.9 Å²	14.9	2%	0.016	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	151.5	175.8	-178.2	65.4	0	0	0	110	I339 P342 A343 Q367 T388 H681 A683	I339-L386 HydrophobicContact CG2-CD1 4.07Å; P342-L386 HydrophobicContact CB-CD2 3.81Å; P342-L386 HydrophobicContact CG-CD2 4.4Å; A343-L386 HydrophobicContact CB-CD1 4.22Å; Q367-L386 HydrophobicContact CG-CD1 4.44Å; Q367-L386 VanDerWaalsContact OE1-CD1 3.26Å; L386-T388 PolarHBondContact O-N 3.2Å; L386-H681 PolarHBondContact N-O 3.43Å; L386-H681 PolarHBondContact O-N 2.89Å; L386-A683 HydrophobicContact CB-CB 3.82Å; L386-A683 HydrophobicContact CD2-CB 4.26Å
387	T	88.3	Confident	86.6	Confident	2 Å²	2	12.7 Å²	12.7	1%	0.012	7%	0.069	C	C	.	.			trans	-68.8	127.5	168.4	-54.6	0	0	0	0	109.7	F346 L391 W679	F346-T387 WeakPolarHBondContact CD2-O 3.22Å; F346-T387 WeakPolarHBondContact CE2-O 3.45Å; T387-L391 HydrophobicContact CG2-CD2 3.98Å; T387-L391 HydrophobicContact CG2-CG 4.47Å; T387-W679 PolarHBondContact OG1-O 3.32Å
388	T	85.1	Confident	86.5	Confident	20 Å²	20	7.2 Å²	7.2	12%	0.123	4%	0.044	C	C	.	.			trans	-109.2	167.4	-176.1	59.1	0	0	0	0	112.5	L386 L391 A392 H681 A683	L386-T388 PolarHBondContact O-N 3.2Å; T388-L391 WeakPolarHBondContact O-CB 3.38Å; T388-L391 PolarHBondContact O-N 3.44Å; T388-L391 VanDerWaalsContact O-N 3.15Å; T388-A392 PolarHBondContact O-N 2.92Å; T388-H681 VanDerWaalsContact CG2-CE1 3.45Å; T388-H681 WeakPolarHBondContact CG2-CE1 3.49Å; T388-H681 PolarHBondContact OG1-CE1 3.09Å; T388-H681 VanDerWaalsContact OG1-CE1 3.29Å; T388-H681 PolarHBondContact OG1-NE2 3.42Å; T388-A683 HydrophobicContact CG2-CB 4.23Å
389	A	79.4	Confident	86.5	Confident	2 Å²	2	8.9 Å²	8.9	2%	0.017	5%	0.05	C	C	.	.	H	α-helix	trans	-57.5	-45.3	179.5	0	0	0	0	0	113.8	F346 L391 A392 I393 F455	F346-A389 HydrophobicContact CE1-CB 3.79Å; F346-A389 HydrophobicContact CZ-CB 4.22Å; A389-L391 PolarHBondContact O-N 3.45Å; A389-A392 PolarHBondContact O-N 3.2Å; A389-A392 VanDerWaalsContact O-N 3.17Å; A389-I393 WeakPolarHBondContact O-CG1 3.29Å; A389-I393 PolarHBondContact O-N 3.34Å; A389-F455 HydrophobicContact CB-CD1 4.46Å; A389-F455 HydrophobicContact CB-CE1 3.97Å; A389-F455 HydrophobicContact CB-CZ 4.34Å
390	P	80.8	Confident	86.6	Confident	12 Å²	12	9.7 Å²	9.7	8%	0.078	6%	0.059	C	C	.	.	H	α-helix	trans	-58.3	-35.9	176.4	-25.7	36	0	0	0	112.9	F394 L633 F820	P390-F394 PolarHBondContact O-N 3.37Å; P390-L633 HydrophobicContact CB-CD1 4.01Å; P390-L633 HydrophobicContact CB-CD2 4Å; P390-L633 HydrophobicContact CB-CG 4.49Å; P390-F820 HydrophobicContact CB-CE1 4.23Å
391	L	86.5	Confident	86.6	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-70.2	-43.5	177.5	-169.3	63.8	0	0	0	111.7	T387 T388 A389 I393 F394 I395 L630 W679	T387-L391 HydrophobicContact CG2-CD2 3.98Å; T387-L391 HydrophobicContact CG2-CG 4.47Å; T388-L391 WeakPolarHBondContact O-CB 3.38Å; T388-L391 PolarHBondContact O-N 3.44Å; T388-L391 VanDerWaalsContact O-N 3.15Å; A389-L391 PolarHBondContact O-N 3.45Å; L391-I393 VanDerWaalsContact C-N 3.31Å; L391-I393 PolarHBondContact O-N 3.05Å; L391-F394 WeakPolarHBondContact O-CB 3.4Å; L391-F394 PolarHBondContact O-N 2.83Å; L391-F394 VanDerWaalsContact O-N 3.1Å; L391-I395 HydrophobicContact CG-CD1 4.45Å; L391-I395 VanDerWaalsContact O-CG1 3.28Å; L391-I395 WeakPolarHBondContact O-CG1 3.36Å; L391-I395 PolarHBondContact O-N 3.07Å; L391-L630 HydrophobicContact CD1-CD1 3.49Å; L391-L630 VanDerWaalsContact CD1-CD1 3.49Å; L391-W679 HydrophobicContact CD1-CB 4.35Å; L391-W679 HydrophobicContact CD1-CE3 3.77Å; L391-W679 HydrophobicContact CD2-CB 3.86Å; L391-W679 WeakPolarHBondContact CD2-O 3.4Å; L391-W679 HydrophobicContact CG-CE3 4.48Å
392	A	83.9	Confident	86.9	Confident	2 Å²	2	10.4 Å²	10.4	2%	0.017	6%	0.062	C	C	.	.	H	α-helix	trans	-59.4	-41.2	174.4	0	0	0	0	0	112.1	L349 N350 T388 A389 F394 I395 S396	L349-A392 HydrophobicContact CD2-CB 4.34Å; N350-A392 WeakPolarHBondContact OD1-CA 3.35Å; N350-A392 VanDerWaalsContact OD1-CB 3.26Å; N350-A392 WeakPolarHBondContact OD1-CB 3.34Å; T388-A392 PolarHBondContact O-N 2.92Å; A389-A392 PolarHBondContact O-N 3.2Å; A389-A392 VanDerWaalsContact O-N 3.17Å; A392-F394 VanDerWaalsContact C-N 3.33Å; A392-F394 PolarHBondContact O-N 3.29Å; A392-I395 PolarHBondContact O-N 3.32Å; A392-S396 PolarHBondContact O-N 2.95Å
393	I	82.2	Confident	86.9	Confident	39 Å²	39	13.6 Å²	13.6	20%	0.2	8%	0.079	C	C	.	.	H	α-helix	trans	-60.6	-44.9	173.3	-68.6	167.5	0	0	0	110.5	A389 L391 I395 S396 V397 K817	A389-I393 WeakPolarHBondContact O-CG1 3.29Å; A389-I393 PolarHBondContact O-N 3.34Å; L391-I393 VanDerWaalsContact C-N 3.31Å; L391-I393 PolarHBondContact O-N 3.05Å; I393-I395 VanDerWaalsContact C-N 3.34Å; I393-I395 PolarHBondContact O-N 3.03Å; I393-S396 WeakPolarHBondContact O-CB 3.45Å; I393-S396 PolarHBondContact O-N 3.29Å; I393-V397 VanDerWaalsContact O-CG2 3.29Å; I393-V397 WeakPolarHBondContact O-CG2 3.17Å; I393-V397 PolarHBondContact O-N 3.44Å; I393-K817 HydrophobicContact CG2-CB 4.2Å; I393-K817 HydrophobicContact CG2-CD 3.58Å; I393-K817 HydrophobicContact CG2-CG 4.47Å
394	F	86.7	Confident	86.8	Confident	10 Å²	10	18.5 Å²	18.5	4%	0.044	11%	0.106	C	C	.	.	H	α-helix	trans	-62.7	-40.8	178.8	-159.7	-93.5	0	0	0	111.9	P390 L391 A392 V397 I398 I416 L626 L629 L630 W679	P390-F394 PolarHBondContact O-N 3.37Å; L391-F394 WeakPolarHBondContact O-CB 3.4Å; L391-F394 PolarHBondContact O-N 2.83Å; L391-F394 VanDerWaalsContact O-N 3.1Å; A392-F394 VanDerWaalsContact C-N 3.33Å; A392-F394 PolarHBondContact O-N 3.29Å; F394-V397 WeakPolarHBondContact O-CB 3.41Å; F394-V397 PolarHBondContact O-N 3.18Å; F394-I398 HydrophobicContact CD1-CD1 3.66Å; F394-I398 HydrophobicContact CD1-CG1 4.13Å; F394-I398 HydrophobicContact CE1-CD1 3.73Å; F394-I398 HydrophobicContact CE1-CG1 4.11Å; F394-I398 WeakPolarHBondContact O-CG1 3.42Å; F394-I398 PolarHBondContact O-N 3.27Å; F394-I416 HydrophobicContact CE1-CG2 4.48Å; F394-L626 HydrophobicContact CZ-CB 4.39Å; F394-L626 HydrophobicContact CZ-CD2 4.34Å; F394-L626 WeakPolarHBondContact CZ-O 3.44Å; F394-L629 HydrophobicContact CE2-CB 4.27Å; F394-L629 HydrophobicContact CZ-CB 4.36Å; F394-L630 HydrophobicContact CD1-CB 4.36Å; F394-L630 HydrophobicContact CD1-CD1 3.87Å; F394-L630 HydrophobicContact CD1-CD2 4.46Å; F394-L630 HydrophobicContact CD1-CG 4.46Å; F394-L630 HydrophobicContact CE1-CB 3.76Å; F394-L630 HydrophobicContact CE1-CD1 4.14Å; F394-L630 HydrophobicContact CE1-CD2 4.26Å; F394-L630 HydrophobicContact CE1-CG 4.27Å; F394-L630 HydrophobicContact CG-CD1 4.28Å; F394-L630 HydrophobicContact CZ-CB 3.96Å; F394-W679 HydrophobicContact CD1-CZ3 4.39Å
395	I	88.5	Confident	86.6	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-45.5	174.6	-66.8	172.9	0	0	0	111.2	T354 I358 L391 A392 I393 V397 I398 R399 F409 Y413 W679	T354-I395 HydrophobicContact CG2-CG2 3.6Å; I358-I395 HydrophobicContact CD1-CD1 4.38Å; I358-I395 HydrophobicContact CD1-CG2 3.73Å; L391-I395 HydrophobicContact CG-CD1 4.45Å; L391-I395 VanDerWaalsContact O-CG1 3.28Å; L391-I395 WeakPolarHBondContact O-CG1 3.36Å; L391-I395 PolarHBondContact O-N 3.07Å; A392-I395 PolarHBondContact O-N 3.32Å; I393-I395 VanDerWaalsContact C-N 3.34Å; I393-I395 PolarHBondContact O-N 3.03Å; I395-V397 VanDerWaalsContact C-N 3.27Å; I395-V397 PolarHBondContact O-N 3.2Å; I395-I398 PolarHBondContact O-N 3.4Å; I395-R399 PolarHBondContact O-N 3.2Å; I395-F409 HydrophobicContact CG2-CZ 4.42Å; I395-Y413 HydrophobicContact CD1-CE2 4.47Å; I395-Y413 HydrophobicContact CG1-CE2 4.12Å; I395-W679 HydrophobicContact CD1-CE3 4.49Å; I395-W679 HydrophobicContact CG1-CE3 4.21Å; I395-W679 HydrophobicContact CG1-CZ3 4.05Å
396	S	84.8	Confident	86.3	Confident	43 Å²	43	33.1 Å²	33.1	30%	0.301	17%	0.173	S	C	.	.	H	α-helix	trans	-59.2	-39.4	175.6	176.2	0	0	0	0	112	A392 I393 R399 G400	A392-S396 PolarHBondContact O-N 2.95Å; I393-S396 WeakPolarHBondContact O-CB 3.45Å; I393-S396 PolarHBondContact O-N 3.29Å; S396-R399 PolarHBondContact O-N 3.45Å; S396-G400 PolarHBondContact O-N 3.48Å
397	V	86.6	Confident	86.1	Confident	7 Å²	7	34.9 Å²	34.9	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-66.8	-42.4	176.8	171.3	0	0	0	0	111.5	I393 F394 I395 R399 G400 I401 P814 K817 M818	I393-V397 VanDerWaalsContact O-CG2 3.29Å; I393-V397 WeakPolarHBondContact O-CG2 3.17Å; I393-V397 PolarHBondContact O-N 3.44Å; F394-V397 WeakPolarHBondContact O-CB 3.41Å; F394-V397 PolarHBondContact O-N 3.18Å; I395-V397 VanDerWaalsContact C-N 3.27Å; I395-V397 PolarHBondContact O-N 3.2Å; V397-R399 VanDerWaalsContact C-N 3.31Å; V397-R399 PolarHBondContact O-N 3.06Å; V397-G400 PolarHBondContact O-N 2.61Å; V397-I401 HydrophobicContact CG1-CD1 4.37Å; V397-I401 WeakPolarHBondContact O-CG1 3.2Å; V397-I401 PolarHBondContact O-N 3.19Å; V397-P814 HydrophobicContact CB-CB 4.5Å; V397-P814 HydrophobicContact CG1-CB 4.21Å; V397-P814 HydrophobicContact CG2-CB 4.06Å; V397-K817 HydrophobicContact CG2-CB 4.12Å; V397-K817 HydrophobicContact CG2-CD 4.38Å; V397-M818 HydrophobicContact CG1-CE 3.18Å; V397-M818 HydrophobicContact CG1-CG 3.65Å; V397-M818 HydrophobicContact CG1-SD 4.27Å
398	I	89.2	Confident	86.1	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-58.5	-44.9	174.2	-67.1	168.1	0	0	0	110.3	F394 I395 G400 I401 C402 F409 F412 I416 W679	F394-I398 HydrophobicContact CD1-CD1 3.66Å; F394-I398 HydrophobicContact CD1-CG1 4.13Å; F394-I398 HydrophobicContact CE1-CD1 3.73Å; F394-I398 HydrophobicContact CE1-CG1 4.11Å; F394-I398 WeakPolarHBondContact O-CG1 3.42Å; F394-I398 PolarHBondContact O-N 3.27Å; I395-I398 PolarHBondContact O-N 3.4Å; I398-G400 VanDerWaalsContact C-N 3.29Å; I398-G400 PolarHBondContact O-N 2.8Å; I398-I401 PolarHBondContact O-N 2.92Å; I398-C402 PolarHBondContact O-N 3.35Å; I398-C402 PolarHBondContact O-SG 2.93Å; I398-C402 VanDerWaalsContact O-SG 3.37Å; I398-F409 HydrophobicContact CG2-CD2 4.38Å; I398-F409 HydrophobicContact CG2-CE2 4.1Å; I398-F412 HydrophobicContact CG2-CD1 3.83Å; I398-F412 HydrophobicContact CG2-CE1 4.16Å; I398-I416 HydrophobicContact CD1-CD1 3.82Å; I398-I416 HydrophobicContact CD1-CG2 4.28Å; I398-I416 HydrophobicContact CG1-CD1 3.9Å; I398-I416 HydrophobicContact CG2-CD1 4.01Å; I398-W679 HydrophobicContact CD1-CH2 3.57Å; I398-W679 HydrophobicContact CD1-CZ3 3.82Å
399	R	88.6	Confident	86.3	Confident	36 Å²	36	37.1 Å²	37.1	14%	0.136	19%	0.193	C	C	.	.	H	α-helix	trans	-59.7	-40.9	177.1	-173.7	73.6	-170.9	83.3	4	112	T354 I395 S396 V397 C402 D403 F409	T354-R399 PolarHBondContact O-NE 2.97Å; I395-R399 PolarHBondContact O-N 3.2Å; S396-R399 PolarHBondContact O-N 3.45Å; V397-R399 VanDerWaalsContact C-N 3.31Å; V397-R399 PolarHBondContact O-N 3.06Å; R399-C402 WeakPolarHBondContact O-CB 3.38Å; R399-C402 PolarHBondContact O-N 3.14Å; R399-D403 IonicContact CZ-OD1 2.85Å; R399-D403 IonicContact CZ-OD2 4Å; R399-D403 IonicContact NH1-OD1 2.93Å; R399-D403 PolarHBondContact NH1-OD1 3.42Å; R399-D403 IonicContact NH1-OD2 3.49Å; R399-D403 IonicContact NH2-OD1 2.68Å; R399-D403 PolarHBondContact NH2-OD1 3.12Å; R399-D403 IonicContact NH2-OD2 3.73Å; R399-D403 PolarHBondContact O-N 3.09Å; R399-F409 HydrophobicContact CB-CD2 4.29Å; R399-F409 HydrophobicContact CB-CE2 4.01Å
400	G	87.1	Confident	86.7	Confident	20 Å²	20	37.6 Å²	37.6	21%	0.206	20%	0.195	C	C	.	.	H	α-helix	trans	-61.6	-42.3	175.3	0	0	0	0	0	112.9	S396 V397 I398 C402 D403 D404	S396-G400 PolarHBondContact O-N 3.48Å; V397-G400 PolarHBondContact O-N 2.61Å; I398-G400 VanDerWaalsContact C-N 3.29Å; I398-G400 PolarHBondContact O-N 2.8Å; G400-C402 VanDerWaalsContact C-N 3.34Å; G400-C402 PolarHBondContact O-N 3.48Å; G400-D403 PolarHBondContact O-N 3.35Å; G400-D404 PolarHBondContact O-N 3.08Å
401	I	87.6	Confident	87.2	Confident	17 Å²	17	37 Å²	37	9%	0.087	19%	0.192	C	C	.	.	H	α-helix	trans	-63.2	-42.7	174	-62	162.2	0	0	0	110.5	V397 I398 D403 D404 Y405 F412 L626 M818	V397-I401 HydrophobicContact CG1-CD1 4.37Å; V397-I401 WeakPolarHBondContact O-CG1 3.2Å; V397-I401 PolarHBondContact O-N 3.19Å; I398-I401 PolarHBondContact O-N 2.92Å; I401-D403 VanDerWaalsContact C-N 3.29Å; I401-D403 PolarHBondContact O-N 2.95Å; I401-D404 PolarHBondContact O-N 3.32Å; I401-Y405 HydrophobicContact CG2-CD2 3.74Å; I401-Y405 HydrophobicContact CG2-CE2 4.19Å; I401-Y405 WeakPolarHBondContact O-CD2 3.5Å; I401-Y405 PolarHBondContact O-N 3.37Å; I401-F412 HydrophobicContact CG2-CE1 4.17Å; I401-F412 HydrophobicContact CG2-CZ 4.46Å; I401-L626 HydrophobicContact CD1-CD1 3.68Å; I401-L626 HydrophobicContact CD1-CD2 4.23Å; I401-M818 HydrophobicContact CD1-CE 3.22Å; I401-M818 HydrophobicContact CG1-CE 3.63Å
402	C	88.3	Confident	87.4	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-61.3	-38.8	177.2	-69.6	0	0	0	0	112.2	I398 R399 G400 D406 L407 F412	I398-C402 PolarHBondContact O-N 3.35Å; I398-C402 PolarHBondContact O-SG 2.93Å; I398-C402 VanDerWaalsContact O-SG 3.37Å; R399-C402 WeakPolarHBondContact O-CB 3.38Å; R399-C402 PolarHBondContact O-N 3.14Å; G400-C402 VanDerWaalsContact C-N 3.34Å; G400-C402 PolarHBondContact O-N 3.48Å; C402-D406 CarbonylContact O-C 3.49Å; C402-D406 VanDerWaalsContact O-CA 3.28Å; C402-D406 WeakPolarHBondContact O-CA 3.49Å; C402-D406 PolarHBondContact O-N 3.18Å; C402-L407 HydrophobicContact CB-CB 4.39Å; C402-L407 WeakPolarHBondContact CB-O 3.49Å; C402-L407 PolarHBondContact O-N 2.95Å; C402-F412 VanDerWaalsContact SG-CD1 3.51Å
403	D	88.1	Confident	87.8	Confident	68 Å²	68	37.1 Å²	37.1	36%	0.364	19%	0.192	S	C	.	.	H	α-helix	trans	-67.8	-43.1	174.9	-82.9	-14.7	0	0	0	111.7	R355 R399 G400 I401 Y405	R355-D403 IonicContact CZ-OD2 3.99Å; R355-D403 IonicContact NE-OD2 2.61Å; R355-D403 IonicContact NH2-OD2 2.8Å; R355-D403 PolarHBondContact NH2-OD2 3.33Å; R399-D403 IonicContact CZ-OD1 2.85Å; R399-D403 IonicContact CZ-OD2 4Å; R399-D403 IonicContact NH1-OD1 2.93Å; R399-D403 PolarHBondContact NH1-OD1 3.42Å; R399-D403 IonicContact NH1-OD2 3.49Å; R399-D403 IonicContact NH2-OD1 2.68Å; R399-D403 PolarHBondContact NH2-OD1 3.12Å; R399-D403 IonicContact NH2-OD2 3.73Å; R399-D403 PolarHBondContact O-N 3.09Å; G400-D403 PolarHBondContact O-N 3.35Å; I401-D403 VanDerWaalsContact C-N 3.29Å; I401-D403 PolarHBondContact O-N 2.95Å; D403-Y405 VanDerWaalsContact C-N 3.33Å; D403-Y405 PolarHBondContact O-N 3.19Å
404	D	88.3	Confident	88.2	Confident	104 Å²	104	35.3 Å²	35.3	56%	0.556	18%	0.183	S	C	*	.	H	α-helix	trans	-66.6	-33	-178.9	-73.9	-12.4	0	0	0	113.1	G400 I401 Y815	G400-D404 PolarHBondContact O-N 3.08Å; I401-D404 PolarHBondContact O-N 3.32Å; D404-Y815 PolarHBondContact OD2-OH 3.47Å
405	Y	86.3	Confident	88.5	Confident	153 Å²	153	35.4 Å²	35.4	60%	0.6	18%	0.184	S	C	*	.	H	α-helix	trans	-111.9	7.7	-174.6	-68.7	-83.2	0	0	0	114	I401 D403 L407	I401-Y405 HydrophobicContact CG2-CD2 3.74Å; I401-Y405 HydrophobicContact CG2-CE2 4.19Å; I401-Y405 WeakPolarHBondContact O-CD2 3.5Å; I401-Y405 PolarHBondContact O-N 3.37Å; D403-Y405 VanDerWaalsContact C-N 3.33Å; D403-Y405 PolarHBondContact O-N 3.19Å; Y405-L407 VanDerWaalsContact C-N 3.35Å; Y405-L407 PolarHBondContact O-N 3.19Å
406	D	86.2	Confident	88.7	Confident	155 Å²	155	35.4 Å²	35.4	83%	0.829	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	49	-178.6	-160.3	34	0	0	0	113.3	C402	C402-D406 CarbonylContact O-C 3.49Å; C402-D406 VanDerWaalsContact O-CA 3.28Å; C402-D406 WeakPolarHBondContact O-CA 3.49Å; C402-D406 PolarHBondContact O-N 3.18Å
407	L	86.1	Confident	89.1	Confident	41 Å²	41	33.3 Å²	33.3	22%	0.215	17%	0.17	C	C	.	.			trans	-99.6	143.3	-178.4	-56.4	178.2	0	0	0	111.5	C402 Y405 F409 F412 T619	C402-L407 HydrophobicContact CB-CB 4.39Å; C402-L407 WeakPolarHBondContact CB-O 3.49Å; C402-L407 PolarHBondContact O-N 2.95Å; Y405-L407 VanDerWaalsContact C-N 3.35Å; Y405-L407 PolarHBondContact O-N 3.19Å; L407-F409 PolarHBondContact O-N 3.46Å; L407-F409 VanDerWaalsContact O-N 3.12Å; L407-F412 HydrophobicContact CD1-CD2 4.35Å; L407-F412 HydrophobicContact CD1-CE2 4.37Å; L407-F412 HydrophobicContact CD1-CG 4.48Å; L407-F412 HydrophobicContact CD1-CZ 4.47Å; L407-T619 HydrophobicContact CD1-CG2 3.97Å; L407-T619 HydrophobicContact CD2-CG2 3.59Å; L407-T619 HydrophobicContact CG-CG2 4.46Å
408	D	88.5	Confident	89.5	Confident	59 Å²	59	35.9 Å²	35.9	32%	0.316	18%	0.183	S	C	.	.			trans	-61.6	114.3	170.4	-174.9	7.2	0	0	0	110.4	D410 A411 F412 N614	D408-D410 PolarHBondContact O-N 3.38Å; D408-D410 PolarHBondContact OD1-N 2.96Å; D408-A411 HydrophobicContact CB-CB 4.23Å; D408-F412 VanDerWaalsContact O-CB 3.31Å; D408-F412 WeakPolarHBondContact O-CB 3.29Å; D408-F412 PolarHBondContact O-N 2.94Å; D408-N614 HydrophobicContact CB-CB 4.47Å; D408-N614 PolarHBondContact OD2-ND2 3.02Å
409	F	88.9	Confident	89.8	Confident	10 Å²	10	39.9 Å²	39.9	4%	0.044	20%	0.198	C	C	.	.	H	α-helix	trans	-61.8	-45.8	-173.9	174.2	-101.5	0	0	0	111.6	T354 E357 I358 I395 I398 R399 L407 A411 F412 Y413	T354-F409 HydrophobicContact CG2-CZ 3.99Å; E357-F409 HydrophobicContact CB-CD1 3.81Å; E357-F409 HydrophobicContact CB-CE1 3.81Å; E357-F409 HydrophobicContact CG-CD1 4.05Å; I358-F409 HydrophobicContact CD1-CE1 4.1Å; I358-F409 HydrophobicContact CD1-CZ 3.92Å; I358-F409 HydrophobicContact CG1-CE1 4.08Å; I358-F409 HydrophobicContact CG1-CZ 4.32Å; I395-F409 HydrophobicContact CG2-CZ 4.42Å; I398-F409 HydrophobicContact CG2-CD2 4.38Å; I398-F409 HydrophobicContact CG2-CE2 4.1Å; R399-F409 HydrophobicContact CB-CD2 4.29Å; R399-F409 HydrophobicContact CB-CE2 4.01Å; L407-F409 PolarHBondContact O-N 3.46Å; L407-F409 VanDerWaalsContact O-N 3.12Å; F409-A411 PolarHBondContact O-N 2.91Å; F409-F412 PolarHBondContact O-N 2.85Å; F409-Y413 HydrophobicContact CE2-CD2 4.45Å; F409-Y413 HydrophobicContact CZ-CD2 4.03Å; F409-Y413 HydrophobicContact CZ-CG 4.47Å; F409-Y413 WeakPolarHBondContact O-CB 3.42Å; F409-Y413 PolarHBondContact O-N 3.43Å
410	D	88.4	Confident	90.1	Very high	11 Å²	11	38.1 Å²	38.1	6%	0.059	19%	0.192	C	C	.	.	H	α-helix	trans	-66.2	-43.7	-174.9	-67.7	-48.4	0	0	0	111.9	D408 A414 K608	D408-D410 PolarHBondContact O-N 3.38Å; D408-D410 PolarHBondContact OD1-N 2.96Å; D410-A414 WeakPolarHBondContact O-CB 3.11Å; D410-A414 PolarHBondContact O-N 3.41Å; D410-K608 VanDerWaalsContact OD2-CD 3.26Å; D410-K608 WeakPolarHBondContact OD2-CD 3.45Å; D410-K608 WeakPolarHBondContact OD2-CE 3.18Å; D410-K608 IonicContact OD2-NZ 3.32Å; D410-K608 PolarHBondContact OD2-NZ 3.21Å
411	A	89.8	Confident	90.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.4	-46.8	178.1	0	0	0	0	0	111.2	D408 F409 A414 C415 A611 L615	D408-A411 HydrophobicContact CB-CB 4.23Å; F409-A411 PolarHBondContact O-N 2.91Å; A411-A414 PolarHBondContact O-N 3.42Å; A411-C415 WeakPolarHBondContact O-CB 3.37Å; A411-C415 PolarHBondContact O-N 3.16Å; A411-A611 WeakPolarHBondContact CB-O 3.33Å; A411-L615 HydrophobicContact CB-CD1 3.89Å; A411-L615 HydrophobicContact CB-CG 4.05Å
412	F	91.1	Very high	90.8	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.009	20%	0.2	C	C	.	.	H	α-helix	trans	-66.2	-42.1	179.7	-170.7	-121.1	0	0	0	111.9	I398 I401 C402 L407 D408 F409 C415 I416 L615 A623 L626	I398-F412 HydrophobicContact CG2-CD1 3.83Å; I398-F412 HydrophobicContact CG2-CE1 4.16Å; I401-F412 HydrophobicContact CG2-CE1 4.17Å; I401-F412 HydrophobicContact CG2-CZ 4.46Å; C402-F412 VanDerWaalsContact SG-CD1 3.51Å; L407-F412 HydrophobicContact CD1-CD2 4.35Å; L407-F412 HydrophobicContact CD1-CE2 4.37Å; L407-F412 HydrophobicContact CD1-CG 4.48Å; L407-F412 HydrophobicContact CD1-CZ 4.47Å; D408-F412 VanDerWaalsContact O-CB 3.31Å; D408-F412 WeakPolarHBondContact O-CB 3.29Å; D408-F412 PolarHBondContact O-N 2.94Å; F409-F412 PolarHBondContact O-N 2.85Å; F412-C415 PolarHBondContact O-N 3.03Å; F412-I416 HydrophobicContact CD1-CD1 3.72Å; F412-I416 HydrophobicContact CE1-CD1 3.49Å; F412-I416 VanDerWaalsContact CE1-CD1 3.49Å; F412-I416 HydrophobicContact CE1-CG1 4.49Å; F412-I416 HydrophobicContact CE2-CD1 4.31Å; F412-I416 HydrophobicContact CG-CD1 4.27Å; F412-I416 HydrophobicContact CZ-CD1 3.82Å; F412-I416 HydrophobicContact CZ-CG1 4.43Å; F412-I416 WeakPolarHBondContact O-CG1 3.38Å; F412-I416 PolarHBondContact O-N 3.26Å; F412-L615 HydrophobicContact CB-CD2 4.2Å; F412-L615 HydrophobicContact CD2-CD2 4.08Å; F412-A623 HydrophobicContact CD2-CB 4.36Å; F412-A623 HydrophobicContact CE2-CB 3.93Å; F412-L626 HydrophobicContact CE1-CD1 3.92Å; F412-L626 HydrophobicContact CZ-CD1 3.65Å
413	Y	91.8	Very high	91.1	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-56.6	-51.9	173.8	-177.4	-96.4	0	0	0	111.3	I358 I395 F409 C415 I416 G417 L677 P678 W679	I358-Y413 HydrophobicContact CD1-CE2 3.99Å; I395-Y413 HydrophobicContact CD1-CE2 4.47Å; I395-Y413 HydrophobicContact CG1-CE2 4.12Å; F409-Y413 HydrophobicContact CE2-CD2 4.45Å; F409-Y413 HydrophobicContact CZ-CD2 4.03Å; F409-Y413 HydrophobicContact CZ-CG 4.47Å; F409-Y413 WeakPolarHBondContact O-CB 3.42Å; F409-Y413 PolarHBondContact O-N 3.43Å; Y413-C415 VanDerWaalsContact C-N 3.33Å; Y413-C415 PolarHBondContact O-N 2.94Å; Y413-I416 PolarHBondContact O-N 2.96Å; Y413-G417 PolarHBondContact O-N 2.87Å; Y413-L677 PolarHBondContact OH-O 2.97Å; Y413-P678 WeakPolarHBondContact OH-CA 3.49Å; Y413-W679 HydrophobicContact CD1-CZ2 4.16Å; Y413-W679 AromaticContact CD2-CH2 3.57Å; Y413-W679 HydrophobicContact CD2-CH2 3.57Å; Y413-W679 AromaticContact CD2-CZ2 3.75Å; Y413-W679 HydrophobicContact CD2-CZ2 3.75Å; Y413-W679 HydrophobicContact CD2-CZ3 4.21Å; Y413-W679 AromaticContact CE1-CE2 3.84Å; Y413-W679 AromaticContact CE1-CZ2 3.87Å; Y413-W679 HydrophobicContact CE1-CZ2 3.87Å; Y413-W679 AromaticContact CE1-NE1 3.93Å; Y413-W679 HydrophobicContact CE2-CD2 4.11Å; Y413-W679 AromaticContact CE2-CE2 3.83Å; Y413-W679 AromaticContact CE2-CE3 3.9Å; Y413-W679 HydrophobicContact CE2-CE3 3.9Å; Y413-W679 AromaticContact CE2-CH2 3.25Å; Y413-W679 HydrophobicContact CE2-CH2 3.25Å; Y413-W679 AromaticContact CE2-CZ2 3.42Å; Y413-W679 HydrophobicContact CE2-CZ2 3.42Å; Y413-W679 VanDerWaalsContact CE2-CZ2 3.42Å; Y413-W679 AromaticContact CE2-CZ3 3.49Å; Y413-W679 HydrophobicContact CE2-CZ3 3.49Å; Y413-W679 VanDerWaalsContact CE2-CZ3 3.49Å; Y413-W679 HydrophobicContact CG-CH2 4.33Å; Y413-W679 HydrophobicContact CG-CZ2 4.09Å; Y413-W679 AromaticContact CZ-CD2 3.72Å; Y413-W679 AromaticContact CZ-CE2 3.42Å; Y413-W679 VanDerWaalsContact CZ-CE2 3.42Å; Y413-W679 AromaticContact CZ-CE3 3.96Å; Y413-W679 AromaticContact CZ-CH2 3.79Å; Y413-W679 AromaticContact CZ-CZ2 3.48Å; Y413-W679 VanDerWaalsContact CZ-CZ2 3.48Å; Y413-W679 AromaticContact CZ-NE1 3.89Å; Y413-W679 WeakPolarHBondContact O-CZ2 3.2Å; Y413-W679 PolarHBondContact OH-N 3.42Å
414	A	91.6	Very high	91.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-61.2	-41.5	178.4	0	0	0	0	0	112.3	D410 A411 G417 L418 P610 F612 S673	D410-A414 WeakPolarHBondContact O-CB 3.11Å; D410-A414 PolarHBondContact O-N 3.41Å; A411-A414 PolarHBondContact O-N 3.42Å; A414-G417 PolarHBondContact O-N 3.03Å; A414-L418 WeakPolarHBondContact O-CG 3.49Å; A414-L418 PolarHBondContact O-N 3.49Å; A414-P610 HydrophobicContact CB-CB 3.57Å; A414-P610 HydrophobicContact CB-CG 3.5Å; A414-F612 HydrophobicContact CB-CE1 3.89Å; A414-F612 HydrophobicContact CB-CZ 4Å; A414-S673 WeakPolarHBondContact CB-O 3.37Å
415	C	92.8	Very high	91.6	Very high	12 Å²	12	37.1 Å²	37.1	8%	0.081	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-46.8	178	-170.1	0	0	0	0	112.1	A411 F412 Y413 G417 L418 W419 L615 A623	A411-C415 WeakPolarHBondContact O-CB 3.37Å; A411-C415 PolarHBondContact O-N 3.16Å; F412-C415 PolarHBondContact O-N 3.03Å; Y413-C415 VanDerWaalsContact C-N 3.33Å; Y413-C415 PolarHBondContact O-N 2.94Å; C415-G417 VanDerWaalsContact C-N 3.3Å; C415-G417 PolarHBondContact O-N 3.27Å; C415-L418 PolarHBondContact O-N 3.14Å; C415-W419 PolarHBondContact O-N 2.89Å; C415-W419 VanDerWaalsContact O-N 3.12Å; C415-L615 HydrophobicContact CB-CD1 3.97Å; C415-A623 HydrophobicContact CB-CB 4.26Å
416	I	93.3	Very high	91.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.4	-44.6	175	-69.7	170.1	0	0	0	110.5	F394 I398 F412 Y413 L418 W419 N420 A623 L626 L630 W679	F394-I416 HydrophobicContact CE1-CG2 4.48Å; I398-I416 HydrophobicContact CD1-CD1 3.82Å; I398-I416 HydrophobicContact CD1-CG2 4.28Å; I398-I416 HydrophobicContact CG1-CD1 3.9Å; I398-I416 HydrophobicContact CG2-CD1 4.01Å; F412-I416 HydrophobicContact CD1-CD1 3.72Å; F412-I416 HydrophobicContact CE1-CD1 3.49Å; F412-I416 VanDerWaalsContact CE1-CD1 3.49Å; F412-I416 HydrophobicContact CE1-CG1 4.49Å; F412-I416 HydrophobicContact CE2-CD1 4.31Å; F412-I416 HydrophobicContact CG-CD1 4.27Å; F412-I416 HydrophobicContact CZ-CD1 3.82Å; F412-I416 HydrophobicContact CZ-CG1 4.43Å; F412-I416 WeakPolarHBondContact O-CG1 3.38Å; F412-I416 PolarHBondContact O-N 3.26Å; Y413-I416 PolarHBondContact O-N 2.96Å; I416-L418 PolarHBondContact O-N 2.86Å; I416-W419 PolarHBondContact O-N 2.66Å; I416-N420 VanDerWaalsContact O-CB 3.26Å; I416-N420 WeakPolarHBondContact O-CB 3.43Å; I416-N420 PolarHBondContact O-N 3.47Å; I416-A623 HydrophobicContact CG1-CB 3.8Å; I416-L626 HydrophobicContact CD1-CB 4.03Å; I416-L626 HydrophobicContact CD1-CD1 3.76Å; I416-L626 HydrophobicContact CG1-CB 4.14Å; I416-L626 HydrophobicContact CG2-CB 4.33Å; I416-L630 HydrophobicContact CG2-CD2 3.99Å; I416-W679 HydrophobicContact CB-CH2 4.47Å; I416-W679 HydrophobicContact CG2-CH2 3.99Å; I416-W679 HydrophobicContact CG2-CZ2 4.36Å
417	G	93.6	Very high	92	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.5	-36.6	-179.6	0	0	0	0	0	114	Y413 A414 C415 N420 S421 S673	Y413-G417 PolarHBondContact O-N 2.87Å; A414-G417 PolarHBondContact O-N 3.03Å; C415-G417 VanDerWaalsContact C-N 3.3Å; C415-G417 PolarHBondContact O-N 3.27Å; G417-N420 WeakPolarHBondContact O-CB 3.47Å; G417-S421 WeakPolarHBondContact O-CB 3.33Å; G417-S421 PolarHBondContact O-N 3.05Å; G417-S421 PolarHBondContact O-OG 2.98Å; G417-S673 VanDerWaalsContact CA-OG 3.24Å; G417-S673 WeakPolarHBondContact CA-OG 3.38Å
418	L	93.7	Very high	92	Very high	61 Å²	61	23.8 Å²	23.8	32%	0.319	12%	0.115	S	C	.	.	H	α-helix	trans	-67.4	-45.3	174.1	-70.8	175.8	0	0	0	112.1	A414 C415 I416 S421 F422 F612 I670	A414-L418 WeakPolarHBondContact O-CG 3.49Å; A414-L418 PolarHBondContact O-N 3.49Å; C415-L418 PolarHBondContact O-N 3.14Å; I416-L418 PolarHBondContact O-N 2.86Å; L418-S421 PolarHBondContact O-N 2.99Å; L418-F422 PolarHBondContact O-N 2.8Å; L418-F612 HydrophobicContact CD1-CE1 3.97Å; L418-F612 HydrophobicContact CD1-CZ 3.77Å; L418-I670 HydrophobicContact CD2-CG2 4.02Å
419	W	95.3	Very high	92	Very high	84 Å²	84	23.9 Å²	23.9	32%	0.318	12%	0.116	S	C	.	.	H	α-helix	trans	-64	-41.8	175.2	-76	115.8	0	0	0	112.2	C415 I416 S421 F422 F423 V624	C415-W419 PolarHBondContact O-N 2.89Å; C415-W419 VanDerWaalsContact O-N 3.12Å; I416-W419 PolarHBondContact O-N 2.66Å; W419-S421 VanDerWaalsContact C-N 3.33Å; W419-S421 PolarHBondContact O-N 3.19Å; W419-F422 HydrophobicContact CE3-CD1 4.19Å; W419-F422 HydrophobicContact CZ3-CD1 4.29Å; W419-F422 WeakPolarHBondContact O-CB 3.28Å; W419-F422 PolarHBondContact O-N 3.5Å; W419-F423 HydrophobicContact CB-CE2 4.48Å; W419-F423 WeakPolarHBondContact O-CD2 3.46Å; W419-F423 PolarHBondContact O-N 2.82Å; W419-V624 HydrophobicContact CD2-CB 4.5Å; W419-V624 HydrophobicContact CD2-CG2 3.7Å; W419-V624 VanDerWaalsContact CE2-CG2 3.46Å; W419-V624 HydrophobicContact CE3-CG2 4.19Å; W419-V624 HydrophobicContact CG-CG2 4.09Å; W419-V624 HydrophobicContact CH2-CG2 4.27Å; W419-V624 HydrophobicContact CZ2-CG2 3.78Å; W419-V624 HydrophobicContact CZ3-CG2 4.45Å
420	N	94.6	Very high	92	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-54	-51.4	171.6	163.6	50.1	0	0	0	111.2	I416 G417 F422 F423 L424 G627 L630 A631 I634	I416-N420 VanDerWaalsContact O-CB 3.26Å; I416-N420 WeakPolarHBondContact O-CB 3.43Å; I416-N420 PolarHBondContact O-N 3.47Å; G417-N420 WeakPolarHBondContact O-CB 3.47Å; N420-F422 VanDerWaalsContact C-N 3.32Å; N420-F422 PolarHBondContact O-N 3.49Å; N420-F423 PolarHBondContact O-N 3.08Å; N420-F423 VanDerWaalsContact O-N 3.16Å; N420-L424 WeakPolarHBondContact O-CG 3.38Å; N420-L424 PolarHBondContact O-N 2.87Å; N420-L424 WeakPolarHBondContact OD1-CD1 3.39Å; N420-G627 WeakPolarHBondContact CA-O 3.45Å; N420-L630 HydrophobicContact CB-CB 4.3Å; N420-L630 HydrophobicContact CB-CD2 3.88Å; N420-L630 HydrophobicContact CB-CG 4.14Å; N420-A631 WeakPolarHBondContact OD1-CA 3.47Å; N420-A631 WeakPolarHBondContact OD1-CB 3.48Å; N420-A631 PolarHBondContact OD1-N 2.84Å; N420-A631 VanDerWaalsContact OD1-N 3.08Å; N420-I634 WeakPolarHBondContact ND2-CD1 3.27Å
421	S	94.8	Very high	91.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-38.1	-179.2	-56.5	0	0	0	0	112.6	G417 L418 W419 L424 I425 G666 N669 I670	G417-S421 WeakPolarHBondContact O-CB 3.33Å; G417-S421 PolarHBondContact O-N 3.05Å; G417-S421 PolarHBondContact O-OG 2.98Å; L418-S421 PolarHBondContact O-N 2.99Å; W419-S421 VanDerWaalsContact C-N 3.33Å; W419-S421 PolarHBondContact O-N 3.19Å; S421-L424 PolarHBondContact O-N 3.13Å; S421-I425 VanDerWaalsContact O-CG1 3.31Å; S421-I425 WeakPolarHBondContact O-CG1 3.41Å; S421-I425 PolarHBondContact O-N 3.16Å; S421-G666 WeakPolarHBondContact CB-O 3.37Å; S421-G666 PolarHBondContact OG-O 3.46Å; S421-N669 WeakPolarHBondContact OG-CB 2.97Å; S421-I670 PolarHBondContact OG-N 3.32Å
422	F	95.2	Very high	91.3	Very high	106 Å²	106	29.7 Å²	29.7	47%	0.465	15%	0.145	S	C	.	.	H	α-helix	trans	-57.9	-48.4	172.7	173.6	-101.5	0	0	0	111.5	L418 W419 N420 L424 I425 L426	L418-F422 PolarHBondContact O-N 2.8Å; W419-F422 HydrophobicContact CE3-CD1 4.19Å; W419-F422 HydrophobicContact CZ3-CD1 4.29Å; W419-F422 WeakPolarHBondContact O-CB 3.28Å; W419-F422 PolarHBondContact O-N 3.5Å; N420-F422 VanDerWaalsContact C-N 3.32Å; N420-F422 PolarHBondContact O-N 3.49Å; F422-L424 PolarHBondContact O-N 2.95Å; F422-I425 PolarHBondContact O-N 3.31Å; F422-L426 HydrophobicContact CE1-CD2 4.2Å; F422-L426 HydrophobicContact CZ-CD2 4.38Å; F422-L426 VanDerWaalsContact O-CB 3.28Å; F422-L426 WeakPolarHBondContact O-CB 3.38Å; F422-L426 PolarHBondContact O-N 2.74Å
423	F	94.8	Very high	90.6	Very high	49 Å²	49	29.8 Å²	29.8	22%	0.215	15%	0.145	C	C	.	.	H	α-helix	trans	-65.6	-36.4	177.7	-69.2	-56.4	0	0	0	113.2	W419 N420 L426 G427 V624 F628 A631	W419-F423 HydrophobicContact CB-CE2 4.48Å; W419-F423 WeakPolarHBondContact O-CD2 3.46Å; W419-F423 PolarHBondContact O-N 2.82Å; N420-F423 PolarHBondContact O-N 3.08Å; N420-F423 VanDerWaalsContact O-N 3.16Å; F423-L426 PolarHBondContact O-N 3Å; F423-G427 PolarHBondContact O-N 3.45Å; F423-V624 HydrophobicContact CE2-CG1 4.23Å; F423-V624 HydrophobicContact CZ-CG1 3.98Å; F423-F628 HydrophobicContact CD1-CD2 4.27Å; F423-F628 HydrophobicContact CD2-CB 4Å; F423-F628 HydrophobicContact CD2-CD2 4.29Å; F423-F628 HydrophobicContact CE1-CD2 4.3Å; F423-F628 HydrophobicContact CE2-CB 3.67Å; F423-F628 HydrophobicContact CE2-CD2 4.32Å; F423-F628 HydrophobicContact CG-CD2 4.28Å; F423-F628 HydrophobicContact CZ-CB 4.2Å; F423-F628 HydrophobicContact CZ-CD2 4.32Å; F423-A631 HydrophobicContact CB-CB 3.58Å; F423-A631 HydrophobicContact CD2-CB 4.47Å; F423-A631 HydrophobicContact CG-CB 4.46Å
424	L	93.6	Very high	89.8	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.016	15%	0.154	C	C	.	.	H	α-helix	trans	-65.3	-45.2	176	-68.5	173.3	0	0	0	112	N420 S421 F422 L426 G427 G428 A631 I634 F635 L662	N420-L424 WeakPolarHBondContact O-CG 3.38Å; N420-L424 PolarHBondContact O-N 2.87Å; N420-L424 WeakPolarHBondContact OD1-CD1 3.39Å; S421-L424 PolarHBondContact O-N 3.13Å; F422-L424 PolarHBondContact O-N 2.95Å; L424-L426 VanDerWaalsContact C-N 3.33Å; L424-G427 PolarHBondContact O-N 2.75Å; L424-G428 PolarHBondContact O-N 3.49Å; L424-A631 HydrophobicContact CD2-CB 4.22Å; L424-A631 WeakPolarHBondContact CD2-O 3.01Å; L424-A631 HydrophobicContact CG-CB 4.17Å; L424-I634 HydrophobicContact CD1-CB 4.31Å; L424-I634 HydrophobicContact CD1-CD1 4.37Å; L424-I634 HydrophobicContact CD1-CG2 3.77Å; L424-I634 HydrophobicContact CD2-CB 4.19Å; L424-I634 HydrophobicContact CD2-CG2 3.92Å; L424-F635 HydrophobicContact CD2-CB 4.34Å; L424-L662 HydrophobicContact CD2-CD1 3.78Å
425	I	93.6	Very high	89.1	Confident	31 Å²	31	33.3 Å²	33.3	16%	0.159	16%	0.164	C	C	.	.	H	α-helix	trans	-63	-43.6	175.9	-67.6	167	0	0	0	110	S421 F422 G427 G428 L429 M663 F667 I670	S421-I425 VanDerWaalsContact O-CG1 3.31Å; S421-I425 WeakPolarHBondContact O-CG1 3.41Å; S421-I425 PolarHBondContact O-N 3.16Å; F422-I425 PolarHBondContact O-N 3.31Å; I425-G427 VanDerWaalsContact C-N 3.3Å; I425-G427 PolarHBondContact O-N 3.35Å; I425-G428 PolarHBondContact O-N 3.29Å; I425-L429 HydrophobicContact CG2-CD1 4.07Å; I425-L429 HydrophobicContact CG2-CG 4.5Å; I425-L429 WeakPolarHBondContact O-CG 3.44Å; I425-L429 PolarHBondContact O-N 3.5Å; I425-M663 HydrophobicContact CG1-CG 4.42Å; I425-M663 HydrophobicContact CG2-CG 4.47Å; I425-F667 HydrophobicContact CD1-CD1 3.94Å; I425-F667 HydrophobicContact CD1-CE1 3.76Å; I425-F667 HydrophobicContact CD1-CZ 4.34Å; I425-I670 HydrophobicContact CD1-CD1 3.91Å
426	L	92.2	Very high	88.1	Confident	59 Å²	59	32.9 Å²	32.9	31%	0.309	16%	0.16	S	C	.	.	H	α-helix	trans	-60.7	-40.9	176.1	-159.4	65.6	0	0	0	111.6	F422 F423 L424 L429 F430	F422-L426 HydrophobicContact CE1-CD2 4.2Å; F422-L426 HydrophobicContact CZ-CD2 4.38Å; F422-L426 VanDerWaalsContact O-CB 3.28Å; F422-L426 WeakPolarHBondContact O-CB 3.38Å; F422-L426 PolarHBondContact O-N 2.74Å; F423-L426 PolarHBondContact O-N 3Å; L424-L426 VanDerWaalsContact C-N 3.33Å; L426-L429 PolarHBondContact O-N 3.42Å; L426-F430 HydrophobicContact CD1-CD2 3.86Å; L426-F430 HydrophobicContact CD1-CE2 3.37Å; L426-F430 HydrophobicContact CD1-CZ 4.41Å; L426-F430 HydrophobicContact CD2-CE2 4.37Å; L426-F430 HydrophobicContact CG-CD2 3.74Å; L426-F430 HydrophobicContact CG-CE2 3.68Å; L426-F430 WeakPolarHBondContact O-CD2 3.41Å; L426-F430 PolarHBondContact O-N 2.97Å
427	G	88.6	Confident	87.1	Confident	9 Å²	9	35.2 Å²	35.2	9%	0.093	17%	0.17	C	C	.	.	H	α-helix	trans	-63	-40.6	175.5	0	0	0	0	0	113.2	F423 L424 I425 V432	F423-G427 PolarHBondContact O-N 3.45Å; L424-G427 PolarHBondContact O-N 2.75Å; I425-G427 VanDerWaalsContact C-N 3.3Å; I425-G427 PolarHBondContact O-N 3.35Å; G427-V432 WeakPolarHBondContact O-CB 3.42Å; G427-V432 PolarHBondContact O-N 3.07Å
428	G	86.9	Confident	86.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-42.1	172.7	0	0	0	0	0	112.5	V299 L424 I425	V299-G428 WeakPolarHBondContact CG2-O 3.49Å; L424-G428 PolarHBondContact O-N 3.49Å; I425-G428 PolarHBondContact O-N 3.29Å
429	L	88.5	Confident	85.4	Confident	62 Å²	62	35.4 Å²	35.4	33%	0.325	17%	0.171	S	C	.	.	H	α-helix	trans	-68	-40.9	-179.8	-72.2	171.7	0	0	0	113.4	A295 G296 I425 L426 N431	A295-L429 CarbonylContact C-O 3.6Å; A295-L429 VanDerWaalsContact CA-O 3.31Å; A295-L429 WeakPolarHBondContact CA-O 3.5Å; G296-L429 PolarHBondContact N-O 3Å; I425-L429 HydrophobicContact CG2-CD1 4.07Å; I425-L429 HydrophobicContact CG2-CG 4.5Å; I425-L429 WeakPolarHBondContact O-CG 3.44Å; I425-L429 PolarHBondContact O-N 3.5Å; L426-L429 PolarHBondContact O-N 3.42Å; L429-N431 VanDerWaalsContact C-N 3.31Å; L429-N431 PolarHBondContact O-N 2.89Å
430	F	87.6	Confident	84.7	Confident	85 Å²	85	33.5 Å²	33.5	37%	0.373	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	21.1	-178.6	-70.6	-63.3	0	0	0	114.6	F292 A295 L426 V432	F292-F430 WeakPolarHBondContact CA-O 3.36Å; F292-F430 CarbonylContact O-C 3.58Å; A295-F430 HydrophobicContact CB-CD1 4.35Å; A295-F430 HydrophobicContact CB-CE1 4.22Å; L426-F430 HydrophobicContact CD1-CD2 3.86Å; L426-F430 HydrophobicContact CD1-CE2 3.37Å; L426-F430 HydrophobicContact CD1-CZ 4.41Å; L426-F430 HydrophobicContact CD2-CE2 4.37Å; L426-F430 HydrophobicContact CG-CD2 3.74Å; L426-F430 HydrophobicContact CG-CE2 3.68Å; L426-F430 WeakPolarHBondContact O-CD2 3.41Å; L426-F430 PolarHBondContact O-N 2.97Å; F430-V432 HydrophobicContact CB-CG2 4.14Å; F430-V432 PolarHBondContact O-N 2.93Å; F430-V432 VanDerWaalsContact O-N 3.08Å
431	N	82.2	Confident	83.9	Confident	9 Å²	9	34.8 Å²	34.8	5%	0.048	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	34	-179.6	-48.9	-40.8	0	0	0	113.5	D291 F292 R294 G298 L429 S433 L434 H659	D291-N431 PolarHBondContact O-ND2 2.61Å; D291-N431 VanDerWaalsContact O-ND2 3.08Å; F292-N431 WeakPolarHBondContact CD1-O 3.44Å; R294-N431 PolarHBondContact O-ND2 3.38Å; G298-N431 WeakPolarHBondContact CA-OD1 3.45Å; G298-N431 PolarHBondContact N-OD1 3.36Å; L429-N431 VanDerWaalsContact C-N 3.31Å; L429-N431 PolarHBondContact O-N 2.89Å; N431-S433 PolarHBondContact O-N 3.42Å; N431-L434 HydrophobicContact CB-CD1 3.75Å; N431-L434 HydrophobicContact CB-CG 4.13Å; N431-L434 VanDerWaalsContact O-CB 3.29Å; N431-L434 WeakPolarHBondContact O-CB 3.38Å; N431-L434 WeakPolarHBondContact O-CG 3.34Å; N431-L434 PolarHBondContact O-N 3.25Å; N431-H659 PolarHBondContact OD1-CD2 3.49Å
432	V	81.9	Confident	83.2	Confident	48 Å²	48	35 Å²	35	29%	0.291	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-64.6	-25	180	-179.5	0	0	0	0	110.7	G427 F430 L434 M435 F635	G427-V432 WeakPolarHBondContact O-CB 3.42Å; G427-V432 PolarHBondContact O-N 3.07Å; F430-V432 HydrophobicContact CB-CG2 4.14Å; F430-V432 PolarHBondContact O-N 2.93Å; F430-V432 VanDerWaalsContact O-N 3.08Å; V432-L434 PolarHBondContact O-N 3.35Å; V432-L434 VanDerWaalsContact O-N 3.1Å; V432-M435 WeakPolarHBondContact O-CB 3.26Å; V432-M435 PolarHBondContact O-N 3.03Å; V432-F635 HydrophobicContact CB-CE2 4.17Å; V432-F635 HydrophobicContact CG1-CE2 3.78Å; V432-F635 HydrophobicContact CG1-CZ 3.84Å; V432-F635 WeakPolarHBondContact O-CZ 3.07Å
433	S	76.6	Confident	82.6	Confident	4 Å²	4	30 Å²	30	3%	0.028	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-59.4	-16.1	171.5	55.1	0	0	0	0	114	N431 M435 M436 H659	N431-S433 PolarHBondContact O-N 3.42Å; S433-M435 PolarHBondContact O-N 2.92Å; S433-M436 WeakPolarHBondContact O-CB 3.39Å; S433-M436 PolarHBondContact O-N 3.47Å; S433-H659 PolarHBondContact OG-CD2 3.3Å; S433-H659 PolarHBondContact OG-CE1 3.17Å; S433-H659 VanDerWaalsContact OG-CG 3.28Å; S433-H659 PolarHBondContact OG-NE2 2.97Å
434	L	74.8	Confident	82	Confident	34 Å²	34	27.9 Å²	27.9	18%	0.178	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-60.1	-21.8	166.8	-70	169.7	0	0	0	112.4	L287 D291 F292 N431 V432 M436 K437	L287-L434 HydrophobicContact CD2-CB 3.86Å; D291-L434 HydrophobicContact CB-CD1 4.09Å; F292-L434 HydrophobicContact CE1-CB 4.02Å; F292-L434 HydrophobicContact CZ-CB 4.29Å; N431-L434 HydrophobicContact CB-CD1 3.75Å; N431-L434 HydrophobicContact CB-CG 4.13Å; N431-L434 VanDerWaalsContact O-CB 3.29Å; N431-L434 WeakPolarHBondContact O-CB 3.38Å; N431-L434 WeakPolarHBondContact O-CG 3.34Å; N431-L434 PolarHBondContact O-N 3.25Å; V432-L434 PolarHBondContact O-N 3.35Å; V432-L434 VanDerWaalsContact O-N 3.1Å; L434-M436 PolarHBondContact O-N 3.42Å; L434-M436 VanDerWaalsContact O-N 3.16Å; L434-K437 WeakPolarHBondContact O-CB 3.27Å; L434-K437 WeakPolarHBondContact O-CG 3.4Å; L434-K437 PolarHBondContact O-N 2.87Å; L434-K437 VanDerWaalsContact O-N 3.08Å
435	M	76.1	Confident	81.5	Confident	44 Å²	44	28.3 Å²	28.3	22%	0.217	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-58.9	-22	170.8	-165.8	164.3	68.7	0	0	112	V432 S433 K437 L438 F439 F635 I825	V432-M435 WeakPolarHBondContact O-CB 3.26Å; V432-M435 PolarHBondContact O-N 3.03Å; S433-M435 PolarHBondContact O-N 2.92Å; M435-K437 PolarHBondContact O-N 3Å; M435-L438 HydrophobicContact CG-CD1 3.97Å; M435-L438 VanDerWaalsContact O-CB 3.24Å; M435-L438 WeakPolarHBondContact O-CB 3.46Å; M435-L438 PolarHBondContact O-N 3.42Å; M435-F439 HydrophobicContact CE-CE2 4.48Å; M435-F439 HydrophobicContact CG-CE2 4.33Å; M435-F439 WeakPolarHBondContact O-CD2 3.49Å; M435-F635 HydrophobicContact CB-CE1 4.46Å; M435-F635 HydrophobicContact CB-CZ 4.25Å; M435-F635 HydrophobicContact CE-CD1 3.98Å; M435-F635 HydrophobicContact CE-CE1 3.29Å; M435-F635 HydrophobicContact CE-CZ 4Å; M435-I825 HydrophobicContact CE-CD1 4Å
436	M	72.2	Confident	81.2	Confident	3 Å²	3	26.8 Å²	26.8	2%	0.015	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-56.5	-30.3	173	-172.6	59.6	-153.6	0	0	112.7	S433 L434 L438 F439 E444 N639 S643 F658	S433-M436 WeakPolarHBondContact O-CB 3.39Å; S433-M436 PolarHBondContact O-N 3.47Å; L434-M436 PolarHBondContact O-N 3.42Å; L434-M436 VanDerWaalsContact O-N 3.16Å; M436-L438 PolarHBondContact O-N 3Å; M436-L438 VanDerWaalsContact O-N 3.11Å; M436-F439 HydrophobicContact CE-CB 3.81Å; M436-F439 WeakPolarHBondContact O-CB 3.23Å; M436-F439 PolarHBondContact O-N 3.39Å; M436-F439 HydrophobicContact SD-CB 3.91Å; M436-F439 HydrophobicContact SD-CD2 4.3Å; M436-F439 HydrophobicContact SD-CG 4.28Å; M436-E444 VanDerWaalsContact CE-OE1 3.23Å; M436-E444 WeakPolarHBondContact CE-OE1 3.3Å; M436-N639 HydrophobicContact CG-CB 4.45Å; M436-N639 HydrophobicContact SD-CB 3.79Å; M436-S643 WeakPolarHBondContact CE-OG 3.33Å; M436-F658 HydrophobicContact CG-CE1 4.21Å
437	K	72.7	Confident	80.8	Confident	48 Å²	48	24.1 Å²	24.1	21%	0.209	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-61.7	-23.3	176.5	-55.5	-165.3	179.2	-174.4	0	113.1	P281 L287 L434 M435	P281-K437 HydrophobicContact CB-CG 4.46Å; P281-K437 WeakPolarHBondContact O-CD 3.17Å; P281-K437 WeakPolarHBondContact O-CE 3.29Å; P281-K437 WeakPolarHBondContact O-CG 3.46Å; L287-K437 HydrophobicContact CD1-CB 3.82Å; L287-K437 HydrophobicContact CD1-CD 3.71Å; L287-K437 HydrophobicContact CD1-CG 4.17Å; L434-K437 WeakPolarHBondContact O-CB 3.27Å; L434-K437 WeakPolarHBondContact O-CG 3.4Å; L434-K437 PolarHBondContact O-N 2.87Å; L434-K437 VanDerWaalsContact O-N 3.08Å; M435-K437 PolarHBondContact O-N 3Å
438	L	75.3	Confident	80.5	Confident	63 Å²	63	24.4 Å²	24.4	33%	0.33	12%	0.122	S	C	.	.	G	3₁₀ helix	trans	-80.4	-27.5	177.4	-53.9	-176.6	0	0	0	112	M435 M436 K440 V828 I832	M435-L438 HydrophobicContact CG-CD1 3.97Å; M435-L438 VanDerWaalsContact O-CB 3.24Å; M435-L438 WeakPolarHBondContact O-CB 3.46Å; M435-L438 PolarHBondContact O-N 3.42Å; M436-L438 PolarHBondContact O-N 3Å; M436-L438 VanDerWaalsContact O-N 3.11Å; L438-K440 PolarHBondContact O-N 3.31Å; L438-V828 HydrophobicContact CB-CG1 3.5Å; L438-V828 VanDerWaalsContact CB-CG1 3.5Å; L438-V828 HydrophobicContact CD1-CG1 4.46Å; L438-I832 HydrophobicContact CB-CD1 3.91Å; L438-I832 HydrophobicContact CD1-CD1 4.48Å; L438-I832 HydrophobicContact CD2-CD1 3.78Å; L438-I832 HydrophobicContact CG-CD1 4.27Å
439	F	76.3	Confident	80.5	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.009	12%	0.124	C	C	.	.			trans	-72.8	110.5	173	-71.6	-95.3	0	0	0	108.4	M435 M436 T443 I636 I640 V828	M435-F439 HydrophobicContact CE-CE2 4.48Å; M435-F439 HydrophobicContact CG-CE2 4.33Å; M435-F439 WeakPolarHBondContact O-CD2 3.49Å; M436-F439 HydrophobicContact CE-CB 3.81Å; M436-F439 WeakPolarHBondContact O-CB 3.23Å; M436-F439 PolarHBondContact O-N 3.39Å; M436-F439 HydrophobicContact SD-CB 3.91Å; M436-F439 HydrophobicContact SD-CD2 4.3Å; M436-F439 HydrophobicContact SD-CG 4.28Å; F439-T443 HydrophobicContact CD1-CG2 4.19Å; F439-I636 HydrophobicContact CE1-CG2 4.05Å; F439-I636 HydrophobicContact CZ-CG1 4.2Å; F439-I636 HydrophobicContact CZ-CG2 4.26Å; F439-I640 HydrophobicContact CD1-CD1 4.06Å; F439-I640 HydrophobicContact CD1-CG1 4.2Å; F439-I640 HydrophobicContact CE1-CD1 4.14Å; F439-V828 HydrophobicContact CD1-CG2 3.75Å; F439-V828 HydrophobicContact CD2-CG2 4.3Å; F439-V828 HydrophobicContact CE1-CG2 3.46Å; F439-V828 VanDerWaalsContact CE1-CG2 3.46Å; F439-V828 HydrophobicContact CE2-CG2 4.06Å; F439-V828 HydrophobicContact CG-CG2 4.17Å; F439-V828 HydrophobicContact CZ-CG2 3.64Å
440	K	79.5	Confident	80.4	Confident	45 Å²	45	22.2 Å²	22.2	20%	0.196	11%	0.111	C	C	.	.			trans	-101	165.4	172.2	-62.9	-56.4	-167.5	177.6	0	109.9	L438 S442 T443 E444 R831	L438-K440 PolarHBondContact O-N 3.31Å; K440-S442 PolarHBondContact O-N 3.23Å; K440-T443 WeakPolarHBondContact O-CB 3.49Å; K440-T443 PolarHBondContact O-N 3.26Å; K440-E444 PolarHBondContact O-N 3.36Å; K440-R831 VanDerWaalsContact CG-NH1 3.33Å
441	R	78.4	Confident	80.1	Confident	27 Å²	27	20.1 Å²	20.1	10%	0.102	10%	0.103	C	C	.	.	H	α-helix	trans	-50.1	-43.5	-179	-172.2	-176.6	-177.7	151.1	17.6	112.5	T443 E444 E445 Q762	R441-T443 PolarHBondContact O-N 3.35Å; R441-T443 VanDerWaalsContact O-N 3.11Å; R441-E444 WeakPolarHBondContact CA-OE2 3.22Å; R441-E444 WeakPolarHBondContact O-CB 3.44Å; R441-E444 PolarHBondContact O-N 3.29Å; R441-E444 VanDerWaalsContact O-N 3.12Å; R441-E445 WeakPolarHBondContact CD-OE1 3.25Å; R441-E445 HydrophobicContact CG-CG 4.24Å; R441-E445 WeakPolarHBondContact CG-OE1 3.41Å; R441-E445 IonicContact CZ-OE1 3.71Å; R441-E445 IonicContact NE-OE1 2.7Å; R441-E445 PolarHBondContact NE-OE1 3.03Å; R441-E445 IonicContact NH2-OE1 3.08Å; R441-E445 WeakPolarHBondContact O-CG 3.46Å; R441-E445 PolarHBondContact O-N 3.28Å; R441-Q762 VanDerWaalsContact NH1-CD 3.35Å; R441-Q762 VanDerWaalsContact NH2-NE2 3.2Å
442	S	80.7	Confident	80.3	Confident	4 Å²	4	19.9 Å²	19.9	3%	0.028	10%	0.102	C	C	.	.	H	α-helix	trans	-51	-36	175.8	66.6	0	0	0	0	114.7	K440 V446 Q798 D848	K440-S442 PolarHBondContact O-N 3.23Å; S442-V446 VanDerWaalsContact O-CG2 3.25Å; S442-V446 WeakPolarHBondContact O-CG2 3.24Å; S442-Q798 PolarHBondContact O-NE2 3.27Å; S442-Q798 VanDerWaalsContact O-NE2 3.1Å; S442-D848 WeakPolarHBondContact CB-OD1 3.45Å; S442-D848 PolarHBondContact N-OD1 3.24Å
443	T	82.4	Confident	80.6	Confident	2 Å²	2	20.2 Å²	20.2	1%	0.012	10%	0.101	C	C	.	.	H	α-helix	trans	-83.2	-39.7	-178.9	-53.6	0	0	0	0	110.5	F439 K440 R441 E445 V446 I447 L827 V828	F439-T443 HydrophobicContact CD1-CG2 4.19Å; K440-T443 WeakPolarHBondContact O-CB 3.49Å; K440-T443 PolarHBondContact O-N 3.26Å; R441-T443 PolarHBondContact O-N 3.35Å; R441-T443 VanDerWaalsContact O-N 3.11Å; T443-E445 VanDerWaalsContact C-N 3.28Å; T443-E445 PolarHBondContact O-N 3.44Å; T443-V446 PolarHBondContact O-N 3.28Å; T443-I447 HydrophobicContact CG2-CD1 4Å; T443-I447 VanDerWaalsContact O-CG1 3.28Å; T443-I447 WeakPolarHBondContact O-CG1 3.47Å; T443-I447 PolarHBondContact O-N 3.16Å; T443-I447 VanDerWaalsContact O-N 3.1Å; T443-L827 HydrophobicContact CG2-CB 4.15Å; T443-V828 HydrophobicContact CG2-CG2 4.26Å
444	E	81	Confident	80.9	Confident	3 Å²	3	20.5 Å²	20.5	1%	0.014	10%	0.104	C	C	.	.	H	α-helix	trans	-56.9	-42.5	174.1	-61.9	170	164.6	0	0	111.1	R282 M436 K440 R441 I447 A448 I640 L644	R282-E444 IonicContact CZ-OE1 3.49Å; R282-E444 IonicContact CZ-OE2 2.7Å; R282-E444 IonicContact NH1-OE1 2.66Å; R282-E444 IonicContact NH1-OE2 3.47Å; R282-E444 IonicContact NH2-OE1 2.72Å; R282-E444 PolarHBondContact NH2-OE1 3.24Å; R282-E444 IonicContact NH2-OE2 2.94Å; R282-E444 PolarHBondContact NH2-OE2 3.33Å; M436-E444 VanDerWaalsContact CE-OE1 3.23Å; M436-E444 WeakPolarHBondContact CE-OE1 3.3Å; K440-E444 PolarHBondContact O-N 3.36Å; R441-E444 WeakPolarHBondContact CA-OE2 3.22Å; R441-E444 WeakPolarHBondContact O-CB 3.44Å; R441-E444 PolarHBondContact O-N 3.29Å; R441-E444 VanDerWaalsContact O-N 3.12Å; E444-I447 PolarHBondContact O-N 3.16Å; E444-A448 WeakPolarHBondContact O-CB 3.09Å; E444-A448 PolarHBondContact O-N 3.44Å; E444-I640 HydrophobicContact CG-CG2 4.27Å; E444-L644 HydrophobicContact CB-CD1 4.39Å; E444-L644 HydrophobicContact CB-CD2 4.17Å; E444-L644 HydrophobicContact CG-CD2 4.48Å; E444-L644 WeakPolarHBondContact OE2-CD2 3.31Å
445	E	84.1	Confident	81.4	Confident	12 Å²	12	19.6 Å²	19.6	6%	0.056	10%	0.098	C	C	.	.	H	α-helix	trans	-66.8	-38.4	179.8	-73.1	173.4	173.7	0	0	113.6	R441 T443 L449 N761 Q762 M763 R766	R441-E445 WeakPolarHBondContact CD-OE1 3.25Å; R441-E445 HydrophobicContact CG-CG 4.24Å; R441-E445 WeakPolarHBondContact CG-OE1 3.41Å; R441-E445 IonicContact CZ-OE1 3.71Å; R441-E445 IonicContact NE-OE1 2.7Å; R441-E445 PolarHBondContact NE-OE1 3.03Å; R441-E445 IonicContact NH2-OE1 3.08Å; R441-E445 WeakPolarHBondContact O-CG 3.46Å; R441-E445 PolarHBondContact O-N 3.28Å; T443-E445 VanDerWaalsContact C-N 3.28Å; T443-E445 PolarHBondContact O-N 3.44Å; E445-L449 WeakPolarHBondContact O-CB 3.19Å; E445-L449 PolarHBondContact O-N 2.95Å; E445-N761 WeakPolarHBondContact CB-OD1 3.49Å; E445-N761 WeakPolarHBondContact CG-OD1 3.17Å; E445-N761 PolarHBondContact O-ND2 3.32Å; E445-N761 VanDerWaalsContact O-ND2 3.08Å; E445-Q762 VanDerWaalsContact OE1-CB 3.26Å; E445-Q762 WeakPolarHBondContact OE1-CB 3.26Å; E445-Q762 WeakPolarHBondContact OE1-CG 3.37Å; E445-Q762 PolarHBondContact OE1-OE1 3.16Å; E445-M763 HydrophobicContact CB-CB 4.04Å; E445-R766 IonicContact OE2-CZ 3.84Å; E445-R766 IonicContact OE2-NH1 2.77Å; E445-R766 IonicContact OE2-NH2 3.82Å; E445-R766 PolarHBondContact OE2-NH2 3.3Å
446	V	87.3	Confident	82	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.7	-42.7	175.9	172.8	0	0	0	0	110.1	S442 T443 L449 F450 M763 Q798 L802 L827	S442-V446 VanDerWaalsContact O-CG2 3.25Å; S442-V446 WeakPolarHBondContact O-CG2 3.24Å; T443-V446 PolarHBondContact O-N 3.28Å; V446-L449 PolarHBondContact O-N 3.49Å; V446-F450 WeakPolarHBondContact O-CB 3.36Å; V446-F450 PolarHBondContact O-N 3.34Å; V446-M763 HydrophobicContact CB-SD 4.43Å; V446-M763 HydrophobicContact CG2-SD 3.72Å; V446-Q798 HydrophobicContact CG2-CB 4.06Å; V446-Q798 HydrophobicContact CG2-CG 4.12Å; V446-L802 HydrophobicContact CG1-CB 4.35Å; V446-L802 HydrophobicContact CG1-CD1 4.48Å; V446-L827 HydrophobicContact CG1-CD1 4.17Å
447	I	84	Confident	82.7	Confident	3 Å²	3	21.6 Å²	21.6	2%	0.015	12%	0.119	C	C	.	.	H	α-helix	trans	-65.7	-46.5	178.5	-66.6	169.3	0	0	0	110.5	T443 E444 L449 F450 I451 I636 I640 M824	T443-I447 HydrophobicContact CG2-CD1 4Å; T443-I447 VanDerWaalsContact O-CG1 3.28Å; T443-I447 WeakPolarHBondContact O-CG1 3.47Å; T443-I447 PolarHBondContact O-N 3.16Å; T443-I447 VanDerWaalsContact O-N 3.1Å; E444-I447 PolarHBondContact O-N 3.16Å; I447-L449 VanDerWaalsContact C-N 3.32Å; I447-L449 PolarHBondContact O-N 2.97Å; I447-F450 WeakPolarHBondContact O-CB 3.41Å; I447-F450 PolarHBondContact O-N 2.9Å; I447-I451 HydrophobicContact CG2-CD1 3.98Å; I447-I451 WeakPolarHBondContact O-CG1 3.43Å; I447-I451 PolarHBondContact O-N 3.33Å; I447-I636 HydrophobicContact CD1-CG2 4.46Å; I447-I640 HydrophobicContact CD1-CD1 3.31Å; I447-I640 HydrophobicContact CG2-CD1 4.4Å; I447-M824 HydrophobicContact CD1-CE 4.05Å; I447-M824 HydrophobicContact CD1-SD 4.33Å; I447-M824 HydrophobicContact CG1-CE 3.43Å; I447-M824 VanDerWaalsContact CG1-CE 3.43Å; I447-M824 HydrophobicContact CG1-SD 3.87Å; I447-M824 HydrophobicContact CG2-SD 4.28Å
448	A	81.4	Confident	83.1	Confident	15 Å²	15	21 Å²	21	12%	0.124	12%	0.118	C	C	.	.	H	α-helix	trans	-60	-41.8	177.5	0	0	0	0	0	112.2	E444 I451 S452	E444-A448 WeakPolarHBondContact O-CB 3.09Å; E444-A448 PolarHBondContact O-N 3.44Å; A448-I451 PolarHBondContact O-N 3.17Å; A448-S452 PolarHBondContact O-N 2.73Å; A448-S452 VanDerWaalsContact O-N 3.09Å; A448-S452 PolarHBondContact O-OG 3.13Å
449	L	86.8	Confident	83.7	Confident	8 Å²	8	18 Å²	18	4%	0.042	10%	0.102	C	C	.	.	H	α-helix	trans	-68.2	-38.1	177.1	-173.5	54.6	0	0	0	112.1	E445 V446 I447 S452 I453 L758 M763 V764 L802	E445-L449 WeakPolarHBondContact O-CB 3.19Å; E445-L449 PolarHBondContact O-N 2.95Å; V446-L449 PolarHBondContact O-N 3.49Å; I447-L449 VanDerWaalsContact C-N 3.32Å; I447-L449 PolarHBondContact O-N 2.97Å; L449-S452 WeakPolarHBondContact O-CB 3.46Å; L449-S452 PolarHBondContact O-N 3.18Å; L449-I453 HydrophobicContact CG-CD1 4.35Å; L449-I453 WeakPolarHBondContact O-CG1 3.44Å; L449-I453 PolarHBondContact O-N 2.98Å; L449-L758 HydrophobicContact CD1-CD2 3.2Å; L449-M763 HydrophobicContact CD2-CE 3.82Å; L449-M763 HydrophobicContact CD2-CG 4.26Å; L449-M763 HydrophobicContact CD2-SD 3.84Å; L449-V764 HydrophobicContact CD1-CG2 3.92Å; L449-V764 HydrophobicContact CD2-CG2 4.24Å; L449-L802 HydrophobicContact CB-CD1 4.5Å; L449-L802 HydrophobicContact CB-CD2 4.49Å; L449-L802 HydrophobicContact CD2-CD2 3.5Å; L449-L802 VanDerWaalsContact CD2-CD2 3.5Å; L449-L802 HydrophobicContact CG-CD1 4.48Å; L449-L802 HydrophobicContact CG-CD2 3.77Å
450	F	86.8	Confident	84.3	Confident	8 Å²	8	21.5 Å²	21.5	4%	0.035	12%	0.123	C	C	.	.	H	α-helix	trans	-60.1	-48.2	172.9	166.8	-96.8	0	0	0	112.5	V446 I447 S452 I453 A454 L802 L805 F820	V446-F450 WeakPolarHBondContact O-CB 3.36Å; V446-F450 PolarHBondContact O-N 3.34Å; I447-F450 WeakPolarHBondContact O-CB 3.41Å; I447-F450 PolarHBondContact O-N 2.9Å; F450-S452 PolarHBondContact O-N 2.58Å; F450-I453 PolarHBondContact O-N 3.32Å; F450-I453 VanDerWaalsContact O-N 3.13Å; F450-A454 PolarHBondContact O-N 3.45Å; F450-L802 HydrophobicContact CB-CD1 3.76Å; F450-L805 HydrophobicContact CB-CD2 3.54Å; F450-L805 HydrophobicContact CD1-CD2 3.91Å; F450-L805 HydrophobicContact CD1-CG 4.47Å; F450-L805 HydrophobicContact CD2-CB 4.23Å; F450-L805 HydrophobicContact CD2-CD2 3.54Å; F450-L805 HydrophobicContact CD2-CG 3.61Å; F450-L805 HydrophobicContact CE2-CD2 4.24Å; F450-L805 HydrophobicContact CE2-CG 3.89Å; F450-L805 HydrophobicContact CG-CD2 3.34Å; F450-L805 HydrophobicContact CG-CG 3.92Å; F450-L805 HydrophobicContact CZ-CG 4.46Å; F450-F820 AromaticContact CD1-CE2 3.81Å; F450-F820 HydrophobicContact CD1-CE2 3.81Å; F450-F820 AromaticContact CD1-CZ 3.89Å; F450-F820 HydrophobicContact CD1-CZ 3.89Å; F450-F820 HydrophobicContact CE1-CD2 4.17Å; F450-F820 HydrophobicContact CE1-CE1 4.28Å; F450-F820 AromaticContact CE1-CE2 3.11Å; F450-F820 HydrophobicContact CE1-CE2 3.11Å; F450-F820 AromaticContact CE1-CZ 3.19Å; F450-F820 HydrophobicContact CE1-CZ 3.19Å; F450-F820 AromaticContact CE2-CE2 3.96Å; F450-F820 HydrophobicContact CE2-CE2 3.96Å; F450-F820 AromaticContact CZ-CD2 3.85Å; F450-F820 HydrophobicContact CZ-CD2 3.85Å; F450-F820 AromaticContact CZ-CE2 3.19Å; F450-F820 HydrophobicContact CZ-CE2 3.19Å; F450-F820 AromaticContact CZ-CZ 3.74Å; F450-F820 HydrophobicContact CZ-CZ 3.74Å
451	I	82.6	Confident	84.6	Confident	40 Å²	40	26 Å²	26	21%	0.205	14%	0.143	C	C	.	.	H	α-helix	trans	-58.3	-40.2	177.2	-67.2	167.5	0	0	0	110.1	I447 A448 A454 F455	I447-I451 HydrophobicContact CG2-CD1 3.98Å; I447-I451 WeakPolarHBondContact O-CG1 3.43Å; I447-I451 PolarHBondContact O-N 3.33Å; A448-I451 PolarHBondContact O-N 3.17Å; I451-A454 PolarHBondContact O-N 3.32Å; I451-F455 HydrophobicContact CG2-CD2 3.86Å; I451-F455 HydrophobicContact CG2-CE2 3.48Å; I451-F455 VanDerWaalsContact CG2-CE2 3.48Å; I451-F455 HydrophobicContact CG2-CZ 4.34Å; I451-F455 WeakPolarHBondContact O-CD2 3.44Å; I451-F455 PolarHBondContact O-N 3.41Å
452	S	85.6	Confident	84.8	Confident	4 Å²	4	25.1 Å²	25.1	3%	0.028	14%	0.142	C	C	.	.	H	α-helix	trans	-63.1	-42.9	176.8	-50.2	0	0	0	0	112.1	A448 L449 F450 F455 V456 A754 S757	A448-S452 PolarHBondContact O-N 2.73Å; A448-S452 VanDerWaalsContact O-N 3.09Å; A448-S452 PolarHBondContact O-OG 3.13Å; L449-S452 WeakPolarHBondContact O-CB 3.46Å; L449-S452 PolarHBondContact O-N 3.18Å; F450-S452 PolarHBondContact O-N 2.58Å; S452-F455 PolarHBondContact O-N 2.96Å; S452-V456 WeakPolarHBondContact O-CG2 3.29Å; S452-V456 PolarHBondContact O-N 3.09Å; S452-A754 WeakPolarHBondContact O-CB 3.45Å; S452-S757 WeakPolarHBondContact CB-OG 3.45Å; S452-S757 PolarHBondContact OG-OG 3.24Å
453	I	87.9	Confident	85	Confident	56 Å²	56	25.5 Å²	25.5	29%	0.287	15%	0.145	S	C	.	.	H	α-helix	trans	-65.8	-40.7	175.9	-68.6	168.9	0	0	0	111.1	L449 F450 F455 V456 G457 L802 M810	L449-I453 HydrophobicContact CG-CD1 4.35Å; L449-I453 WeakPolarHBondContact O-CG1 3.44Å; L449-I453 PolarHBondContact O-N 2.98Å; F450-I453 PolarHBondContact O-N 3.32Å; F450-I453 VanDerWaalsContact O-N 3.13Å; I453-F455 VanDerWaalsContact C-N 3.34Å; I453-F455 PolarHBondContact O-N 3.22Å; I453-V456 PolarHBondContact O-N 3.02Å; I453-G457 PolarHBondContact O-N 3.19Å; I453-L802 HydrophobicContact CD1-CD1 4.22Å; I453-L802 HydrophobicContact CD1-CD2 3.91Å; I453-L802 HydrophobicContact CD1-CG 4.25Å; I453-M810 HydrophobicContact CG2-CE 3.81Å; I453-M810 HydrophobicContact CG2-SD 4.13Å
454	A	83.8	Confident	85.3	Confident	10 Å²	10	28.7 Å²	28.7	8%	0.083	16%	0.164	C	C	.	.	H	α-helix	trans	-60.5	-42.7	177	0	0	0	0	0	111.7	F450 I451 V456 G457 D458	F450-A454 PolarHBondContact O-N 3.45Å; I451-A454 PolarHBondContact O-N 3.32Å; A454-V456 PolarHBondContact O-N 3.26Å; A454-G457 WeakPolarHBondContact O-CA 3.41Å; A454-G457 PolarHBondContact O-N 2.93Å; A454-G457 VanDerWaalsContact O-N 3.14Å; A454-D458 PolarHBondContact O-N 3.08Å
455	F	84.3	Confident	85.4	Confident	14 Å²	14	33.9 Å²	33.9	6%	0.061	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-42.2	174.8	-80.7	-52.2	0	0	0	113.6	F346 A389 I451 S452 I453 G457 A459 F750 I753 A754	F346-F455 AromaticContact CE1-CE1 3.85Å; F346-F455 HydrophobicContact CE1-CE1 3.85Å; F346-F455 AromaticContact CZ-CE1 3.45Å; F346-F455 HydrophobicContact CZ-CE1 3.45Å; F346-F455 VanDerWaalsContact CZ-CE1 3.45Å; F346-F455 AromaticContact CZ-CZ 3.77Å; F346-F455 HydrophobicContact CZ-CZ 3.77Å; A389-F455 HydrophobicContact CB-CD1 4.46Å; A389-F455 HydrophobicContact CB-CE1 3.97Å; A389-F455 HydrophobicContact CB-CZ 4.34Å; I451-F455 HydrophobicContact CG2-CD2 3.86Å; I451-F455 HydrophobicContact CG2-CE2 3.48Å; I451-F455 VanDerWaalsContact CG2-CE2 3.48Å; I451-F455 HydrophobicContact CG2-CZ 4.34Å; I451-F455 WeakPolarHBondContact O-CD2 3.44Å; I451-F455 PolarHBondContact O-N 3.41Å; S452-F455 PolarHBondContact O-N 2.96Å; I453-F455 VanDerWaalsContact C-N 3.34Å; I453-F455 PolarHBondContact O-N 3.22Å; F455-G457 VanDerWaalsContact C-N 3.34Å; F455-A459 WeakPolarHBondContact O-CB 3.18Å; F455-A459 PolarHBondContact O-N 3.06Å; F455-A459 VanDerWaalsContact O-N 3.07Å; F455-F750 HydrophobicContact CD1-CB 4.35Å; F455-F750 AromaticContact CD1-CD1 3.95Å; F455-F750 HydrophobicContact CD1-CD1 3.95Å; F455-F750 HydrophobicContact CD1-CE1 4.48Å; F455-F750 HydrophobicContact CD1-CG 4.21Å; F455-F750 HydrophobicContact CE1-CD1 4.09Å; F455-F750 HydrophobicContact CE1-CE1 4.3Å; F455-I753 HydrophobicContact CD2-CG2 4.22Å; F455-I753 HydrophobicContact CE2-CG2 3.97Å; F455-A754 HydrophobicContact CB-CB 3.96Å
456	V	89.1	Confident	85.4	Confident	62 Å²	62	34 Å²	34	38%	0.376	19%	0.187	S	C	.	.	H	α-helix	trans	-63.8	-43.4	174.1	177	0	0	0	0	110.3	S452 I453 A454 D458 A459 V460 L751 A754	S452-V456 WeakPolarHBondContact O-CG2 3.29Å; S452-V456 PolarHBondContact O-N 3.09Å; I453-V456 PolarHBondContact O-N 3.02Å; A454-V456 PolarHBondContact O-N 3.26Å; V456-D458 PolarHBondContact O-N 2.9Å; V456-A459 PolarHBondContact O-N 2.88Å; V456-V460 HydrophobicContact CG1-CG2 4.3Å; V456-V460 WeakPolarHBondContact O-CB 3.48Å; V456-V460 VanDerWaalsContact O-CG2 3.28Å; V456-V460 WeakPolarHBondContact O-CG2 3.29Å; V456-V460 PolarHBondContact O-N 3.09Å; V456-L751 HydrophobicContact CB-CD2 4.27Å; V456-L751 HydrophobicContact CG1-CD2 4.1Å; V456-L751 HydrophobicContact CG2-CD2 4.05Å; V456-A754 HydrophobicContact CG2-CB 3.69Å
457	G	86.1	Confident	85.2	Confident	27 Å²	27	36.7 Å²	36.7	28%	0.278	20%	0.199	S	C	.	.	H	α-helix	trans	-58	-47	177.2	0	0	0	0	0	113	I453 A454 F455 V460 K461	I453-G457 PolarHBondContact O-N 3.19Å; A454-G457 WeakPolarHBondContact O-CA 3.41Å; A454-G457 PolarHBondContact O-N 2.93Å; A454-G457 VanDerWaalsContact O-N 3.14Å; F455-G457 VanDerWaalsContact C-N 3.34Å; G457-V460 PolarHBondContact O-N 3.02Å; G457-K461 VanDerWaalsContact O-CB 3.25Å; G457-K461 WeakPolarHBondContact O-CB 3.34Å; G457-K461 PolarHBondContact O-N 3.27Å
458	D	82	Confident	85.2	Confident	36 Å²	36	42.4 Å²	42.4	19%	0.193	23%	0.225	C	C	.	.	H	α-helix	trans	-67.7	-40.1	179.4	-74.7	-24.3	0	0	0	112.2	A454 V456 K461 G462	A454-D458 PolarHBondContact O-N 3.08Å; V456-D458 PolarHBondContact O-N 2.9Å; D458-K461 PolarHBondContact O-N 3.1Å; D458-G462 PolarHBondContact O-N 2.7Å
459	A	87.2	Confident	85	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.2	-43.4	175.4	0	0	0	0	0	112.3	F455 V456 T463 F750 L751	F455-A459 WeakPolarHBondContact O-CB 3.18Å; F455-A459 PolarHBondContact O-N 3.06Å; F455-A459 VanDerWaalsContact O-N 3.07Å; V456-A459 PolarHBondContact O-N 2.88Å; A459-T463 WeakPolarHBondContact O-CB 3.37Å; A459-T463 PolarHBondContact O-N 3.35Å; A459-T463 PolarHBondContact O-OG1 2.7Å; A459-F750 HydrophobicContact CB-CB 4.15Å; A459-L751 HydrophobicContact CB-CD2 3.87Å; A459-L751 HydrophobicContact CB-CG 3.92Å
460	V	89.8	Confident	84.5	Confident	75 Å²	75	48.8 Å²	48.8	46%	0.455	25%	0.252	S	S	.	.	H	α-helix	trans	-67.4	-46	176.9	172.4	0	0	0	0	110.5	V456 G457 G462 T463 V464	V456-V460 HydrophobicContact CG1-CG2 4.3Å; V456-V460 WeakPolarHBondContact O-CB 3.48Å; V456-V460 VanDerWaalsContact O-CG2 3.28Å; V456-V460 WeakPolarHBondContact O-CG2 3.29Å; V456-V460 PolarHBondContact O-N 3.09Å; G457-V460 PolarHBondContact O-N 3.02Å; V460-G462 VanDerWaalsContact C-N 3.34Å; V460-G462 PolarHBondContact O-N 3.08Å; V460-T463 PolarHBondContact O-N 2.73Å; V460-T463 VanDerWaalsContact O-N 3.17Å; V460-V464 HydrophobicContact CG1-CG2 4.25Å; V460-V464 WeakPolarHBondContact O-CG2 3.44Å; V460-V464 PolarHBondContact O-N 3.34Å
461	K	85.3	Confident	83.9	Confident	140 Å²	140	53.6 Å²	53.6	61%	0.609	27%	0.271	S	S	*	.	H	α-helix	trans	-60.6	-43.3	178.5	-175.1	-178.3	177.2	-173.9	0	111.9	G457 D458 T463 V464 K465	G457-K461 VanDerWaalsContact O-CB 3.25Å; G457-K461 WeakPolarHBondContact O-CB 3.34Å; G457-K461 PolarHBondContact O-N 3.27Å; D458-K461 PolarHBondContact O-N 3.1Å; K461-T463 VanDerWaalsContact C-N 3.34Å; K461-V464 PolarHBondContact O-N 3.29Å; K461-K465 WeakPolarHBondContact O-CB 3.28Å; K461-K465 PolarHBondContact O-N 3.21Å
462	G	82	Confident	83	Confident	8 Å²	8	58.4 Å²	58.4	8%	0.082	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-43.5	174.5	0	0	0	0	0	112.1	D458 V460 K465 I466	D458-G462 PolarHBondContact O-N 2.7Å; V460-G462 VanDerWaalsContact C-N 3.34Å; V460-G462 PolarHBondContact O-N 3.08Å; G462-K465 PolarHBondContact O-N 3.08Å; G462-I466 WeakPolarHBondContact O-CG1 3.19Å; G462-I466 PolarHBondContact O-N 2.9Å; G462-I466 VanDerWaalsContact O-N 3.11Å
463	T	85.8	Confident	81.6	Confident	13 Å²	13	59.6 Å²	59.6	8%	0.08	31%	0.305	C	S	.	.	H	α-helix	trans	-65.8	-44.4	176.9	-56.3	0	0	0	0	112.1	A459 V460 K461 K465 I466 F467 M544	A459-T463 WeakPolarHBondContact O-CB 3.37Å; A459-T463 PolarHBondContact O-N 3.35Å; A459-T463 PolarHBondContact O-OG1 2.7Å; V460-T463 PolarHBondContact O-N 2.73Å; V460-T463 VanDerWaalsContact O-N 3.17Å; K461-T463 VanDerWaalsContact C-N 3.34Å; T463-K465 VanDerWaalsContact C-N 3.31Å; T463-K465 PolarHBondContact O-N 3.34Å; T463-I466 WeakPolarHBondContact O-CB 3.19Å; T463-I466 PolarHBondContact O-N 3.17Å; T463-I466 VanDerWaalsContact O-N 3.14Å; T463-F467 HydrophobicContact CG2-CD2 3.87Å; T463-F467 HydrophobicContact CG2-CE2 3.85Å; T463-F467 WeakPolarHBondContact O-CD2 3.36Å; T463-F467 PolarHBondContact O-N 3.43Å; T463-M544 HydrophobicContact CG2-CE 4.25Å; T463-M544 HydrophobicContact CG2-SD 4.47Å; T463-M544 PolarHBondContact OG1-SD 3.28Å
464	V	88.3	Confident	79.7	Confident	69 Å²	69	62 Å²	62	42%	0.418	32%	0.324	S	S	.	.	H	α-helix	trans	-58.7	-43.7	176.1	171	0	0	0	0	110.8	V460 K461 I466 F467 E468	V460-V464 HydrophobicContact CG1-CG2 4.25Å; V460-V464 WeakPolarHBondContact O-CG2 3.44Å; V460-V464 PolarHBondContact O-N 3.34Å; K461-V464 PolarHBondContact O-N 3.29Å; V464-I466 VanDerWaalsContact C-N 3.32Å; V464-I466 PolarHBondContact O-N 3.27Å; V464-F467 CarbonylContact O-C 3.54Å; V464-F467 PolarHBondContact O-N 3.29Å; V464-F467 VanDerWaalsContact O-N 3.12Å; V464-E468 HydrophobicContact CG1-CG 4.29Å; V464-E468 WeakPolarHBondContact O-CG 2.97Å; V464-E468 PolarHBondContact O-N 3.49Å
465	K	83.9	Confident	78.1	Confident	112 Å²	112	64.7 Å²	64.7	49%	0.487	34%	0.34	S	S	.	.	H	α-helix	trans	-59.9	-39.9	176.2	-173.2	-177.8	175.4	-170.2	0	112.3	E352 K461 G462 T463 H469	E352-K465 IonicContact OE2-NZ 3.68Å; E352-K465 PolarHBondContact OE2-NZ 3.47Å; K461-K465 WeakPolarHBondContact O-CB 3.28Å; K461-K465 PolarHBondContact O-N 3.21Å; G462-K465 PolarHBondContact O-N 3.08Å; T463-K465 VanDerWaalsContact C-N 3.31Å; T463-K465 PolarHBondContact O-N 3.34Å; K465-H469 VanDerWaalsContact O-CB 3.31Å; K465-H469 WeakPolarHBondContact O-CB 3.21Å; K465-H469 PolarHBondContact O-N 3.41Å
466	I	82.8	Confident	76.2	Confident	14 Å²	14	69.1 Å²	69.1	7%	0.072	36%	0.363	C	S	.	.	H	α-helix	trans	-63.9	-45.2	173.8	-69.4	173.9	0	0	0	110.6	G462 T463 V464 H469 F470 C540 P597 P744 Y747	G462-I466 WeakPolarHBondContact O-CG1 3.19Å; G462-I466 PolarHBondContact O-N 2.9Å; G462-I466 VanDerWaalsContact O-N 3.11Å; T463-I466 WeakPolarHBondContact O-CB 3.19Å; T463-I466 PolarHBondContact O-N 3.17Å; T463-I466 VanDerWaalsContact O-N 3.14Å; V464-I466 VanDerWaalsContact C-N 3.32Å; V464-I466 PolarHBondContact O-N 3.27Å; I466-H469 PolarHBondContact O-N 3.06Å; I466-F470 HydrophobicContact CG2-CD2 3.81Å; I466-F470 HydrophobicContact CG2-CE2 4.28Å; I466-F470 WeakPolarHBondContact O-CD2 3.47Å; I466-F470 PolarHBondContact O-N 2.98Å; I466-C540 HydrophobicContact CG2-CB 4.11Å; I466-P597 HydrophobicContact CD1-CG 4.05Å; I466-P744 HydrophobicContact CD1-CG 4.34Å; I466-Y747 HydrophobicContact CD1-CD2 4.39Å; I466-Y747 HydrophobicContact CD1-CE2 3.7Å
467	F	84.9	Confident	74.1	Confident	57 Å²	57	68.2 Å²	68.2	25%	0.25	36%	0.362	C	S	.	.	H	α-helix	trans	-62.4	-48.3	177.1	-90.6	-101.8	0	0	0	111.4	T463 V464 H469 Y471 P537 L541	T463-F467 HydrophobicContact CG2-CD2 3.87Å; T463-F467 HydrophobicContact CG2-CE2 3.85Å; T463-F467 WeakPolarHBondContact O-CD2 3.36Å; T463-F467 PolarHBondContact O-N 3.43Å; V464-F467 CarbonylContact O-C 3.54Å; V464-F467 PolarHBondContact O-N 3.29Å; V464-F467 VanDerWaalsContact O-N 3.12Å; F467-H469 VanDerWaalsContact C-N 3.31Å; F467-H469 PolarHBondContact O-N 2.92Å; F467-Y471 WeakPolarHBondContact O-CA 3.48Å; F467-Y471 WeakPolarHBondContact O-CB 3.16Å; F467-Y471 PolarHBondContact O-N 2.87Å; F467-P537 HydrophobicContact CD1-CB 3.61Å; F467-P537 HydrophobicContact CD2-CB 3.77Å; F467-P537 HydrophobicContact CE1-CB 3.53Å; F467-P537 HydrophobicContact CE2-CB 3.69Å; F467-P537 VanDerWaalsContact CE2-O 3.28Å; F467-P537 WeakPolarHBondContact CE2-O 3.27Å; F467-P537 HydrophobicContact CG-CB 3.74Å; F467-P537 HydrophobicContact CZ-CB 3.57Å; F467-P537 WeakPolarHBondContact CZ-O 3.43Å; F467-L541 HydrophobicContact CE2-CB 4.06Å; F467-L541 HydrophobicContact CE2-CD1 4.07Å; F467-L541 HydrophobicContact CZ-CB 4.05Å; F467-L541 HydrophobicContact CZ-CD1 3.91Å
468	E	83.3	Confident	72	Confident	122 Å²	122	70.1 Å²	70.1	57%	0.57	37%	0.368	S	S	*	.	I	π-helix	trans	-58.3	-43.7	177.5	-72.7	178.5	175.3	0	0	112.1	V464 H472	V464-E468 HydrophobicContact CG1-CG 4.29Å; V464-E468 WeakPolarHBondContact O-CG 2.97Å; V464-E468 PolarHBondContact O-N 3.49Å; E468-H472 PolarHBondContact O-N 3.36Å
469	H	77.6	Confident	70.1	Confident	123 Å²	123	75.3 Å²	75.3	57%	0.569	40%	0.402	S	S	*	.	I	π-helix	trans	-69.3	-48.2	-177.7	-169.6	67.9	0	0	0	113.2	K465 I466 F467	K465-H469 VanDerWaalsContact O-CB 3.31Å; K465-H469 WeakPolarHBondContact O-CB 3.21Å; K465-H469 PolarHBondContact O-N 3.41Å; I466-H469 PolarHBondContact O-N 3.06Å; F467-H469 VanDerWaalsContact C-N 3.31Å; F467-H469 PolarHBondContact O-N 2.92Å
470	F	76.3	Confident	68.1	Low	34 Å²	34	79.6 Å²	79.6	15%	0.149	43%	0.425	C	S	.	.	I	π-helix	trans	-95.8	-19.5	-172.4	-66.5	-71.9	0	0	0	114.4	I466 R536 P537	I466-F470 HydrophobicContact CG2-CD2 3.81Å; I466-F470 HydrophobicContact CG2-CE2 4.28Å; I466-F470 WeakPolarHBondContact O-CD2 3.47Å; I466-F470 PolarHBondContact O-N 2.98Å; F470-R536 HydrophobicContact CB-CB 4.4Å; F470-R536 HydrophobicContact CG-CB 4.45Å; F470-P537 HydrophobicContact CB-CG 3.85Å
471	Y	72.9	Confident	66	Low	110 Å²	110	84.8 Å²	84.8	43%	0.431	44%	0.441	S	S	.	.	I	π-helix	trans	-93.4	-38.6	179.6	-166.4	-97.1	0	0	0	112.8	F467 R534	F467-Y471 WeakPolarHBondContact O-CA 3.48Å; F467-Y471 WeakPolarHBondContact O-CB 3.16Å; F467-Y471 PolarHBondContact O-N 2.87Å; Y471-R534 HydrophobicContact CD2-CG 4.43Å; Y471-R534 HydrophobicContact CE2-CG 4.38Å
472	H	64.1	Low	64.2	Low	141 Å²	141	82.9 Å²	82.9	65%	0.653	44%	0.441	S	S	*	.	I	π-helix	trans	-103	-19.3	-175.8	-68.9	-68.6	0	0	0	114.4	E468	E468-H472 PolarHBondContact O-N 3.36Å
473	G	55.5	Low	62.8	Low	29 Å²	29	85.2 Å²	85.2	30%	0.299	45%	0.454	S	S	.	.	S	Bend	trans	-77.5	124.8	-179.6	0	0	0	0	0	112.8	T475	G473-T475 PolarHBondContact O-N 3.01Å; G473-T475 VanDerWaalsContact O-N 3.07Å
474	P	49.3	Very low	61.2	Low	106 Å²	106	85.6 Å²	85.6	69%	0.688	46%	0.456	S	S	*	.			trans	-70.3	104.5	168.3	28.1	-30.1	0	0	0	108.4
475	T	50	Low	59.5	Low	67 Å²	67	87.6 Å²	87.6	41%	0.411	46%	0.464	S	S	.	.			trans	-83.7	116.3	171.1	22.5	0	0	0	0	108.3	G473 A477 E531	G473-T475 PolarHBondContact O-N 3.01Å; G473-T475 VanDerWaalsContact O-N 3.07Å; T475-A477 PolarHBondContact O-N 3.4Å; T475-E531 PolarHBondContact OG1-O 3.06Å
476	L	44.5	Very low	58.1	Low	107 Å²	107	88 Å²	88	56%	0.56	47%	0.468	S	S	*	.	B	Isolated β-bridge	trans	-71.7	117.2	-178.8	-137.5	83.5	0	0	0	109.2	T478 V484	L476-T478 PolarHBondContact O-N 3.3Å; L476-V484 HydrophobicContact CD2-CB 4.48Å; L476-V484 HydrophobicContact CD2-CG1 3.84Å; L476-V484 HydrophobicContact CD2-CG2 4Å
477	A	44.2	Very low	56.8	Low	43 Å²	43	91.8 Å²	91.8	36%	0.355	49%	0.485	S	S	.	.			trans	-78.3	26.9	-166.3	0	0	0	0	0	115.9	T475 L529 E531	T475-A477 PolarHBondContact O-N 3.4Å; A477-L529 PolarHBondContact N-O 2.84Å; A477-E531 HydrophobicContact CB-CB 3.99Å
478	T	41.7	Very low	55.7	Low	66 Å²	66	92.9 Å²	92.9	41%	0.405	49%	0.492	S	S	.	.			trans	-144	123.4	-176.2	-34.6	0	0	0	0	114.4	L476 N480	L476-T478 PolarHBondContact O-N 3.3Å; T478-N480 PolarHBondContact O-N 3.42Å
479	T	42.4	Very low	54.5	Low	145 Å²	145	91.7 Å²	91.7	89%	0.89	49%	0.49	S	S	*	.	S	Bend	trans	-62.2	-10.4	-179.8	-47.5	0	0	0	0	114.3
480	N	45.2	Very low	53.6	Low	90 Å²	90	91.8 Å²	91.8	48%	0.481	49%	0.491	S	S	.	.			trans	-109.9	94.8	-179	-71.7	-19.7	0	0	0	111.9	T478 T482 V483	T478-N480 PolarHBondContact O-N 3.42Å; N480-T482 PolarHBondContact O-N 2.81Å; N480-V483 HydrophobicContact CB-CB 4.35Å; N480-V483 HydrophobicContact CB-CG2 3.92Å; N480-V483 PolarHBondContact O-N 3.12Å; N480-V483 VanDerWaalsContact O-N 3.14Å
481	K	46.3	Very low	52.9	Low	185 Å²	185	94.5 Å²	94.5	80%	0.804	51%	0.506	S	S	*	.	H	α-helix	trans	-51.2	-26.1	170.7	-78.1	-178.8	176.1	176.3	0	113.4	L485	K481-L485 PolarHBondContact O-N 3.35Å
482	T	48.1	Very low	52.2	Low	99 Å²	99	94.3 Å²	94.3	61%	0.607	51%	0.512	S	S	*	.	H	α-helix	trans	-72.6	-38.9	-179.4	48.8	0	0	0	0	113.4	N480 Q486	N480-T482 PolarHBondContact O-N 2.81Å; T482-Q486 WeakPolarHBondContact O-CB 3.49Å; T482-Q486 PolarHBondContact O-N 2.93Å; T482-Q486 VanDerWaalsContact O-N 3.1Å
483	V	51.3	Low	51.9	Low	58 Å²	58	92.3 Å²	92.3	35%	0.352	51%	0.506	S	S	.	.	H	α-helix	trans	-73	-35	-178.4	178.3	0	0	0	0	111	N480 Q486 Q487	N480-V483 HydrophobicContact CB-CB 4.35Å; N480-V483 HydrophobicContact CB-CG2 3.92Å; N480-V483 PolarHBondContact O-N 3.12Å; N480-V483 VanDerWaalsContact O-N 3.14Å; V483-Q486 PolarHBondContact O-N 3.4Å; V483-Q487 PolarHBondContact O-N 3.17Å
484	V	51.8	Low	51.9	Low	21 Å²	21	92.6 Å²	92.6	13%	0.127	51%	0.509	C	S	.	.	H	α-helix	trans	-66.5	-45.3	176.2	177.2	0	0	0	0	111.3	L476 Q486 Q487 I488	L476-V484 HydrophobicContact CD2-CB 4.48Å; L476-V484 HydrophobicContact CD2-CG1 3.84Å; L476-V484 HydrophobicContact CD2-CG2 4Å; V484-Q486 VanDerWaalsContact C-N 3.26Å; V484-Q486 PolarHBondContact O-N 2.83Å; V484-Q487 PolarHBondContact O-N 3.05Å; V484-I488 HydrophobicContact CG1-CD1 3.75Å; V484-I488 HydrophobicContact CG1-CG1 4.44Å; V484-I488 WeakPolarHBondContact O-CB 3.39Å; V484-I488 WeakPolarHBondContact O-CG1 3.35Å; V484-I488 PolarHBondContact O-N 3.43Å
485	L	54.3	Low	52.4	Low	111 Å²	111	92.2 Å²	92.2	58%	0.581	50%	0.5	S	S	*	.	H	α-helix	trans	-63	-35	174.5	-82.2	167.9	0	0	0	112	K481 N489	K481-L485 PolarHBondContact O-N 3.35Å; L485-N489 WeakPolarHBondContact O-CB 3.45Å; L485-N489 PolarHBondContact O-N 3.41Å
486	Q	54.5	Low	52.3	Low	121 Å²	121	94.9 Å²	94.9	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-69.4	-43.2	178.2	-164	171.4	-4.6	0	0	112.2	T482 V483 V484 N489 E490	T482-Q486 WeakPolarHBondContact O-CB 3.49Å; T482-Q486 PolarHBondContact O-N 2.93Å; T482-Q486 VanDerWaalsContact O-N 3.1Å; V483-Q486 PolarHBondContact O-N 3.4Å; V484-Q486 VanDerWaalsContact C-N 3.26Å; V484-Q486 PolarHBondContact O-N 2.83Å; Q486-N489 PolarHBondContact O-N 2.84Å; Q486-E490 PolarHBondContact O-N 3.45Å
487	Q	55.2	Low	52.7	Low	92 Å²	92	94.9 Å²	94.9	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-71.5	-32.7	176.2	-80.9	175.8	-49.9	0	0	113.2	V483 V484 E490 I491	V483-Q487 PolarHBondContact O-N 3.17Å; V484-Q487 PolarHBondContact O-N 3.05Å; Q487-E490 PolarHBondContact O-N 3.4Å; Q487-I491 WeakPolarHBondContact O-CD1 3.39Å; Q487-I491 VanDerWaalsContact O-CG1 3.28Å; Q487-I491 WeakPolarHBondContact O-CG1 3.05Å; Q487-I491 PolarHBondContact O-N 3.49Å; Q487-I491 VanDerWaalsContact O-N 3.13Å
488	I	61.3	Low	53	Low	80 Å²	80	99.4 Å²	99.4	41%	0.41	52%	0.522	S	S	.	.	H	α-helix	trans	-66.3	-41	172.5	-70.1	170.2	0	0	0	110.4	V484 I491 L492	V484-I488 HydrophobicContact CG1-CD1 3.75Å; V484-I488 HydrophobicContact CG1-CG1 4.44Å; V484-I488 WeakPolarHBondContact O-CB 3.39Å; V484-I488 WeakPolarHBondContact O-CG1 3.35Å; V484-I488 PolarHBondContact O-N 3.43Å; I488-I491 PolarHBondContact O-N 3.14Å; I488-L492 WeakPolarHBondContact O-CB 3.26Å; I488-L492 PolarHBondContact O-N 3.44Å
489	N	58	Low	53.4	Low	98 Å²	98	100.3 Å²	100.3	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-65.6	-38.9	175.4	-81.1	-7.1	0	0	0	112.5	L485 Q486 I491 L492 D493	L485-N489 WeakPolarHBondContact O-CB 3.45Å; L485-N489 PolarHBondContact O-N 3.41Å; Q486-N489 PolarHBondContact O-N 2.84Å; N489-I491 VanDerWaalsContact C-N 3.33Å; N489-I491 PolarHBondContact O-N 2.89Å; N489-L492 PolarHBondContact O-N 2.96Å; N489-D493 PolarHBondContact O-N 3.25Å
490	E	59.5	Low	53.5	Low	125 Å²	125	98 Å²	98	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-64.3	-35.7	175.1	-77.6	178.7	174.4	0	0	112.9	Q486 Q487 G494	Q486-E490 PolarHBondContact O-N 3.45Å; Q487-E490 PolarHBondContact O-N 3.4Å; E490-G494 PolarHBondContact O-N 3.07Å; E490-G494 VanDerWaalsContact O-N 3.09Å
491	I	61.8	Low	53.4	Low	91 Å²	91	99.2 Å²	99.2	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-72	-36.1	175.2	-66.4	166.7	0	0	0	110.8	Q487 I488 N489 G494 I495	Q487-I491 WeakPolarHBondContact O-CD1 3.39Å; Q487-I491 VanDerWaalsContact O-CG1 3.28Å; Q487-I491 WeakPolarHBondContact O-CG1 3.05Å; Q487-I491 PolarHBondContact O-N 3.49Å; Q487-I491 VanDerWaalsContact O-N 3.13Å; I488-I491 PolarHBondContact O-N 3.14Å; N489-I491 VanDerWaalsContact C-N 3.33Å; N489-I491 PolarHBondContact O-N 2.89Å; I491-G494 PolarHBondContact O-N 3.43Å; I491-I495 HydrophobicContact CG2-CD1 4.35Å; I491-I495 WeakPolarHBondContact O-CG1 3.3Å; I491-I495 PolarHBondContact O-N 2.76Å
492	L	58.2	Low	53	Low	106 Å²	106	99.3 Å²	99.3	56%	0.555	53%	0.525	S	S	*	.	H	α-helix	trans	-67.4	-42	176.5	-151.6	73.7	0	0	0	111.5	I488 N489 G494 I495 E496	I488-L492 WeakPolarHBondContact O-CB 3.26Å; I488-L492 PolarHBondContact O-N 3.44Å; N489-L492 PolarHBondContact O-N 2.96Å; L492-G494 VanDerWaalsContact C-N 3.29Å; L492-G494 PolarHBondContact O-N 3.04Å; L492-I495 PolarHBondContact O-N 3.31Å; L492-I495 VanDerWaalsContact O-N 3.15Å; L492-E496 PolarHBondContact O-N 3.33Å; L492-E496 VanDerWaalsContact O-N 3.11Å
493	D	56.4	Low	52.5	Low	99 Å²	99	102 Å²	102	53%	0.529	54%	0.535	S	S	.	.	H	α-helix	trans	-62.5	-34.7	172.4	-101.7	3	0	0	0	112	N489 I495 N497	N489-D493 PolarHBondContact O-N 3.25Å; D493-I495 VanDerWaalsContact C-N 3.29Å; D493-I495 PolarHBondContact O-N 3.24Å; D493-N497 PolarHBondContact O-N 3.46Å; D493-N497 PolarHBondContact O-ND2 2.97Å
494	G	56.7	Low	51.8	Low	35 Å²	35	108.4 Å²	108.4	36%	0.361	56%	0.561	S	S	.	*	H	α-helix	trans	-65.4	-29.6	174.6	0	0	0	0	0	113.8	E490 I491 L492	E490-G494 PolarHBondContact O-N 3.07Å; E490-G494 VanDerWaalsContact O-N 3.09Å; I491-G494 PolarHBondContact O-N 3.43Å; L492-G494 VanDerWaalsContact C-N 3.29Å; L492-G494 PolarHBondContact O-N 3.04Å
495	I	58.5	Low	51	Low	97 Å²	97	115.6 Å²	115.6	50%	0.497	59%	0.592	S	S	.	*	H	α-helix	trans	-82.8	-37.1	178.9	-66.4	166.9	0	0	0	110.9	I491 L492 D493 N497 Q498 T499	I491-I495 HydrophobicContact CG2-CD1 4.35Å; I491-I495 WeakPolarHBondContact O-CG1 3.3Å; I491-I495 PolarHBondContact O-N 2.76Å; L492-I495 PolarHBondContact O-N 3.31Å; L492-I495 VanDerWaalsContact O-N 3.15Å; D493-I495 VanDerWaalsContact C-N 3.29Å; D493-I495 PolarHBondContact O-N 3.24Å; I495-N497 VanDerWaalsContact C-N 3.29Å; I495-N497 PolarHBondContact O-N 3.39Å; I495-Q498 PolarHBondContact O-N 3.13Å; I495-Q498 VanDerWaalsContact O-N 3.13Å; I495-T499 PolarHBondContact O-N 3.27Å; I495-T499 PolarHBondContact O-OG1 3.09Å
496	E	49.1	Very low	49.9	Very low	123 Å²	123	119.7 Å²	119.7	58%	0.575	61%	0.606	S	S	*	*	H	α-helix	trans	-66.5	-29.3	178.4	-161.3	168.2	-171.5	0	0	112.9	L492 T499 T500	L492-E496 PolarHBondContact O-N 3.33Å; L492-E496 VanDerWaalsContact O-N 3.11Å; E496-T499 PolarHBondContact O-OG1 3.47Å; E496-T499 VanDerWaalsContact O-OG1 3.07Å; E496-T500 PolarHBondContact O-OG1 3.22Å
497	N	51.5	Low	49.2	Very low	107 Å²	107	122.7 Å²	122.7	57%	0.572	62%	0.624	S	S	*	*	H	α-helix	trans	-77	-18.2	173.8	-71.7	-47.9	0	0	0	114	D493 I495 T500 T501	D493-N497 PolarHBondContact O-N 3.46Å; D493-N497 PolarHBondContact O-ND2 2.97Å; I495-N497 VanDerWaalsContact C-N 3.29Å; I495-N497 PolarHBondContact O-N 3.39Å; N497-T500 PolarHBondContact O-OG1 2.87Å; N497-T501 PolarHBondContact O-OG1 2.94Å
498	Q	51.5	Low	47.9	Very low	138 Å²	138	121 Å²	121	65%	0.645	63%	0.632	S	S	*	*	H	α-helix	trans	-88.4	-27	176.1	-72.1	-174.6	14.9	0	0	113.1	I495	I495-Q498 PolarHBondContact O-N 3.13Å; I495-Q498 VanDerWaalsContact O-N 3.13Å
499	T	50.3	Low	46.4	Very low	85 Å²	85	123.4 Å²	123.4	52%	0.521	65%	0.65	S	S	.	*	H	α-helix	trans	-78.4	-26.8	176.8	47.4	0	0	0	0	112.5	I495 E496	I495-T499 PolarHBondContact O-N 3.27Å; I495-T499 PolarHBondContact O-OG1 3.09Å; E496-T499 PolarHBondContact O-OG1 3.47Å; E496-T499 VanDerWaalsContact O-OG1 3.07Å
500	T	44.9	Very low	45	Very low	96 Å²	96	125.8 Å²	125.8	59%	0.589	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-17.4	178.9	41.2	0	0	0	0	114.3	E496 N497	E496-T500 PolarHBondContact O-OG1 3.22Å; N497-T500 PolarHBondContact O-OG1 2.87Å
501	T	42	Very low	43.4	Very low	117 Å²	117	128 Å²	128	72%	0.718	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-3.5	-179.3	46.3	0	0	0	0	114.8	N497	N497-T501 PolarHBondContact O-OG1 2.94Å
502	K	38.5	Very low	41.7	Very low	187 Å²	187	128.6 Å²	128.6	81%	0.813	69%	0.687	S	S	*	*	S	Bend	trans	-112.8	2.9	178.2	-77.1	-177.9	177.5	173.5	0	114.8
503	L	38.3	Very low	40.2	Very low	155 Å²	155	131.5 Å²	131.5	81%	0.812	70%	0.702	S	S	*	*			trans	-102.3	26.9	-173	-151.7	93.3	0	0	0	115
504	E	34.8	Very low	39	Very low	192 Å²	192	136 Å²	136	90%	0.897	72%	0.718	S	S	*	*	S	Bend	trans	-113.4	3.1	175.2	-81.6	-165.4	153.3	0	0	115.2
505	H	35.9	Very low	37.4	Very low	172 Å²	172	143.5 Å²	143.5	80%	0.796	74%	0.743	S	S	*	*	S	Bend	trans	-141.2	81.2	179.1	-144.8	28.3	0	0	0	115.5
506	K	31.7	Very low	35.9	Very low	198 Å²	198	146.2 Å²	146.2	86%	0.861	75%	0.754	S	S	*	*				171	107.9	122.4	-95.1	171.9	177.4	179.4	0	111.4
507	I	39.4	Very low	34.9	Very low	183 Å²	183	146.2 Å²	146.2	94%	0.938	76%	0.764	S	S	*	*			trans	-76.2	135.2	161.4	-67.2	167.8	0	0	0	108.2
508	G	28.5	Very low	33.8	Very low	58 Å²	58	149.3 Å²	149.3	60%	0.598	78%	0.775	S	S	*	*			trans	153.5	97.1	159.4	0	0	0	0	0	116.8
509	T	28.6	Very low	32.6	Very low	130 Å²	130	151.3 Å²	151.3	80%	0.798	79%	0.785	S	S	*	*			trans	52.5	105.5	135.2	31.8	0	0	0	0	120.3
510	N	28.9	Very low	31.5	Very low	147 Å²	147	156.7 Å²	156.7	79%	0.786	80%	0.801	S	S	*	*				156.4	126.6	105.4	-80.1	-15.9	0	0	0	114.4
511	M	26.8	Very low	30.8	Very low	172 Å²	172	158.2 Å²	158.2	85%	0.847	81%	0.81	S	S	*	*			trans	0.9	132.7	147	-117.1	152.9	-70.5	0	0	121.3
512	S	25.7	Very low	30.2	Very low	104 Å²	104	158.7 Å²	158.7	73%	0.727	81%	0.808	S	S	*	*				111.1	134.9	126.9	80.7	0	0	0	0	120.1
513	L	26.9	Very low	30.1	Very low	166 Å²	166	155.3 Å²	155.3	87%	0.869	80%	0.803	S	S	*	*			trans	81.3	129.3	157.8	-85.9	120.8	0	0	0	121.5
514	F	30.1	Very low	29.9	Very low	195 Å²	195	156.7 Å²	156.7	86%	0.855	80%	0.802	S	S	*	*			trans	-42.3	138.8	168.2	-92.9	-110	0	0	0	114.7
515	E	24.6	Very low	30.2	Very low	192 Å²	192	152.3 Å²	152.3	90%	0.897	79%	0.785	S	S	*	*				-177	136.6	124.1	-102	175.4	177.4	0	0	111
516	H	26.2	Very low	30.2	Very low	154 Å²	154	147.1 Å²	147.1	71%	0.713	77%	0.766	S	S	*	*			trans	-65.9	154	174.7	-94.9	-75.8	0	0	0	111.7	E518	H516-E518 IonicContact CE1-OE1 3.73Å
517	P	29.1	Very low	30.8	Very low	123 Å²	123	146.7 Å²	146.7	80%	0.799	77%	0.767	S	S	*	*				-139.6	148.7	75.3	31	-10.9	0	0	0	115.3	E519	P517-E519 PolarHBondContact O-N 2.95Å; P517-E519 VanDerWaalsContact O-N 3.09Å
518	E	27.4	Very low	30.9	Very low	171 Å²	171	143.9 Å²	143.9	80%	0.799	76%	0.759	S	S	*	*			trans	-66.8	100.1	174.9	-63.1	177.6	161.9	0	0	110.7	H516 K520	H516-E518 IonicContact CE1-OE1 3.73Å; E518-K520 PolarHBondContact O-N 3.03Å
519	E	25.7	Very low	31.4	Very low	181 Å²	181	142.5 Å²	142.5	85%	0.846	74%	0.737	S	S	*	*			trans	-67.5	112.7	160.9	-96.7	-177	151.9	0	0	108.9	P517 T521	P517-E519 PolarHBondContact O-N 2.95Å; P517-E519 VanDerWaalsContact O-N 3.09Å; E519-T521 PolarHBondContact O-N 3.39Å
520	K	27.6	Very low	32.2	Very low	198 Å²	198	139.5 Å²	139.5	86%	0.861	72%	0.719	S	S	*	*			trans	-62.6	98.6	163.6	-82	177.4	176	175.4	0	108.4	E518 L522	E518-K520 PolarHBondContact O-N 3.03Å; K520-L522 PolarHBondContact O-N 3.45Å
521	T	29.8	Very low	33	Very low	128 Å²	128	138.9 Å²	138.9	79%	0.785	71%	0.711	S	S	*	*			trans	-61.5	100.3	166.4	-44.2	0	0	0	0	108.4	E519 V523	E519-T521 PolarHBondContact O-N 3.39Å; T521-V523 PolarHBondContact O-N 3.31Å; T521-V523 VanDerWaalsContact O-N 3.1Å
522	L	29.7	Very low	34.1	Very low	127 Å²	127	133.2 Å²	133.2	67%	0.665	69%	0.688	S	S	*	*			trans	-79	93.5	-177.5	-143.4	151.4	0	0	0	108	K520 F524	K520-L522 PolarHBondContact O-N 3.45Å; L522-F524 HydrophobicContact CD2-CD2 3.89Å; L522-F524 HydrophobicContact CD2-CE2 3.74Å; L522-F524 HydrophobicContact CD2-CG 4.49Å; L522-F524 HydrophobicContact CD2-CZ 4.22Å; L522-F524 PolarHBondContact O-N 2.67Å; L522-F524 VanDerWaalsContact O-N 3.1Å
523	V	37.3	Very low	35.8	Very low	116 Å²	116	128.9 Å²	128.9	70%	0.703	66%	0.657	S	S	*	*			trans	-68.5	103.5	170.9	179.5	0	0	0	0	107.6	T521 L525	T521-V523 PolarHBondContact O-N 3.31Å; T521-V523 VanDerWaalsContact O-N 3.1Å; V523-L525 PolarHBondContact O-N 3.39Å; V523-L525 VanDerWaalsContact O-N 3.15Å
524	F	34.5	Very low	38	Very low	184 Å²	184	127.9 Å²	127.9	81%	0.807	64%	0.642	S	S	*	*			trans	-71.4	101.1	170.5	-90.9	-91.9	0	0	0	109	L522	L522-F524 HydrophobicContact CD2-CD2 3.89Å; L522-F524 HydrophobicContact CD2-CE2 3.74Å; L522-F524 HydrophobicContact CD2-CG 4.49Å; L522-F524 HydrophobicContact CD2-CZ 4.22Å; L522-F524 PolarHBondContact O-N 2.67Å; L522-F524 VanDerWaalsContact O-N 3.1Å
525	L	39.5	Very low	40.4	Very low	100 Å²	100	122.6 Å²	122.6	52%	0.524	62%	0.62	S	S	.	*			trans	-67.3	139.8	163.8	-84.7	154.9	0	0	0	109.1	V523 L529	V523-L525 PolarHBondContact O-N 3.39Å; V523-L525 VanDerWaalsContact O-N 3.15Å; L525-L529 HydrophobicContact CD2-CD1 4.47Å
526	P	37.3	Very low	43.1	Very low	63 Å²	63	115.7 Å²	115.7	41%	0.409	59%	0.586	S	S	.	*			trans	-62.6	139.6	-178.2	22.6	-30	0	0	0	111.9	T528 L529	P526-T528 PolarHBondContact O-N 2.94Å; P526-L529 HydrophobicContact CG-CD1 4.25Å; P526-L529 PolarHBondContact O-N 2.92Å
527	E	43	Very low	45.8	Very low	188 Å²	188	108.3 Å²	108.3	88%	0.879	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-56.3	-11.1	-176.7	-73.7	-178.3	149.7	0	0	114.7	L529	E527-L529 VanDerWaalsContact C-N 3.33Å; E527-L529 PolarHBondContact O-N 3.37Å
528	T	42.3	Very low	48.6	Very low	125 Å²	125	107.5 Å²	107.5	77%	0.767	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-80	-5.9	179.2	56.4	0	0	0	0	114.6	P526	P526-T528 PolarHBondContact O-N 2.94Å
529	L	39.7	Very low	51.6	Low	29 Å²	29	99.8 Å²	99.8	15%	0.152	50%	0.504	C	S	.	.	G	3₁₀ helix	trans	-107.2	-4.7	-177.7	-80.2	164.8	0	0	0	114.5	A477 L525 P526 E527	A477-L529 PolarHBondContact N-O 2.84Å; L525-L529 HydrophobicContact CD2-CD1 4.47Å; P526-L529 HydrophobicContact CG-CD1 4.25Å; P526-L529 PolarHBondContact O-N 2.92Å; E527-L529 VanDerWaalsContact C-N 3.33Å; E527-L529 PolarHBondContact O-N 3.37Å
530	V	43.4	Very low	54.6	Low	66 Å²	66	91.2 Å²	91.2	40%	0.4	46%	0.464	S	S	.	.	B	Isolated β-bridge	trans	-115.9	92.7	-174.6	-175.9	0	0	0	0	109.6	S532	V530-S532 PolarHBondContact O-N 3.18Å; V530-S532 VanDerWaalsContact O-N 3.17Å
531	E	46.5	Very low	57.6	Low	134 Å²	134	85.1 Å²	85.1	63%	0.626	44%	0.44	S	S	*	.			trans	-84.4	89.7	169.9	-161	151.3	-148.7	0	0	108.1	T475 A477 T533	T475-E531 PolarHBondContact OG1-O 3.06Å; A477-E531 HydrophobicContact CB-CB 3.99Å; E531-T533 PolarHBondContact O-N 3.11Å
532	S	49.7	Very low	60.5	Low	53 Å²	53	83 Å²	83	37%	0.371	42%	0.424	S	S	.	.			trans	-72.7	95.3	174.6	-69.5	0	0	0	0	109.2	V530 R534	V530-S532 PolarHBondContact O-N 3.18Å; V530-S532 VanDerWaalsContact O-N 3.17Å; S532-R534 PolarHBondContact O-N 3.12Å
533	T	62.5	Low	63.5	Low	13 Å²	13	77 Å²	77	8%	0.08	39%	0.392	C	S	.	.			trans	-74.5	66.1	177.1	59	0	0	0	0	111.8	E531 E535 R536 P537	E531-T533 PolarHBondContact O-N 3.11Å; T533-E535 WeakPolarHBondContact CA-OE1 3.4Å; T533-E535 WeakPolarHBondContact CA-OE2 3.46Å; T533-E535 WeakPolarHBondContact CB-OE1 3.37Å; T533-E535 WeakPolarHBondContact CG2-OE1 3.31Å; T533-E535 PolarHBondContact O-N 2.66Å; T533-R536 PolarHBondContact O-N 3.1Å; T533-R536 WeakPolarHBondContact OG1-CD 3.48Å; T533-P537 WeakPolarHBondContact O-CD 3.34Å
534	R	72.3	Confident	66.2	Low	146 Å²	146	72.1 Å²	72.1	55%	0.551	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.3	-178.4	-66.1	-179.2	-178.2	167.1	2.9	112.4	Y471 S532 P537 I538	Y471-R534 HydrophobicContact CD2-CG 4.43Å; Y471-R534 HydrophobicContact CE2-CG 4.38Å; S532-R534 PolarHBondContact O-N 3.12Å; R534-P537 WeakPolarHBondContact O-CD 3.14Å; R534-I538 WeakPolarHBondContact O-CD1 3.34Å; R534-I538 WeakPolarHBondContact O-CG1 3.43Å
535	E	80.1	Confident	69	Low	84 Å²	84	67.2 Å²	67.2	39%	0.393	34%	0.344	S	S	.	.	H	α-helix	trans	-71.1	-28.5	177	62.8	-72.7	162.7	0	0	113.3	T533 I538 L539 I594	T533-E535 WeakPolarHBondContact CA-OE1 3.4Å; T533-E535 WeakPolarHBondContact CA-OE2 3.46Å; T533-E535 WeakPolarHBondContact CB-OE1 3.37Å; T533-E535 WeakPolarHBondContact CG2-OE1 3.31Å; T533-E535 PolarHBondContact O-N 2.66Å; E535-I538 PolarHBondContact O-N 3.49Å; E535-L539 WeakPolarHBondContact O-CB 3.38Å; E535-L539 PolarHBondContact O-N 3.07Å; E535-I594 HydrophobicContact CB-CD1 4.11Å; E535-I594 HydrophobicContact CG-CD1 3.91Å; E535-I594 HydrophobicContact CG-CG1 4.05Å; E535-I594 HydrophobicContact CG-CG2 4.4Å
536	R	81	Confident	71.7	Confident	46 Å²	46	63 Å²	63	17%	0.174	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-53.4	-178.5	-66.2	176.8	-171.8	-156	-0.3	113	F470 T533 I538 L539 C540 I594 Q595	F470-R536 HydrophobicContact CB-CB 4.4Å; F470-R536 HydrophobicContact CG-CB 4.45Å; T533-R536 PolarHBondContact O-N 3.1Å; T533-R536 WeakPolarHBondContact OG1-CD 3.48Å; R536-I538 VanDerWaalsContact C-N 3.29Å; R536-I538 PolarHBondContact O-N 2.9Å; R536-L539 PolarHBondContact O-N 3.49Å; R536-C540 PolarHBondContact O-N 2.88Å; R536-C540 PolarHBondContact O-SG 3.3Å; R536-I594 HydrophobicContact CB-CG2 4.3Å; R536-I594 HydrophobicContact CG-CG2 3.59Å; R536-Q595 VanDerWaalsContact NH2-OE1 3.07Å
537	P	84.6	Confident	74.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.7	-37.1	178.4	-21	30.9	0	0	0	113.4	F467 F470 T533 R534 C540 L541	F467-P537 HydrophobicContact CD1-CB 3.61Å; F467-P537 HydrophobicContact CD2-CB 3.77Å; F467-P537 HydrophobicContact CE1-CB 3.53Å; F467-P537 HydrophobicContact CE2-CB 3.69Å; F467-P537 VanDerWaalsContact CE2-O 3.28Å; F467-P537 WeakPolarHBondContact CE2-O 3.27Å; F467-P537 HydrophobicContact CG-CB 3.74Å; F467-P537 HydrophobicContact CZ-CB 3.57Å; F467-P537 WeakPolarHBondContact CZ-O 3.43Å; F470-P537 HydrophobicContact CB-CG 3.85Å; T533-P537 WeakPolarHBondContact O-CD 3.34Å; R534-P537 WeakPolarHBondContact O-CD 3.14Å; P537-C540 WeakPolarHBondContact O-CB 3.39Å; P537-C540 PolarHBondContact O-N 3.23Å; P537-L541 WeakPolarHBondContact O-CB 3.37Å; P537-L541 PolarHBondContact O-N 3.42Å
538	I	87.9	Confident	76.7	Confident	106 Å²	106	53.1 Å²	53.1	54%	0.544	27%	0.274	S	S	.	.	H	α-helix	trans	-65.9	-45.4	179.8	-61.6	172	0	0	0	109.9	R534 E535 R536 L541 L542	R534-I538 WeakPolarHBondContact O-CD1 3.34Å; R534-I538 WeakPolarHBondContact O-CG1 3.43Å; E535-I538 PolarHBondContact O-N 3.49Å; R536-I538 VanDerWaalsContact C-N 3.29Å; R536-I538 PolarHBondContact O-N 2.9Å; I538-L541 PolarHBondContact O-N 3.29Å; I538-L542 PolarHBondContact O-N 3.26Å
539	L	88.7	Confident	79.2	Confident	9 Å²	9	56 Å²	56	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-62.6	-43.2	174.9	-178.2	61.5	0	0	0	111.3	E535 R536 L541 L542 L543 F591 I594 L596	E535-L539 WeakPolarHBondContact O-CB 3.38Å; E535-L539 PolarHBondContact O-N 3.07Å; R536-L539 PolarHBondContact O-N 3.49Å; L539-L541 VanDerWaalsContact C-N 3.32Å; L539-L541 PolarHBondContact O-N 3.46Å; L539-L542 PolarHBondContact O-N 2.95Å; L539-L543 HydrophobicContact CD1-CD1 4.45Å; L539-L543 HydrophobicContact CD1-CG 4.19Å; L539-L543 HydrophobicContact CG-CD1 4.14Å; L539-L543 HydrophobicContact CG-CG 4.31Å; L539-L543 WeakPolarHBondContact O-CB 3.34Å; L539-L543 VanDerWaalsContact O-CG 3.3Å; L539-L543 WeakPolarHBondContact O-CG 3.44Å; L539-L543 PolarHBondContact O-N 3.29Å; L539-F591 HydrophobicContact CD1-CD1 4.32Å; L539-F591 HydrophobicContact CD1-CD2 3.55Å; L539-F591 HydrophobicContact CD1-CE1 4.45Å; L539-F591 HydrophobicContact CD1-CE2 3.71Å; L539-F591 HydrophobicContact CD1-CG 3.88Å; L539-F591 HydrophobicContact CD1-CZ 4.17Å; L539-F591 HydrophobicContact CD2-CB 3.61Å; L539-F591 HydrophobicContact CD2-CD1 4.42Å; L539-F591 HydrophobicContact CD2-CD2 4.21Å; L539-F591 HydrophobicContact CD2-CG 3.85Å; L539-I594 HydrophobicContact CD2-CB 3.92Å; L539-I594 HydrophobicContact CD2-CD1 4.01Å; L539-I594 HydrophobicContact CD2-CG2 3.81Å; L539-L596 HydrophobicContact CD2-CD1 4.32Å; L539-L596 HydrophobicContact CD2-CD2 3.82Å; L539-L596 HydrophobicContact CD2-CG 4.2Å; L539-L596 HydrophobicContact CG-CD2 4.09Å
540	C	88.3	Confident	81.8	Confident	1 Å²	1	56 Å²	56	1%	0.007	27%	0.271	C	S	.	.	H	α-helix	trans	-56.9	-44.4	175.1	-69.3	0	0	0	0	112.1	I466 R536 P537 L543 M544 P744	I466-C540 HydrophobicContact CG2-CB 4.11Å; R536-C540 PolarHBondContact O-N 2.88Å; R536-C540 PolarHBondContact O-SG 3.3Å; P537-C540 WeakPolarHBondContact O-CB 3.39Å; P537-C540 PolarHBondContact O-N 3.23Å; C540-L543 PolarHBondContact O-N 3.37Å; C540-M544 WeakPolarHBondContact O-CB 3.22Å; C540-M544 PolarHBondContact O-N 3.09Å; C540-P744 HydrophobicContact CB-CB 3.92Å; C540-P744 HydrophobicContact CB-CG 3.62Å; C540-P744 WeakPolarHBondContact O-CB 3.35Å; C540-P744 WeakPolarHBondContact SG-CG 3.28Å
541	L	90.9	Very high	84.1	Confident	69 Å²	69	52.9 Å²	52.9	36%	0.361	25%	0.252	S	S	.	.	H	α-helix	trans	-65.5	-40.7	177.4	-173.3	133.4	0	0	0	111.9	F467 P537 I538 L539 M544 L545	F467-L541 HydrophobicContact CE2-CB 4.06Å; F467-L541 HydrophobicContact CE2-CD1 4.07Å; F467-L541 HydrophobicContact CZ-CB 4.05Å; F467-L541 HydrophobicContact CZ-CD1 3.91Å; P537-L541 WeakPolarHBondContact O-CB 3.37Å; P537-L541 PolarHBondContact O-N 3.42Å; I538-L541 PolarHBondContact O-N 3.29Å; L539-L541 VanDerWaalsContact C-N 3.32Å; L539-L541 PolarHBondContact O-N 3.46Å; L541-M544 PolarHBondContact O-N 3.24Å; L541-L545 HydrophobicContact CD2-CD1 3.72Å; L541-L545 HydrophobicContact CG-CD1 4.1Å; L541-L545 WeakPolarHBondContact O-CB 3.16Å; L541-L545 WeakPolarHBondContact O-CG 3.25Å; L541-L545 PolarHBondContact O-N 3.46Å
542	L	92.4	Very high	86.2	Confident	84 Å²	84	51 Å²	51	44%	0.44	24%	0.24	S	C	.	.	H	α-helix	trans	-62.9	-44.6	175.1	-176.8	148.6	0	0	0	111.7	I538 L539 G546	I538-L542 PolarHBondContact O-N 3.26Å; L539-L542 PolarHBondContact O-N 2.95Å; L542-G546 WeakPolarHBondContact O-CA 3.43Å; L542-G546 PolarHBondContact O-N 3.07Å
543	L	92.2	Very high	88.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-42.4	178.1	-69.1	177.7	0	0	0	111.7	L539 C540 T547 F583 I586 L596 P742 P744 V745	L539-L543 HydrophobicContact CD1-CD1 4.45Å; L539-L543 HydrophobicContact CD1-CG 4.19Å; L539-L543 HydrophobicContact CG-CD1 4.14Å; L539-L543 HydrophobicContact CG-CG 4.31Å; L539-L543 WeakPolarHBondContact O-CB 3.34Å; L539-L543 VanDerWaalsContact O-CG 3.3Å; L539-L543 WeakPolarHBondContact O-CG 3.44Å; L539-L543 PolarHBondContact O-N 3.29Å; C540-L543 PolarHBondContact O-N 3.37Å; L543-T547 WeakPolarHBondContact O-CB 3.4Å; L543-T547 PolarHBondContact O-N 2.92Å; L543-T547 PolarHBondContact O-OG1 3.08Å; L543-F583 HydrophobicContact CD2-CB 4.46Å; L543-F583 HydrophobicContact CD2-CD1 3.98Å; L543-F583 WeakPolarHBondContact CD2-O 3.29Å; L543-I586 HydrophobicContact CD2-CG2 4.42Å; L543-L596 HydrophobicContact CD1-CD1 3.62Å; L543-L596 HydrophobicContact CD1-CD2 3.82Å; L543-L596 HydrophobicContact CD1-CG 4.4Å; L543-P742 HydrophobicContact CD1-CG 4.21Å; L543-P744 HydrophobicContact CB-CB 4.24Å; L543-V745 HydrophobicContact CB-CG2 4.11Å
544	M	92.9	Very high	89.4	Confident	14 Å²	14	50.9 Å²	50.9	7%	0.069	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-55.5	177.7	-179.9	-173	67.5	0	0	111.7	T463 C540 L541 T547 L548 P744 G748 L751	T463-M544 HydrophobicContact CG2-CE 4.25Å; T463-M544 HydrophobicContact CG2-SD 4.47Å; T463-M544 PolarHBondContact OG1-SD 3.28Å; C540-M544 WeakPolarHBondContact O-CB 3.22Å; C540-M544 PolarHBondContact O-N 3.09Å; L541-M544 PolarHBondContact O-N 3.24Å; M544-T547 PolarHBondContact O-N 3.14Å; M544-L548 PolarHBondContact O-N 3.35Å; M544-P744 WeakPolarHBondContact CA-O 3.3Å; M544-G748 WeakPolarHBondContact O-CA 3.21Å; M544-L751 HydrophobicContact CE-CD1 4.31Å; M544-L751 HydrophobicContact CG-CD1 3.9Å; M544-L751 HydrophobicContact SD-CD1 3.91Å
545	L	94.6	Very high	90.1	Very high	82 Å²	82	45.3 Å²	45.3	43%	0.429	22%	0.219	S	C	.	.	H	α-helix	trans	-69.6	-34.2	-178.5	-67.2	178.2	0	0	0	112.1	L541 L548 W549	L541-L545 HydrophobicContact CD2-CD1 3.72Å; L541-L545 HydrophobicContact CG-CD1 4.1Å; L541-L545 WeakPolarHBondContact O-CB 3.16Å; L541-L545 WeakPolarHBondContact O-CG 3.25Å; L541-L545 PolarHBondContact O-N 3.46Å; L545-L548 PolarHBondContact O-N 3.29Å; L545-W549 VanDerWaalsContact O-CB 3.32Å; L545-W549 WeakPolarHBondContact O-CB 3.47Å; L545-W549 PolarHBondContact O-N 3.28Å
546	G	94.5	Very high	90.4	Very high	12 Å²	12	44.8 Å²	44.8	12%	0.124	22%	0.218	C	C	.	.	H	α-helix	trans	-63.6	-45.5	175.8	0	0	0	0	0	112.2	L542 L548 W549 L550 F583	L542-G546 WeakPolarHBondContact O-CA 3.43Å; L542-G546 PolarHBondContact O-N 3.07Å; G546-L548 VanDerWaalsContact C-N 3.32Å; G546-L548 PolarHBondContact O-N 3.36Å; G546-W549 PolarHBondContact O-N 2.95Å; G546-L550 WeakPolarHBondContact O-CB 3.22Å; G546-L550 PolarHBondContact O-N 3.29Å; G546-F583 WeakPolarHBondContact O-CE2 3.07Å; G546-F583 WeakPolarHBondContact O-CZ 3.43Å
547	T	93.3	Very high	90.6	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-60	-43.6	176.2	-55.4	0	0	0	0	111.1	L543 M544 G551 V580 F583 V745	L543-T547 WeakPolarHBondContact O-CB 3.4Å; L543-T547 PolarHBondContact O-N 2.92Å; L543-T547 PolarHBondContact O-OG1 3.08Å; M544-T547 PolarHBondContact O-N 3.14Å; T547-G551 PolarHBondContact O-N 3.42Å; T547-V580 HydrophobicContact CG2-CG2 4.11Å; T547-F583 WeakPolarHBondContact OG1-CB 3.25Å; T547-V745 HydrophobicContact CG2-CG1 4.09Å
548	L	93.4	Very high	90.4	Very high	42 Å²	42	47 Å²	47	22%	0.22	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-49.5	174.5	172.6	64.6	0	0	0	111.8	M544 L545 G546 G551 Y552 L751 A755	M544-L548 PolarHBondContact O-N 3.35Å; L545-L548 PolarHBondContact O-N 3.29Å; G546-L548 VanDerWaalsContact C-N 3.32Å; G546-L548 PolarHBondContact O-N 3.36Å; L548-G551 PolarHBondContact O-N 2.93Å; L548-Y552 VanDerWaalsContact O-CB 3.29Å; L548-Y552 WeakPolarHBondContact O-CB 3.36Å; L548-Y552 PolarHBondContact O-N 3.13Å; L548-L751 HydrophobicContact CB-CB 4.45Å; L548-L751 HydrophobicContact CD1-CB 4.04Å; L548-L751 HydrophobicContact CD2-CB 4.04Å; L548-L751 HydrophobicContact CD2-CD1 4.17Å; L548-L751 HydrophobicContact CG-CB 4.4Å; L548-A755 HydrophobicContact CD1-CB 4.28Å
549	W	94.8	Very high	89.8	Confident	185 Å²	185	50 Å²	50	70%	0.701	24%	0.235	S	C	*	.	H	α-helix	trans	-60.6	-50.1	-176.6	172.8	79.1	0	0	0	111.7	L545 G546 Y552 A553	L545-W549 VanDerWaalsContact O-CB 3.32Å; L545-W549 WeakPolarHBondContact O-CB 3.47Å; L545-W549 PolarHBondContact O-N 3.28Å; G546-W549 PolarHBondContact O-N 2.95Å; W549-Y552 PolarHBondContact O-N 2.85Å; W549-A553 VanDerWaalsContact O-CB 3.24Å; W549-A553 WeakPolarHBondContact O-CB 3.48Å; W549-A553 PolarHBondContact O-N 3.05Å
550	L	94.3	Very high	89.4	Confident	30 Å²	30	50.9 Å²	50.9	16%	0.157	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-42.2	179	-179.3	61.8	0	0	0	111.4	G546 Y552 A553 L554 I582 F583	G546-L550 WeakPolarHBondContact O-CB 3.22Å; G546-L550 PolarHBondContact O-N 3.29Å; L550-Y552 PolarHBondContact O-N 3.16Å; L550-A553 PolarHBondContact O-N 3.37Å; L550-L554 HydrophobicContact CD1-CD1 4.24Å; L550-L554 HydrophobicContact CD1-CG 4.13Å; L550-L554 HydrophobicContact CG-CD1 4.18Å; L550-L554 HydrophobicContact CG-CG 4.45Å; L550-L554 WeakPolarHBondContact O-CB 3.27Å; L550-L554 VanDerWaalsContact O-CG 3.31Å; L550-L554 WeakPolarHBondContact O-CG 3.34Å; L550-L554 PolarHBondContact O-N 3.25Å; L550-I582 HydrophobicContact CD2-CB 4.13Å; L550-I582 HydrophobicContact CD2-CD1 3.94Å; L550-I582 HydrophobicContact CD2-CG2 3.98Å; L550-F583 HydrophobicContact CB-CD2 4.41Å; L550-F583 HydrophobicContact CB-CE2 3.67Å; L550-F583 HydrophobicContact CD2-CD2 4.03Å; L550-F583 HydrophobicContact CD2-CE2 3.67Å; L550-F583 HydrophobicContact CG-CE2 4.33Å
551	G	90.7	Very high	88.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-49.7	177.3	0	0	0	0	0	111.6	T547 L548 L554 Y555 S579 Y752	T547-G551 PolarHBondContact O-N 3.42Å; L548-G551 PolarHBondContact O-N 2.93Å; G551-L554 PolarHBondContact O-N 3.49Å; G551-Y555 WeakPolarHBondContact O-CB 3.35Å; G551-Y555 PolarHBondContact O-N 3.38Å; G551-S579 WeakPolarHBondContact CA-OG 3.22Å; G551-S579 PolarHBondContact N-OG 3.14Å; G551-Y752 VanDerWaalsContact C-CE2 3.41Å; G551-Y752 WeakPolarHBondContact O-CE2 2.92Å
552	Y	90.2	Very high	88.5	Confident	95 Å²	95	61.4 Å²	61.4	37%	0.373	29%	0.293	S	S	.	.	H	α-helix	trans	-67.3	-37.5	179.5	-168	-102.9	0	0	0	112.4	L548 W549 L550 Y555 L556	L548-Y552 VanDerWaalsContact O-CB 3.29Å; L548-Y552 WeakPolarHBondContact O-CB 3.36Å; L548-Y552 PolarHBondContact O-N 3.13Å; W549-Y552 PolarHBondContact O-N 2.85Å; L550-Y552 PolarHBondContact O-N 3.16Å; Y552-Y555 HydrophobicContact CD2-CD1 4.43Å; Y552-Y555 HydrophobicContact CE2-CD1 4.34Å; Y552-Y555 WeakPolarHBondContact O-CB 3.42Å; Y552-Y555 PolarHBondContact O-N 2.87Å; Y552-L556 HydrophobicContact CE1-CD1 4.31Å; Y552-L556 WeakPolarHBondContact O-CB 3.47Å; Y552-L556 PolarHBondContact O-N 3.16Å
553	A	91.4	Very high	88	Confident	39 Å²	39	62.1 Å²	62.1	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-47.6	174.7	0	0	0	0	0	111.7	W549 L550 Y555 L556 I557	W549-A553 VanDerWaalsContact O-CB 3.24Å; W549-A553 WeakPolarHBondContact O-CB 3.48Å; W549-A553 PolarHBondContact O-N 3.05Å; L550-A553 PolarHBondContact O-N 3.37Å; A553-Y555 VanDerWaalsContact C-N 3.32Å; A553-Y555 PolarHBondContact O-N 3.48Å; A553-L556 PolarHBondContact O-N 2.8Å; A553-L556 VanDerWaalsContact O-N 3.17Å; A553-I557 WeakPolarHBondContact O-CG1 3.42Å; A553-I557 PolarHBondContact O-N 2.74Å; A553-I557 VanDerWaalsContact O-N 3.13Å
554	L	89.9	Confident	87.5	Confident	23 Å²	23	67.9 Å²	67.9	12%	0.12	33%	0.327	C	S	.	.	H	α-helix	trans	-64.1	-36.4	176.8	-68.2	178.9	0	0	0	112.2	L550 G551 I557 V571 A575 I578	L550-L554 HydrophobicContact CD1-CD1 4.24Å; L550-L554 HydrophobicContact CD1-CG 4.13Å; L550-L554 HydrophobicContact CG-CD1 4.18Å; L550-L554 HydrophobicContact CG-CG 4.45Å; L550-L554 WeakPolarHBondContact O-CB 3.27Å; L550-L554 VanDerWaalsContact O-CG 3.31Å; L550-L554 WeakPolarHBondContact O-CG 3.34Å; L550-L554 PolarHBondContact O-N 3.25Å; G551-L554 PolarHBondContact O-N 3.49Å; L554-I557 HydrophobicContact CD2-CD1 3.71Å; L554-I557 WeakPolarHBondContact O-CB 3.49Å; L554-I557 PolarHBondContact O-N 3.37Å; L554-V571 HydrophobicContact CD2-CG1 3.86Å; L554-A575 HydrophobicContact CB-CB 3.54Å; L554-I578 HydrophobicContact CD1-CB 3.97Å; L554-I578 HydrophobicContact CD1-CG2 3.65Å
555	Y	85.4	Confident	86.6	Confident	30 Å²	30	69.1 Å²	69.1	12%	0.118	34%	0.344	C	S	.	.	H	α-helix	trans	-62	-43.1	172.1	175.3	-103.8	0	0	0	111.8	G551 Y552 A553 I557 K558 T756 D759	G551-Y555 WeakPolarHBondContact O-CB 3.35Å; G551-Y555 PolarHBondContact O-N 3.38Å; Y552-Y555 HydrophobicContact CD2-CD1 4.43Å; Y552-Y555 HydrophobicContact CE2-CD1 4.34Å; Y552-Y555 WeakPolarHBondContact O-CB 3.42Å; Y552-Y555 PolarHBondContact O-N 2.87Å; A553-Y555 VanDerWaalsContact C-N 3.32Å; A553-Y555 PolarHBondContact O-N 3.48Å; Y555-I557 VanDerWaalsContact C-N 3.27Å; Y555-I557 PolarHBondContact O-N 2.77Å; Y555-K558 WeakPolarHBondContact O-CB 3.49Å; Y555-K558 PolarHBondContact O-N 3.16Å; Y555-T756 HydrophobicContact CD1-CG2 4.41Å; Y555-T756 HydrophobicContact CD2-CG2 4.39Å; Y555-T756 HydrophobicContact CG-CG2 4.32Å; Y555-D759 WeakPolarHBondContact CE1-OD2 3.28Å; Y555-D759 PolarHBondContact OH-OD2 3.31Å
556	L	86.2	Confident	85.5	Confident	72 Å²	72	73.6 Å²	73.6	38%	0.377	36%	0.36	S	S	.	.	H	α-helix	trans	-71.5	-20.3	-178.5	-144.6	72.8	0	0	0	113.4	Y552 A553 K558 R559 S560	Y552-L556 HydrophobicContact CE1-CD1 4.31Å; Y552-L556 WeakPolarHBondContact O-CB 3.47Å; Y552-L556 PolarHBondContact O-N 3.16Å; A553-L556 PolarHBondContact O-N 2.8Å; A553-L556 VanDerWaalsContact O-N 3.17Å; L556-K558 PolarHBondContact O-N 3.03Å; L556-R559 PolarHBondContact O-N 3Å; L556-S560 PolarHBondContact O-N 3.35Å
557	I	86.6	Confident	84.8	Confident	40 Å²	40	77 Å²	77	21%	0.205	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-53.3	-29.8	173.7	-72.1	172.4	0	0	0	110.8	A553 L554 Y555 R559 S560 L563 R568 V571	A553-I557 WeakPolarHBondContact O-CG1 3.42Å; A553-I557 PolarHBondContact O-N 2.74Å; A553-I557 VanDerWaalsContact O-N 3.13Å; L554-I557 HydrophobicContact CD2-CD1 3.71Å; L554-I557 WeakPolarHBondContact O-CB 3.49Å; L554-I557 PolarHBondContact O-N 3.37Å; Y555-I557 VanDerWaalsContact C-N 3.27Å; Y555-I557 PolarHBondContact O-N 2.77Å; I557-R559 PolarHBondContact O-N 2.89Å; I557-S560 WeakPolarHBondContact O-CB 3.42Å; I557-S560 PolarHBondContact O-N 3.08Å; I557-L563 HydrophobicContact CG2-CD1 3.97Å; I557-R568 HydrophobicContact CG2-CG 4.08Å; I557-R568 WeakPolarHBondContact O-CD 3.25Å; I557-R568 VanDerWaalsContact O-CG 3.25Å; I557-R568 WeakPolarHBondContact O-CG 3.48Å; I557-V571 HydrophobicContact CD1-CG1 4.14Å
558	K	78.8	Confident	84.3	Confident	54 Å²	54	78.9 Å²	78.9	24%	0.235	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-54.8	-35.6	175.1	-164.2	166.7	-171.4	153.7	0	114.8	Y555 L556 R568	Y555-K558 WeakPolarHBondContact O-CB 3.49Å; Y555-K558 PolarHBondContact O-N 3.16Å; L556-K558 PolarHBondContact O-N 3.03Å; K558-R568 VanDerWaalsContact O-CD 3.25Å; K558-R568 WeakPolarHBondContact O-CD 3.32Å; K558-R568 PolarHBondContact O-NE 3.37Å
559	R	76.4	Confident	83.4	Confident	168 Å²	168	80.7 Å²	80.7	63%	0.634	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-90.3	-15	179.6	-63.5	-177.2	-178.1	175.8	4.5	112.3	L556 I557 D759	L556-R559 PolarHBondContact O-N 3Å; I557-R559 PolarHBondContact O-N 2.89Å; R559-D759 IonicContact CZ-OD1 2.89Å; R559-D759 IonicContact CZ-OD2 3.83Å; R559-D759 IonicContact NH1-OD1 3.65Å; R559-D759 VanDerWaalsContact NH2-CG 3.28Å; R559-D759 IonicContact NH2-OD1 3.3Å; R559-D759 PolarHBondContact NH2-OD1 2.86Å; R559-D759 IonicContact NH2-OD2 2.98Å; R559-D759 PolarHBondContact NH2-OD2 3.45Å
560	S	80.8	Confident	82.6	Confident	27 Å²	27	75.9 Å²	75.9	19%	0.189	38%	0.379	C	S	.	.	S	Bend	trans	-72.4	144.8	-177.7	136.5	0	0	0	0	111.7	L556 I557 Y562 R568	L556-S560 PolarHBondContact O-N 3.35Å; I557-S560 WeakPolarHBondContact O-CB 3.42Å; I557-S560 PolarHBondContact O-N 3.08Å; S560-Y562 PolarHBondContact O-N 2.9Å; S560-Y562 WeakPolarHBondContact OG-CB 3.44Å; S560-Y562 VanDerWaalsContact OG-CD2 3.28Å; S560-Y562 WeakPolarHBondContact OG-CD2 3.4Å; S560-Y562 PolarHBondContact OG-N 3.2Å; S560-R568 WeakPolarHBondContact O-CD 3.5Å; S560-R568 PolarHBondContact O-NH1 3.1Å
561	P	78	Confident	82.1	Confident	113 Å²	113	76.1 Å²	76.1	73%	0.734	38%	0.382	S	S	*	.	S	Bend	trans	-74.8	-12.2	173.9	32.9	-35.7	0	0	0	113.1
562	Y	81.8	Confident	81.5	Confident	178 Å²	178	76.4 Å²	76.4	70%	0.698	38%	0.384	S	S	*	.	S	Bend	trans	-75.8	144.9	177.2	-52	-71.7	0	0	0	110.7	S560	S560-Y562 PolarHBondContact O-N 2.9Å; S560-Y562 WeakPolarHBondContact OG-CB 3.44Å; S560-Y562 VanDerWaalsContact OG-CD2 3.28Å; S560-Y562 WeakPolarHBondContact OG-CD2 3.4Å; S560-Y562 PolarHBondContact OG-N 3.2Å
563	L	82.8	Confident	80.9	Confident	100 Å²	100	73.5 Å²	73.5	52%	0.524	38%	0.375	S	S	.	.	S	Bend	trans	76.2	155.2	-178	-61.2	150.7	0	0	0	116.2	I557 I567	I557-L563 HydrophobicContact CG2-CD1 3.97Å; L563-I567 HydrophobicContact CD2-CG2 4.28Å
564	N	81.6	Confident	80.3	Confident	120 Å²	120	73.5 Å²	73.5	64%	0.642	37%	0.372	S	S	*	.			trans	-63	141.2	172.7	-80	-25.9	0	0	0	111	K566 I567 R568	N564-K566 VanDerWaalsContact C-N 3.27Å; N564-K566 PolarHBondContact O-N 3.41Å; N564-K566 VanDerWaalsContact O-N 3.12Å; N564-I567 HydrophobicContact CB-CD1 4.2Å; N564-I567 HydrophobicContact CB-CG1 4.3Å; N564-I567 PolarHBondContact O-N 3.32Å; N564-R568 WeakPolarHBondContact O-CB 3.4Å; N564-R568 PolarHBondContact O-N 2.79Å
565	G	72.6	Confident	80	Confident	40 Å²	40	72.4 Å²	72.4	41%	0.412	37%	0.367	S	S	.	.	H	α-helix	trans	-52.7	-38.9	-176.7	0	0	0	0	0	114.6	E569	G565-E569 WeakPolarHBondContact O-CB 3.31Å; G565-E569 PolarHBondContact O-N 3.46Å
566	K	71.5	Confident	79.8	Confident	176 Å²	176	71.7 Å²	71.7	77%	0.765	37%	0.365	S	S	*	.	H	α-helix	trans	-65.9	-42.2	176.5	-64.8	-175.8	-179.2	177.4	0	113	N564 V570	N564-K566 VanDerWaalsContact C-N 3.27Å; N564-K566 PolarHBondContact O-N 3.41Å; N564-K566 VanDerWaalsContact O-N 3.12Å; K566-V570 WeakPolarHBondContact O-CG2 3.35Å; K566-V570 PolarHBondContact O-N 2.77Å
567	I	80.3	Confident	79.7	Confident	83 Å²	83	68.6 Å²	68.6	43%	0.426	35%	0.349	S	S	.	.	H	α-helix	trans	-70	-42.8	-179.7	-62	175.8	0	0	0	109.3	L563 N564 E569 V570 V571	L563-I567 HydrophobicContact CD2-CG2 4.28Å; N564-I567 HydrophobicContact CB-CD1 4.2Å; N564-I567 HydrophobicContact CB-CG1 4.3Å; N564-I567 PolarHBondContact O-N 3.32Å; I567-E569 VanDerWaalsContact C-N 3.3Å; I567-E569 PolarHBondContact O-N 3.15Å; I567-V570 PolarHBondContact O-N 3Å; I567-V571 HydrophobicContact CG2-CG2 4.05Å; I567-V571 WeakPolarHBondContact O-CB 3.36Å; I567-V571 VanDerWaalsContact O-CG2 3.27Å; I567-V571 WeakPolarHBondContact O-CG2 3.5Å; I567-V571 PolarHBondContact O-N 3.2Å
568	R	82.4	Confident	79.8	Confident	42 Å²	42	69.7 Å²	69.7	16%	0.158	35%	0.354	C	S	.	.	H	α-helix	trans	-58.2	-41	176.7	175.4	173.7	76.7	-171.1	1.5	112.7	I557 K558 S560 N564 S572	I557-R568 HydrophobicContact CG2-CG 4.08Å; I557-R568 WeakPolarHBondContact O-CD 3.25Å; I557-R568 VanDerWaalsContact O-CG 3.25Å; I557-R568 WeakPolarHBondContact O-CG 3.48Å; K558-R568 VanDerWaalsContact O-CD 3.25Å; K558-R568 WeakPolarHBondContact O-CD 3.32Å; K558-R568 PolarHBondContact O-NE 3.37Å; S560-R568 WeakPolarHBondContact O-CD 3.5Å; S560-R568 PolarHBondContact O-NH1 3.1Å; N564-R568 WeakPolarHBondContact O-CB 3.4Å; N564-R568 PolarHBondContact O-N 2.79Å; R568-S572 VanDerWaalsContact O-CB 3.23Å; R568-S572 WeakPolarHBondContact O-CB 3.36Å; R568-S572 PolarHBondContact O-N 2.95Å
569	E	75.7	Confident	80.3	Confident	79 Å²	79	67.1 Å²	67.1	37%	0.369	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-51.4	175.3	-171.7	172.4	-163.5	0	0	111.3	G565 I567 V571 S572 D573	G565-E569 WeakPolarHBondContact O-CB 3.31Å; G565-E569 PolarHBondContact O-N 3.46Å; I567-E569 VanDerWaalsContact C-N 3.3Å; I567-E569 PolarHBondContact O-N 3.15Å; E569-V571 PolarHBondContact O-N 3.2Å; E569-S572 PolarHBondContact O-N 3.25Å; E569-D573 WeakPolarHBondContact O-CB 3.39Å; E569-D573 PolarHBondContact O-N 3.35Å
570	V	76.9	Confident	80.9	Confident	84 Å²	84	59.3 Å²	59.3	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-61	-42.6	179.1	173.8	0	0	0	0	112.3	K566 I567 D573 C574	K566-V570 WeakPolarHBondContact O-CG2 3.35Å; K566-V570 PolarHBondContact O-N 2.77Å; I567-V570 PolarHBondContact O-N 3Å; V570-D573 PolarHBondContact O-N 2.7Å; V570-C574 WeakPolarHBondContact O-CB 3.35Å; V570-C574 PolarHBondContact O-N 3.04Å
571	V	83.2	Confident	81.2	Confident	35 Å²	35	62.7 Å²	62.7	21%	0.212	33%	0.334	C	S	.	.	H	α-helix	trans	-67.4	-42.7	179.2	171.1	0	0	0	0	111.4	L554 I557 I567 E569 D573 C574 A575	L554-V571 HydrophobicContact CD2-CG1 3.86Å; I557-V571 HydrophobicContact CD1-CG1 4.14Å; I567-V571 HydrophobicContact CG2-CG2 4.05Å; I567-V571 WeakPolarHBondContact O-CB 3.36Å; I567-V571 VanDerWaalsContact O-CG2 3.27Å; I567-V571 WeakPolarHBondContact O-CG2 3.5Å; I567-V571 PolarHBondContact O-N 3.2Å; E569-V571 PolarHBondContact O-N 3.2Å; V571-D573 VanDerWaalsContact C-N 3.32Å; V571-C574 CarbonylContact O-C 3.6Å; V571-C574 PolarHBondContact O-N 2.83Å; V571-A575 PolarHBondContact O-N 2.94Å
572	S	79.3	Confident	81.9	Confident	6 Å²	6	60.7 Å²	60.7	4%	0.042	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-35.9	176.7	175.9	0	0	0	0	112.2	R568 E569 A575	R568-S572 VanDerWaalsContact O-CB 3.23Å; R568-S572 WeakPolarHBondContact O-CB 3.36Å; R568-S572 PolarHBondContact O-N 2.95Å; E569-S572 PolarHBondContact O-N 3.25Å; S572-A575 VanDerWaalsContact O-CB 3.32Å; S572-A575 WeakPolarHBondContact O-CB 3.25Å
573	D	76.9	Confident	82.3	Confident	34 Å²	34	53.2 Å²	53.2	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-70.7	-43.1	177.7	-70.9	-10.7	0	0	0	109.4	F334 E569 V570 V571 A575	F334-D573 VanDerWaalsContact CD2-O 3.24Å; F334-D573 WeakPolarHBondContact CD2-O 3.49Å; F334-D573 WeakPolarHBondContact CE2-O 3.31Å; E569-D573 WeakPolarHBondContact O-CB 3.39Å; E569-D573 PolarHBondContact O-N 3.35Å; V570-D573 PolarHBondContact O-N 2.7Å; V571-D573 VanDerWaalsContact C-N 3.32Å; D573-A575 VanDerWaalsContact C-N 3.26Å; D573-A575 PolarHBondContact O-N 3.15Å
574	C	78.9	Confident	82.6	Confident	40 Å²	40	48.9 Å²	48.9	27%	0.27	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	10.4	177	-66.8	0	0	0	0	115.1	V570 V571 L576 P577 I578	V570-C574 WeakPolarHBondContact O-CB 3.35Å; V570-C574 PolarHBondContact O-N 3.04Å; V571-C574 CarbonylContact O-C 3.6Å; V571-C574 PolarHBondContact O-N 2.83Å; C574-L576 PolarHBondContact O-N 3.36Å; C574-P577 WeakPolarHBondContact O-CD 3.2Å; C574-I578 HydrophobicContact CB-CD1 3.58Å; C574-I578 HydrophobicContact CB-CG1 4.08Å; C574-I578 WeakPolarHBondContact O-CB 3.26Å; C574-I578 WeakPolarHBondContact O-CD1 3.45Å; C574-I578 WeakPolarHBondContact O-CG1 3.31Å; C574-I578 PolarHBondContact O-N 3.2Å
575	A	84.2	Confident	83	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-54.5	-47.8	-173	0	0	0	0	0	113.4	L554 V571 S572 D573 S579	L554-A575 HydrophobicContact CB-CB 3.54Å; V571-A575 PolarHBondContact O-N 2.94Å; S572-A575 VanDerWaalsContact O-CB 3.32Å; S572-A575 WeakPolarHBondContact O-CB 3.25Å; D573-A575 VanDerWaalsContact C-N 3.26Å; D573-A575 PolarHBondContact O-N 3.15Å; A575-S579 WeakPolarHBondContact O-CB 3.28Å; A575-S579 PolarHBondContact O-N 3.07Å; A575-S579 VanDerWaalsContact O-N 3.13Å; A575-S579 PolarHBondContact O-OG 3.11Å
576	L	81.9	Confident	83.8	Confident	14 Å²	14	48.7 Å²	48.7	7%	0.073	25%	0.249	C	C	.	.	H	α-helix	trans	-69.5	-52.9	-178.4	172.7	67.9	0	0	0	113.1	L341 C574 I578 S579 V580 L749 Y752	L341-L576 HydrophobicContact CD1-CG 4.28Å; C574-L576 PolarHBondContact O-N 3.36Å; L576-I578 VanDerWaalsContact C-N 3.31Å; L576-I578 PolarHBondContact O-N 2.75Å; L576-S579 PolarHBondContact O-N 3.38Å; L576-V580 HydrophobicContact CD1-CG2 4.16Å; L576-V580 PolarHBondContact O-N 3.39Å; L576-L749 HydrophobicContact CD1-CB 4.45Å; L576-L749 HydrophobicContact CD1-CD1 3.33Å; L576-L749 HydrophobicContact CD1-CG 4.5Å; L576-L749 HydrophobicContact CD2-CD1 3.41Å; L576-L749 VanDerWaalsContact CD2-CD1 3.41Å; L576-L749 HydrophobicContact CG-CD1 3.83Å; L576-Y752 HydrophobicContact CB-CD1 4.13Å; L576-Y752 HydrophobicContact CB-CE1 3.67Å; L576-Y752 HydrophobicContact CD1-CD1 3.61Å; L576-Y752 HydrophobicContact CD1-CE1 4.06Å; L576-Y752 HydrophobicContact CD1-CG 4.04Å; L576-Y752 HydrophobicContact CD2-CD1 4.21Å; L576-Y752 HydrophobicContact CD2-CE1 4.17Å; L576-Y752 HydrophobicContact CG-CD1 4.18Å; L576-Y752 HydrophobicContact CG-CE1 4.17Å
577	P	83.3	Confident	84.4	Confident	8 Å²	8	40.3 Å²	40.3	5%	0.052	21%	0.213	C	C	.	.	H	α-helix	trans	-48.2	-50.2	172.4	-32.7	35.5	0	0	0	114	I337 C574 S579 V580 V581	I337-P577 HydrophobicContact CB-CB 4.2Å; I337-P577 HydrophobicContact CB-CG 3.83Å; I337-P577 HydrophobicContact CD1-CB 3.82Å; I337-P577 HydrophobicContact CD1-CG 4.12Å; I337-P577 HydrophobicContact CG2-CB 3.62Å; I337-P577 HydrophobicContact CG2-CG 3.56Å; C574-P577 WeakPolarHBondContact O-CD 3.2Å; P577-S579 VanDerWaalsContact C-N 3.29Å; P577-S579 PolarHBondContact O-N 3.14Å; P577-V580 PolarHBondContact O-N 2.93Å; P577-V581 WeakPolarHBondContact O-CG2 3.29Å; P577-V581 PolarHBondContact O-N 3.46Å
578	I	87.9	Confident	84.5	Confident	62 Å²	62	38.2 Å²	38.2	32%	0.318	21%	0.206	S	C	.	.	H	α-helix	trans	-61.7	-42.6	-177.2	-69.8	168.2	0	0	0	110	L554 C574 L576 V581 I582	L554-I578 HydrophobicContact CD1-CB 3.97Å; L554-I578 HydrophobicContact CD1-CG2 3.65Å; C574-I578 HydrophobicContact CB-CD1 3.58Å; C574-I578 HydrophobicContact CB-CG1 4.08Å; C574-I578 WeakPolarHBondContact O-CB 3.26Å; C574-I578 WeakPolarHBondContact O-CD1 3.45Å; C574-I578 WeakPolarHBondContact O-CG1 3.31Å; C574-I578 PolarHBondContact O-N 3.2Å; L576-I578 VanDerWaalsContact C-N 3.31Å; L576-I578 PolarHBondContact O-N 2.75Å; I578-V581 PolarHBondContact O-N 3.25Å; I578-I582 HydrophobicContact CG2-CD1 3.55Å; I578-I582 HydrophobicContact CG2-CG1 4.42Å; I578-I582 WeakPolarHBondContact O-CB 3.44Å; I578-I582 VanDerWaalsContact O-CG1 3.25Å; I578-I582 WeakPolarHBondContact O-CG1 3.36Å; I578-I582 PolarHBondContact O-N 2.99Å
579	S	90.1	Very high	84.5	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.007	23%	0.227	C	C	.	.	H	α-helix	trans	-66.6	-43.5	-178.5	-57	0	0	0	0	112.4	G551 A575 L576 P577 F583	G551-S579 WeakPolarHBondContact CA-OG 3.22Å; G551-S579 PolarHBondContact N-OG 3.14Å; A575-S579 WeakPolarHBondContact O-CB 3.28Å; A575-S579 PolarHBondContact O-N 3.07Å; A575-S579 VanDerWaalsContact O-N 3.13Å; A575-S579 PolarHBondContact O-OG 3.11Å; L576-S579 PolarHBondContact O-N 3.38Å; P577-S579 VanDerWaalsContact C-N 3.29Å; P577-S579 PolarHBondContact O-N 3.14Å; S579-F583 WeakPolarHBondContact O-CD2 3.48Å; S579-F583 PolarHBondContact O-N 3.49Å
580	V	88.3	Confident	84.8	Confident	3 Å²	3	45 Å²	45	2%	0.018	24%	0.237	C	C	.	.	H	α-helix	trans	-65.7	-43.7	177.9	170.6	0	0	0	0	111.3	L341 T547 L576 P577 S584 I741 V745	L341-V580 HydrophobicContact CD1-CB 4.08Å; L341-V580 HydrophobicContact CD1-CG1 4.3Å; L341-V580 HydrophobicContact CD1-CG2 3.9Å; L341-V580 HydrophobicContact CD2-CB 4.37Å; L341-V580 HydrophobicContact CD2-CG1 3.68Å; T547-V580 HydrophobicContact CG2-CG2 4.11Å; L576-V580 HydrophobicContact CD1-CG2 4.16Å; L576-V580 PolarHBondContact O-N 3.39Å; P577-V580 PolarHBondContact O-N 2.93Å; V580-S584 WeakPolarHBondContact O-CB 3.32Å; V580-S584 PolarHBondContact O-N 3.49Å; V580-S584 PolarHBondContact O-OG 3.41Å; V580-I741 HydrophobicContact CG1-CG2 4.36Å; V580-V745 HydrophobicContact CB-CG1 4.15Å; V580-V745 HydrophobicContact CG1-CG1 3.77Å; V580-V745 HydrophobicContact CG2-CG1 4.07Å
581	V	88.4	Confident	85	Confident	98 Å²	98	44.8 Å²	44.8	59%	0.594	23%	0.229	S	C	*	.	H	α-helix	trans	-63.4	-45.3	178.8	172	0	0	0	0	111.1	P577 I578 F585	P577-V581 WeakPolarHBondContact O-CG2 3.29Å; P577-V581 PolarHBondContact O-N 3.46Å; I578-V581 PolarHBondContact O-N 3.25Å; V581-F585 WeakPolarHBondContact O-CB 3.27Å; V581-F585 PolarHBondContact O-N 3.15Å
582	I	91.4	Very high	84.6	Confident	72 Å²	72	49.1 Å²	49.1	37%	0.369	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-49.2	179.9	-71.7	170.4	0	0	0	111	L550 I578 F585 I586	L550-I582 HydrophobicContact CD2-CB 4.13Å; L550-I582 HydrophobicContact CD2-CD1 3.94Å; L550-I582 HydrophobicContact CD2-CG2 3.98Å; I578-I582 HydrophobicContact CG2-CD1 3.55Å; I578-I582 HydrophobicContact CG2-CG1 4.42Å; I578-I582 WeakPolarHBondContact O-CB 3.44Å; I578-I582 VanDerWaalsContact O-CG1 3.25Å; I578-I582 WeakPolarHBondContact O-CG1 3.36Å; I578-I582 PolarHBondContact O-N 2.99Å; I582-F585 PolarHBondContact O-N 3.02Å; I582-I586 HydrophobicContact CG2-CD1 3.71Å; I582-I586 HydrophobicContact CG2-CG1 4.48Å; I582-I586 VanDerWaalsContact O-CG1 3.27Å; I582-I586 WeakPolarHBondContact O-CG1 3.39Å; I582-I586 PolarHBondContact O-N 3Å
583	F	91.5	Very high	84.2	Confident	20 Å²	20	56.1 Å²	56.1	9%	0.088	29%	0.286	C	S	.	.	H	α-helix	trans	-74.8	-26.3	-178.7	-83.2	-79.4	0	0	0	113.6	L543 G546 T547 L550 S579 I586 G587 V745	L543-F583 HydrophobicContact CD2-CB 4.46Å; L543-F583 HydrophobicContact CD2-CD1 3.98Å; L543-F583 WeakPolarHBondContact CD2-O 3.29Å; G546-F583 WeakPolarHBondContact O-CE2 3.07Å; G546-F583 WeakPolarHBondContact O-CZ 3.43Å; T547-F583 WeakPolarHBondContact OG1-CB 3.25Å; L550-F583 HydrophobicContact CB-CD2 4.41Å; L550-F583 HydrophobicContact CB-CE2 3.67Å; L550-F583 HydrophobicContact CD2-CD2 4.03Å; L550-F583 HydrophobicContact CD2-CE2 3.67Å; L550-F583 HydrophobicContact CG-CE2 4.33Å; S579-F583 WeakPolarHBondContact O-CD2 3.48Å; S579-F583 PolarHBondContact O-N 3.49Å; F583-I586 HydrophobicContact CD1-CD1 4.17Å; F583-I586 HydrophobicContact CE1-CD1 4.21Å; F583-G587 PolarHBondContact O-N 2.9Å; F583-V745 HydrophobicContact CB-CG2 4.08Å
584	S	88.9	Confident	84	Confident	10 Å²	10	56 Å²	56	7%	0.07	29%	0.285	C	S	.	.	H	α-helix	trans	-68.1	-40.1	168.8	-56.4	0	0	0	0	111	V580 G587 S588	V580-S584 WeakPolarHBondContact O-CB 3.32Å; V580-S584 PolarHBondContact O-N 3.49Å; V580-S584 PolarHBondContact O-OG 3.41Å; S584-G587 PolarHBondContact O-N 3.46Å; S584-S588 WeakPolarHBondContact O-CB 3.13Å; S584-S588 PolarHBondContact O-N 2.87Å; S584-S588 PolarHBondContact O-OG 3.03Å
585	F	89.4	Confident	83.5	Confident	116 Å²	116	60.4 Å²	60.4	51%	0.509	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-45.7	174	-179.6	-99.3	0	0	0	111.8	V581 I582 G587 Y589	V581-F585 WeakPolarHBondContact O-CB 3.27Å; V581-F585 PolarHBondContact O-N 3.15Å; I582-F585 PolarHBondContact O-N 3.02Å; F585-G587 PolarHBondContact O-N 2.81Å; F585-Y589 HydrophobicContact CD2-CG 4.43Å; F585-Y589 HydrophobicContact CE1-CD1 4.07Å; F585-Y589 AromaticContact CE2-CD1 3.86Å; F585-Y589 HydrophobicContact CE2-CD1 3.86Å; F585-Y589 HydrophobicContact CE2-CD2 4.29Å; F585-Y589 AromaticContact CE2-CG 3.71Å; F585-Y589 HydrophobicContact CE2-CG 3.71Å; F585-Y589 AromaticContact CZ-CD1 3.43Å; F585-Y589 HydrophobicContact CZ-CD1 3.43Å; F585-Y589 VanDerWaalsContact CZ-CD1 3.43Å; F585-Y589 HydrophobicContact CZ-CE1 4.01Å; F585-Y589 AromaticContact CZ-CG 3.79Å; F585-Y589 HydrophobicContact CZ-CG 3.79Å; F585-Y589 WeakPolarHBondContact O-CA 3.06Å; F585-Y589 WeakPolarHBondContact O-CB 3.47Å; F585-Y589 PolarHBondContact O-N 2.88Å
586	I	89.1	Confident	83.1	Confident	39 Å²	39	61.6 Å²	61.6	20%	0.2	31%	0.308	C	S	.	.	I	π-helix	trans	-59.3	-48.7	175.6	-68.8	165.2	0	0	0	110.3	L543 I582 F583 L590 F591	L543-I586 HydrophobicContact CD2-CG2 4.42Å; I582-I586 HydrophobicContact CG2-CD1 3.71Å; I582-I586 HydrophobicContact CG2-CG1 4.48Å; I582-I586 VanDerWaalsContact O-CG1 3.27Å; I582-I586 WeakPolarHBondContact O-CG1 3.39Å; I582-I586 PolarHBondContact O-N 3Å; F583-I586 HydrophobicContact CD1-CD1 4.17Å; F583-I586 HydrophobicContact CE1-CD1 4.21Å; I586-L590 HydrophobicContact CB-CD1 4.28Å; I586-L590 HydrophobicContact CG1-CD1 4.01Å; I586-L590 HydrophobicContact CG2-CD1 4.17Å; I586-L590 WeakPolarHBondContact O-CB 3.2Å; I586-L590 PolarHBondContact O-N 2.96Å; I586-F591 HydrophobicContact CG2-CD2 4.24Å; I586-F591 HydrophobicContact CG2-CE2 3.91Å; I586-F591 WeakPolarHBondContact O-CD2 3.18Å; I586-F591 PolarHBondContact O-N 3.45Å
587	G	83.7	Confident	82.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.312	C	S	.	.	I	π-helix	trans	-62.8	-47.5	-178.9	0	0	0	0	0	113.3	F583 S584 F585 L596	F583-G587 PolarHBondContact O-N 2.9Å; S584-G587 PolarHBondContact O-N 3.46Å; F585-G587 PolarHBondContact O-N 2.81Å; G587-L596 WeakPolarHBondContact O-CD1 3.28Å
588	S	82.8	Confident	82.4	Confident	40 Å²	40	64.4 Å²	64.4	28%	0.28	33%	0.326	S	S	.	.	I	π-helix	trans	-90.3	-27.4	-170.6	-59	0	0	0	0	114.1	S584 W740	S584-S588 WeakPolarHBondContact O-CB 3.13Å; S584-S588 PolarHBondContact O-N 2.87Å; S584-S588 PolarHBondContact O-OG 3.03Å; S588-W740 PolarHBondContact OG-O 3.33Å
589	Y	83.2	Confident	81.8	Confident	156 Å²	156	61.6 Å²	61.6	61%	0.612	31%	0.312	S	S	*	.	I	π-helix	trans	-101.7	-43.2	-177.9	-171.7	-97.9	0	0	0	113.5	F585	F585-Y589 HydrophobicContact CD2-CG 4.43Å; F585-Y589 HydrophobicContact CE1-CD1 4.07Å; F585-Y589 AromaticContact CE2-CD1 3.86Å; F585-Y589 HydrophobicContact CE2-CD1 3.86Å; F585-Y589 HydrophobicContact CE2-CD2 4.29Å; F585-Y589 AromaticContact CE2-CG 3.71Å; F585-Y589 HydrophobicContact CE2-CG 3.71Å; F585-Y589 AromaticContact CZ-CD1 3.43Å; F585-Y589 HydrophobicContact CZ-CD1 3.43Å; F585-Y589 VanDerWaalsContact CZ-CD1 3.43Å; F585-Y589 HydrophobicContact CZ-CE1 4.01Å; F585-Y589 AromaticContact CZ-CG 3.79Å; F585-Y589 HydrophobicContact CZ-CG 3.79Å; F585-Y589 WeakPolarHBondContact O-CA 3.06Å; F585-Y589 WeakPolarHBondContact O-CB 3.47Å; F585-Y589 PolarHBondContact O-N 2.88Å
590	L	81.3	Confident	80.7	Confident	108 Å²	108	64.5 Å²	64.5	57%	0.565	33%	0.332	S	S	*	.	I	π-helix	trans	-79.9	-29.5	-179	-63.4	174.8	0	0	0	112.6	I586	I586-L590 HydrophobicContact CB-CD1 4.28Å; I586-L590 HydrophobicContact CG1-CD1 4.01Å; I586-L590 HydrophobicContact CG2-CD1 4.17Å; I586-L590 WeakPolarHBondContact O-CB 3.2Å; I586-L590 PolarHBondContact O-N 2.96Å
591	F	81.1	Confident	79.9	Confident	79 Å²	79	66.3 Å²	66.3	35%	0.346	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	47	179.2	-62.7	-77.3	0	0	0	111.9	L539 I586 D593 I594	L539-F591 HydrophobicContact CD1-CD1 4.32Å; L539-F591 HydrophobicContact CD1-CD2 3.55Å; L539-F591 HydrophobicContact CD1-CE1 4.45Å; L539-F591 HydrophobicContact CD1-CE2 3.71Å; L539-F591 HydrophobicContact CD1-CG 3.88Å; L539-F591 HydrophobicContact CD1-CZ 4.17Å; L539-F591 HydrophobicContact CD2-CB 3.61Å; L539-F591 HydrophobicContact CD2-CD1 4.42Å; L539-F591 HydrophobicContact CD2-CD2 4.21Å; L539-F591 HydrophobicContact CD2-CG 3.85Å; I586-F591 HydrophobicContact CG2-CD2 4.24Å; I586-F591 HydrophobicContact CG2-CE2 3.91Å; I586-F591 WeakPolarHBondContact O-CD2 3.18Å; I586-F591 PolarHBondContact O-N 3.45Å; F591-D593 PolarHBondContact O-N 3.06Å; F591-D593 VanDerWaalsContact O-N 3.16Å; F591-I594 HydrophobicContact CD1-CD1 4.13Å; F591-I594 PolarHBondContact O-N 3.41Å
592	I	73.9	Confident	79.2	Confident	125 Å²	125	65.5 Å²	65.5	64%	0.641	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.7	-177.4	-149.9	163.8	0	0	0	112.9	I594	I592-I594 VanDerWaalsContact C-N 3.25Å; I592-I594 PolarHBondContact O-N 3.07Å
593	D	71.3	Confident	77.9	Confident	153 Å²	153	70 Å²	70	82%	0.818	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-18	180	-59.9	-36.7	0	0	0	112.7	F591	F591-D593 PolarHBondContact O-N 3.06Å; F591-D593 VanDerWaalsContact O-N 3.16Å
594	I	72.8	Confident	76.7	Confident	31 Å²	31	71 Å²	71	16%	0.159	37%	0.372	C	S	.	.	S	Bend	trans	-106.3	105.3	-177.4	-56.5	175.3	0	0	0	109	E535 R536 L539 F591 I592 L596	E535-I594 HydrophobicContact CB-CD1 4.11Å; E535-I594 HydrophobicContact CG-CD1 3.91Å; E535-I594 HydrophobicContact CG-CG1 4.05Å; E535-I594 HydrophobicContact CG-CG2 4.4Å; R536-I594 HydrophobicContact CB-CG2 4.3Å; R536-I594 HydrophobicContact CG-CG2 3.59Å; L539-I594 HydrophobicContact CD2-CB 3.92Å; L539-I594 HydrophobicContact CD2-CD1 4.01Å; L539-I594 HydrophobicContact CD2-CG2 3.81Å; F591-I594 HydrophobicContact CD1-CD1 4.13Å; F591-I594 PolarHBondContact O-N 3.41Å; I592-I594 VanDerWaalsContact C-N 3.25Å; I592-I594 PolarHBondContact O-N 3.07Å; I594-L596 PolarHBondContact O-N 2.9Å
595	Q	69.9	Low	75.9	Confident	134 Å²	134	75.2 Å²	75.2	63%	0.626	40%	0.4	S	S	*	.			trans	-64.3	108.3	177.5	-68.3	172.9	-10.5	0	0	111.2	R536	R536-Q595 VanDerWaalsContact NH2-OE1 3.07Å
596	L	75.7	Confident	75.2	Confident	25 Å²	25	71.9 Å²	71.9	13%	0.131	39%	0.387	C	S	.	.			trans	-83	148.5	175	-71.7	167.5	0	0	0	111.2	L539 L543 G587 I594 V598 P742	L539-L596 HydrophobicContact CD2-CD1 4.32Å; L539-L596 HydrophobicContact CD2-CD2 3.82Å; L539-L596 HydrophobicContact CD2-CG 4.2Å; L539-L596 HydrophobicContact CG-CD2 4.09Å; L543-L596 HydrophobicContact CD1-CD1 3.62Å; L543-L596 HydrophobicContact CD1-CD2 3.82Å; L543-L596 HydrophobicContact CD1-CG 4.4Å; G587-L596 WeakPolarHBondContact O-CD1 3.28Å; I594-L596 PolarHBondContact O-N 2.9Å; L596-V598 PolarHBondContact O-N 3.1Å; L596-V598 VanDerWaalsContact O-N 3.13Å; L596-P742 HydrophobicContact CB-CB 3.84Å; L596-P742 HydrophobicContact CD1-CB 3.88Å; L596-P742 HydrophobicContact CD1-CG 4.06Å; L596-P742 HydrophobicContact CG-CB 4.39Å
597	P	69.3	Low	74.7	Confident	24 Å²	24	75.2 Å²	75.2	16%	0.156	40%	0.4	C	S	.	.			trans	-70.4	111.3	174.5	28.1	-31.3	0	0	0	109.6	I466 K743 P744	I466-P597 HydrophobicContact CD1-CG 4.05Å; P597-K743 HydrophobicContact CB-CD 4.34Å; P597-K743 HydrophobicContact CG-CB 4.46Å; P597-K743 WeakPolarHBondContact O-CB 3.25Å; P597-K743 WeakPolarHBondContact O-CG 3.23Å; P597-K743 PolarHBondContact O-N 2.69Å; P597-P744 HydrophobicContact CG-CG 4.25Å
598	V	79.8	Confident	74.2	Confident	56 Å²	56	79.2 Å²	79.2	34%	0.339	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-96.2	156	173.3	-178.8	0	0	0	0	109.1	L596 Q739 K743	L596-V598 PolarHBondContact O-N 3.1Å; L596-V598 VanDerWaalsContact O-N 3.13Å; V598-Q739 HydrophobicContact CG1-CB 4.09Å; V598-Q739 WeakPolarHBondContact CG1-O 3.36Å; V598-K743 VanDerWaalsContact O-CE 3.29Å; V598-K743 WeakPolarHBondContact O-CE 3.31Å
599	F	76.2	Confident	73.8	Confident	4 Å²	4	85.7 Å²	85.7	2%	0.018	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-73.4	140.4	171.9	58.5	-91.9	0	0	0	111	I344 V360 V601 L734 L738 Q739 I741	I344-F599 HydrophobicContact CG2-CD1 3.94Å; I344-F599 HydrophobicContact CG2-CE1 3.7Å; I344-F599 HydrophobicContact CG2-CZ 4.1Å; V360-F599 HydrophobicContact CB-CD2 4.09Å; V360-F599 HydrophobicContact CB-CE2 4.45Å; V360-F599 HydrophobicContact CG1-CD2 4.12Å; V360-F599 HydrophobicContact CG1-CE2 4.05Å; V360-F599 HydrophobicContact CG2-CB 4.03Å; V360-F599 HydrophobicContact CG2-CD2 3.74Å; V360-F599 HydrophobicContact CG2-CE2 4.49Å; V360-F599 HydrophobicContact CG2-CG 4.04Å; F599-V601 HydrophobicContact CD2-CG2 4.39Å; F599-V601 HydrophobicContact CE2-CG2 4.24Å; F599-L734 HydrophobicContact CE2-CD2 4.18Å; F599-L738 VanDerWaalsContact CE1-O 3.28Å; F599-L738 WeakPolarHBondContact CE1-O 3.38Å; F599-L738 HydrophobicContact CZ-CB 4.22Å; F599-L738 WeakPolarHBondContact CZ-O 3.42Å; F599-Q739 HydrophobicContact CE2-CG 4.41Å; F599-I741 HydrophobicContact CE1-CB 4.45Å
600	S	67.2	Low	73.5	Confident	61 Å²	61	78.5 Å²	78.5	43%	0.427	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-74.8	148.7	-179.8	-59.8	0	0	0	0	110.3	D359	D359-S600 VanDerWaalsContact OD1-O 3.13Å
601	V	70.3	Confident	73.4	Confident	41 Å²	41	75.7 Å²	75.7	25%	0.248	40%	0.401	C	S	.	.			trans	-119.3	115.3	167.9	178.4	0	0	0	0	106.6	F599 Q739	F599-V601 HydrophobicContact CD2-CG2 4.39Å; F599-V601 HydrophobicContact CE2-CG2 4.24Å; V601-Q739 HydrophobicContact CG2-CG 4.26Å; V601-Q739 VanDerWaalsContact CG2-NE2 3.33Å
602	H	74.1	Confident	73.1	Confident	82 Å²	82	75.5 Å²	75.5	38%	0.38	40%	0.401	S	S	.	.			trans	-91.3	129	177.6	-59.8	83.6	0	0	0	110.2	D351 D359 G604	D351-H602 IonicContact OD1-CE1 2.99Å; D351-H602 PolarHBondContact OD1-CE1 3.41Å; D351-H602 VanDerWaalsContact OD1-CE1 3.29Å; D351-H602 IonicContact OD1-ND1 3.85Å; D359-H602 IonicContact OD1-ND1 2.89Å; D359-H602 IonicContact OD2-CE1 3.69Å; D359-H602 IonicContact OD2-CG 3.96Å; D359-H602 PolarHBondContact OD2-N 2.88Å; D359-H602 IonicContact OD2-ND1 2.88Å; D359-H602 PolarHBondContact OD2-ND1 3.25Å; H602-G604 PolarHBondContact O-N 3.1Å
603	D	64.9	Low	72.9	Confident	167 Å²	167	78.7 Å²	78.7	89%	0.893	41%	0.413	S	S	*	.			trans	-74.9	26.5	178.4	-67.2	-37.9	0	0	0	113.9
604	G	65.5	Low	72.9	Confident	39 Å²	39	76.5 Å²	76.5	40%	0.402	40%	0.401	S	S	.	.	S	Bend	trans	-76.9	165.1	-178.7	0	0	0	0	0	113.8	H602 I606	H602-G604 PolarHBondContact O-N 3.1Å; G604-I606 PolarHBondContact O-N 2.89Å
605	P	72.1	Confident	73.1	Confident	99 Å²	99	76.7 Å²	76.7	64%	0.643	40%	0.402	S	S	*	.			trans	-62	122.2	172.4	26.2	-32.6	0	0	0	110.3	F607	P605-F607 VanDerWaalsContact C-N 3.27Å; P605-F607 PolarHBondContact O-N 3.23Å
606	I	74.5	Confident	73.7	Confident	46 Å²	46	75 Å²	75	24%	0.236	40%	0.401	C	S	.	.	S	Bend	trans	-61.7	-39.3	-178.9	-56.7	170.8	0	0	0	110.9	Q361 V365 G604	Q361-I606 HydrophobicContact CG-CD1 4.39Å; Q361-I606 HydrophobicContact CG-CG1 4.44Å; V365-I606 HydrophobicContact CB-CG2 4.27Å; V365-I606 HydrophobicContact CG1-CG2 4.14Å; V365-I606 HydrophobicContact CG2-CG2 4.24Å; G604-I606 PolarHBondContact O-N 2.89Å
607	F	79.8	Confident	73.9	Confident	109 Å²	109	76.8 Å²	76.8	48%	0.478	43%	0.425	S	S	.	.			trans	-102.6	113.7	177.8	-55.2	-66.2	0	0	0	109.3	V365 I369 P605 L675 L677	V365-F607 HydrophobicContact CG1-CE1 4.38Å; V365-F607 HydrophobicContact CG1-CZ 4.23Å; I369-F607 HydrophobicContact CD1-CE1 4.26Å; I369-F607 HydrophobicContact CD1-CZ 4.39Å; P605-F607 VanDerWaalsContact C-N 3.27Å; P605-F607 PolarHBondContact O-N 3.23Å; F607-L675 HydrophobicContact CD1-CB 4.1Å; F607-L675 HydrophobicContact CD1-CD1 4.24Å; F607-L675 HydrophobicContact CD1-CD2 3.83Å; F607-L675 HydrophobicContact CD1-CG 4.27Å; F607-L675 HydrophobicContact CE1-CD1 4.08Å; F607-L675 HydrophobicContact CE1-CD2 4.39Å; F607-L677 HydrophobicContact CE1-CD1 4.25Å
608	K	72.1	Confident	74.6	Confident	84 Å²	84	81.9 Å²	81.9	37%	0.365	45%	0.451	S	S	.	.			trans	-117.8	113.7	175.2	-164.5	174.8	176.5	-164	0	107.6	E357 D410	E357-K608 IonicContact OE2-NZ 2.73Å; D410-K608 VanDerWaalsContact OD2-CD 3.26Å; D410-K608 WeakPolarHBondContact OD2-CD 3.45Å; D410-K608 WeakPolarHBondContact OD2-CE 3.18Å; D410-K608 IonicContact OD2-NZ 3.32Å; D410-K608 PolarHBondContact OD2-NZ 3.21Å
609	Y	75.8	Confident	74.8	Confident	177 Å²	177	80.2 Å²	80.2	69%	0.694	44%	0.441	S	S	*	.			trans	-76.5	128.2	179.7	-163.5	-90.9	0	0	0	109.4
610	P	76.3	Confident	75.3	Confident	5 Å²	5	81.9 Å²	81.9	3%	0.032	45%	0.453	C	S	.	.			trans	-70.9	130.5	-176.1	27.2	-34.5	0	0	0	111.5	A414 F612 C674	A414-P610 HydrophobicContact CB-CB 3.57Å; A414-P610 HydrophobicContact CB-CG 3.5Å; P610-F612 HydrophobicContact CB-CE1 4.45Å; P610-F612 HydrophobicContact CB-CE2 4.42Å; P610-F612 HydrophobicContact CB-CZ 4.21Å; P610-F612 HydrophobicContact CG-CE1 4.27Å; P610-F612 HydrophobicContact CG-CE2 3.72Å; P610-F612 HydrophobicContact CG-CZ 3.58Å; P610-F612 PolarHBondContact O-N 3.15Å; P610-C674 VanDerWaalsContact CD-O 3.28Å; P610-C674 WeakPolarHBondContact CD-O 3.4Å
611	A	78.7	Confident	76.3	Confident	48 Å²	48	84.7 Å²	84.7	40%	0.397	46%	0.463	S	S	.	.			trans	-83	88.2	173.3	0	0	0	0	0	110	A411 E613 N614	A411-A611 WeakPolarHBondContact CB-O 3.33Å; A611-E613 PolarHBondContact O-N 2.85Å; A611-E613 VanDerWaalsContact O-N 3.08Å; A611-N614 PolarHBondContact O-N 3.27Å
612	F	75.4	Confident	77.1	Confident	76 Å²	76	85.3 Å²	85.3	33%	0.333	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-61.6	-16.5	179.7	-64.9	-71.9	0	0	0	114.1	A414 L418 P610 N614 L615	A414-F612 HydrophobicContact CB-CE1 3.89Å; A414-F612 HydrophobicContact CB-CZ 4Å; L418-F612 HydrophobicContact CD1-CE1 3.97Å; L418-F612 HydrophobicContact CD1-CZ 3.77Å; P610-F612 HydrophobicContact CB-CE1 4.45Å; P610-F612 HydrophobicContact CB-CE2 4.42Å; P610-F612 HydrophobicContact CB-CZ 4.21Å; P610-F612 HydrophobicContact CG-CE1 4.27Å; P610-F612 HydrophobicContact CG-CE2 3.72Å; P610-F612 HydrophobicContact CG-CZ 3.58Å; P610-F612 PolarHBondContact O-N 3.15Å; F612-N614 PolarHBondContact O-N 2.89Å; F612-L615 HydrophobicContact CD1-CD1 4.45Å; F612-L615 PolarHBondContact O-N 3.47Å
613	E	68.9	Low	77.9	Confident	192 Å²	192	81.4 Å²	81.4	90%	0.897	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-66.9	-20.6	179.7	-61.6	-178.6	-179	0	0	113.2	A611 L615	A611-E613 PolarHBondContact O-N 2.85Å; A611-E613 VanDerWaalsContact O-N 3.08Å; E613-L615 VanDerWaalsContact C-N 3.3Å; E613-L615 PolarHBondContact O-N 3.32Å
614	N	71.4	Confident	79.2	Confident	107 Å²	107	75.2 Å²	75.2	57%	0.572	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-79.6	-8.1	-179.8	-67.3	-15.8	0	0	0	113.6	D408 A611 F612	D408-N614 HydrophobicContact CB-CB 4.47Å; D408-N614 PolarHBondContact OD2-ND2 3.02Å; A611-N614 PolarHBondContact O-N 3.27Å; F612-N614 PolarHBondContact O-N 2.89Å
615	L	76.5	Confident	80.4	Confident	35 Å²	35	75.2 Å²	75.2	18%	0.183	42%	0.422	C	S	.	.			trans	-93.6	130.8	-174.7	-73	161.4	0	0	0	112.2	A411 F412 C415 F612 E613 T619	A411-L615 HydrophobicContact CB-CD1 3.89Å; A411-L615 HydrophobicContact CB-CG 4.05Å; F412-L615 HydrophobicContact CB-CD2 4.2Å; F412-L615 HydrophobicContact CD2-CD2 4.08Å; C415-L615 HydrophobicContact CB-CD1 3.97Å; F612-L615 HydrophobicContact CD1-CD1 4.45Å; F612-L615 PolarHBondContact O-N 3.47Å; E613-L615 VanDerWaalsContact C-N 3.3Å; E613-L615 PolarHBondContact O-N 3.32Å; L615-T619 WeakPolarHBondContact CD2-OG1 3.48Å
616	T	82.5	Confident	81.3	Confident	98 Å²	98	71.3 Å²	71.3	60%	0.601	40%	0.396	S	S	*	.			trans	-77.5	152	172.1	-57.6	0	0	0	0	110.4	L618 T619 S620	T616-L618 PolarHBondContact O-N 3.32Å; T616-L618 VanDerWaalsContact O-N 3.08Å; T616-T619 PolarHBondContact N-OG1 3.44Å; T616-T619 PolarHBondContact O-N 2.89Å; T616-T619 PolarHBondContact O-OG1 3.3Å; T616-S620 PolarHBondContact O-N 3.02Å; T616-S620 VanDerWaalsContact O-N 3.13Å
617	G	80.9	Confident	82.2	Confident	62 Å²	62	69.1 Å²	69.1	64%	0.639	39%	0.385	S	S	*	.	H	α-helix	trans	-54.7	-32.2	178.1	0	0	0	0	0	114.4	S620 L621	G617-S620 PolarHBondContact O-N 2.99Å; G617-L621 PolarHBondContact O-N 2.94Å; G617-L621 VanDerWaalsContact O-N 3.12Å
618	L	84.1	Confident	82.8	Confident	131 Å²	131	68.6 Å²	68.6	69%	0.686	38%	0.382	S	S	*	.	H	α-helix	trans	-69	-38.9	176.7	-171.9	68.7	0	0	0	112.7	T616 S620 L621 A622	T616-L618 PolarHBondContact O-N 3.32Å; T616-L618 VanDerWaalsContact O-N 3.08Å; L618-S620 VanDerWaalsContact C-N 3.33Å; L618-L621 PolarHBondContact O-N 2.98Å; L618-A622 PolarHBondContact O-N 3.21Å
619	T	84.6	Confident	83.7	Confident	21 Å²	21	65.9 Å²	65.9	13%	0.129	37%	0.372	C	S	.	.	H	α-helix	trans	-70.7	-34.5	177.9	60.5	0	0	0	0	110.4	L407 L615 T616 L621 A622 A623	L407-T619 HydrophobicContact CD1-CG2 3.97Å; L407-T619 HydrophobicContact CD2-CG2 3.59Å; L407-T619 HydrophobicContact CG-CG2 4.46Å; L615-T619 WeakPolarHBondContact CD2-OG1 3.48Å; T616-T619 PolarHBondContact N-OG1 3.44Å; T616-T619 PolarHBondContact O-N 2.89Å; T616-T619 PolarHBondContact O-OG1 3.3Å; T619-L621 VanDerWaalsContact C-N 3.33Å; T619-L621 PolarHBondContact O-N 2.99Å; T619-A622 PolarHBondContact O-N 3.26Å; T619-A623 WeakPolarHBondContact O-CB 3.25Å; T619-A623 PolarHBondContact O-N 3.04Å
620	S	84.9	Confident	84.5	Confident	40 Å²	40	57.4 Å²	57.4	28%	0.28	34%	0.339	S	S	.	.	H	α-helix	trans	-62.4	-37.6	170.1	-176.3	0	0	0	0	112.4	T616 G617 L618 A623 V624	T616-S620 PolarHBondContact O-N 3.02Å; T616-S620 VanDerWaalsContact O-N 3.13Å; G617-S620 PolarHBondContact O-N 2.99Å; L618-S620 VanDerWaalsContact C-N 3.33Å; S620-A623 WeakPolarHBondContact O-CB 3.49Å; S620-A623 PolarHBondContact O-N 2.9Å; S620-V624 WeakPolarHBondContact O-CG2 3.47Å; S620-V624 PolarHBondContact O-N 3.31Å
621	L	88.4	Confident	85.3	Confident	120 Å²	120	57.5 Å²	57.5	63%	0.628	34%	0.339	S	S	*	.	H	α-helix	trans	-68	-40.3	175.7	-176.6	65.6	0	0	0	111.6	G617 L618 T619 A623 V624	G617-L621 PolarHBondContact O-N 2.94Å; G617-L621 VanDerWaalsContact O-N 3.12Å; L618-L621 PolarHBondContact O-N 2.98Å; T619-L621 VanDerWaalsContact C-N 3.33Å; T619-L621 PolarHBondContact O-N 2.99Å; L621-A623 VanDerWaalsContact C-N 3.29Å; L621-A623 PolarHBondContact O-N 3.48Å; L621-V624 WeakPolarHBondContact O-CB 3.37Å; L621-V624 PolarHBondContact O-N 3.07Å
622	A	87.8	Confident	85.8	Confident	53 Å²	53	56.3 Å²	56.3	44%	0.438	33%	0.326	S	S	.	.	H	α-helix	trans	-62.3	-38.2	173.1	0	0	0	0	0	111.8	L618 T619 V624 G625 L626	L618-A622 PolarHBondContact O-N 3.21Å; T619-A622 PolarHBondContact O-N 3.26Å; A622-V624 VanDerWaalsContact C-N 3.27Å; A622-V624 PolarHBondContact O-N 3.42Å; A622-G625 PolarHBondContact O-N 3.24Å; A622-G625 VanDerWaalsContact O-N 3.13Å; A622-L626 PolarHBondContact O-N 3.27Å; A622-L626 VanDerWaalsContact O-N 3.12Å
623	A	90.2	Very high	86.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.6	-30.2	175.5	0	0	0	0	0	113	F412 C415 I416 T619 S620 L621 G627	F412-A623 HydrophobicContact CD2-CB 4.36Å; F412-A623 HydrophobicContact CE2-CB 3.93Å; C415-A623 HydrophobicContact CB-CB 4.26Å; I416-A623 HydrophobicContact CG1-CB 3.8Å; T619-A623 WeakPolarHBondContact O-CB 3.25Å; T619-A623 PolarHBondContact O-N 3.04Å; S620-A623 WeakPolarHBondContact O-CB 3.49Å; S620-A623 PolarHBondContact O-N 2.9Å; L621-A623 VanDerWaalsContact C-N 3.29Å; L621-A623 PolarHBondContact O-N 3.48Å; A623-G627 WeakPolarHBondContact O-CA 3.42Å; A623-G627 PolarHBondContact O-N 2.97Å
624	V	93.1	Very high	87.5	Confident	37 Å²	37	43.7 Å²	43.7	22%	0.224	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-46.4	172.3	177.3	0	0	0	0	110.7	W419 F423 S620 L621 A622 G627 F628	W419-V624 HydrophobicContact CD2-CB 4.5Å; W419-V624 HydrophobicContact CD2-CG2 3.7Å; W419-V624 VanDerWaalsContact CE2-CG2 3.46Å; W419-V624 HydrophobicContact CE3-CG2 4.19Å; W419-V624 HydrophobicContact CG-CG2 4.09Å; W419-V624 HydrophobicContact CH2-CG2 4.27Å; W419-V624 HydrophobicContact CZ2-CG2 3.78Å; W419-V624 HydrophobicContact CZ3-CG2 4.45Å; F423-V624 HydrophobicContact CE2-CG1 4.23Å; F423-V624 HydrophobicContact CZ-CG1 3.98Å; S620-V624 WeakPolarHBondContact O-CG2 3.47Å; S620-V624 PolarHBondContact O-N 3.31Å; L621-V624 WeakPolarHBondContact O-CB 3.37Å; L621-V624 PolarHBondContact O-N 3.07Å; A622-V624 VanDerWaalsContact C-N 3.27Å; A622-V624 PolarHBondContact O-N 3.42Å; V624-G627 PolarHBondContact O-N 3.28Å; V624-F628 WeakPolarHBondContact O-CB 3.26Å; V624-F628 PolarHBondContact O-N 3.34Å
625	G	91.2	Very high	88.4	Confident	40 Å²	40	39.2 Å²	39.2	41%	0.412	24%	0.244	S	C	.	.	H	α-helix	trans	-63.8	-46.4	179.9	0	0	0	0	0	112.5	A622 F628 L629	A622-G625 PolarHBondContact O-N 3.24Å; A622-G625 VanDerWaalsContact O-N 3.13Å; G625-F628 PolarHBondContact O-N 2.9Å; G625-L629 WeakPolarHBondContact O-CG 3.08Å; G625-L629 PolarHBondContact O-N 3.34Å; G625-L629 VanDerWaalsContact O-N 3.13Å
626	L	90.6	Very high	88.8	Confident	17 Å²	17	37.6 Å²	37.6	9%	0.089	24%	0.235	C	C	.	.	H	α-helix	trans	-66.6	-39.6	176.1	-68	172.6	0	0	0	111.9	F394 I401 F412 I416 A622 F628 L629 L630 M818	F394-L626 HydrophobicContact CZ-CB 4.39Å; F394-L626 HydrophobicContact CZ-CD2 4.34Å; F394-L626 WeakPolarHBondContact CZ-O 3.44Å; I401-L626 HydrophobicContact CD1-CD1 3.68Å; I401-L626 HydrophobicContact CD1-CD2 4.23Å; F412-L626 HydrophobicContact CE1-CD1 3.92Å; F412-L626 HydrophobicContact CZ-CD1 3.65Å; I416-L626 HydrophobicContact CD1-CB 4.03Å; I416-L626 HydrophobicContact CD1-CD1 3.76Å; I416-L626 HydrophobicContact CG1-CB 4.14Å; I416-L626 HydrophobicContact CG2-CB 4.33Å; A622-L626 PolarHBondContact O-N 3.27Å; A622-L626 VanDerWaalsContact O-N 3.12Å; L626-F628 VanDerWaalsContact C-N 3.31Å; L626-F628 PolarHBondContact O-N 3.08Å; L626-L629 PolarHBondContact O-N 2.96Å; L626-L630 WeakPolarHBondContact O-CB 3.24Å; L626-L630 PolarHBondContact O-N 3.32Å; L626-M818 HydrophobicContact CD2-SD 4.11Å
627	G	93.4	Very high	89	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-37.9	175.1	0	0	0	0	0	112.3	N420 A623 V624 L630 A631	N420-G627 WeakPolarHBondContact CA-O 3.45Å; A623-G627 WeakPolarHBondContact O-CA 3.42Å; A623-G627 PolarHBondContact O-N 2.97Å; V624-G627 PolarHBondContact O-N 3.28Å; G627-L630 PolarHBondContact O-N 2.96Å; G627-A631 WeakPolarHBondContact O-CB 3.23Å; G627-A631 PolarHBondContact O-N 3.24Å
628	F	92.9	Very high	89.4	Confident	97 Å²	97	30.5 Å²	30.5	43%	0.425	18%	0.179	S	C	.	.	H	α-helix	trans	-65.1	-45.4	173.6	177.8	-101.2	0	0	0	112.3	F423 V624 G625 L626 L630 A631 L632	F423-F628 HydrophobicContact CD1-CD2 4.27Å; F423-F628 HydrophobicContact CD2-CB 4Å; F423-F628 HydrophobicContact CD2-CD2 4.29Å; F423-F628 HydrophobicContact CE1-CD2 4.3Å; F423-F628 HydrophobicContact CE2-CB 3.67Å; F423-F628 HydrophobicContact CE2-CD2 4.32Å; F423-F628 HydrophobicContact CG-CD2 4.28Å; F423-F628 HydrophobicContact CZ-CB 4.2Å; F423-F628 HydrophobicContact CZ-CD2 4.32Å; V624-F628 WeakPolarHBondContact O-CB 3.26Å; V624-F628 PolarHBondContact O-N 3.34Å; G625-F628 PolarHBondContact O-N 2.9Å; L626-F628 VanDerWaalsContact C-N 3.31Å; L626-F628 PolarHBondContact O-N 3.08Å; F628-L630 VanDerWaalsContact C-N 3.32Å; F628-L630 PolarHBondContact O-N 3.37Å; F628-A631 PolarHBondContact O-N 3.31Å; F628-L632 WeakPolarHBondContact O-CB 3.48Å; F628-L632 PolarHBondContact O-N 2.78Å
629	L	90.6	Very high	89.4	Confident	27 Å²	27	24.3 Å²	24.3	14%	0.141	15%	0.147	C	C	.	.	H	α-helix	trans	-62.6	-40.2	176.7	-69.2	173.5	0	0	0	112	F394 G625 L626 L632 L633 L822	F394-L629 HydrophobicContact CE2-CB 4.27Å; F394-L629 HydrophobicContact CZ-CB 4.36Å; G625-L629 WeakPolarHBondContact O-CG 3.08Å; G625-L629 PolarHBondContact O-N 3.34Å; G625-L629 VanDerWaalsContact O-N 3.13Å; L626-L629 PolarHBondContact O-N 2.96Å; L629-L632 WeakPolarHBondContact O-CB 3.3Å; L629-L632 PolarHBondContact O-N 3Å; L629-L633 PolarHBondContact O-N 3.3Å; L629-L822 HydrophobicContact CD2-CD1 3.8Å; L629-L822 HydrophobicContact CD2-CD2 4.07Å; L629-L822 HydrophobicContact CD2-CG 3.68Å
630	L	91.8	Very high	89.3	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.1	-43.3	175.2	-178.8	58.9	0	0	0	111.9	L391 F394 I416 N420 L626 G627 F628 L632 L633 I634 W679	L391-L630 HydrophobicContact CD1-CD1 3.49Å; L391-L630 VanDerWaalsContact CD1-CD1 3.49Å; F394-L630 HydrophobicContact CD1-CB 4.36Å; F394-L630 HydrophobicContact CD1-CD1 3.87Å; F394-L630 HydrophobicContact CD1-CD2 4.46Å; F394-L630 HydrophobicContact CD1-CG 4.46Å; F394-L630 HydrophobicContact CE1-CB 3.76Å; F394-L630 HydrophobicContact CE1-CD1 4.14Å; F394-L630 HydrophobicContact CE1-CD2 4.26Å; F394-L630 HydrophobicContact CE1-CG 4.27Å; F394-L630 HydrophobicContact CG-CD1 4.28Å; F394-L630 HydrophobicContact CZ-CB 3.96Å; I416-L630 HydrophobicContact CG2-CD2 3.99Å; N420-L630 HydrophobicContact CB-CB 4.3Å; N420-L630 HydrophobicContact CB-CD2 3.88Å; N420-L630 HydrophobicContact CB-CG 4.14Å; L626-L630 WeakPolarHBondContact O-CB 3.24Å; L626-L630 PolarHBondContact O-N 3.32Å; G627-L630 PolarHBondContact O-N 2.96Å; F628-L630 VanDerWaalsContact C-N 3.32Å; F628-L630 PolarHBondContact O-N 3.37Å; L630-L632 VanDerWaalsContact C-N 3.26Å; L630-L632 PolarHBondContact O-N 3.19Å; L630-L633 WeakPolarHBondContact O-CB 3.02Å; L630-L633 PolarHBondContact O-N 3.06Å; L630-I634 HydrophobicContact CD1-CD1 4.02Å; L630-I634 HydrophobicContact CD1-CG1 4.34Å; L630-I634 HydrophobicContact CG-CD1 4.03Å; L630-I634 WeakPolarHBondContact O-CG1 3.12Å; L630-I634 PolarHBondContact O-N 3.4Å; L630-W679 HydrophobicContact CD1-CE3 4.33Å; L630-W679 HydrophobicContact CD1-CZ3 4.4Å; L630-W679 HydrophobicContact CD2-CD2 3.96Å; L630-W679 HydrophobicContact CD2-CE3 3.62Å; L630-W679 HydrophobicContact CD2-CH2 3.61Å; L630-W679 HydrophobicContact CD2-CZ2 3.98Å; L630-W679 HydrophobicContact CD2-CZ3 3.43Å; L630-W679 VanDerWaalsContact CD2-CZ3 3.43Å
631	A	93.1	Very high	89.3	Confident	6 Å²	6	22.1 Å²	22.1	5%	0.05	13%	0.131	C	C	.	.	H	α-helix	trans	-61.7	-38	175.4	0	0	0	0	0	111.6	N420 F423 L424 G627 F628 F635	N420-A631 WeakPolarHBondContact OD1-CA 3.47Å; N420-A631 WeakPolarHBondContact OD1-CB 3.48Å; N420-A631 PolarHBondContact OD1-N 2.84Å; N420-A631 VanDerWaalsContact OD1-N 3.08Å; F423-A631 HydrophobicContact CB-CB 3.58Å; F423-A631 HydrophobicContact CD2-CB 4.47Å; F423-A631 HydrophobicContact CG-CB 4.46Å; L424-A631 HydrophobicContact CD2-CB 4.22Å; L424-A631 WeakPolarHBondContact CD2-O 3.01Å; L424-A631 HydrophobicContact CG-CB 4.17Å; G627-A631 WeakPolarHBondContact O-CB 3.23Å; G627-A631 PolarHBondContact O-N 3.24Å; F628-A631 PolarHBondContact O-N 3.31Å; A631-F635 WeakPolarHBondContact O-CB 2.91Å; A631-F635 PolarHBondContact O-N 2.96Å
632	L	89.7	Confident	89.1	Confident	24 Å²	24	16.4 Å²	16.4	13%	0.126	10%	0.101	C	C	.	.	H	α-helix	trans	-61.5	-46.3	175.1	-155.4	69.8	0	0	0	111.7	F628 L629 L630 F635 I636 P821 L822 I825	F628-L632 WeakPolarHBondContact O-CB 3.48Å; F628-L632 PolarHBondContact O-N 2.78Å; L629-L632 WeakPolarHBondContact O-CB 3.3Å; L629-L632 PolarHBondContact O-N 3Å; L630-L632 VanDerWaalsContact C-N 3.26Å; L630-L632 PolarHBondContact O-N 3.19Å; L632-F635 PolarHBondContact O-N 3.41Å; L632-I636 HydrophobicContact CG-CD1 4.41Å; L632-I636 WeakPolarHBondContact O-CD1 2.99Å; L632-I636 WeakPolarHBondContact O-CG1 3.46Å; L632-I636 PolarHBondContact O-N 3.02Å; L632-P821 HydrophobicContact CB-CB 4.4Å; L632-P821 HydrophobicContact CD2-CB 4.31Å; L632-L822 HydrophobicContact CD2-CD2 3.73Å; L632-L822 HydrophobicContact CD2-CG 4.4Å; L632-I825 HydrophobicContact CD1-CD1 3.22Å; L632-I825 HydrophobicContact CD1-CG1 4.37Å; L632-I825 HydrophobicContact CD2-CD1 3.65Å; L632-I825 HydrophobicContact CD2-CG1 3.99Å; L632-I825 HydrophobicContact CG-CD1 3.39Å; L632-I825 HydrophobicContact CG-CG1 4.05Å
633	L	88.4	Confident	88.7	Confident	2 Å²	2	14.2 Å²	14.2	1%	0.01	8%	0.083	C	C	.	.	H	α-helix	trans	-60.3	-52.6	177.8	179.2	61.6	0	0	0	111.2	P390 L629 L630 F635 I636 D637 F820 P821	P390-L633 HydrophobicContact CB-CD1 4.01Å; P390-L633 HydrophobicContact CB-CD2 4Å; P390-L633 HydrophobicContact CB-CG 4.49Å; L629-L633 PolarHBondContact O-N 3.3Å; L630-L633 WeakPolarHBondContact O-CB 3.02Å; L630-L633 PolarHBondContact O-N 3.06Å; L633-F635 VanDerWaalsContact C-N 3.31Å; L633-F635 PolarHBondContact O-N 2.92Å; L633-I636 PolarHBondContact O-N 2.97Å; L633-D637 PolarHBondContact O-N 3.38Å; L633-F820 HydrophobicContact CD1-CD1 4.32Å; L633-F820 HydrophobicContact CD1-CE1 3.79Å; L633-P821 HydrophobicContact CB-CB 4.05Å; L633-P821 HydrophobicContact CB-CG 3.93Å; L633-P821 HydrophobicContact CD1-CG 4.33Å; L633-P821 HydrophobicContact CG-CG 4.5Å
634	I	91.1	Very high	88.1	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.6	-39.8	179.8	-68.5	171.5	0	0	0	110.8	N420 L424 L630 I636 Q638 T665 H681	N420-I634 WeakPolarHBondContact ND2-CD1 3.27Å; L424-I634 HydrophobicContact CD1-CB 4.31Å; L424-I634 HydrophobicContact CD1-CD1 4.37Å; L424-I634 HydrophobicContact CD1-CG2 3.77Å; L424-I634 HydrophobicContact CD2-CB 4.19Å; L424-I634 HydrophobicContact CD2-CG2 3.92Å; L630-I634 HydrophobicContact CD1-CD1 4.02Å; L630-I634 HydrophobicContact CD1-CG1 4.34Å; L630-I634 HydrophobicContact CG-CD1 4.03Å; L630-I634 WeakPolarHBondContact O-CG1 3.12Å; L630-I634 PolarHBondContact O-N 3.4Å; I634-I636 PolarHBondContact O-N 2.87Å; I634-Q638 WeakPolarHBondContact O-CB 3.45Å; I634-Q638 PolarHBondContact O-N 3.24Å; I634-T665 HydrophobicContact CG2-CG2 3.9Å; I634-H681 HydrophobicContact CG1-CB 4.47Å; I634-H681 HydrophobicContact CG2-CB 3.91Å
635	F	90.4	Very high	87.3	Confident	13 Å²	13	13.9 Å²	13.9	6%	0.057	8%	0.079	C	C	.	.	H	α-helix	trans	-60	-44.6	177.1	173	-86.6	0	0	0	112.3	L424 V432 M435 A631 L632 L633 N639 L662	L424-F635 HydrophobicContact CD2-CB 4.34Å; V432-F635 HydrophobicContact CB-CE2 4.17Å; V432-F635 HydrophobicContact CG1-CE2 3.78Å; V432-F635 HydrophobicContact CG1-CZ 3.84Å; V432-F635 WeakPolarHBondContact O-CZ 3.07Å; M435-F635 HydrophobicContact CB-CE1 4.46Å; M435-F635 HydrophobicContact CB-CZ 4.25Å; M435-F635 HydrophobicContact CE-CD1 3.98Å; M435-F635 HydrophobicContact CE-CE1 3.29Å; M435-F635 HydrophobicContact CE-CZ 4Å; A631-F635 WeakPolarHBondContact O-CB 2.91Å; A631-F635 PolarHBondContact O-N 2.96Å; L632-F635 PolarHBondContact O-N 3.41Å; L633-F635 VanDerWaalsContact C-N 3.31Å; L633-F635 PolarHBondContact O-N 2.92Å; F635-N639 WeakPolarHBondContact CD2-ND2 3.28Å; F635-N639 WeakPolarHBondContact CE2-ND2 3.48Å; F635-N639 VanDerWaalsContact CZ-ND2 3.26Å; F635-N639 WeakPolarHBondContact CZ-ND2 3.37Å; F635-N639 WeakPolarHBondContact O-CB 3.44Å; F635-N639 PolarHBondContact O-N 2.85Å; F635-N639 PolarHBondContact O-ND2 2.88Å; F635-L662 HydrophobicContact CB-CD1 4.43Å; F635-L662 HydrophobicContact CD2-CD1 3.88Å; F635-L662 HydrophobicContact CD2-CD2 3.58Å; F635-L662 HydrophobicContact CD2-CG 4.41Å; F635-L662 HydrophobicContact CE2-CD2 3.76Å
636	I	85.8	Confident	86.6	Confident	1 Å²	1	13.1 Å²	13.1	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-67.2	-54.6	-179.4	-66.3	163.2	0	0	0	109.7	F439 I447 L632 L633 I634 Q638 N639 I640 M824 I825	F439-I636 HydrophobicContact CE1-CG2 4.05Å; F439-I636 HydrophobicContact CZ-CG1 4.2Å; F439-I636 HydrophobicContact CZ-CG2 4.26Å; I447-I636 HydrophobicContact CD1-CG2 4.46Å; L632-I636 HydrophobicContact CG-CD1 4.41Å; L632-I636 WeakPolarHBondContact O-CD1 2.99Å; L632-I636 WeakPolarHBondContact O-CG1 3.46Å; L632-I636 PolarHBondContact O-N 3.02Å; L633-I636 PolarHBondContact O-N 2.97Å; I634-I636 PolarHBondContact O-N 2.87Å; I636-Q638 PolarHBondContact O-N 2.74Å; I636-N639 PolarHBondContact O-N 3.21Å; I636-I640 HydrophobicContact CG2-CD1 3.48Å; I636-I640 VanDerWaalsContact CG2-CD1 3.48Å; I636-I640 HydrophobicContact CG2-CG1 4.37Å; I636-I640 WeakPolarHBondContact O-CB 3.42Å; I636-I640 VanDerWaalsContact O-CG1 3.26Å; I636-I640 WeakPolarHBondContact O-CG1 3.23Å; I636-I640 PolarHBondContact O-N 3.27Å; I636-M824 HydrophobicContact CD1-CB 3.88Å; I636-I825 HydrophobicContact CD1-CD1 3.94Å; I636-I825 HydrophobicContact CD1-CG1 3.28Å; I636-I825 HydrophobicContact CG1-CD1 4.23Å; I636-I825 HydrophobicContact CG1-CG1 3.95Å
637	D	85.4	Confident	85.6	Confident	11 Å²	11	12.9 Å²	12.9	6%	0.059	6%	0.064	C	C	.	.	H	α-helix	trans	-60.5	-48.4	-175.7	-77.3	-4.7	0	0	0	110.5	L633 N639 I640 V641 H681	L633-D637 PolarHBondContact O-N 3.38Å; D637-N639 PolarHBondContact O-N 2.8Å; D637-I640 PolarHBondContact O-N 3.35Å; D637-V641 WeakPolarHBondContact O-CG2 3.4Å; D637-V641 PolarHBondContact O-N 3.14Å; D637-H681 WeakPolarHBondContact CB-CE1 3.34Å; D637-H681 IonicContact OD2-CE1 3.81Å; D637-H681 PolarHBondContact OD2-CE1 3.22Å; D637-H681 IonicContact OD2-NE2 3.57Å; D637-H681 PolarHBondContact OD2-NE2 3.42Å
638	Q	89	Confident	84.3	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-55.3	-50.8	179.9	-175.5	73.1	20.2	0	0	112.1	Y374 I634 I636 V641 I642	Y374-Q638 PolarHBondContact OH-NE2 3.22Å; I634-Q638 WeakPolarHBondContact O-CB 3.45Å; I634-Q638 PolarHBondContact O-N 3.24Å; I636-Q638 PolarHBondContact O-N 2.74Å; Q638-V641 PolarHBondContact O-N 3.03Å; Q638-I642 HydrophobicContact CG-CD1 3.95Å; Q638-I642 VanDerWaalsContact O-CG1 3.25Å; Q638-I642 WeakPolarHBondContact O-CG1 3.48Å; Q638-I642 PolarHBondContact O-N 3.06Å
639	N	85.8	Confident	83	Confident	2 Å²	2	16.2 Å²	16.2	1%	0.011	9%	0.088	C	C	.	.	H	α-helix	trans	-70.3	-37.4	-176	-73.8	-51.3	0	0	0	112.3	M436 F635 I636 D637 I642 S643	M436-N639 HydrophobicContact CG-CB 4.45Å; M436-N639 HydrophobicContact SD-CB 3.79Å; F635-N639 WeakPolarHBondContact CD2-ND2 3.28Å; F635-N639 WeakPolarHBondContact CE2-ND2 3.48Å; F635-N639 VanDerWaalsContact CZ-ND2 3.26Å; F635-N639 WeakPolarHBondContact CZ-ND2 3.37Å; F635-N639 WeakPolarHBondContact O-CB 3.44Å; F635-N639 PolarHBondContact O-N 2.85Å; F635-N639 PolarHBondContact O-ND2 2.88Å; I636-N639 PolarHBondContact O-N 3.21Å; D637-N639 PolarHBondContact O-N 2.8Å; N639-I642 PolarHBondContact O-N 3.29Å; N639-S643 PolarHBondContact O-N 2.87Å
640	I	82.1	Confident	82	Confident	8 Å²	8	15.9 Å²	15.9	4%	0.041	9%	0.086	C	C	.	.	H	α-helix	trans	-61.9	-46.7	174.5	-71.6	173.6	0	0	0	110.2	F439 E444 I447 I636 D637 I642 S643 L644	F439-I640 HydrophobicContact CD1-CD1 4.06Å; F439-I640 HydrophobicContact CD1-CG1 4.2Å; F439-I640 HydrophobicContact CE1-CD1 4.14Å; E444-I640 HydrophobicContact CG-CG2 4.27Å; I447-I640 HydrophobicContact CD1-CD1 3.31Å; I447-I640 HydrophobicContact CG2-CD1 4.4Å; I636-I640 HydrophobicContact CG2-CD1 3.48Å; I636-I640 VanDerWaalsContact CG2-CD1 3.48Å; I636-I640 HydrophobicContact CG2-CG1 4.37Å; I636-I640 WeakPolarHBondContact O-CB 3.42Å; I636-I640 VanDerWaalsContact O-CG1 3.26Å; I636-I640 WeakPolarHBondContact O-CG1 3.23Å; I636-I640 PolarHBondContact O-N 3.27Å; D637-I640 PolarHBondContact O-N 3.35Å; I640-I642 PolarHBondContact O-N 3.01Å; I640-S643 PolarHBondContact O-N 3.32Å; I640-L644 HydrophobicContact CG2-CD1 3.53Å; I640-L644 HydrophobicContact CG2-CG 4.21Å; I640-L644 WeakPolarHBondContact O-CB 3.46Å; I640-L644 WeakPolarHBondContact O-CG 3.44Å; I640-L644 PolarHBondContact O-N 2.91Å
641	V	84.8	Confident	80.9	Confident	7 Å²	7	19.6 Å²	19.6	4%	0.042	10%	0.102	C	C	.	.	H	α-helix	trans	-64.2	-42.8	-179.6	176.3	0	0	0	0	111.9	V383 D637 Q638 S643 L644 T645 A682 F684	V383-V641 HydrophobicContact CG1-CG1 4.31Å; D637-V641 WeakPolarHBondContact O-CG2 3.4Å; D637-V641 PolarHBondContact O-N 3.14Å; Q638-V641 PolarHBondContact O-N 3.03Å; V641-S643 VanDerWaalsContact C-N 3.32Å; V641-S643 PolarHBondContact O-N 3.44Å; V641-L644 PolarHBondContact O-N 2.67Å; V641-T645 WeakPolarHBondContact O-CB 3.38Å; V641-T645 PolarHBondContact O-N 3.07Å; V641-T645 PolarHBondContact O-OG1 3.43Å; V641-A682 HydrophobicContact CB-CB 3.77Å; V641-A682 HydrophobicContact CG1-CB 3.72Å; V641-A682 HydrophobicContact CG2-CB 4.31Å; V641-A682 WeakPolarHBondContact CG2-O 3.32Å; V641-F684 HydrophobicContact CG2-CB 3.72Å
642	I	84.3	Confident	80	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.2	-45.9	175.9	-65.8	165.5	0	0	0	109.5	V383 Q638 N639 I640 L644 T645 H646 F658 D661	V383-I642 HydrophobicContact CG2-CG1 4.16Å; Q638-I642 HydrophobicContact CG-CD1 3.95Å; Q638-I642 VanDerWaalsContact O-CG1 3.25Å; Q638-I642 WeakPolarHBondContact O-CG1 3.48Å; Q638-I642 PolarHBondContact O-N 3.06Å; N639-I642 PolarHBondContact O-N 3.29Å; I640-I642 PolarHBondContact O-N 3.01Å; I642-L644 PolarHBondContact O-N 3.04Å; I642-T645 PolarHBondContact O-N 3.1Å; I642-H646 WeakPolarHBondContact O-CB 3.47Å; I642-H646 PolarHBondContact O-CD2 2.84Å; I642-H646 PolarHBondContact O-N 3.45Å; I642-F658 HydrophobicContact CB-CD1 3.98Å; I642-F658 HydrophobicContact CB-CE1 3.71Å; I642-F658 HydrophobicContact CD1-CD1 4.34Å; I642-F658 HydrophobicContact CG2-CD1 3.61Å; I642-F658 HydrophobicContact CG2-CE1 3.32Å; I642-F658 HydrophobicContact CG2-CG 4.34Å; I642-F658 HydrophobicContact CG2-CZ 3.83Å; I642-D661 HydrophobicContact CD1-CB 3.7Å
643	S	78.8	Confident	78.9	Confident	6 Å²	6	27 Å²	27	4%	0.042	14%	0.14	C	C	.	.	H	α-helix	trans	-67.4	-38.4	-179.3	-164	0	0	0	0	113.5	R282 M436 N639 I640 V641 T645 H646	R282-S643 PolarHBondContact NH2-OG 3.4Å; M436-S643 WeakPolarHBondContact CE-OG 3.33Å; N639-S643 PolarHBondContact O-N 2.87Å; I640-S643 PolarHBondContact O-N 3.32Å; V641-S643 VanDerWaalsContact C-N 3.32Å; V641-S643 PolarHBondContact O-N 3.44Å; S643-T645 VanDerWaalsContact C-N 3.31Å; S643-H646 CarbonylContact O-C 3.39Å; S643-H646 PolarHBondContact O-N 3.18Å
644	L	76.8	Confident	78.2	Confident	30 Å²	30	28.1 Å²	28.1	16%	0.157	15%	0.145	C	C	.	.	H	α-helix	trans	-72.1	-25	176.8	-70.1	171.1	0	0	0	112.9	E444 I640 V641 I642 V647 F684	E444-L644 HydrophobicContact CB-CD1 4.39Å; E444-L644 HydrophobicContact CB-CD2 4.17Å; E444-L644 HydrophobicContact CG-CD2 4.48Å; E444-L644 WeakPolarHBondContact OE2-CD2 3.31Å; I640-L644 HydrophobicContact CG2-CD1 3.53Å; I640-L644 HydrophobicContact CG2-CG 4.21Å; I640-L644 WeakPolarHBondContact O-CB 3.46Å; I640-L644 WeakPolarHBondContact O-CG 3.44Å; I640-L644 PolarHBondContact O-N 2.91Å; V641-L644 PolarHBondContact O-N 2.67Å; I642-L644 PolarHBondContact O-N 3.04Å; L644-V647 WeakPolarHBondContact O-CG2 3.43Å; L644-F684 HydrophobicContact CB-CD2 3.85Å; L644-F684 HydrophobicContact CB-CE2 3.58Å; L644-F684 HydrophobicContact CD1-CD2 3.5Å; L644-F684 HydrophobicContact CD1-CE2 3.43Å; L644-F684 VanDerWaalsContact CD1-CE2 3.43Å; L644-F684 HydrophobicContact CD1-CG 4.25Å; L644-F684 HydrophobicContact CD1-CZ 4.06Å; L644-F684 HydrophobicContact CG-CD2 4.32Å; L644-F684 HydrophobicContact CG-CE2 4.04Å
645	T	77	Confident	77.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-77.1	-35.1	173.5	-53.8	0	0	0	0	110.9	L382 V383 V641 I642 S643 V647 H650 S687 A691	L382-T645 HydrophobicContact CB-CG2 3.98Å; V383-T645 HydrophobicContact CG2-CG2 4.35Å; V641-T645 WeakPolarHBondContact O-CB 3.38Å; V641-T645 PolarHBondContact O-N 3.07Å; V641-T645 PolarHBondContact O-OG1 3.43Å; I642-T645 PolarHBondContact O-N 3.1Å; S643-T645 VanDerWaalsContact C-N 3.31Å; T645-V647 VanDerWaalsContact C-N 3.28Å; T645-V647 PolarHBondContact O-N 2.94Å; T645-H650 PolarHBondContact O-ND1 3.3Å; T645-S687 WeakPolarHBondContact OG1-CB 3.45Å; T645-A691 HydrophobicContact CG2-CB 4.16Å
646	H	75.9	Confident	76.5	Confident	25 Å²	25	30.9 Å²	30.9	12%	0.116	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	38.4	179.3	-70.4	-81.6	0	0	0	113.7	S380 I642 S643 L652 T656	S380-H646 WeakPolarHBondContact CB-NE2 3.49Å; S380-H646 PolarHBondContact OG-NE2 3.18Å; S380-H646 VanDerWaalsContact OG-NE2 3.15Å; I642-H646 WeakPolarHBondContact O-CB 3.47Å; I642-H646 PolarHBondContact O-CD2 2.84Å; I642-H646 PolarHBondContact O-N 3.45Å; S643-H646 CarbonylContact O-C 3.39Å; S643-H646 PolarHBondContact O-N 3.18Å; H646-L652 HydrophobicContact CB-CD1 4.31Å; H646-L652 WeakPolarHBondContact ND1-CD1 3.38Å; H646-T656 HydrophobicContact CB-CG2 3.56Å
647	V	70.8	Confident	76.5	Confident	11 Å²	11	31 Å²	31	7%	0.067	17%	0.172	C	C	.	.			trans	-64.2	135.8	174.1	162.7	0	0	0	0	109.6	L644 T645 E649 H650 Q850	L644-V647 WeakPolarHBondContact O-CG2 3.43Å; T645-V647 VanDerWaalsContact C-N 3.28Å; T645-V647 PolarHBondContact O-N 2.94Å; V647-E649 HydrophobicContact CG1-CB 3.67Å; V647-E649 HydrophobicContact CG1-CG 3.59Å; V647-E649 PolarHBondContact O-N 2.95Å; V647-H650 WeakPolarHBondContact O-CB 3.32Å; V647-H650 PolarHBondContact O-N 3.42Å; V647-Q850 VanDerWaalsContact CG1-NE2 3.35Å
648	P	65.3	Low	76.5	Confident	83 Å²	83	31.1 Å²	31.1	54%	0.539	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-57.3	-23	179.7	21	-34.2	0	0	0	113.8	H650 K651	P648-H650 PolarHBondContact O-N 2.92Å; P648-K651 PolarHBondContact O-N 3.48Å
649	E	66.5	Low	76.5	Confident	84 Å²	84	32.1 Å²	32.1	39%	0.393	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-58.9	-28.9	171.6	-54.1	175.3	-179.4	0	0	112.8	V647 K651	V647-E649 HydrophobicContact CG1-CB 3.67Å; V647-E649 HydrophobicContact CG1-CG 3.59Å; V647-E649 PolarHBondContact O-N 2.95Å; E649-K651 VanDerWaalsContact C-N 3.26Å; E649-K651 PolarHBondContact O-N 3.29Å
650	H	68.7	Low	76.8	Confident	21 Å²	21	34.6 Å²	34.6	10%	0.097	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-79.3	-8.7	178.6	-69.7	-164.8	0	0	0	112.8	T645 V647 P648 L652 V713	T645-H650 PolarHBondContact O-ND1 3.3Å; V647-H650 WeakPolarHBondContact O-CB 3.32Å; V647-H650 PolarHBondContact O-N 3.42Å; P648-H650 PolarHBondContact O-N 2.92Å; H650-L652 HydrophobicContact CB-CD1 4.24Å; H650-L652 HydrophobicContact CB-CD2 4.48Å; H650-L652 HydrophobicContact CB-CG 3.93Å; H650-L652 PolarHBondContact O-N 3.4Å; H650-L652 VanDerWaalsContact O-N 3.14Å; H650-V713 HydrophobicContact CB-CG2 4.02Å; H650-V713 WeakPolarHBondContact O-CG2 3.44Å
651	K	68.8	Low	77.2	Confident	78 Å²	78	34.2 Å²	34.2	34%	0.339	18%	0.184	S	C	.	.			trans	45	45.2	178.7	-64	176.4	172.6	-173.9	0	113.2	D239 P648 E649 V711	D239-K651 IonicContact OD1-NZ 2.89Å; P648-K651 PolarHBondContact O-N 3.48Å; E649-K651 VanDerWaalsContact C-N 3.26Å; E649-K651 PolarHBondContact O-N 3.29Å; K651-V711 VanDerWaalsContact CD-O 3.26Å; K651-V711 WeakPolarHBondContact CD-O 3.42Å
652	L	74.9	Confident	77.6	Confident	35 Å²	35	33.9 Å²	33.9	18%	0.183	18%	0.182	C	C	.	.			trans	-69.4	138	-178.9	-65.2	170.8	0	0	0	110.6	L382 H646 H650 V713 E715	L382-L652 HydrophobicContact CD1-CD1 4.04Å; L382-L652 HydrophobicContact CD1-CD2 3.65Å; H646-L652 HydrophobicContact CB-CD1 4.31Å; H646-L652 WeakPolarHBondContact ND1-CD1 3.38Å; H650-L652 HydrophobicContact CB-CD1 4.24Å; H650-L652 HydrophobicContact CB-CD2 4.48Å; H650-L652 HydrophobicContact CB-CG 3.93Å; H650-L652 PolarHBondContact O-N 3.4Å; H650-L652 VanDerWaalsContact O-N 3.14Å; L652-V713 HydrophobicContact CD2-CB 3.69Å; L652-V713 HydrophobicContact CD2-CG1 3.85Å; L652-V713 HydrophobicContact CD2-CG2 4.41Å; L652-E715 HydrophobicContact CD2-CG 3.83Å
653	L	67.1	Low	78	Confident	150 Å²	150	35.3 Å²	35.3	79%	0.785	19%	0.189	S	C	*	.	S	Bend	trans	-100.7	-24.3	-167.8	-66.3	175.3	0	0	0	113.1	E715	L653-E715 PolarHBondContact N-OE1 2.86Å
654	K	73.2	Confident	78.7	Confident	25 Å²	25	35.3 Å²	35.3	11%	0.109	19%	0.189	C	C	.	.	S	Bend	trans	-101	15.9	-166.9	-53.4	178	178.6	173.8	0	114.4	R306 L309 S312 D313 D316 E715	R306-K654 PolarHBondContact NH1-O 2.85Å; L309-K654 HydrophobicContact CD1-CB 3.92Å; L309-K654 HydrophobicContact CD1-CG 4.26Å; S312-K654 WeakPolarHBondContact OG-CE 3.24Å; S312-K654 PolarHBondContact OG-NZ 2.77Å; D313-K654 WeakPolarHBondContact OD1-CD 3.31Å; D313-K654 WeakPolarHBondContact OD1-CE 3.41Å; D313-K654 IonicContact OD1-NZ 2.78Å; D313-K654 PolarHBondContact OD1-NZ 2.93Å; D316-K654 VanDerWaalsContact OD2-CE 3.29Å; D316-K654 WeakPolarHBondContact OD2-CE 3.32Å; D316-K654 IonicContact OD2-NZ 3.83Å; D316-K654 PolarHBondContact OD2-NZ 2.9Å; K654-E715 VanDerWaalsContact CB-OE2 3.3Å; K654-E715 WeakPolarHBondContact CB-OE2 3.42Å; K654-E715 HydrophobicContact CD-CB 4.04Å; K654-E715 PolarHBondContact N-OE1 3.32Å; K654-E715 PolarHBondContact NZ-O 3.35Å
655	G	69.1	Low	79.5	Confident	43 Å²	43	34 Å²	34	44%	0.443	18%	0.182	S	C	.	.			trans	68.9	169	172.9	0	0	0	0	0	115	R306	R306-G655 PolarHBondContact NH1-O 2.92Å
656	T	77.2	Confident	80.4	Confident	29 Å²	29	34 Å²	34	18%	0.178	18%	0.182	C	C	.	.			trans	-103.9	154.4	-177.4	61.5	0	0	0	0	111.8	H646 F658	H646-T656 HydrophobicContact CB-CG2 3.56Å; T656-F658 HydrophobicContact CG2-CE2 4.18Å; T656-F658 VanDerWaalsContact OG1-CE2 3.23Å; T656-F658 WeakPolarHBondContact OG1-CE2 3.35Å
657	A	84.5	Confident	81.3	Confident	2 Å²	2	37.2 Å²	37.2	2%	0.017	20%	0.196	C	C	.	.			trans	-137.3	65.6	-177.7	0	0	0	0	0	112.1	D302 H659 W660 D661	D302-A657 HydrophobicContact CB-CB 4.17Å; A657-H659 PolarHBondContact O-N 3.06Å; A657-W660 HydrophobicContact CB-CB 4.5Å; A657-D661 VanDerWaalsContact O-CB 3.32Å; A657-D661 WeakPolarHBondContact O-CB 3.37Å; A657-D661 PolarHBondContact O-N 3.31Å
658	F	85.4	Confident	82.4	Confident	14 Å²	14	36.9 Å²	36.9	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-63.1	-40.4	-175	-66.3	-84.9	0	0	0	113.8	P281 D302 M436 I642 T656 L662	P281-F658 HydrophobicContact CB-CE2 4.4Å; P281-F658 HydrophobicContact CG-CE2 3.81Å; P281-F658 HydrophobicContact CG-CZ 3.98Å; D302-F658 PolarHBondContact OD2-N 3.29Å; M436-F658 HydrophobicContact CG-CE1 4.21Å; I642-F658 HydrophobicContact CB-CD1 3.98Å; I642-F658 HydrophobicContact CB-CE1 3.71Å; I642-F658 HydrophobicContact CD1-CD1 4.34Å; I642-F658 HydrophobicContact CG2-CD1 3.61Å; I642-F658 HydrophobicContact CG2-CE1 3.32Å; I642-F658 HydrophobicContact CG2-CG 4.34Å; I642-F658 HydrophobicContact CG2-CZ 3.83Å; T656-F658 HydrophobicContact CG2-CE2 4.18Å; T656-F658 VanDerWaalsContact OG1-CE2 3.23Å; T656-F658 WeakPolarHBondContact OG1-CE2 3.35Å; F658-L662 WeakPolarHBondContact O-CB 2.78Å; F658-L662 PolarHBondContact O-N 3.4Å
659	H	89.9	Confident	83.8	Confident	22 Å²	22	32.9 Å²	32.9	10%	0.102	17%	0.168	C	C	.	.	H	α-helix	trans	-72.3	-43.7	-174.5	-55.9	79.9	0	0	0	111	V299 D302 N431 S433 A657 M663	V299-H659 HydrophobicContact CB-CB 4.5Å; V299-H659 HydrophobicContact CG2-CB 3.74Å; D302-H659 IonicContact OD1-ND1 2.64Å; D302-H659 VanDerWaalsContact OD2-CB 3.29Å; D302-H659 WeakPolarHBondContact OD2-CB 3.38Å; D302-H659 IonicContact OD2-CG 3.97Å; D302-H659 PolarHBondContact OD2-N 3.01Å; D302-H659 IonicContact OD2-ND1 3.53Å; D302-H659 PolarHBondContact OD2-ND1 3.32Å; N431-H659 PolarHBondContact OD1-CD2 3.49Å; S433-H659 PolarHBondContact OG-CD2 3.3Å; S433-H659 PolarHBondContact OG-CE1 3.17Å; S433-H659 VanDerWaalsContact OG-CG 3.28Å; S433-H659 PolarHBondContact OG-NE2 2.97Å; A657-H659 PolarHBondContact O-N 3.06Å; H659-M663 PolarHBondContact O-N 2.7Å; H659-M663 VanDerWaalsContact O-N 3.15Å
660	W	91.4	Very high	85.1	Confident	53 Å²	53	31.6 Å²	31.6	20%	0.201	16%	0.163	C	C	.	.	H	α-helix	trans	-69	-43.9	-179.9	176.2	-114.2	0	0	0	112	V299 D302 L303 F377 A657 L662 M663 L664	V299-W660 HydrophobicContact CG1-CE3 3.98Å; D302-W660 HydrophobicContact CB-CB 4.31Å; L303-W660 HydrophobicContact CD1-CB 4.08Å; L303-W660 HydrophobicContact CD1-CD2 3.69Å; L303-W660 HydrophobicContact CD1-CE3 3.61Å; L303-W660 HydrophobicContact CD1-CG 3.9Å; L303-W660 HydrophobicContact CD1-CZ3 4.29Å; L303-W660 HydrophobicContact CG-CD2 4.44Å; F377-W660 PolarHBondContact O-NE1 3.43Å; A657-W660 HydrophobicContact CB-CB 4.5Å; W660-L662 VanDerWaalsContact C-N 3.28Å; W660-L662 PolarHBondContact O-N 3.46Å; W660-M663 HydrophobicContact CE3-SD 4.43Å; W660-M663 HydrophobicContact CZ3-SD 4.34Å; W660-M663 PolarHBondContact O-N 3.24Å; W660-L664 WeakPolarHBondContact O-CB 3.4Å; W660-L664 PolarHBondContact O-N 2.94Å
661	D	91.5	Very high	86.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.3	-35.4	179	-71.2	-13.1	0	0	0	111.8	G379 S380 I642 A657 T665	G379-D661 WeakPolarHBondContact CA-OD1 3.41Å; G379-D661 PolarHBondContact N-OD1 3.46Å; S380-D661 WeakPolarHBondContact CB-OD2 3.43Å; S380-D661 PolarHBondContact N-OD1 2.83Å; S380-D661 PolarHBondContact N-OD2 2.86Å; S380-D661 VanDerWaalsContact N-OD2 3.1Å; S380-D661 PolarHBondContact OG-OD2 3.44Å; I642-D661 HydrophobicContact CD1-CB 3.7Å; A657-D661 VanDerWaalsContact O-CB 3.32Å; A657-D661 WeakPolarHBondContact O-CB 3.37Å; A657-D661 PolarHBondContact O-N 3.31Å; D661-T665 WeakPolarHBondContact O-CB 3.36Å; D661-T665 PolarHBondContact O-N 3.46Å; D661-T665 PolarHBondContact O-OG1 3.09Å
662	L	91.8	Very high	87.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.1	-46.4	174	-176.8	68.2	0	0	0	111.9	L424 F635 F658 W660 T665 G666	L424-L662 HydrophobicContact CD2-CD1 3.78Å; F635-L662 HydrophobicContact CB-CD1 4.43Å; F635-L662 HydrophobicContact CD2-CD1 3.88Å; F635-L662 HydrophobicContact CD2-CD2 3.58Å; F635-L662 HydrophobicContact CD2-CG 4.41Å; F635-L662 HydrophobicContact CE2-CD2 3.76Å; F658-L662 WeakPolarHBondContact O-CB 2.78Å; F658-L662 PolarHBondContact O-N 3.4Å; W660-L662 VanDerWaalsContact C-N 3.28Å; W660-L662 PolarHBondContact O-N 3.46Å; L662-T665 PolarHBondContact O-N 3.37Å; L662-G666 PolarHBondContact O-N 2.77Å; L662-G666 VanDerWaalsContact O-N 3.08Å
663	M	93.2	Very high	88.3	Confident	30 Å²	30	28.2 Å²	28.2	15%	0.148	15%	0.15	C	C	.	.	H	α-helix	trans	-65.4	-40.5	178.2	-175.7	173.3	166.3	0	0	111.6	V299 I425 H659 W660 G666 F667	V299-M663 HydrophobicContact CG1-SD 4.25Å; V299-M663 HydrophobicContact CG2-SD 4.28Å; I425-M663 HydrophobicContact CG1-CG 4.42Å; I425-M663 HydrophobicContact CG2-CG 4.47Å; H659-M663 PolarHBondContact O-N 2.7Å; H659-M663 VanDerWaalsContact O-N 3.15Å; W660-M663 HydrophobicContact CE3-SD 4.43Å; W660-M663 HydrophobicContact CZ3-SD 4.34Å; W660-M663 PolarHBondContact O-N 3.24Å; M663-G666 WeakPolarHBondContact O-CA 2.95Å; M663-G666 PolarHBondContact O-N 2.95Å; M663-F667 HydrophobicContact CE-CE2 3.46Å; M663-F667 VanDerWaalsContact CE-CE2 3.46Å; M663-F667 HydrophobicContact CE-CZ 3.47Å; M663-F667 VanDerWaalsContact CE-CZ 3.47Å; M663-F667 HydrophobicContact CG-CD2 4.24Å; M663-F667 HydrophobicContact CG-CE2 3.64Å; M663-F667 HydrophobicContact CG-CZ 4.26Å; M663-F667 VanDerWaalsContact O-CD2 3.28Å; M663-F667 WeakPolarHBondContact O-CD2 3.24Å; M663-F667 PolarHBondContact O-N 3.17Å; M663-F667 HydrophobicContact SD-CE2 4.33Å
664	L	94	Very high	89.4	Confident	7 Å²	7	22.6 Å²	22.6	4%	0.037	12%	0.122	C	C	.	.	H	α-helix	trans	-61.5	-42.8	174.9	-179.2	62.2	0	0	0	111.9	I373 Y374 F377 A378 W660 G666 F667 I668	I373-L664 HydrophobicContact CG2-CD1 4.42Å; Y374-L664 HydrophobicContact CD2-CD2 4.08Å; Y374-L664 HydrophobicContact CD2-CG 4.47Å; Y374-L664 HydrophobicContact CE2-CD2 4.43Å; F377-L664 VanDerWaalsContact C-CD2 3.49Å; F377-L664 HydrophobicContact CB-CD1 3.78Å; F377-L664 HydrophobicContact CB-CD2 3.89Å; A378-L664 VanDerWaalsContact CA-CD2 3.44Å; A378-L664 HydrophobicContact CB-CD2 3.98Å; A378-L664 VanDerWaalsContact N-CD2 3.32Å; W660-L664 WeakPolarHBondContact O-CB 3.4Å; W660-L664 PolarHBondContact O-N 2.94Å; L664-G666 VanDerWaalsContact C-N 3.27Å; L664-G666 PolarHBondContact O-N 3.42Å; L664-F667 PolarHBondContact O-N 2.89Å; L664-F667 VanDerWaalsContact O-N 3.16Å; L664-I668 HydrophobicContact CD1-CD1 4.42Å; L664-I668 HydrophobicContact CG-CD1 4.07Å; L664-I668 WeakPolarHBondContact O-CG1 3.45Å; L664-I668 PolarHBondContact O-N 3.15Å
665	T	93.8	Very high	90.2	Very high	3 Å²	3	23.4 Å²	23.4	2%	0.018	13%	0.127	C	C	.	.	H	α-helix	trans	-61.4	-38.2	174.9	-56.3	0	0	0	0	111.1	I634 D661 L662 I668 N669 H681	I634-T665 HydrophobicContact CG2-CG2 3.9Å; D661-T665 WeakPolarHBondContact O-CB 3.36Å; D661-T665 PolarHBondContact O-N 3.46Å; D661-T665 PolarHBondContact O-OG1 3.09Å; L662-T665 PolarHBondContact O-N 3.37Å; T665-I668 PolarHBondContact O-N 2.81Å; T665-N669 WeakPolarHBondContact O-CB 3.49Å; T665-N669 PolarHBondContact O-N 3.16Å; T665-N669 PolarHBondContact O-ND2 3.13Å; T665-H681 HydrophobicContact CG2-CB 4.34Å
666	G	94.9	Very high	91.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-57.5	-49.3	170.6	0	0	0	0	0	112.6	S421 L662 M663 L664 I668 N669 I670	S421-G666 WeakPolarHBondContact CB-O 3.37Å; S421-G666 PolarHBondContact OG-O 3.46Å; L662-G666 PolarHBondContact O-N 2.77Å; L662-G666 VanDerWaalsContact O-N 3.08Å; M663-G666 WeakPolarHBondContact O-CA 2.95Å; M663-G666 PolarHBondContact O-N 2.95Å; L664-G666 VanDerWaalsContact C-N 3.27Å; L664-G666 PolarHBondContact O-N 3.42Å; G666-I668 PolarHBondContact O-N 3.29Å; G666-N669 PolarHBondContact O-N 2.93Å; G666-I670 WeakPolarHBondContact O-CG1 3.4Å; G666-I670 PolarHBondContact O-N 3.36Å
667	F	95.1	Very high	91.7	Very high	91 Å²	91	20.3 Å²	20.3	40%	0.399	10%	0.101	S	C	.	.	H	α-helix	trans	-63.2	-40.1	177.6	-68.7	-56	0	0	0	113.6	I425 M663 L664 N669 I670 L671	I425-F667 HydrophobicContact CD1-CD1 3.94Å; I425-F667 HydrophobicContact CD1-CE1 3.76Å; I425-F667 HydrophobicContact CD1-CZ 4.34Å; M663-F667 HydrophobicContact CE-CE2 3.46Å; M663-F667 VanDerWaalsContact CE-CE2 3.46Å; M663-F667 HydrophobicContact CE-CZ 3.47Å; M663-F667 VanDerWaalsContact CE-CZ 3.47Å; M663-F667 HydrophobicContact CG-CD2 4.24Å; M663-F667 HydrophobicContact CG-CE2 3.64Å; M663-F667 HydrophobicContact CG-CZ 4.26Å; M663-F667 VanDerWaalsContact O-CD2 3.28Å; M663-F667 WeakPolarHBondContact O-CD2 3.24Å; M663-F667 PolarHBondContact O-N 3.17Å; M663-F667 HydrophobicContact SD-CE2 4.33Å; L664-F667 PolarHBondContact O-N 2.89Å; L664-F667 VanDerWaalsContact O-N 3.16Å; F667-N669 VanDerWaalsContact C-N 3.31Å; F667-N669 PolarHBondContact O-N 3Å; F667-I670 HydrophobicContact CD1-CD1 4.3Å; F667-I670 PolarHBondContact O-N 3.24Å; F667-L671 PolarHBondContact O-N 3.29Å
668	I	94.6	Very high	92.1	Very high	4 Å²	4	20.2 Å²	20.2	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-62.3	-42.9	175.6	-68.6	166.4	0	0	0	110	I373 Y374 L664 T665 G666 I670 L671 M672 M680	I373-I668 HydrophobicContact CB-CD1 4.47Å; I373-I668 HydrophobicContact CB-CG1 4.31Å; I373-I668 HydrophobicContact CG2-CD1 4.11Å; I373-I668 HydrophobicContact CG2-CG1 3.77Å; Y374-I668 HydrophobicContact CD2-CD1 3.81Å; Y374-I668 HydrophobicContact CG-CD1 4.33Å; L664-I668 HydrophobicContact CD1-CD1 4.42Å; L664-I668 HydrophobicContact CG-CD1 4.07Å; L664-I668 WeakPolarHBondContact O-CG1 3.45Å; L664-I668 PolarHBondContact O-N 3.15Å; T665-I668 PolarHBondContact O-N 2.81Å; G666-I668 PolarHBondContact O-N 3.29Å; I668-I670 VanDerWaalsContact C-N 3.34Å; I668-I670 PolarHBondContact O-N 3.3Å; I668-L671 WeakPolarHBondContact O-CB 3.19Å; I668-L671 PolarHBondContact O-N 3.38Å; I668-L671 VanDerWaalsContact O-N 3.14Å; I668-M672 HydrophobicContact CG2-CE 4.36Å; I668-M672 HydrophobicContact CG2-CG 4.2Å; I668-M672 WeakPolarHBondContact O-CG 3.34Å; I668-M672 PolarHBondContact O-N 3.17Å; I668-M680 HydrophobicContact CG2-CG 3.76Å; I668-M680 HydrophobicContact CG2-SD 3.7Å
669	N	94.3	Very high	92.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-68.1	-29.2	179.2	-74.5	-27.3	0	0	0	113.3	S421 T665 G666 F667 M672 S673 M680	S421-N669 WeakPolarHBondContact OG-CB 2.97Å; T665-N669 WeakPolarHBondContact O-CB 3.49Å; T665-N669 PolarHBondContact O-N 3.16Å; T665-N669 PolarHBondContact O-ND2 3.13Å; G666-N669 PolarHBondContact O-N 2.93Å; F667-N669 VanDerWaalsContact C-N 3.31Å; F667-N669 PolarHBondContact O-N 3Å; N669-M672 PolarHBondContact O-N 3.08Å; N669-S673 VanDerWaalsContact O-CB 3.27Å; N669-S673 WeakPolarHBondContact O-CB 3.24Å; N669-S673 PolarHBondContact O-N 3.11Å; N669-S673 PolarHBondContact O-OG 2.93Å; N669-M680 PolarHBondContact OD1-N 3.25Å; N669-M680 PolarHBondContact OD1-O 3.44Å
670	I	94.6	Very high	92.5	Very high	56 Å²	56	18.6 Å²	18.6	29%	0.287	9%	0.094	S	C	.	.	H	α-helix	trans	-58.5	-51.1	168.5	-65.6	174.2	0	0	0	109.4	L418 S421 I425 G666 F667 I668 M672 S673 C674	L418-I670 HydrophobicContact CD2-CG2 4.02Å; S421-I670 PolarHBondContact OG-N 3.32Å; I425-I670 HydrophobicContact CD1-CD1 3.91Å; G666-I670 WeakPolarHBondContact O-CG1 3.4Å; G666-I670 PolarHBondContact O-N 3.36Å; F667-I670 HydrophobicContact CD1-CD1 4.3Å; F667-I670 PolarHBondContact O-N 3.24Å; I668-I670 VanDerWaalsContact C-N 3.34Å; I668-I670 PolarHBondContact O-N 3.3Å; I670-M672 PolarHBondContact O-N 3.01Å; I670-S673 PolarHBondContact O-N 3.04Å; I670-C674 PolarHBondContact O-N 2.96Å; I670-C674 PolarHBondContact O-SG 3Å; I670-C674 VanDerWaalsContact O-SG 3.37Å
671	L	93.4	Very high	92.5	Very high	64 Å²	64	16.2 Å²	16.2	34%	0.335	9%	0.085	S	C	.	.	H	α-helix	trans	-60.9	-46.9	-179.9	-177.9	65.2	0	0	0	111.5	I369 I373 F667 I668 S673 C674 L675	I369-L671 HydrophobicContact CG2-CD2 3.81Å; I373-L671 HydrophobicContact CD1-CD2 3.46Å; I373-L671 VanDerWaalsContact CD1-CD2 3.46Å; F667-L671 PolarHBondContact O-N 3.29Å; I668-L671 WeakPolarHBondContact O-CB 3.19Å; I668-L671 PolarHBondContact O-N 3.38Å; I668-L671 VanDerWaalsContact O-N 3.14Å; L671-S673 VanDerWaalsContact C-N 3.32Å; L671-S673 PolarHBondContact O-N 2.82Å; L671-C674 PolarHBondContact O-N 3.18Å; L671-L675 HydrophobicContact CD1-CD1 3.8Å; L671-L675 HydrophobicContact CD1-CG 4.26Å; L671-L675 HydrophobicContact CG-CD1 3.93Å; L671-L675 WeakPolarHBondContact O-CB 3.43Å; L671-L675 VanDerWaalsContact O-CG 3.25Å; L671-L675 WeakPolarHBondContact O-CG 3.27Å; L671-L675 PolarHBondContact O-N 3.1Å; L671-L675 VanDerWaalsContact O-N 3.16Å
672	M	92.1	Very high	92.4	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.2	-41.1	178.2	-63.8	-55.4	116.3	0	0	111.8	I369 I668 N669 I670 L675 G676 L677 M680	I369-M672 HydrophobicContact CB-CE 4.07Å; I369-M672 HydrophobicContact CG2-CE 3.73Å; I668-M672 HydrophobicContact CG2-CE 4.36Å; I668-M672 HydrophobicContact CG2-CG 4.2Å; I668-M672 WeakPolarHBondContact O-CG 3.34Å; I668-M672 PolarHBondContact O-N 3.17Å; N669-M672 PolarHBondContact O-N 3.08Å; I670-M672 PolarHBondContact O-N 3.01Å; M672-L675 PolarHBondContact O-N 2.97Å; M672-G676 PolarHBondContact O-N 3.44Å; M672-G676 VanDerWaalsContact O-N 3.1Å; M672-L677 HydrophobicContact CB-CB 4.3Å; M672-L677 HydrophobicContact CE-CD1 4.5Å; M672-L677 PolarHBondContact O-N 2.92Å; M672-L677 HydrophobicContact SD-CB 3.8Å; M672-L677 HydrophobicContact SD-CD1 3.9Å; M672-M680 HydrophobicContact SD-CE 4.12Å
673	S	92.9	Very high	92.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-66.9	-42.2	-179.8	-54.8	0	0	0	0	112.6	A414 G417 N669 I670 L671 L675 G676 W679	A414-S673 WeakPolarHBondContact CB-O 3.37Å; G417-S673 VanDerWaalsContact CA-OG 3.24Å; G417-S673 WeakPolarHBondContact CA-OG 3.38Å; N669-S673 VanDerWaalsContact O-CB 3.27Å; N669-S673 WeakPolarHBondContact O-CB 3.24Å; N669-S673 PolarHBondContact O-N 3.11Å; N669-S673 PolarHBondContact O-OG 2.93Å; I670-S673 PolarHBondContact O-N 3.04Å; L671-S673 VanDerWaalsContact C-N 3.32Å; L671-S673 PolarHBondContact O-N 2.82Å; S673-L675 VanDerWaalsContact C-N 3.26Å; S673-L675 PolarHBondContact O-N 2.87Å; S673-G676 PolarHBondContact O-N 3.37Å; S673-W679 PolarHBondContact OG-NE1 3.16Å
674	C	90.6	Very high	91.5	Very high	32 Å²	32	17.7 Å²	17.7	22%	0.216	9%	0.091	C	C	.	.	H	α-helix	trans	-67.9	-26.9	177.4	-69.3	0	0	0	0	113	P610 I670 L671	P610-C674 VanDerWaalsContact CD-O 3.28Å; P610-C674 WeakPolarHBondContact CD-O 3.4Å; I670-C674 PolarHBondContact O-N 2.96Å; I670-C674 PolarHBondContact O-SG 3Å; I670-C674 VanDerWaalsContact O-SG 3.37Å; L671-C674 PolarHBondContact O-N 3.18Å
675	L	89.9	Confident	90.7	Very high	41 Å²	41	19.2 Å²	19.2	22%	0.215	10%	0.101	C	C	.	.	H	α-helix	trans	-91.8	-5.9	179.8	-65.6	178.7	0	0	0	113.5	F607 L671 M672 S673 L677	F607-L675 HydrophobicContact CD1-CB 4.1Å; F607-L675 HydrophobicContact CD1-CD1 4.24Å; F607-L675 HydrophobicContact CD1-CD2 3.83Å; F607-L675 HydrophobicContact CD1-CG 4.27Å; F607-L675 HydrophobicContact CE1-CD1 4.08Å; F607-L675 HydrophobicContact CE1-CD2 4.39Å; L671-L675 HydrophobicContact CD1-CD1 3.8Å; L671-L675 HydrophobicContact CD1-CG 4.26Å; L671-L675 HydrophobicContact CG-CD1 3.93Å; L671-L675 WeakPolarHBondContact O-CB 3.43Å; L671-L675 VanDerWaalsContact O-CG 3.25Å; L671-L675 WeakPolarHBondContact O-CG 3.27Å; L671-L675 PolarHBondContact O-N 3.1Å; L671-L675 VanDerWaalsContact O-N 3.16Å; M672-L675 PolarHBondContact O-N 2.97Å; S673-L675 VanDerWaalsContact C-N 3.26Å; S673-L675 PolarHBondContact O-N 2.87Å; L675-L677 VanDerWaalsContact C-N 3.28Å; L675-L677 HydrophobicContact CB-CD1 3.78Å; L675-L677 HydrophobicContact CB-CG 3.8Å; L675-L677 HydrophobicContact CD1-CD1 3.87Å; L675-L677 PolarHBondContact O-N 3.46Å
676	G	87.4	Confident	90.1	Very high	7 Å²	7	19.7 Å²	19.7	7%	0.072	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	26.7	-174.5	0	0	0	0	0	113.4	M672 S673	M672-G676 PolarHBondContact O-N 3.44Å; M672-G676 VanDerWaalsContact O-N 3.1Å; S673-G676 PolarHBondContact O-N 3.37Å
677	L	91.3	Very high	89.7	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.103	C	C	.	.	P	Polyproline II helix	trans	-95.9	152.3	179.2	-60.5	174.1	0	0	0	110.1	K362 I369 Y413 F607 M672 L675 W679	K362-L677 HydrophobicContact CB-CD2 3.99Å; K362-L677 HydrophobicContact CG-CD2 4.32Å; I369-L677 HydrophobicContact CD1-CD1 4.25Å; Y413-L677 PolarHBondContact OH-O 2.97Å; F607-L677 HydrophobicContact CE1-CD1 4.25Å; M672-L677 HydrophobicContact CB-CB 4.3Å; M672-L677 HydrophobicContact CE-CD1 4.5Å; M672-L677 PolarHBondContact O-N 2.92Å; M672-L677 HydrophobicContact SD-CB 3.8Å; M672-L677 HydrophobicContact SD-CD1 3.9Å; L675-L677 VanDerWaalsContact C-N 3.28Å; L675-L677 HydrophobicContact CB-CD1 3.78Å; L675-L677 HydrophobicContact CB-CG 3.8Å; L675-L677 HydrophobicContact CD1-CD1 3.87Å; L675-L677 PolarHBondContact O-N 3.46Å; L677-W679 PolarHBondContact O-N 3.48Å
678	P	91.4	Very high	89	Confident	1 Å²	1	16.9 Å²	16.9	1%	0.006	10%	0.095	C	C	.	.	P	Polyproline II helix	trans	-62.1	138.6	178.1	24.7	-32	0	0	0	111.2	I358 T363 Y413	I358-P678 HydrophobicContact CG2-CB 4.23Å; I358-P678 HydrophobicContact CG2-CG 4.33Å; T363-P678 HydrophobicContact CG2-CG 4.13Å; Y413-P678 WeakPolarHBondContact OH-CA 3.49Å
679	W	93.1	Very high	88.2	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.108	C	C	.	.	P	Polyproline II helix	trans	-62.7	161.4	173.8	-51.2	-56.1	0	0	0	111.9	T387 L391 F394 I395 I398 Y413 I416 L630 S673 L677	T387-W679 PolarHBondContact OG1-O 3.32Å; L391-W679 HydrophobicContact CD1-CB 4.35Å; L391-W679 HydrophobicContact CD1-CE3 3.77Å; L391-W679 HydrophobicContact CD2-CB 3.86Å; L391-W679 WeakPolarHBondContact CD2-O 3.4Å; L391-W679 HydrophobicContact CG-CE3 4.48Å; F394-W679 HydrophobicContact CD1-CZ3 4.39Å; I395-W679 HydrophobicContact CD1-CE3 4.49Å; I395-W679 HydrophobicContact CG1-CE3 4.21Å; I395-W679 HydrophobicContact CG1-CZ3 4.05Å; I398-W679 HydrophobicContact CD1-CH2 3.57Å; I398-W679 HydrophobicContact CD1-CZ3 3.82Å; Y413-W679 HydrophobicContact CD1-CZ2 4.16Å; Y413-W679 AromaticContact CD2-CH2 3.57Å; Y413-W679 HydrophobicContact CD2-CH2 3.57Å; Y413-W679 AromaticContact CD2-CZ2 3.75Å; Y413-W679 HydrophobicContact CD2-CZ2 3.75Å; Y413-W679 HydrophobicContact CD2-CZ3 4.21Å; Y413-W679 AromaticContact CE1-CE2 3.84Å; Y413-W679 AromaticContact CE1-CZ2 3.87Å; Y413-W679 HydrophobicContact CE1-CZ2 3.87Å; Y413-W679 AromaticContact CE1-NE1 3.93Å; Y413-W679 HydrophobicContact CE2-CD2 4.11Å; Y413-W679 AromaticContact CE2-CE2 3.83Å; Y413-W679 AromaticContact CE2-CE3 3.9Å; Y413-W679 HydrophobicContact CE2-CE3 3.9Å; Y413-W679 AromaticContact CE2-CH2 3.25Å; Y413-W679 HydrophobicContact CE2-CH2 3.25Å; Y413-W679 AromaticContact CE2-CZ2 3.42Å; Y413-W679 HydrophobicContact CE2-CZ2 3.42Å; Y413-W679 VanDerWaalsContact CE2-CZ2 3.42Å; Y413-W679 AromaticContact CE2-CZ3 3.49Å; Y413-W679 HydrophobicContact CE2-CZ3 3.49Å; Y413-W679 VanDerWaalsContact CE2-CZ3 3.49Å; Y413-W679 HydrophobicContact CG-CH2 4.33Å; Y413-W679 HydrophobicContact CG-CZ2 4.09Å; Y413-W679 AromaticContact CZ-CD2 3.72Å; Y413-W679 AromaticContact CZ-CE2 3.42Å; Y413-W679 VanDerWaalsContact CZ-CE2 3.42Å; Y413-W679 AromaticContact CZ-CE3 3.96Å; Y413-W679 AromaticContact CZ-CH2 3.79Å; Y413-W679 AromaticContact CZ-CZ2 3.48Å; Y413-W679 VanDerWaalsContact CZ-CZ2 3.48Å; Y413-W679 AromaticContact CZ-NE1 3.89Å; Y413-W679 WeakPolarHBondContact O-CZ2 3.2Å; Y413-W679 PolarHBondContact OH-N 3.42Å; I416-W679 HydrophobicContact CB-CH2 4.47Å; I416-W679 HydrophobicContact CG2-CH2 3.99Å; I416-W679 HydrophobicContact CG2-CZ2 4.36Å; L630-W679 HydrophobicContact CD1-CE3 4.33Å; L630-W679 HydrophobicContact CD1-CZ3 4.4Å; L630-W679 HydrophobicContact CD2-CD2 3.96Å; L630-W679 HydrophobicContact CD2-CE3 3.62Å; L630-W679 HydrophobicContact CD2-CH2 3.61Å; L630-W679 HydrophobicContact CD2-CZ2 3.98Å; L630-W679 HydrophobicContact CD2-CZ3 3.43Å; L630-W679 VanDerWaalsContact CD2-CZ3 3.43Å; S673-W679 PolarHBondContact OG-NE1 3.16Å; L677-W679 PolarHBondContact O-N 3.48Å
680	M	91.3	Very high	87.7	Confident	2 Å²	2	19.3 Å²	19.3	1%	0.01	11%	0.108	C	C	.	.			trans	-144.8	152	-179.3	56.6	169.8	72.2	0	0	111.9	G366 G370 P385 I668 N669 M672	G366-M680 VanDerWaalsContact C-CE 3.44Å; G366-M680 WeakPolarHBondContact O-CE 3.44Å; G370-M680 VanDerWaalsContact C-SD 3.57Å; G370-M680 WeakPolarHBondContact CA-SD 3.46Å; P385-M680 HydrophobicContact CB-CB 4.44Å; P385-M680 HydrophobicContact CB-CG 4.43Å; P385-M680 HydrophobicContact CB-SD 3.89Å; P385-M680 HydrophobicContact CG-SD 4.2Å; I668-M680 HydrophobicContact CG2-CG 3.76Å; I668-M680 HydrophobicContact CG2-SD 3.7Å; N669-M680 PolarHBondContact OD1-N 3.25Å; N669-M680 PolarHBondContact OD1-O 3.44Å; M672-M680 HydrophobicContact SD-CE 4.12Å
681	H	91.7	Very high	87.1	Confident	3 Å²	3	16.6 Å²	16.6	1%	0.014	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	174	175.9	70.1	76.9	0	0	0	109.4	P385 L386 T388 I634 D637 T665 A683	P385-H681 CarbonylContact C-O 3.47Å; P385-H681 VanDerWaalsContact CA-O 3.25Å; P385-H681 WeakPolarHBondContact CA-O 3.31Å; L386-H681 PolarHBondContact N-O 3.43Å; L386-H681 PolarHBondContact O-N 2.89Å; T388-H681 VanDerWaalsContact CG2-CE1 3.45Å; T388-H681 WeakPolarHBondContact CG2-CE1 3.49Å; T388-H681 PolarHBondContact OG1-CE1 3.09Å; T388-H681 VanDerWaalsContact OG1-CE1 3.29Å; T388-H681 PolarHBondContact OG1-NE2 3.42Å; I634-H681 HydrophobicContact CG1-CB 4.47Å; I634-H681 HydrophobicContact CG2-CB 3.91Å; D637-H681 WeakPolarHBondContact CB-CE1 3.34Å; D637-H681 IonicContact OD2-CE1 3.81Å; D637-H681 PolarHBondContact OD2-CE1 3.22Å; D637-H681 IonicContact OD2-NE2 3.57Å; D637-H681 PolarHBondContact OD2-NE2 3.42Å; T665-H681 HydrophobicContact CG2-CB 4.34Å; H681-A683 PolarHBondContact O-N 3.44Å
682	A	90.3	Very high	86.4	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	125.7	-176.3	0	0	0	0	0	113.2	V383 V641	V383-A682 HydrophobicContact CG1-CB 3.26Å; V641-A682 HydrophobicContact CB-CB 3.77Å; V641-A682 HydrophobicContact CG1-CB 3.72Å; V641-A682 HydrophobicContact CG2-CB 4.31Å; V641-A682 WeakPolarHBondContact CG2-O 3.32Å
683	A	86.1	Confident	85.7	Confident	4 Å²	4	18.6 Å²	18.6	3%	0.033	10%	0.097	C	C	.	.			trans	-98.8	128.2	177	0	0	0	0	0	112.9	I384 L386 T388 H681 S687	I384-A683 PolarHBondContact O-N 3.3Å; L386-A683 HydrophobicContact CB-CB 3.82Å; L386-A683 HydrophobicContact CD2-CB 4.26Å; T388-A683 HydrophobicContact CG2-CB 4.23Å; H681-A683 PolarHBondContact O-N 3.44Å; A683-S687 VanDerWaalsContact O-CB 3.27Å; A683-S687 WeakPolarHBondContact O-CB 3.32Å; A683-S687 PolarHBondContact O-N 3.08Å; A683-S687 VanDerWaalsContact O-N 3.08Å; A683-S687 PolarHBondContact O-OG 3.28Å
684	F	79.8	Confident	85	Confident	56 Å²	56	18.9 Å²	18.9	25%	0.246	10%	0.099	C	C	.	.	H	α-helix	trans	-64.5	-57.2	-172.6	170.6	-115.2	0	0	0	115	V641 L644 H686 S687 S688	V641-F684 HydrophobicContact CG2-CB 3.72Å; L644-F684 HydrophobicContact CB-CD2 3.85Å; L644-F684 HydrophobicContact CB-CE2 3.58Å; L644-F684 HydrophobicContact CD1-CD2 3.5Å; L644-F684 HydrophobicContact CD1-CE2 3.43Å; L644-F684 VanDerWaalsContact CD1-CE2 3.43Å; L644-F684 HydrophobicContact CD1-CG 4.25Å; L644-F684 HydrophobicContact CD1-CZ 4.06Å; L644-F684 HydrophobicContact CG-CD2 4.32Å; L644-F684 HydrophobicContact CG-CE2 4.04Å; F684-H686 PolarHBondContact O-N 2.96Å; F684-S687 PolarHBondContact O-N 3.42Å; F684-S688 PolarHBondContact O-N 2.97Å; F684-S688 VanDerWaalsContact O-N 3.1Å; F684-S688 PolarHBondContact O-OG 2.85Å
685	P	75.9	Confident	84.3	Confident	39 Å²	39	17.4 Å²	17.4	25%	0.253	9%	0.089	S	C	.	.	H	α-helix	trans	-64.5	-33.1	-173.9	23.9	-33.1	0	0	0	111.7	S688 L689 I753	P685-S688 PolarHBondContact O-OG 3.13Å; P685-L689 WeakPolarHBondContact O-CB 3.36Å; P685-L689 PolarHBondContact O-N 3.2Å; P685-I753 HydrophobicContact CG-CG2 4.27Å
686	H	82.5	Confident	83.4	Confident	14 Å²	14	18.9 Å²	18.9	7%	0.065	9%	0.094	C	C	.	.	H	α-helix	trans	-75.5	-41.9	179.6	-59.9	-69.7	0	0	0	112.5	A338 P342 I384 F684 L689 H690	A338-H686 PolarHBondContact O-CE1 2.95Å; A338-H686 PolarHBondContact O-ND1 3.46Å; P342-H686 VanDerWaalsContact CG-CE1 3.48Å; P342-H686 WeakPolarHBondContact CG-CE1 3.26Å; I384-H686 HydrophobicContact CD1-CB 4.26Å; F684-H686 PolarHBondContact O-N 2.96Å; H686-L689 PolarHBondContact O-N 3.43Å; H686-H690 WeakPolarHBondContact O-CB 3.29Å; H686-H690 PolarHBondContact O-N 3.5Å
687	S	86.5	Confident	82.6	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-66.5	-43	180	-57.5	0	0	0	0	112.1	I384 T645 A683 F684 H690 A691	I384-S687 PolarHBondContact N-OG 2.68Å; T645-S687 WeakPolarHBondContact OG1-CB 3.45Å; A683-S687 VanDerWaalsContact O-CB 3.27Å; A683-S687 WeakPolarHBondContact O-CB 3.32Å; A683-S687 PolarHBondContact O-N 3.08Å; A683-S687 VanDerWaalsContact O-N 3.08Å; A683-S687 PolarHBondContact O-OG 3.28Å; F684-S687 PolarHBondContact O-N 3.42Å; S687-H690 PolarHBondContact O-N 3.48Å; S687-A691 PolarHBondContact O-N 2.92Å; S687-A691 VanDerWaalsContact O-N 3.09Å
688	S	78.9	Confident	81.2	Confident	32 Å²	32	23.3 Å²	23.3	22%	0.224	12%	0.116	C	C	.	.	H	α-helix	trans	-66.7	-37.6	176.1	57.1	0	0	0	0	112.2	F684 P685 A691 R692	F684-S688 PolarHBondContact O-N 2.97Å; F684-S688 VanDerWaalsContact O-N 3.1Å; F684-S688 PolarHBondContact O-OG 2.85Å; P685-S688 PolarHBondContact O-OG 3.13Å; S688-A691 PolarHBondContact O-N 3.21Å; S688-R692 WeakPolarHBondContact O-CB 3.37Å; S688-R692 PolarHBondContact O-N 2.94Å
689	L	78.4	Confident	79.9	Confident	54 Å²	54	27.9 Å²	27.9	28%	0.283	14%	0.137	S	C	.	.	H	α-helix	trans	-67.9	-39.4	176.6	-171.1	56.8	0	0	0	112.4	F334 P685 H686 R692 Q693	F334-L689 HydrophobicContact CE1-CD2 3.67Å; F334-L689 HydrophobicContact CE1-CG 3.77Å; F334-L689 HydrophobicContact CZ-CD2 3.35Å; F334-L689 HydrophobicContact CZ-CG 3.86Å; P685-L689 WeakPolarHBondContact O-CB 3.36Å; P685-L689 PolarHBondContact O-N 3.2Å; H686-L689 PolarHBondContact O-N 3.43Å; L689-R692 PolarHBondContact O-N 3.33Å; L689-Q693 WeakPolarHBondContact O-CG 3.38Å; L689-Q693 PolarHBondContact O-N 3.1Å
690	H	84.6	Confident	78.1	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.2	-47.2	173	-177.4	-146.9	0	0	0	111.7	L335 L382 I384 H686 S687 R692 Q693 L694 T719	L335-H690 HydrophobicContact CD1-CB 4.07Å; L382-H690 PolarHBondContact O-ND1 2.86Å; I384-H690 HydrophobicContact CD1-CB 3.75Å; H686-H690 WeakPolarHBondContact O-CB 3.29Å; H686-H690 PolarHBondContact O-N 3.5Å; S687-H690 PolarHBondContact O-N 3.48Å; H690-R692 VanDerWaalsContact C-N 3.33Å; H690-R692 PolarHBondContact O-N 2.98Å; H690-Q693 PolarHBondContact O-N 3.36Å; H690-L694 WeakPolarHBondContact NE2-CD1 3.49Å; H690-L694 PolarHBondContact O-N 3.05Å; H690-T719 PolarHBondContact NE2-OG1 3.37Å
691	A	81.9	Confident	76.4	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.8	-42.1	175.2	0	0	0	0	0	111.9	L382 T645 S687 S688 Q693 L694 A695 V713	L382-A691 HydrophobicContact CD1-CB 4.18Å; T645-A691 HydrophobicContact CG2-CB 4.16Å; S687-A691 PolarHBondContact O-N 2.92Å; S687-A691 VanDerWaalsContact O-N 3.09Å; S688-A691 PolarHBondContact O-N 3.21Å; A691-Q693 PolarHBondContact O-N 3.11Å; A691-L694 PolarHBondContact O-N 3.02Å; A691-A695 PolarHBondContact O-N 3.29Å; A691-V713 WeakPolarHBondContact O-CG1 3.28Å
692	R	77.5	Confident	74.3	Confident	95 Å²	95	37.3 Å²	37.3	36%	0.358	19%	0.186	S	C	.	.	H	α-helix	trans	-65.2	-34.3	179.1	-171.4	176.8	-179.1	-179.5	0.5	113.2	S688 L689 H690 A695	S688-R692 WeakPolarHBondContact O-CB 3.37Å; S688-R692 PolarHBondContact O-N 2.94Å; L689-R692 PolarHBondContact O-N 3.33Å; H690-R692 VanDerWaalsContact C-N 3.33Å; H690-R692 PolarHBondContact O-N 2.98Å; R692-A695 WeakPolarHBondContact O-CB 3.44Å; R692-A695 PolarHBondContact O-N 3.34Å
693	Q	76.8	Confident	72.4	Confident	11 Å²	11	44 Å²	44	5%	0.051	22%	0.221	C	C	.	.	H	α-helix	trans	-73.7	-31.8	177.5	-74.8	-173.8	-16.4	0	0	113.1	K327 T331 L689 H690 A691	K327-Q693 WeakPolarHBondContact CE-O 3.35Å; K327-Q693 PolarHBondContact NZ-O 2.73Å; T331-Q693 HydrophobicContact CG2-CB 4.03Å; L689-Q693 WeakPolarHBondContact O-CG 3.38Å; L689-Q693 PolarHBondContact O-N 3.1Å; H690-Q693 PolarHBondContact O-N 3.36Å; A691-Q693 PolarHBondContact O-N 3.11Å
694	L	78.5	Confident	70.8	Confident	6 Å²	6	47 Å²	47	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-78.9	-10.5	172.7	-67.4	170.8	0	0	0	112.3	Y328 T331 L382 H690 A691 V713 K714 T719	Y328-L694 HydrophobicContact CD1-CD2 3.83Å; Y328-L694 HydrophobicContact CE1-CD2 3.73Å; T331-L694 HydrophobicContact CG2-CD2 4.25Å; T331-L694 HydrophobicContact CG2-CG 4.33Å; L382-L694 HydrophobicContact CD2-CD1 3.52Å; H690-L694 WeakPolarHBondContact NE2-CD1 3.49Å; H690-L694 PolarHBondContact O-N 3.05Å; A691-L694 PolarHBondContact O-N 3.02Å; L694-V713 HydrophobicContact CB-CG1 3.95Å; L694-K714 WeakPolarHBondContact CB-O 3.32Å; L694-K714 WeakPolarHBondContact CD1-O 3.05Å; L694-K714 PolarHBondContact O-N 3.46Å; L694-T719 HydrophobicContact CD2-CG2 4.33Å
695	A	77.1	Confident	69.3	Low	1 Å²	1	50.2 Å²	50.2	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	142.8	175.1	0	0	0	0	0	112.2	K327 A691 R692 V697 I710 V713	K327-A695 PolarHBondContact NZ-O 3.39Å; A691-A695 PolarHBondContact O-N 3.29Å; R692-A695 WeakPolarHBondContact O-CB 3.44Å; R692-A695 PolarHBondContact O-N 3.34Å; A695-V697 HydrophobicContact CB-CG2 4.28Å; A695-I710 HydrophobicContact CB-CG1 4.36Å; A695-I710 HydrophobicContact CB-CG2 3.86Å; A695-V713 HydrophobicContact CB-CG2 3.78Å
696	K	71.5	Confident	68.3	Low	72 Å²	72	52.6 Å²	52.6	31%	0.313	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	111.8	162.6	-166.8	168	-179.5	176.9	0	107.4	Q242 E246 V711 S712	Q242-K696 VanDerWaalsContact CD-CE 3.49Å; Q242-K696 HydrophobicContact CG-CD 4.48Å; Q242-K696 VanDerWaalsContact NE2-CD 3.3Å; E246-K696 IonicContact OE1-NZ 2.68Å; E246-K696 PolarHBondContact OE1-NZ 3.24Å; K696-V711 PolarHBondContact O-N 3.16Å; K696-S712 PolarHBondContact N-O 3.2Å
697	V	68.7	Low	67.2	Low	57 Å²	57	56.6 Å²	56.6	35%	0.345	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.5	-177.3	-173.8	0	0	0	0	108.9	A695 T708 I710	A695-V697 HydrophobicContact CB-CG2 4.28Å; V697-T708 HydrophobicContact CG1-CG2 4.46Å; V697-I710 HydrophobicContact CG2-CG1 4.27Å
698	E	63.5	Low	66.1	Low	43 Å²	43	60.4 Å²	60.4	20%	0.201	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	139.8	170.4	-174.5	166.3	-147.4	0	0	109.2	T708 T709 V711	E698-T708 CarbonylContact O-C 3.53Å; E698-T708 VanDerWaalsContact O-CA 3.3Å; E698-T708 WeakPolarHBondContact O-CA 3.47Å; E698-T709 PolarHBondContact N-O 2.99Å; E698-T709 PolarHBondContact O-N 3.26Å; E698-V711 HydrophobicContact CB-CG2 3.54Å
699	Q	62.9	Low	65.4	Low	96 Å²	96	61.7 Å²	61.7	45%	0.449	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.2	173.9	-50.3	-162.3	-54.1	0	0	107.5	V706 Y707 T708	Q699-V706 HydrophobicContact CB-CG1 3.98Å; Q699-Y707 CarbonylContact C-O 3.21Å; Q699-Y707 VanDerWaalsContact CA-O 3.29Å; Q699-Y707 WeakPolarHBondContact CA-O 3.36Å; Q699-T708 HydrophobicContact CG-CG2 3.95Å
700	H	56.7	Low	64.8	Low	47 Å²	47	60.4 Å²	60.4	22%	0.218	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	149.9	172.4	61.4	85.3	0	0	0	109.3	E702 V706 Y707 T709	H700-E702 IonicContact CE1-OE1 3.73Å; H700-E702 PolarHBondContact CE1-OE1 3.43Å; H700-E702 VanDerWaalsContact CE1-OE1 3.24Å; H700-E702 WeakPolarHBondContact ND1-CG 3.46Å; H700-E702 IonicContact ND1-OE1 3.92Å; H700-V706 CarbonylContact O-C 3.54Å; H700-Y707 WeakPolarHBondContact CE1-CB 3.24Å; H700-Y707 AromaticContact CE1-CG 3.95Å; H700-Y707 PolarHBondContact N-O 3.35Å; H700-Y707 PolarHBondContact O-N 3.23Å; H700-Y707 VanDerWaalsContact O-O 3.14Å; H700-T709 PolarHBondContact CD2-OG1 2.95Å; H700-T709 PolarHBondContact NE2-OG1 3.42Å
701	V	54.3	Low	63.8	Low	64 Å²	64	60.5 Å²	60.5	39%	0.388	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	107.6	-176.5	-174.4	0	0	0	0	109.2	Q171 H705 V706	Q171-V701 PolarHBondContact OE1-O 2.94Å; V701-H705 CarbonylContact C-O 3.55Å; V701-H705 WeakPolarHBondContact CA-O 3.49Å; V701-V706 HydrophobicContact CG2-CG2 4.22Å
702	E	48.7	Very low	63.2	Low	92 Å²	92	62.5 Å²	62.5	43%	0.43	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.5	173	-49.7	178.7	163	0	0	109.8	H700 G704 H705 Y707	H700-E702 IonicContact CE1-OE1 3.73Å; H700-E702 PolarHBondContact CE1-OE1 3.43Å; H700-E702 VanDerWaalsContact CE1-OE1 3.24Å; H700-E702 WeakPolarHBondContact ND1-CG 3.46Å; H700-E702 IonicContact ND1-OE1 3.92Å; E702-G704 PolarHBondContact O-N 3.46Å; E702-G704 VanDerWaalsContact O-N 3.12Å; E702-H705 PolarHBondContact N-O 3.08Å; E702-H705 PolarHBondContact O-N 3.41Å; E702-Y707 HydrophobicContact CB-CD2 3.73Å; E702-Y707 HydrophobicContact CB-CE2 3.58Å; E702-Y707 HydrophobicContact CG-CD2 3.83Å; E702-Y707 HydrophobicContact CG-CE2 4.14Å
703	N	49.6	Very low	63.2	Low	140 Å²	140	58.3 Å²	58.3	75%	0.749	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	32.5	176.8	-57.2	-38.6	0	0	0	114.6	H705	N703-H705 VanDerWaalsContact C-N 3.3Å; N703-H705 PolarHBondContact O-N 3.17Å
704	G	53.4	Low	63.4	Low	67 Å²	67	61.8 Å²	61.8	69%	0.691	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	1	-177.2	0	0	0	0	0	114.9	E702	E702-G704 PolarHBondContact O-N 3.46Å; E702-G704 VanDerWaalsContact O-N 3.12Å
705	H	46.8	Very low	63.6	Low	124 Å²	124	61.8 Å²	61.8	57%	0.574	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	133.1	171.8	-67.9	-65.3	0	0	0	110.8	V701 E702 N703 Y707	V701-H705 CarbonylContact C-O 3.55Å; V701-H705 WeakPolarHBondContact CA-O 3.49Å; E702-H705 PolarHBondContact N-O 3.08Å; E702-H705 PolarHBondContact O-N 3.41Å; N703-H705 VanDerWaalsContact C-N 3.3Å; N703-H705 PolarHBondContact O-N 3.17Å; H705-Y707 HydrophobicContact CB-CD2 4.36Å; H705-Y707 HydrophobicContact CB-CE2 3.64Å; H705-Y707 VanDerWaalsContact O-CD2 3.27Å; H705-Y707 WeakPolarHBondContact O-CD2 3.11Å; H705-Y707 PolarHBondContact O-N 3.3Å
706	V	55.4	Low	64.1	Low	89 Å²	89	61.7 Å²	61.7	54%	0.539	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	112.6	176.2	-173.1	0	0	0	0	108.7	Q699 H700 V701	Q699-V706 HydrophobicContact CB-CG1 3.98Å; H700-V706 CarbonylContact O-C 3.54Å; V701-V706 HydrophobicContact CG2-CG2 4.22Å
707	Y	59.2	Low	64.9	Low	98 Å²	98	58.4 Å²	58.4	38%	0.384	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	142.2	172.1	-66.3	-89.4	0	0	0	109.6	Q699 H700 E702 H705	Q699-Y707 CarbonylContact C-O 3.21Å; Q699-Y707 VanDerWaalsContact CA-O 3.29Å; Q699-Y707 WeakPolarHBondContact CA-O 3.36Å; H700-Y707 WeakPolarHBondContact CE1-CB 3.24Å; H700-Y707 AromaticContact CE1-CG 3.95Å; H700-Y707 PolarHBondContact N-O 3.35Å; H700-Y707 PolarHBondContact O-N 3.23Å; H700-Y707 VanDerWaalsContact O-O 3.14Å; E702-Y707 HydrophobicContact CB-CD2 3.73Å; E702-Y707 HydrophobicContact CB-CE2 3.58Å; E702-Y707 HydrophobicContact CG-CD2 3.83Å; E702-Y707 HydrophobicContact CG-CE2 4.14Å; H705-Y707 HydrophobicContact CB-CD2 4.36Å; H705-Y707 HydrophobicContact CB-CE2 3.64Å; H705-Y707 VanDerWaalsContact O-CD2 3.27Å; H705-Y707 WeakPolarHBondContact O-CD2 3.11Å; H705-Y707 PolarHBondContact O-N 3.3Å
708	T	63.1	Low	65.8	Low	81 Å²	81	58.6 Å²	58.6	50%	0.497	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114.1	176.7	62	0	0	0	0	109.1	V697 E698 Q699	V697-T708 HydrophobicContact CG1-CG2 4.46Å; E698-T708 CarbonylContact O-C 3.53Å; E698-T708 VanDerWaalsContact O-CA 3.3Å; E698-T708 WeakPolarHBondContact O-CA 3.47Å; Q699-T708 HydrophobicContact CG-CG2 3.95Å
709	T	64.2	Low	67.1	Low	58 Å²	58	56.7 Å²	56.7	36%	0.356	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.7	178.5	-59	0	0	0	0	109.9	E698 H700 V711	E698-T709 PolarHBondContact N-O 2.99Å; E698-T709 PolarHBondContact O-N 3.26Å; H700-T709 PolarHBondContact CD2-OG1 2.95Å; H700-T709 PolarHBondContact NE2-OG1 3.42Å; T709-V711 PolarHBondContact O-N 2.84Å
710	I	67.6	Low	68.4	Low	28 Å²	28	52.2 Å²	52.2	14%	0.144	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	117.7	173.6	-64	165.4	0	0	0	107.7	A695 V697 V713	A695-I710 HydrophobicContact CB-CG1 4.36Å; A695-I710 HydrophobicContact CB-CG2 3.86Å; V697-I710 HydrophobicContact CG2-CG1 4.27Å; I710-V713 HydrophobicContact CG2-CG2 3.79Å
711	V	61.8	Low	70.1	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-47.3	-177.8	-175.2	0	0	0	0	110.5	I238 K651 K696 E698 T709	I238-V711 HydrophobicContact CG2-CG1 4.25Å; K651-V711 VanDerWaalsContact CD-O 3.26Å; K651-V711 WeakPolarHBondContact CD-O 3.42Å; K696-V711 PolarHBondContact O-N 3.16Å; E698-V711 HydrophobicContact CB-CG2 3.54Å; T709-V711 PolarHBondContact O-N 2.84Å
712	S	70.1	Confident	71.9	Confident	41 Å²	41	49.8 Å²	49.8	29%	0.287	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	145.9	178.3	-178.5	0	0	0	0	110.2	K696	K696-S712 PolarHBondContact N-O 3.2Å
713	V	77.4	Confident	74	Confident	8 Å²	8	45.4 Å²	45.4	5%	0.048	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.6	172.8	179.7	0	0	0	0	108.4	L382 H650 L652 A691 L694 A695 I710	L382-V713 HydrophobicContact CD1-CG1 4.31Å; H650-V713 HydrophobicContact CB-CG2 4.02Å; H650-V713 WeakPolarHBondContact O-CG2 3.44Å; L652-V713 HydrophobicContact CD2-CB 3.69Å; L652-V713 HydrophobicContact CD2-CG1 3.85Å; L652-V713 HydrophobicContact CD2-CG2 4.41Å; A691-V713 WeakPolarHBondContact O-CG1 3.28Å; L694-V713 HydrophobicContact CB-CG1 3.95Å; A695-V713 HydrophobicContact CB-CG2 3.78Å; I710-V713 HydrophobicContact CG2-CG2 3.79Å
714	K	80.1	Confident	76	Confident	83 Å²	83	38.8 Å²	38.8	36%	0.361	22%	0.224	S	C	.	.			trans	-79.3	123.4	172.7	-67.4	-166.1	179.5	-174.6	0	109.8	C324 Y328 L694	C324-K714 PolarHBondContact SG-NZ 3.49Å; Y328-K714 WeakPolarHBondContact OH-CD 3.29Å; L694-K714 WeakPolarHBondContact CB-O 3.32Å; L694-K714 WeakPolarHBondContact CD1-O 3.05Å; L694-K714 PolarHBondContact O-N 3.46Å
715	E	84.4	Confident	78	Confident	6 Å²	6	39.6 Å²	39.6	3%	0.028	21%	0.211	C	C	.	.			trans	-90.2	110.9	177.7	-67.1	-175.1	-138.8	0	0	110.8	R306 L382 L652 L653 K654	R306-E715 IonicContact CZ-OE2 3.91Å; R306-E715 IonicContact NH1-OE2 3.29Å; R306-E715 PolarHBondContact NH1-OE2 2.94Å; R306-E715 VanDerWaalsContact NH1-OE2 3.08Å; R306-E715 IonicContact NH2-OE2 3.52Å; R306-E715 PolarHBondContact NH2-OE2 3.04Å; L382-E715 HydrophobicContact CD1-CG 4.21Å; L652-E715 HydrophobicContact CD2-CG 3.83Å; L653-E715 PolarHBondContact N-OE1 2.86Å; K654-E715 VanDerWaalsContact CB-OE2 3.3Å; K654-E715 WeakPolarHBondContact CB-OE2 3.42Å; K654-E715 HydrophobicContact CD-CB 4.04Å; K654-E715 PolarHBondContact N-OE1 3.32Å; K654-E715 PolarHBondContact NZ-O 3.35Å
716	T	86	Confident	80.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.			trans	-132.4	138.1	-177.5	62.9	0	0	0	0	112.2	Y328 T719	Y328-T716 HydrophobicContact CE1-CG2 3.87Å; T716-T719 PolarHBondContact OG1-OG1 3.02Å
717	R	88.9	Confident	81.8	Confident	3 Å²	3	32.5 Å²	32.5	1%	0.011	17%	0.174	C	C	.	.	S	Bend	trans	-83.3	-28.2	171.9	-74.6	169.6	-168.4	-90.9	-6.9	113.3	Y310 D313 F314 S375 L376 A378 P381 T719 S720 L721	Y310-R717 VanDerWaalsContact CE2-CZ 3.46Å; D313-R717 HydrophobicContact CB-CG 3.94Å; D313-R717 PolarHBondContact O-N 3.25Å; D313-R717 IonicContact OD2-CZ 3.22Å; D313-R717 IonicContact OD2-NE 3.57Å; D313-R717 PolarHBondContact OD2-NE 3.47Å; D313-R717 IonicContact OD2-NH2 3.24Å; D313-R717 PolarHBondContact OD2-NH2 3.39Å; D313-R717 VanDerWaalsContact OD2-NH2 3.16Å; F314-R717 HydrophobicContact CE1-CB 4.21Å; F314-R717 HydrophobicContact CZ-CB 4.13Å; S375-R717 PolarHBondContact O-NH1 3.39Å; L376-R717 PolarHBondContact O-NH1 3.18Å; A378-R717 PolarHBondContact O-NH1 2.89Å; A378-R717 PolarHBondContact O-NH2 3.01Å; P381-R717 HydrophobicContact CB-CB 4.48Å; P381-R717 HydrophobicContact CB-CG 3.42Å; P381-R717 VanDerWaalsContact CB-CG 3.42Å; P381-R717 HydrophobicContact CG-CG 4.21Å; R717-T719 VanDerWaalsContact C-N 3.32Å; R717-T719 PolarHBondContact O-N 3.48Å; R717-S720 PolarHBondContact O-N 3.27Å; R717-L721 WeakPolarHBondContact O-CB 3.46Å; R717-L721 PolarHBondContact O-N 3.36Å
718	L	88.4	Confident	83.3	Confident	61 Å²	61	28.7 Å²	28.7	32%	0.319	17%	0.165	S	C	.	.	H	α-helix	trans	-61.9	-36.9	-170	-171.4	66.9	0	0	0	113	I318 A722	I318-L718 HydrophobicContact CD1-CD2 4.06Å; I318-L718 HydrophobicContact CG1-CD2 3.78Å; L718-A722 WeakPolarHBondContact O-CB 3.27Å; L718-A722 PolarHBondContact O-N 3.17Å
719	T	89.4	Confident	84.5	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.018	17%	0.165	C	C	.	.	H	α-helix	trans	-64.5	-48.2	179.7	47.3	0	0	0	0	112.1	Y328 T331 H690 L694 T716 R717 A723	Y328-T719 HydrophobicContact CD1-CG2 4.09Å; T331-T719 HydrophobicContact CG2-CG2 4.12Å; H690-T719 PolarHBondContact NE2-OG1 3.37Å; L694-T719 HydrophobicContact CD2-CG2 4.33Å; T716-T719 PolarHBondContact OG1-OG1 3.02Å; R717-T719 VanDerWaalsContact C-N 3.32Å; R717-T719 PolarHBondContact O-N 3.48Å; T719-A723 WeakPolarHBondContact O-CB 3.48Å; T719-A723 PolarHBondContact O-N 2.66Å
720	S	90.2	Very high	85.6	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.007	15%	0.148	C	C	.	.	H	α-helix	trans	-66.8	-42.5	177.2	-177.3	0	0	0	0	111.6	R717 A723 N724	R717-S720 PolarHBondContact O-N 3.27Å; S720-A723 PolarHBondContact O-N 2.79Å; S720-N724 PolarHBondContact O-N 3Å; S720-N724 PolarHBondContact O-ND2 2.94Å; S720-N724 PolarHBondContact OG-ND2 3.43Å
721	L	92.7	Very high	86.3	Confident	28 Å²	28	26.3 Å²	26.3	15%	0.147	15%	0.149	C	C	.	.	H	α-helix	trans	-61.3	-48.9	176.3	-178.9	66.2	0	0	0	111.5	V372 S375 L376 R717 A723 N724 I725	V372-L721 HydrophobicContact CG1-CD1 4.04Å; V372-L721 HydrophobicContact CG2-CD1 4.4Å; S375-L721 VanDerWaalsContact OG-CD1 3.31Å; S375-L721 WeakPolarHBondContact OG-CD1 3.45Å; L376-L721 HydrophobicContact CD2-CD1 4.14Å; L376-L721 HydrophobicContact CD2-CD2 4.2Å; L376-L721 HydrophobicContact CG-CD1 4.21Å; R717-L721 WeakPolarHBondContact O-CB 3.46Å; R717-L721 PolarHBondContact O-N 3.36Å; L721-A723 PolarHBondContact O-N 2.76Å; L721-N724 PolarHBondContact O-N 2.87Å; L721-I725 HydrophobicContact CD1-CD1 4.13Å; L721-I725 HydrophobicContact CG-CD1 3.99Å; L721-I725 VanDerWaalsContact O-CG1 3.31Å; L721-I725 WeakPolarHBondContact O-CG1 3.37Å; L721-I725 PolarHBondContact O-N 3.42Å
722	A	92.1	Very high	87.3	Confident	33 Å²	33	34.2 Å²	34.2	27%	0.273	18%	0.184	S	C	.	.	H	α-helix	trans	-61.8	-43	178.7	0	0	0	0	0	111.8	A332 L718 I725 L726	A332-A722 HydrophobicContact CB-CB 4.18Å; L718-A722 WeakPolarHBondContact O-CB 3.27Å; L718-A722 PolarHBondContact O-N 3.17Å; A722-I725 PolarHBondContact O-N 3.38Å; A722-L726 VanDerWaalsContact O-CG 3.29Å; A722-L726 WeakPolarHBondContact O-CG 3.06Å; A722-L726 PolarHBondContact O-N 3.32Å
723	A	92.2	Very high	87.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.1	-47.4	176.6	0	0	0	0	0	111.9	L335 T719 S720 L721 I725 L726 I727	L335-A723 HydrophobicContact CB-CB 3.94Å; L335-A723 HydrophobicContact CD2-CB 3.83Å; L335-A723 HydrophobicContact CG-CB 4.01Å; T719-A723 WeakPolarHBondContact O-CB 3.48Å; T719-A723 PolarHBondContact O-N 2.66Å; S720-A723 PolarHBondContact O-N 2.79Å; L721-A723 PolarHBondContact O-N 2.76Å; A723-I725 VanDerWaalsContact C-N 3.34Å; A723-I725 PolarHBondContact O-N 3.15Å; A723-L726 WeakPolarHBondContact O-CB 3.47Å; A723-L726 PolarHBondContact O-N 2.91Å; A723-I727 VanDerWaalsContact O-CG1 3.29Å; A723-I727 WeakPolarHBondContact O-CG1 3.46Å; A723-I727 PolarHBondContact O-N 2.98Å
724	N	93.4	Very high	87.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-68.8	-29	-179.3	-71.2	-56.6	0	0	0	113.8	S368 G371 V372 S720 L721 G728	S368-N724 PolarHBondContact OG-O 3.25Å; G371-N724 PolarHBondContact O-ND2 3.31Å; V372-N724 HydrophobicContact CG2-CB 3.95Å; S720-N724 PolarHBondContact O-N 3Å; S720-N724 PolarHBondContact O-ND2 2.94Å; S720-N724 PolarHBondContact OG-ND2 3.43Å; L721-N724 PolarHBondContact O-N 2.87Å; N724-G728 PolarHBondContact O-N 3.33Å; N724-G728 VanDerWaalsContact O-N 3.13Å
725	I	93.6	Very high	86.7	Confident	84 Å²	84	36.8 Å²	36.8	43%	0.431	20%	0.2	S	C	.	.	H	α-helix	trans	-68.7	-44.1	170.2	-67.5	167.9	0	0	0	110.2	V372 L721 A722 A723 I727 G728 L729	V372-I725 HydrophobicContact CG2-CG1 4.07Å; L721-I725 HydrophobicContact CD1-CD1 4.13Å; L721-I725 HydrophobicContact CG-CD1 3.99Å; L721-I725 VanDerWaalsContact O-CG1 3.31Å; L721-I725 WeakPolarHBondContact O-CG1 3.37Å; L721-I725 PolarHBondContact O-N 3.42Å; A722-I725 PolarHBondContact O-N 3.38Å; A723-I725 VanDerWaalsContact C-N 3.34Å; A723-I725 PolarHBondContact O-N 3.15Å; I725-I727 VanDerWaalsContact C-N 3.31Å; I725-I727 PolarHBondContact O-N 2.97Å; I725-G728 PolarHBondContact O-N 3.47Å; I725-G728 VanDerWaalsContact O-N 3.14Å; I725-L729 HydrophobicContact CG2-CD1 4.28Å; I725-L729 WeakPolarHBondContact O-CG 3.24Å; I725-L729 PolarHBondContact O-N 2.92Å
726	L	91.6	Very high	86	Confident	65 Å²	65	41.9 Å²	41.9	34%	0.34	23%	0.227	S	C	.	.	H	α-helix	trans	-62	-36.8	175.8	-70.7	170.1	0	0	0	112.3	Y336 A722 A723 L729 S730	Y336-L726 HydrophobicContact CD2-CB 3.5Å; Y336-L726 HydrophobicContact CE2-CB 4.05Å; Y336-L726 WeakPolarHBondContact CE2-O 3.37Å; Y336-L726 HydrophobicContact CG-CB 3.94Å; Y336-L726 HydrophobicContact CG-CD1 4.38Å; A722-L726 VanDerWaalsContact O-CG 3.29Å; A722-L726 WeakPolarHBondContact O-CG 3.06Å; A722-L726 PolarHBondContact O-N 3.32Å; A723-L726 WeakPolarHBondContact O-CB 3.47Å; A723-L726 PolarHBondContact O-N 2.91Å; L726-L729 HydrophobicContact CD2-CD1 4.33Å; L726-L729 PolarHBondContact O-N 3.25Å; L726-S730 PolarHBondContact O-N 3.03Å
727	I	91.6	Very high	85.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.5	-44.2	172.9	-65.2	167.3	0	0	0	110.3	Y336 I339 I364 Q367 A723 I725 L729 S730 A731	Y336-I727 HydrophobicContact CD2-CG1 3.83Å; Y336-I727 HydrophobicContact CE2-CG1 4.33Å; I339-I727 HydrophobicContact CB-CD1 3.63Å; I339-I727 HydrophobicContact CD1-CD1 4.2Å; I339-I727 HydrophobicContact CG2-CD1 3.37Å; I364-I727 HydrophobicContact CG2-CG2 3.91Å; Q367-I727 HydrophobicContact CB-CG2 4.45Å; Q367-I727 HydrophobicContact CG-CD1 4.16Å; Q367-I727 HydrophobicContact CG-CG2 4.16Å; A723-I727 VanDerWaalsContact O-CG1 3.29Å; A723-I727 WeakPolarHBondContact O-CG1 3.46Å; A723-I727 PolarHBondContact O-N 2.98Å; I725-I727 VanDerWaalsContact C-N 3.31Å; I725-I727 PolarHBondContact O-N 2.97Å; I727-L729 VanDerWaalsContact C-N 3.32Å; I727-L729 PolarHBondContact O-N 3.48Å; I727-S730 WeakPolarHBondContact O-CB 3.43Å; I727-S730 PolarHBondContact O-N 2.95Å; I727-S730 PolarHBondContact O-OG 3.39Å; I727-A731 PolarHBondContact O-N 3.4Å
728	G	90.1	Very high	84.9	Confident	18 Å²	18	45.3 Å²	45.3	19%	0.186	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-42.9	174.9	0	0	0	0	0	112.2	S368 N724 I725 S730 A731	S368-G728 WeakPolarHBondContact OG-CA 3.43Å; S368-G728 PolarHBondContact OG-N 3.28Å; N724-G728 PolarHBondContact O-N 3.33Å; N724-G728 VanDerWaalsContact O-N 3.13Å; I725-G728 PolarHBondContact O-N 3.47Å; I725-G728 VanDerWaalsContact O-N 3.14Å; G728-S730 VanDerWaalsContact C-N 3.27Å; G728-S730 PolarHBondContact O-N 3.2Å; G728-A731 VanDerWaalsContact O-CB 3.25Å; G728-A731 WeakPolarHBondContact O-CB 3.39Å; G728-A731 PolarHBondContact O-N 2.83Å; G728-A731 VanDerWaalsContact O-N 3.16Å
729	L	89.4	Confident	84.5	Confident	95 Å²	95	45.6 Å²	45.6	50%	0.497	25%	0.248	S	C	.	.	H	α-helix	trans	-64.2	-31.9	174.7	-69.1	167.9	0	0	0	112.6	I725 L726 I727 A731 F732	I725-L729 HydrophobicContact CG2-CD1 4.28Å; I725-L729 WeakPolarHBondContact O-CG 3.24Å; I725-L729 PolarHBondContact O-N 2.92Å; L726-L729 HydrophobicContact CD2-CD1 4.33Å; L726-L729 PolarHBondContact O-N 3.25Å; I727-L729 VanDerWaalsContact C-N 3.32Å; I727-L729 PolarHBondContact O-N 3.48Å; L729-A731 PolarHBondContact O-N 3.1Å; L729-F732 WeakPolarHBondContact O-CB 3.3Å; L729-F732 PolarHBondContact O-N 3.43Å; L729-F732 VanDerWaalsContact O-N 3.14Å
730	S	87.1	Confident	84.1	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.007	28%	0.279	C	S	.	.	H	α-helix	trans	-69.7	-15.4	176.8	77.3	0	0	0	0	113.8	Y336 L340 L726 I727 G728 F732 M733 L734	Y336-S730 WeakPolarHBondContact OH-CB 3.49Å; L340-S730 WeakPolarHBondContact CD1-OG 3.44Å; L726-S730 PolarHBondContact O-N 3.03Å; I727-S730 WeakPolarHBondContact O-CB 3.43Å; I727-S730 PolarHBondContact O-N 2.95Å; I727-S730 PolarHBondContact O-OG 3.39Å; G728-S730 VanDerWaalsContact C-N 3.27Å; G728-S730 PolarHBondContact O-N 3.2Å; S730-F732 PolarHBondContact O-N 3.47Å; S730-M733 CarbonylContact O-C 3.47Å; S730-M733 WeakPolarHBondContact O-CA 3.49Å; S730-M733 WeakPolarHBondContact O-CB 3.4Å; S730-M733 PolarHBondContact O-N 3.26Å; S730-L734 PolarHBondContact O-N 3.35Å
731	A	82.4	Confident	84	Confident	20 Å²	20	54.7 Å²	54.7	17%	0.165	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-61.9	-32.6	170.1	0	0	0	0	0	111.5	I364 V365 I727 G728 L729 M733 L734	I364-A731 HydrophobicContact CG2-CB 4.05Å; V365-A731 HydrophobicContact CG2-CB 4.34Å; I727-A731 PolarHBondContact O-N 3.4Å; G728-A731 VanDerWaalsContact O-CB 3.25Å; G728-A731 WeakPolarHBondContact O-CB 3.39Å; G728-A731 PolarHBondContact O-N 2.83Å; G728-A731 VanDerWaalsContact O-N 3.16Å; L729-A731 PolarHBondContact O-N 3.1Å; A731-M733 PolarHBondContact O-N 2.93Å; A731-L734 HydrophobicContact CB-CD1 4.35Å; A731-L734 WeakPolarHBondContact O-CB 3.39Å; A731-L734 PolarHBondContact O-N 2.88Å
732	F	81.5	Confident	83.7	Confident	169 Å²	169	53.4 Å²	53.4	74%	0.741	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-70.9	-18.9	173.2	-62.1	-69	0	0	0	113	L729 S730 P735	L729-F732 WeakPolarHBondContact O-CB 3.3Å; L729-F732 PolarHBondContact O-N 3.43Å; L729-F732 VanDerWaalsContact O-N 3.14Å; S730-F732 PolarHBondContact O-N 3.47Å; F732-P735 WeakPolarHBondContact O-CD 3.39Å
733	M	77.8	Confident	83.4	Confident	102 Å²	102	52.8 Å²	52.8	50%	0.502	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-90.3	-2	176.6	-66.7	-176.3	154	0	0	112.9	S730 A731 P737 L738	S730-M733 CarbonylContact O-C 3.47Å; S730-M733 WeakPolarHBondContact O-CA 3.49Å; S730-M733 WeakPolarHBondContact O-CB 3.4Å; S730-M733 PolarHBondContact O-N 3.26Å; A731-M733 PolarHBondContact O-N 2.93Å; M733-P737 HydrophobicContact CB-CG 3.85Å; M733-P737 HydrophobicContact CG-CG 4.47Å; M733-P737 WeakPolarHBondContact O-CD 3.39Å; M733-P737 WeakPolarHBondContact O-CG 3.27Å; M733-L738 HydrophobicContact CB-CD1 3.81Å
734	L	71.3	Confident	83.3	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.016	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-41	176.8	-86.1	163.5	0	0	0	115.5	V360 Q361 I364 F599 S730 A731 I736 L738	V360-L734 HydrophobicContact CG1-CD2 4.23Å; Q361-L734 HydrophobicContact CB-CD1 3.9Å; Q361-L734 HydrophobicContact CG-CD1 3.77Å; I364-L734 HydrophobicContact CD1-CD1 4.13Å; I364-L734 HydrophobicContact CD1-CD2 3.84Å; I364-L734 HydrophobicContact CD1-CG 4.15Å; F599-L734 HydrophobicContact CE2-CD2 4.18Å; S730-L734 PolarHBondContact O-N 3.35Å; A731-L734 HydrophobicContact CB-CD1 4.35Å; A731-L734 WeakPolarHBondContact O-CB 3.39Å; A731-L734 PolarHBondContact O-N 2.88Å; L734-I736 VanDerWaalsContact C-N 3.31Å; L734-I736 PolarHBondContact O-N 3.23Å; L734-L738 HydrophobicContact CD2-CB 4.36Å; L734-L738 HydrophobicContact CD2-CD2 3.98Å; L734-L738 HydrophobicContact CG-CD2 4.27Å
735	P	67.2	Low	83.2	Confident	80 Å²	80	52.9 Å²	52.9	52%	0.519	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-16.9	-167.5	25.4	-33.1	0	0	0	114.9	F732	F732-P735 WeakPolarHBondContact O-CD 3.39Å
736	I	68.9	Low	83	Confident	113 Å²	113	49 Å²	49	58%	0.579	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.1	-67	-174.5	-53	172.8	0	0	0	112.5	L734	L734-I736 VanDerWaalsContact C-N 3.31Å; L734-I736 PolarHBondContact O-N 3.23Å
737	P	73.1	Confident	82.9	Confident	62 Å²	62	46.8 Å²	46.8	40%	0.403	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-32.2	-173	27.4	-37.6	0	0	0	115	M733 W740	M733-P737 HydrophobicContact CB-CG 3.85Å; M733-P737 HydrophobicContact CG-CG 4.47Å; M733-P737 WeakPolarHBondContact O-CD 3.39Å; M733-P737 WeakPolarHBondContact O-CG 3.27Å; P737-W740 PolarHBondContact O-N 3.01Å
738	L	78.4	Confident	82.9	Confident	13 Å²	13	46.8 Å²	46.8	7%	0.068	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-76.3	-30.5	-177	-91.7	67.9	0	0	0	112.6	L340 I344 I364 F599 M733 L734 W740 I741	L340-L738 HydrophobicContact CD1-CD2 4.39Å; I344-L738 HydrophobicContact CD1-CD2 3.88Å; I344-L738 HydrophobicContact CD1-CG 4.27Å; I364-L738 HydrophobicContact CD1-CD2 4.19Å; F599-L738 VanDerWaalsContact CE1-O 3.28Å; F599-L738 WeakPolarHBondContact CE1-O 3.38Å; F599-L738 HydrophobicContact CZ-CB 4.22Å; F599-L738 WeakPolarHBondContact CZ-O 3.42Å; M733-L738 HydrophobicContact CB-CD1 3.81Å; L734-L738 HydrophobicContact CD2-CB 4.36Å; L734-L738 HydrophobicContact CD2-CD2 3.98Å; L734-L738 HydrophobicContact CG-CD2 4.27Å; L738-W740 PolarHBondContact O-N 3.44Å; L738-W740 VanDerWaalsContact O-N 3.17Å; L738-I741 PolarHBondContact O-N 3.35Å; L738-I741 VanDerWaalsContact O-N 3.16Å
739	Q	79.9	Confident	82.8	Confident	67 Å²	67	46 Å²	46	31%	0.313	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-64.9	-14.5	175.5	-74.7	-178.1	2.6	0	0	113.1	V598 F599 V601 I741	V598-Q739 HydrophobicContact CG1-CB 4.09Å; V598-Q739 WeakPolarHBondContact CG1-O 3.36Å; F599-Q739 HydrophobicContact CE2-CG 4.41Å; V601-Q739 HydrophobicContact CG2-CG 4.26Å; V601-Q739 VanDerWaalsContact CG2-NE2 3.33Å; Q739-I741 PolarHBondContact O-N 3.13Å
740	W	82.5	Confident	82.7	Confident	173 Å²	173	41.6 Å²	41.6	66%	0.655	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-74.6	-5.4	174.9	-65.9	-5.7	0	0	0	113.8	S588 P737 L738 P742	S588-W740 PolarHBondContact OG-O 3.33Å; P737-W740 PolarHBondContact O-N 3.01Å; L738-W740 PolarHBondContact O-N 3.44Å; L738-W740 VanDerWaalsContact O-N 3.17Å; W740-P742 VanDerWaalsContact O-CD 3.23Å; W740-P742 WeakPolarHBondContact O-CD 3.05Å
741	I	86.8	Confident	82.8	Confident	23 Å²	23	42.5 Å²	42.5	12%	0.118	21%	0.209	C	C	.	.	S	Bend	trans	-86.8	108.5	176.6	-56	173.1	0	0	0	108.7	L341 I344 V580 F599 L738 Q739 L746	L341-I741 HydrophobicContact CD2-CD1 4.33Å; I344-I741 HydrophobicContact CD1-CD1 4.33Å; V580-I741 HydrophobicContact CG1-CG2 4.36Å; F599-I741 HydrophobicContact CE1-CB 4.45Å; L738-I741 PolarHBondContact O-N 3.35Å; L738-I741 VanDerWaalsContact O-N 3.16Å; Q739-I741 PolarHBondContact O-N 3.13Å; I741-L746 HydrophobicContact CG2-CD2 3.77Å; I741-L746 HydrophobicContact CG2-CG 4.15Å
742	P	87.2	Confident	83.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.205	C	C	.	.			trans	-78.6	147.6	-177.9	36.2	-37.6	0	0	0	110.5	L543 L596 W740 P744 V745	L543-P742 HydrophobicContact CD1-CG 4.21Å; L596-P742 HydrophobicContact CB-CB 3.84Å; L596-P742 HydrophobicContact CD1-CB 3.88Å; L596-P742 HydrophobicContact CD1-CG 4.06Å; L596-P742 HydrophobicContact CG-CB 4.39Å; W740-P742 VanDerWaalsContact O-CD 3.23Å; W740-P742 WeakPolarHBondContact O-CD 3.05Å; P742-P744 VanDerWaalsContact C-N 3.33Å; P742-V745 HydrophobicContact CG-CB 4.22Å; P742-V745 HydrophobicContact CG-CG2 3.65Å; P742-V745 WeakPolarHBondContact O-CB 3.1Å; P742-V745 PolarHBondContact O-N 3.26Å
743	K	86.4	Confident	83.2	Confident	21 Å²	21	35 Å²	35	9%	0.091	17%	0.172	C	C	.	.	H	α-helix	trans	-51.5	-37.5	179.7	-68.2	-177.6	-177.3	-176.6	0	115	S348 E352 P597 V598 V745 L746 Y747	S348-K743 VanDerWaalsContact OG-CE 3.28Å; S348-K743 WeakPolarHBondContact OG-CE 3.49Å; E352-K743 IonicContact OE1-NZ 2.53Å; E352-K743 PolarHBondContact OE1-NZ 3.28Å; P597-K743 HydrophobicContact CB-CD 4.34Å; P597-K743 HydrophobicContact CG-CB 4.46Å; P597-K743 WeakPolarHBondContact O-CB 3.25Å; P597-K743 WeakPolarHBondContact O-CG 3.23Å; P597-K743 PolarHBondContact O-N 2.69Å; V598-K743 VanDerWaalsContact O-CE 3.29Å; V598-K743 WeakPolarHBondContact O-CE 3.31Å; K743-V745 VanDerWaalsContact C-N 3.27Å; K743-V745 PolarHBondContact O-N 3.05Å; K743-L746 WeakPolarHBondContact O-CA 3.18Å; K743-L746 VanDerWaalsContact O-CB 3.31Å; K743-L746 WeakPolarHBondContact O-CB 3.41Å; K743-L746 PolarHBondContact O-N 3.39Å; K743-Y747 PolarHBondContact O-N 3.43Å; K743-Y747 VanDerWaalsContact O-N 3.09Å
744	P	89.9	Confident	83.6	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-63	-30.6	179	-20.6	33.1	0	0	0	113.7	I466 C540 L543 M544 P597 P742 L746 Y747 G748	I466-P744 HydrophobicContact CD1-CG 4.34Å; C540-P744 HydrophobicContact CB-CB 3.92Å; C540-P744 HydrophobicContact CB-CG 3.62Å; C540-P744 WeakPolarHBondContact O-CB 3.35Å; C540-P744 WeakPolarHBondContact SG-CG 3.28Å; L543-P744 HydrophobicContact CB-CB 4.24Å; M544-P744 WeakPolarHBondContact CA-O 3.3Å; P597-P744 HydrophobicContact CG-CG 4.25Å; P742-P744 VanDerWaalsContact C-N 3.33Å; P744-L746 VanDerWaalsContact C-N 3.32Å; P744-Y747 PolarHBondContact O-N 3.11Å; P744-G748 PolarHBondContact O-N 3.15Å
745	V	90.8	Very high	84.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.6	-35.1	174.3	173.8	0	0	0	0	110.4	L543 T547 V580 F583 P742 K743 G748 L749	L543-V745 HydrophobicContact CB-CG2 4.11Å; T547-V745 HydrophobicContact CG2-CG1 4.09Å; V580-V745 HydrophobicContact CB-CG1 4.15Å; V580-V745 HydrophobicContact CG1-CG1 3.77Å; V580-V745 HydrophobicContact CG2-CG1 4.07Å; F583-V745 HydrophobicContact CB-CG2 4.08Å; P742-V745 HydrophobicContact CG-CB 4.22Å; P742-V745 HydrophobicContact CG-CG2 3.65Å; P742-V745 WeakPolarHBondContact O-CB 3.1Å; P742-V745 PolarHBondContact O-N 3.26Å; K743-V745 VanDerWaalsContact C-N 3.27Å; K743-V745 PolarHBondContact O-N 3.05Å; V745-G748 WeakPolarHBondContact O-CA 3.49Å; V745-G748 PolarHBondContact O-N 3.06Å; V745-L749 PolarHBondContact O-N 3.2Å
746	L	88.8	Confident	84.9	Confident	4 Å²	4	29 Å²	29	2%	0.021	14%	0.143	C	C	.	.	H	α-helix	trans	-67.2	-34.3	173.6	-55.4	174	0	0	0	112.1	I344 A345 I741 K743 P744 L749 F750	I344-L746 HydrophobicContact CG2-CD1 3.93Å; I344-L746 HydrophobicContact CG2-CD2 4.29Å; A345-L746 HydrophobicContact CB-CB 4.04Å; A345-L746 HydrophobicContact CB-CD2 4.28Å; I741-L746 HydrophobicContact CG2-CD2 3.77Å; I741-L746 HydrophobicContact CG2-CG 4.15Å; K743-L746 WeakPolarHBondContact O-CA 3.18Å; K743-L746 VanDerWaalsContact O-CB 3.31Å; K743-L746 WeakPolarHBondContact O-CB 3.41Å; K743-L746 PolarHBondContact O-N 3.39Å; P744-L746 VanDerWaalsContact C-N 3.32Å; L746-L749 HydrophobicContact CD2-CD2 4.43Å; L746-L749 VanDerWaalsContact O-CB 3.29Å; L746-L749 WeakPolarHBondContact O-CB 3.45Å; L746-L749 PolarHBondContact O-N 3.27Å; L746-F750 PolarHBondContact O-N 2.86Å; L746-F750 VanDerWaalsContact O-N 3.08Å
747	Y	89.6	Confident	85.3	Confident	18 Å²	18	24.8 Å²	24.8	7%	0.071	12%	0.124	C	C	.	.	H	α-helix	trans	-67.2	-36.7	169.9	-60	-32.4	0	0	0	112.1	I466 K743 P744 L749 F750 L751	I466-Y747 HydrophobicContact CD1-CD2 4.39Å; I466-Y747 HydrophobicContact CD1-CE2 3.7Å; K743-Y747 PolarHBondContact O-N 3.43Å; K743-Y747 VanDerWaalsContact O-N 3.09Å; P744-Y747 PolarHBondContact O-N 3.11Å; Y747-L749 VanDerWaalsContact C-N 3.29Å; Y747-L749 PolarHBondContact O-N 3.36Å; Y747-F750 HydrophobicContact CD1-CD2 4.09Å; Y747-F750 HydrophobicContact CD1-CE2 4.26Å; Y747-F750 PolarHBondContact O-N 3.1Å; Y747-L751 PolarHBondContact O-N 3.4Å; Y747-L751 VanDerWaalsContact O-N 3.08Å
748	G	91.4	Very high	85.7	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.8	-38	171	0	0	0	0	0	112.6	M544 P744 V745 L751 Y752	M544-G748 WeakPolarHBondContact O-CA 3.21Å; P744-G748 PolarHBondContact O-N 3.15Å; V745-G748 WeakPolarHBondContact O-CA 3.49Å; V745-G748 PolarHBondContact O-N 3.06Å; G748-L751 PolarHBondContact O-N 3.37Å; G748-Y752 PolarHBondContact O-N 3.34Å
749	L	88.7	Confident	85.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.6	-45.1	171.1	160.2	76.6	0	0	0	112	L341 A345 L576 V745 L746 Y747 L751 Y752 I753	L341-L749 HydrophobicContact CB-CD1 4.44Å; L341-L749 HydrophobicContact CB-CD2 3.86Å; A345-L749 HydrophobicContact CB-CD2 4.08Å; L576-L749 HydrophobicContact CD1-CB 4.45Å; L576-L749 HydrophobicContact CD1-CD1 3.33Å; L576-L749 HydrophobicContact CD1-CG 4.5Å; L576-L749 HydrophobicContact CD2-CD1 3.41Å; L576-L749 VanDerWaalsContact CD2-CD1 3.41Å; L576-L749 HydrophobicContact CG-CD1 3.83Å; V745-L749 PolarHBondContact O-N 3.2Å; L746-L749 HydrophobicContact CD2-CD2 4.43Å; L746-L749 VanDerWaalsContact O-CB 3.29Å; L746-L749 WeakPolarHBondContact O-CB 3.45Å; L746-L749 PolarHBondContact O-N 3.27Å; Y747-L749 VanDerWaalsContact C-N 3.29Å; Y747-L749 PolarHBondContact O-N 3.36Å; L749-L751 VanDerWaalsContact C-N 3.34Å; L749-L751 PolarHBondContact O-N 3.29Å; L749-Y752 PolarHBondContact O-N 3.39Å; L749-I753 HydrophobicContact CD1-CD1 3.74Å; L749-I753 HydrophobicContact CD1-CG1 4.1Å; L749-I753 HydrophobicContact CG-CD1 4.04Å; L749-I753 WeakPolarHBondContact O-CG1 3.22Å; L749-I753 PolarHBondContact O-N 3.45Å
750	F	87.1	Confident	85.2	Confident	3 Å²	3	26.6 Å²	26.6	1%	0.013	15%	0.145	C	C	.	.	H	α-helix	trans	-60.5	-42.8	176.1	-69.8	-26.6	0	0	0	112.1	A345 F346 F455 A459 L746 Y747 Y752 I753 A754	A345-F750 HydrophobicContact CB-CD1 4.47Å; A345-F750 HydrophobicContact CB-CE1 3.54Å; A345-F750 HydrophobicContact CB-CE2 4.46Å; A345-F750 HydrophobicContact CB-CZ 3.53Å; F346-F750 HydrophobicContact CD1-CE1 4.39Å; F346-F750 HydrophobicContact CD1-CZ 4.26Å; F346-F750 HydrophobicContact CE1-CE1 4.1Å; F346-F750 HydrophobicContact CE1-CZ 4.26Å; F346-F750 HydrophobicContact CZ-CE1 4.32Å; F455-F750 HydrophobicContact CD1-CB 4.35Å; F455-F750 AromaticContact CD1-CD1 3.95Å; F455-F750 HydrophobicContact CD1-CD1 3.95Å; F455-F750 HydrophobicContact CD1-CE1 4.48Å; F455-F750 HydrophobicContact CD1-CG 4.21Å; F455-F750 HydrophobicContact CE1-CD1 4.09Å; F455-F750 HydrophobicContact CE1-CE1 4.3Å; A459-F750 HydrophobicContact CB-CB 4.15Å; L746-F750 PolarHBondContact O-N 2.86Å; L746-F750 VanDerWaalsContact O-N 3.08Å; Y747-F750 HydrophobicContact CD1-CD2 4.09Å; Y747-F750 HydrophobicContact CD1-CE2 4.26Å; Y747-F750 PolarHBondContact O-N 3.1Å; F750-Y752 VanDerWaalsContact C-N 3.33Å; F750-Y752 PolarHBondContact O-N 3.03Å; F750-I753 PolarHBondContact O-N 3.15Å; F750-A754 WeakPolarHBondContact O-CB 3.37Å; F750-A754 PolarHBondContact O-N 3.33Å
751	L	90.1	Very high	85	Confident	21 Å²	21	18.9 Å²	18.9	11%	0.11	12%	0.116	C	C	.	.	H	α-helix	trans	-63.6	-38.7	174.9	-65.8	178.8	0	0	0	112.2	V456 A459 M544 L548 Y747 G748 L749 A754 A755	V456-L751 HydrophobicContact CB-CD2 4.27Å; V456-L751 HydrophobicContact CG1-CD2 4.1Å; V456-L751 HydrophobicContact CG2-CD2 4.05Å; A459-L751 HydrophobicContact CB-CD2 3.87Å; A459-L751 HydrophobicContact CB-CG 3.92Å; M544-L751 HydrophobicContact CE-CD1 4.31Å; M544-L751 HydrophobicContact CG-CD1 3.9Å; M544-L751 HydrophobicContact SD-CD1 3.91Å; L548-L751 HydrophobicContact CB-CB 4.45Å; L548-L751 HydrophobicContact CD1-CB 4.04Å; L548-L751 HydrophobicContact CD2-CB 4.04Å; L548-L751 HydrophobicContact CD2-CD1 4.17Å; L548-L751 HydrophobicContact CG-CB 4.4Å; Y747-L751 PolarHBondContact O-N 3.4Å; Y747-L751 VanDerWaalsContact O-N 3.08Å; G748-L751 PolarHBondContact O-N 3.37Å; L749-L751 VanDerWaalsContact C-N 3.34Å; L749-L751 PolarHBondContact O-N 3.29Å; L751-A754 PolarHBondContact O-N 3.26Å; L751-A755 WeakPolarHBondContact O-CB 3.42Å; L751-A755 PolarHBondContact O-N 3.45Å
752	Y	88.1	Confident	84.8	Confident	22 Å²	22	18 Å²	18	9%	0.086	11%	0.112	C	C	.	.	H	α-helix	trans	-64.8	-46.3	176.6	172.7	-89.3	0	0	0	111.9	G551 L576 G748 L749 F750 A754 A755 T756	G551-Y752 VanDerWaalsContact C-CE2 3.41Å; G551-Y752 WeakPolarHBondContact O-CE2 2.92Å; L576-Y752 HydrophobicContact CB-CD1 4.13Å; L576-Y752 HydrophobicContact CB-CE1 3.67Å; L576-Y752 HydrophobicContact CD1-CD1 3.61Å; L576-Y752 HydrophobicContact CD1-CE1 4.06Å; L576-Y752 HydrophobicContact CD1-CG 4.04Å; L576-Y752 HydrophobicContact CD2-CD1 4.21Å; L576-Y752 HydrophobicContact CD2-CE1 4.17Å; L576-Y752 HydrophobicContact CG-CD1 4.18Å; L576-Y752 HydrophobicContact CG-CE1 4.17Å; G748-Y752 PolarHBondContact O-N 3.34Å; L749-Y752 PolarHBondContact O-N 3.39Å; F750-Y752 VanDerWaalsContact C-N 3.33Å; F750-Y752 PolarHBondContact O-N 3.03Å; Y752-A754 VanDerWaalsContact C-N 3.29Å; Y752-A754 PolarHBondContact O-N 3.31Å; Y752-A755 PolarHBondContact O-N 3.48Å; Y752-T756 HydrophobicContact CD1-CG2 4.38Å; Y752-T756 HydrophobicContact CD2-CG2 4.23Å; Y752-T756 HydrophobicContact CE1-CG2 3.9Å; Y752-T756 HydrophobicContact CE2-CG2 3.73Å; Y752-T756 WeakPolarHBondContact O-CG2 3.49Å; Y752-T756 PolarHBondContact O-N 3.13Å; Y752-T756 PolarHBondContact O-OG1 3.22Å
753	I	83.1	Confident	84.8	Confident	9 Å²	9	18 Å²	18	5%	0.046	11%	0.112	C	C	.	.	H	α-helix	trans	-60	-44.1	176.7	-67.8	170.1	0	0	0	109.6	P342 F455 P685 L749 F750 T756 S757	P342-I753 HydrophobicContact CG-CD1 4.28Å; F455-I753 HydrophobicContact CD2-CG2 4.22Å; F455-I753 HydrophobicContact CE2-CG2 3.97Å; P685-I753 HydrophobicContact CG-CG2 4.27Å; L749-I753 HydrophobicContact CD1-CD1 3.74Å; L749-I753 HydrophobicContact CD1-CG1 4.1Å; L749-I753 HydrophobicContact CG-CD1 4.04Å; L749-I753 WeakPolarHBondContact O-CG1 3.22Å; L749-I753 PolarHBondContact O-N 3.45Å; F750-I753 PolarHBondContact O-N 3.15Å; I753-T756 PolarHBondContact O-N 3.13Å; I753-T756 PolarHBondContact O-OG1 3.16Å; I753-S757 WeakPolarHBondContact O-CB 3.48Å; I753-S757 PolarHBondContact O-N 3.28Å; I753-S757 PolarHBondContact O-OG 3.1Å
754	A	86	Confident	84.8	Confident	2 Å²	2	18 Å²	18	2%	0.017	11%	0.114	C	C	.	.	H	α-helix	trans	-62.9	-42.2	176.5	0	0	0	0	0	113	S452 F455 V456 F750 L751 Y752 S757 L758	S452-A754 WeakPolarHBondContact O-CB 3.45Å; F455-A754 HydrophobicContact CB-CB 3.96Å; V456-A754 HydrophobicContact CG2-CB 3.69Å; F750-A754 WeakPolarHBondContact O-CB 3.37Å; F750-A754 PolarHBondContact O-N 3.33Å; L751-A754 PolarHBondContact O-N 3.26Å; Y752-A754 VanDerWaalsContact C-N 3.29Å; Y752-A754 PolarHBondContact O-N 3.31Å; A754-S757 WeakPolarHBondContact CA-OG 3.08Å; A754-S757 PolarHBondContact O-OG 3.31Å; A754-L758 WeakPolarHBondContact O-CG 3.47Å; A754-L758 PolarHBondContact O-N 3.45Å
755	A	86.4	Confident	84.6	Confident	27 Å²	27	21.2 Å²	21.2	22%	0.223	13%	0.131	C	C	.	.	H	α-helix	trans	-69.3	-38.8	-179.9	0	0	0	0	0	112.2	L548 L751 Y752 L758	L548-A755 HydrophobicContact CD1-CB 4.28Å; L751-A755 WeakPolarHBondContact O-CB 3.42Å; L751-A755 PolarHBondContact O-N 3.45Å; Y752-A755 PolarHBondContact O-N 3.48Å; A755-L758 PolarHBondContact O-N 2.96Å
756	T	79.9	Confident	84.5	Confident	30 Å²	30	21.3 Å²	21.3	18%	0.184	13%	0.131	C	C	.	.	H	α-helix	trans	-74.8	-27.4	179.3	51.6	0	0	0	0	113.1	Y555 Y752 I753 L758 D759	Y555-T756 HydrophobicContact CD1-CG2 4.41Å; Y555-T756 HydrophobicContact CD2-CG2 4.39Å; Y555-T756 HydrophobicContact CG-CG2 4.32Å; Y752-T756 HydrophobicContact CD1-CG2 4.38Å; Y752-T756 HydrophobicContact CD2-CG2 4.23Å; Y752-T756 HydrophobicContact CE1-CG2 3.9Å; Y752-T756 HydrophobicContact CE2-CG2 3.73Å; Y752-T756 WeakPolarHBondContact O-CG2 3.49Å; Y752-T756 PolarHBondContact O-N 3.13Å; Y752-T756 PolarHBondContact O-OG1 3.22Å; I753-T756 PolarHBondContact O-N 3.13Å; I753-T756 PolarHBondContact O-OG1 3.16Å; T756-L758 VanDerWaalsContact C-N 3.3Å; T756-L758 PolarHBondContact O-N 3.09Å; T756-D759 PolarHBondContact O-N 2.73Å
757	S	76.3	Confident	84.4	Confident	25 Å²	25	24.1 Å²	24.1	18%	0.175	15%	0.145	C	C	.	.	H	α-helix	trans	-74.5	-16.3	173.2	57.5	0	0	0	0	114	S452 I753 A754	S452-S757 WeakPolarHBondContact CB-OG 3.45Å; S452-S757 PolarHBondContact OG-OG 3.24Å; I753-S757 WeakPolarHBondContact O-CB 3.48Å; I753-S757 PolarHBondContact O-N 3.28Å; I753-S757 PolarHBondContact O-OG 3.1Å; A754-S757 WeakPolarHBondContact CA-OG 3.08Å; A754-S757 PolarHBondContact O-OG 3.31Å
758	L	81.6	Confident	84.3	Confident	67 Å²	67	26.7 Å²	26.7	35%	0.351	16%	0.163	S	C	.	.	H	α-helix	trans	-74.6	-31.5	170.7	-63.3	173.7	0	0	0	112	L449 A754 A755 T756 G760 N761 V764	L449-L758 HydrophobicContact CD1-CD2 3.2Å; A754-L758 WeakPolarHBondContact O-CG 3.47Å; A754-L758 PolarHBondContact O-N 3.45Å; A755-L758 PolarHBondContact O-N 2.96Å; T756-L758 VanDerWaalsContact C-N 3.3Å; T756-L758 PolarHBondContact O-N 3.09Å; L758-G760 PolarHBondContact O-N 3.5Å; L758-N761 PolarHBondContact O-N 3.39Å; L758-V764 HydrophobicContact CD2-CG2 3.78Å
759	D	76.6	Confident	84.1	Confident	58 Å²	58	27 Å²	27	31%	0.31	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	108.8	179.9	-169.5	30.8	0	0	0	110	Y555 R559 T756	Y555-D759 WeakPolarHBondContact CE1-OD2 3.28Å; Y555-D759 PolarHBondContact OH-OD2 3.31Å; R559-D759 IonicContact CZ-OD1 2.89Å; R559-D759 IonicContact CZ-OD2 3.83Å; R559-D759 IonicContact NH1-OD1 3.65Å; R559-D759 VanDerWaalsContact NH2-CG 3.28Å; R559-D759 IonicContact NH2-OD1 3.3Å; R559-D759 PolarHBondContact NH2-OD1 2.86Å; R559-D759 IonicContact NH2-OD2 2.98Å; R559-D759 PolarHBondContact NH2-OD2 3.45Å; T756-D759 PolarHBondContact O-N 2.73Å
760	G	71.7	Confident	83.9	Confident	55 Å²	55	31.2 Å²	31.2	57%	0.567	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	104.5	-2.4	-176.8	0	0	0	0	0	115.1	L758	L758-G760 PolarHBondContact O-N 3.5Å
761	N	79.4	Confident	83.9	Confident	10 Å²	10	38.7 Å²	38.7	5%	0.053	23%	0.225	C	C	.	.			trans	-82.5	114	172.4	-172.1	-20.9	0	0	0	110.7	E445 L758 M763 V764 D765	E445-N761 WeakPolarHBondContact CB-OD1 3.49Å; E445-N761 WeakPolarHBondContact CG-OD1 3.17Å; E445-N761 PolarHBondContact O-ND2 3.32Å; E445-N761 VanDerWaalsContact O-ND2 3.08Å; L758-N761 PolarHBondContact O-N 3.39Å; N761-M763 PolarHBondContact O-N 2.89Å; N761-M763 WeakPolarHBondContact OD1-CB 3.42Å; N761-M763 PolarHBondContact OD1-N 3.41Å; N761-V764 HydrophobicContact CB-CB 4.35Å; N761-V764 HydrophobicContact CB-CG2 3.93Å; N761-V764 WeakPolarHBondContact O-CB 3.29Å; N761-V764 PolarHBondContact O-N 3.1Å; N761-D765 PolarHBondContact O-N 3.38Å; N761-D765 VanDerWaalsContact O-N 3.16Å
762	Q	82.6	Confident	83.7	Confident	6 Å²	6	42 Å²	42	3%	0.028	24%	0.239	C	C	.	.	H	α-helix	trans	-65.3	-24.6	-177.7	-54.5	-172.2	-31.8	0	0	112.9	R441 E445 V764 D765 R766	R441-Q762 VanDerWaalsContact NH1-CD 3.35Å; R441-Q762 VanDerWaalsContact NH2-NE2 3.2Å; E445-Q762 VanDerWaalsContact OE1-CB 3.26Å; E445-Q762 WeakPolarHBondContact OE1-CB 3.26Å; E445-Q762 WeakPolarHBondContact OE1-CG 3.37Å; E445-Q762 PolarHBondContact OE1-OE1 3.16Å; Q762-V764 VanDerWaalsContact C-N 3.29Å; Q762-V764 PolarHBondContact O-N 3Å; Q762-D765 PolarHBondContact O-N 2.9Å; Q762-R766 WeakPolarHBondContact O-CB 3.49Å; Q762-R766 VanDerWaalsContact O-CG 3.27Å; Q762-R766 WeakPolarHBondContact O-CG 3.29Å; Q762-R766 PolarHBondContact O-N 3.27Å
763	M	86.3	Confident	83.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-39.8	172.7	-177.6	178.5	168	0	0	110.9	E445 V446 L449 N761 R766 M767 Q798 M799 L802	E445-M763 HydrophobicContact CB-CB 4.04Å; V446-M763 HydrophobicContact CB-SD 4.43Å; V446-M763 HydrophobicContact CG2-SD 3.72Å; L449-M763 HydrophobicContact CD2-CE 3.82Å; L449-M763 HydrophobicContact CD2-CG 4.26Å; L449-M763 HydrophobicContact CD2-SD 3.84Å; N761-M763 PolarHBondContact O-N 2.89Å; N761-M763 WeakPolarHBondContact OD1-CB 3.42Å; N761-M763 PolarHBondContact OD1-N 3.41Å; M763-R766 PolarHBondContact O-N 3.37Å; M763-M767 WeakPolarHBondContact O-CB 3.42Å; M763-M767 PolarHBondContact O-N 3.43Å; M763-Q798 HydrophobicContact CE-CB 3.85Å; M763-Q798 HydrophobicContact SD-CB 4.09Å; M763-M799 HydrophobicContact CE-CG 4.24Å; M763-M799 HydrophobicContact CE-SD 3.53Å; M763-M799 VanDerWaalsContact CE-SD 3.53Å; M763-L802 HydrophobicContact CE-CB 4.2Å; M763-L802 HydrophobicContact CE-CD2 3.84Å
764	V	86.9	Confident	83.6	Confident	21 Å²	21	53 Å²	53	13%	0.127	29%	0.291	C	S	.	.	H	α-helix	trans	-68.6	-41.3	176.6	178.6	0	0	0	0	110.5	L449 L758 N761 Q762 R766 M767 T768	L449-V764 HydrophobicContact CD1-CG2 3.92Å; L449-V764 HydrophobicContact CD2-CG2 4.24Å; L758-V764 HydrophobicContact CD2-CG2 3.78Å; N761-V764 HydrophobicContact CB-CB 4.35Å; N761-V764 HydrophobicContact CB-CG2 3.93Å; N761-V764 WeakPolarHBondContact O-CB 3.29Å; N761-V764 PolarHBondContact O-N 3.1Å; Q762-V764 VanDerWaalsContact C-N 3.29Å; Q762-V764 PolarHBondContact O-N 3Å; V764-R766 VanDerWaalsContact C-N 3.35Å; V764-R766 PolarHBondContact O-N 3.48Å; V764-M767 PolarHBondContact O-N 3.49Å; V764-T768 WeakPolarHBondContact O-CB 3.38Å; V764-T768 PolarHBondContact O-N 3.28Å; V764-T768 PolarHBondContact O-OG1 3.49Å
765	D	85.2	Confident	83.2	Confident	67 Å²	67	58 Å²	58	36%	0.358	32%	0.322	S	S	.	.	H	α-helix	trans	-58.9	-47.7	173.9	-68.8	-27.9	0	0	0	110.7	N761 Q762 M767 T768 L769	N761-D765 PolarHBondContact O-N 3.38Å; N761-D765 VanDerWaalsContact O-N 3.16Å; Q762-D765 PolarHBondContact O-N 2.9Å; D765-M767 PolarHBondContact O-N 3.42Å; D765-T768 WeakPolarHBondContact O-CB 3.09Å; D765-T768 PolarHBondContact O-N 3.33Å; D765-L769 WeakPolarHBondContact O-CG 3.4Å; D765-L769 PolarHBondContact O-N 3.14Å
766	R	88.3	Confident	82.9	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.008	33%	0.33	C	S	.	.	H	α-helix	trans	-64.7	-36.8	176.6	-71.2	-177.2	-58.1	-132.6	-6.1	113	E445 Q762 M763 V764 T768 L769 Y782 V791 F794 T795	E445-R766 IonicContact OE2-CZ 3.84Å; E445-R766 IonicContact OE2-NH1 2.77Å; E445-R766 IonicContact OE2-NH2 3.82Å; E445-R766 PolarHBondContact OE2-NH2 3.3Å; Q762-R766 WeakPolarHBondContact O-CB 3.49Å; Q762-R766 VanDerWaalsContact O-CG 3.27Å; Q762-R766 WeakPolarHBondContact O-CG 3.29Å; Q762-R766 PolarHBondContact O-N 3.27Å; M763-R766 PolarHBondContact O-N 3.37Å; V764-R766 VanDerWaalsContact C-N 3.35Å; V764-R766 PolarHBondContact O-N 3.48Å; R766-T768 VanDerWaalsContact C-N 3.32Å; R766-L769 WeakPolarHBondContact O-CB 2.84Å; R766-L769 PolarHBondContact O-N 2.92Å; R766-Y782 HydrophobicContact CG-CE2 4.05Å; R766-V791 HydrophobicContact CG-CG1 4.38Å; R766-F794 VanDerWaalsContact CZ-CE1 3.46Å; R766-T795 HydrophobicContact CB-CG2 4.04Å
767	M	88.1	Confident	82.9	Confident	64 Å²	64	59.7 Å²	59.7	32%	0.315	33%	0.328	S	S	.	.	H	α-helix	trans	-64.1	-40.6	173.5	-174.9	177	70.8	0	0	110.6	M763 V764 D765 L769 L770 M799	M763-M767 WeakPolarHBondContact O-CB 3.42Å; M763-M767 PolarHBondContact O-N 3.43Å; V764-M767 PolarHBondContact O-N 3.49Å; D765-M767 PolarHBondContact O-N 3.42Å; M767-L769 VanDerWaalsContact C-N 3.27Å; M767-L769 PolarHBondContact O-N 2.61Å; M767-L770 VanDerWaalsContact O-CB 3.32Å; M767-L770 WeakPolarHBondContact O-CB 3.21Å; M767-L770 PolarHBondContact O-N 3.23Å; M767-M799 HydrophobicContact CG-SD 4.41Å; M767-M799 HydrophobicContact SD-CE 3.84Å; M767-M799 HydrophobicContact SD-SD 3.73Å
768	T	86.4	Confident	82.8	Confident	72 Å²	72	61 Å²	61	44%	0.442	34%	0.335	S	S	.	.	H	α-helix	trans	-64.5	-31.9	176.2	-54.1	0	0	0	0	111.6	V764 D765 R766 L770 L771 K772	V764-T768 WeakPolarHBondContact O-CB 3.38Å; V764-T768 PolarHBondContact O-N 3.28Å; V764-T768 PolarHBondContact O-OG1 3.49Å; D765-T768 WeakPolarHBondContact O-CB 3.09Å; D765-T768 PolarHBondContact O-N 3.33Å; R766-T768 VanDerWaalsContact C-N 3.32Å; T768-L770 PolarHBondContact O-N 3.05Å; T768-L771 PolarHBondContact O-N 2.74Å; T768-K772 PolarHBondContact O-N 3.05Å; T768-K772 VanDerWaalsContact O-N 3.08Å
769	L	86.3	Confident	82.1	Confident	7 Å²	7	62 Å²	62	4%	0.037	35%	0.346	C	S	.	.	H	α-helix	trans	-62	-26.8	173.2	-61	173.8	0	0	0	113.1	D765 R766 M767 L771 K772 Y777 P778 Y782 I783	D765-L769 WeakPolarHBondContact O-CG 3.4Å; D765-L769 PolarHBondContact O-N 3.14Å; R766-L769 WeakPolarHBondContact O-CB 2.84Å; R766-L769 PolarHBondContact O-N 2.92Å; M767-L769 VanDerWaalsContact C-N 3.27Å; M767-L769 PolarHBondContact O-N 2.61Å; L769-L771 PolarHBondContact O-N 3.26Å; L769-K772 PolarHBondContact O-N 2.88Å; L769-Y777 HydrophobicContact CB-CE1 4.39Å; L769-Y777 HydrophobicContact CD2-CD1 4.06Å; L769-Y777 HydrophobicContact CD2-CD2 4.46Å; L769-Y777 HydrophobicContact CD2-CE1 4.24Å; L769-Y777 HydrophobicContact CD2-CG 4.18Å; L769-Y777 PolarHBondContact O-OH 2.87Å; L769-Y777 VanDerWaalsContact O-OH 3.13Å; L769-P778 HydrophobicContact CD2-CG 4.45Å; L769-Y782 HydrophobicContact CD1-CE2 4.15Å; L769-I783 HydrophobicContact CD1-CD1 3.66Å; L769-I783 HydrophobicContact CD1-CG1 4.19Å; L769-I783 HydrophobicContact CD2-CD1 4.02Å
770	L	84.9	Confident	81.9	Confident	88 Å²	88	60.2 Å²	60.2	46%	0.461	34%	0.337	S	S	.	.	H	α-helix	trans	-67.1	-27.9	174.9	-68.6	164.2	0	0	0	112.2	M767 T768 H792 T795	M767-L770 VanDerWaalsContact O-CB 3.32Å; M767-L770 WeakPolarHBondContact O-CB 3.21Å; M767-L770 PolarHBondContact O-N 3.23Å; T768-L770 PolarHBondContact O-N 3.05Å; L770-H792 HydrophobicContact CD2-CB 4.11Å; L770-H792 WeakPolarHBondContact CD2-ND1 3.44Å; L770-T795 HydrophobicContact CD1-CG2 4.25Å
771	L	87.3	Confident	81.5	Confident	159 Å²	159	58.7 Å²	58.7	83%	0.832	32%	0.316	S	S	*	.	H	α-helix	trans	-96	-11	-180	-58.3	177.8	0	0	0	112.5	T768 L769	T768-L771 PolarHBondContact O-N 2.74Å; L769-L771 PolarHBondContact O-N 3.26Å
772	K	85.5	Confident	81.1	Confident	90 Å²	90	58.7 Å²	58.7	39%	0.391	32%	0.315	S	S	.	.	S	Bend	trans	-92.1	143.9	-176.5	-158.4	176.1	-161.2	-171.8	0	111	T768 L769 S776 Y777	T768-K772 PolarHBondContact O-N 3.05Å; T768-K772 VanDerWaalsContact O-N 3.08Å; L769-K772 PolarHBondContact O-N 2.88Å; K772-S776 WeakPolarHBondContact CD-O 3.32Å; K772-S776 WeakPolarHBondContact CE-O 3.4Å; K772-S776 PolarHBondContact NZ-O 3.33Å; K772-Y777 HydrophobicContact CB-CD1 4.48Å; K772-Y777 HydrophobicContact CB-CE1 4.23Å
773	E	87.6	Confident	80.7	Confident	132 Å²	132	59.8 Å²	59.8	62%	0.617	32%	0.321	S	S	*	.			trans	-65.3	140.9	170.4	-164.7	-170.6	145.4	0	0	111.1	T775 S776 Y777	E773-T775 PolarHBondContact O-N 3.33Å; E773-T775 WeakPolarHBondContact OE1-CG2 3.22Å; E773-T775 PolarHBondContact OE1-OG1 2.95Å; E773-S776 PolarHBondContact O-N 2.95Å; E773-Y777 VanDerWaalsContact O-CD1 3.29Å; E773-Y777 WeakPolarHBondContact O-CD1 3.49Å
774	Q	81.3	Confident	80	Confident	130 Å²	130	67.3 Å²	67.3	61%	0.607	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-57.3	-32.8	-176.9	-68.8	-179.8	-8.3	0	0	113.7	S776 Y777	Q774-S776 PolarHBondContact O-N 3.49Å; Q774-Y777 PolarHBondContact O-N 2.98Å
775	T	79.4	Confident	79.3	Confident	109 Å²	109	71 Å²	71	67%	0.669	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-66.7	-25.1	178.4	54.4	0	0	0	0	112.7	E773	E773-T775 PolarHBondContact O-N 3.33Å; E773-T775 WeakPolarHBondContact OE1-CG2 3.22Å; E773-T775 PolarHBondContact OE1-OG1 2.95Å
776	S	79.1	Confident	79.2	Confident	58 Å²	58	68.1 Å²	68.1	41%	0.406	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-99	10.5	-175.8	-62.7	0	0	0	0	113	K772 E773 Q774	K772-S776 WeakPolarHBondContact CD-O 3.32Å; K772-S776 WeakPolarHBondContact CE-O 3.4Å; K772-S776 PolarHBondContact NZ-O 3.33Å; E773-S776 PolarHBondContact O-N 2.95Å; Q774-S776 PolarHBondContact O-N 3.49Å
777	Y	79.2	Confident	79	Confident	34 Å²	34	70.9 Å²	70.9	13%	0.133	36%	0.364	C	S	.	.			trans	-62.5	125.5	-179.6	-82	19.8	0	0	0	110.3	L769 K772 E773 Q774 I783 Q788 H792	L769-Y777 HydrophobicContact CB-CE1 4.39Å; L769-Y777 HydrophobicContact CD2-CD1 4.06Å; L769-Y777 HydrophobicContact CD2-CD2 4.46Å; L769-Y777 HydrophobicContact CD2-CE1 4.24Å; L769-Y777 HydrophobicContact CD2-CG 4.18Å; L769-Y777 PolarHBondContact O-OH 2.87Å; L769-Y777 VanDerWaalsContact O-OH 3.13Å; K772-Y777 HydrophobicContact CB-CD1 4.48Å; K772-Y777 HydrophobicContact CB-CE1 4.23Å; E773-Y777 VanDerWaalsContact O-CD1 3.29Å; E773-Y777 WeakPolarHBondContact O-CD1 3.49Å; Q774-Y777 PolarHBondContact O-N 2.98Å; Y777-I783 HydrophobicContact CD2-CD1 4.23Å; Y777-I783 HydrophobicContact CD2-CG2 4.15Å; Y777-Q788 HydrophobicContact CE2-CG 4.42Å; Y777-H792 PolarHBondContact OH-CE1 3.45Å; Y777-H792 VanDerWaalsContact OH-CE1 3.25Å; Y777-H792 PolarHBondContact OH-NE2 3.28Å; Y777-H792 VanDerWaalsContact OH-NE2 3.14Å
778	P	74.5	Confident	78.7	Confident	51 Å²	51	71.5 Å²	71.5	33%	0.331	37%	0.366	S	S	.	.			trans	-63.2	144.9	175.6	27.3	-31.7	0	0	0	109.2	L769 T780 I783	L769-P778 HydrophobicContact CD2-CG 4.45Å; P778-T780 HydrophobicContact CB-CG2 4.25Å; P778-T780 HydrophobicContact CG-CG2 4.08Å; P778-T780 PolarHBondContact O-N 3.16Å; P778-I783 WeakPolarHBondContact O-CD1 3.42Å
779	P	67.7	Low	78.7	Confident	89 Å²	89	78.6 Å²	78.6	58%	0.578	38%	0.384	S	S	*	.			trans	-76.2	65.1	-177.4	31	-35.6	0	0	0	112.1
780	T	71.8	Confident	78.7	Confident	20 Å²	20	81.7 Å²	81.7	12%	0.123	40%	0.397	C	S	.	.			trans	-80.9	158.9	178.8	67.6	0	0	0	0	112.2	P778 Y782 I783 R784	P778-T780 HydrophobicContact CB-CG2 4.25Å; P778-T780 HydrophobicContact CG-CG2 4.08Å; P778-T780 PolarHBondContact O-N 3.16Å; T780-Y782 VanDerWaalsContact C-N 3.33Å; T780-Y782 HydrophobicContact CG2-CE1 4.39Å; T780-Y782 PolarHBondContact O-N 3.38Å; T780-Y782 WeakPolarHBondContact OG1-CE1 3.46Å; T780-Y782 VanDerWaalsContact OG1-CZ 3.27Å; T780-I783 PolarHBondContact O-N 3.42Å; T780-I783 VanDerWaalsContact OG1-CD1 3.23Å; T780-I783 WeakPolarHBondContact OG1-CD1 3.34Å; T780-I783 VanDerWaalsContact OG1-CG1 3.23Å; T780-I783 WeakPolarHBondContact OG1-CG1 3.46Å; T780-R784 PolarHBondContact O-N 2.97Å
781	H	63.2	Low	78.8	Confident	24 Å²	24	77.8 Å²	77.8	11%	0.111	38%	0.377	C	S	.	.	H	α-helix	trans	-55	-41.7	-177	171.7	-92.5	0	0	0	113.8	R785 S849 M852	H781-R785 VanDerWaalsContact CD2-CZ 3.48Å; H781-R785 PolarHBondContact NE2-NE 2.97Å; H781-R785 PolarHBondContact NE2-NH1 3.29Å; H781-R785 PolarHBondContact NE2-NH2 2.84Å; H781-R785 WeakPolarHBondContact O-CG 3.16Å; H781-S849 PolarHBondContact CE1-OG 3.24Å; H781-M852 WeakPolarHBondContact NE2-CB 3.37Å
782	Y	71.3	Confident	78.9	Confident	10 Å²	10	72.1 Å²	72.1	4%	0.039	35%	0.347	C	S	.	.	H	α-helix	trans	-80.8	-32.7	-178.2	55.3	-91.3	0	0	0	113	R766 L769 T780 R784 R785 V786	R766-Y782 HydrophobicContact CG-CE2 4.05Å; L769-Y782 HydrophobicContact CD1-CE2 4.15Å; T780-Y782 VanDerWaalsContact C-N 3.33Å; T780-Y782 HydrophobicContact CG2-CE1 4.39Å; T780-Y782 PolarHBondContact O-N 3.38Å; T780-Y782 WeakPolarHBondContact OG1-CE1 3.46Å; T780-Y782 VanDerWaalsContact OG1-CZ 3.27Å; Y782-R784 PolarHBondContact O-N 3.44Å; Y782-R785 PolarHBondContact O-N 3.25Å; Y782-V786 WeakPolarHBondContact O-CB 3.49Å; Y782-V786 PolarHBondContact O-N 3.41Å
783	I	74.1	Confident	79	Confident	29 Å²	29	73 Å²	73	15%	0.149	35%	0.348	C	S	.	.	H	α-helix	trans	-64.4	-33.1	176.5	-67.7	173.3	0	0	0	111	L769 Y777 P778 T780	L769-I783 HydrophobicContact CD1-CD1 3.66Å; L769-I783 HydrophobicContact CD1-CG1 4.19Å; L769-I783 HydrophobicContact CD2-CD1 4.02Å; Y777-I783 HydrophobicContact CD2-CD1 4.23Å; Y777-I783 HydrophobicContact CD2-CG2 4.15Å; P778-I783 WeakPolarHBondContact O-CD1 3.42Å; T780-I783 PolarHBondContact O-N 3.42Å; T780-I783 VanDerWaalsContact OG1-CD1 3.23Å; T780-I783 WeakPolarHBondContact OG1-CD1 3.34Å; T780-I783 VanDerWaalsContact OG1-CG1 3.23Å; T780-I783 WeakPolarHBondContact OG1-CG1 3.46Å
784	R	71.8	Confident	79	Confident	157 Å²	157	66.8 Å²	66.8	59%	0.592	32%	0.319	S	S	*	.	H	α-helix	trans	-74.8	-29.4	177.3	-71.5	176	170.7	178.9	-4.6	113.7	T780 Y782	T780-R784 PolarHBondContact O-N 2.97Å; Y782-R784 PolarHBondContact O-N 3.44Å
785	R	73.5	Confident	79.4	Confident	100 Å²	100	60.6 Å²	60.6	38%	0.377	29%	0.29	S	S	.	.	H	α-helix	trans	-105.4	-21.9	-169.5	-68.8	-176.7	-177.3	-171.7	10.4	114.3	H781 Y782 I846	H781-R785 VanDerWaalsContact CD2-CZ 3.48Å; H781-R785 PolarHBondContact NE2-NE 2.97Å; H781-R785 PolarHBondContact NE2-NH1 3.29Å; H781-R785 PolarHBondContact NE2-NH2 2.84Å; H781-R785 WeakPolarHBondContact O-CG 3.16Å; Y782-R785 PolarHBondContact O-N 3.25Å; R785-I846 HydrophobicContact CB-CD1 4.2Å; R785-I846 HydrophobicContact CB-CG2 3.86Å
786	V	81.6	Confident	79.9	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.03	28%	0.276	C	S	.	.	S	Bend	trans	-117	134.6	-175.1	-173.7	0	0	0	0	109.6	Y782 Q788 K790 V791 Y843 I846 M847	Y782-V786 WeakPolarHBondContact O-CB 3.49Å; Y782-V786 PolarHBondContact O-N 3.41Å; V786-Q788 PolarHBondContact O-N 2.99Å; V786-K790 HydrophobicContact CG1-CB 4.11Å; V786-V791 HydrophobicContact CB-CG2 3.95Å; V786-V791 HydrophobicContact CG1-CG2 3.78Å; V786-Y843 HydrophobicContact CB-CD1 4.24Å; V786-Y843 HydrophobicContact CG1-CD1 3.98Å; V786-Y843 HydrophobicContact CG1-CG 4.05Å; V786-Y843 HydrophobicContact CG2-CD1 3.99Å; V786-I846 HydrophobicContact CG2-CB 4.19Å; V786-I846 HydrophobicContact CG2-CG2 3.78Å; V786-M847 HydrophobicContact CG1-SD 4.32Å; V786-M847 HydrophobicContact CG2-CG 4.14Å
787	P	84.6	Confident	80.3	Confident	61 Å²	61	55.6 Å²	55.6	40%	0.396	26%	0.262	S	S	.	.			trans	-60.8	133.5	174.9	23.7	-32.9	0	0	0	111.3	R789 K790 V791	P787-R789 VanDerWaalsContact C-N 3.28Å; P787-R789 PolarHBondContact O-N 3.15Å; P787-R789 VanDerWaalsContact O-N 3.14Å; P787-K790 HydrophobicContact CG-CB 4.19Å; P787-K790 HydrophobicContact CG-CG 3.8Å; P787-K790 WeakPolarHBondContact O-CB 3.21Å; P787-K790 PolarHBondContact O-N 3.47Å; P787-V791 PolarHBondContact O-N 3.45Å
788	Q	82.7	Confident	80.8	Confident	76 Å²	76	54.1 Å²	54.1	36%	0.355	26%	0.256	S	S	.	.	H	α-helix	trans	-53.3	-40.4	-171.9	-63.9	174.3	-6.1	0	0	113.6	Y777 V786 K790 V791 H792	Y777-Q788 HydrophobicContact CE2-CG 4.42Å; V786-Q788 PolarHBondContact O-N 2.99Å; Q788-K790 VanDerWaalsContact C-N 3.25Å; Q788-K790 PolarHBondContact O-N 3.05Å; Q788-V791 WeakPolarHBondContact O-CB 3.02Å; Q788-V791 PolarHBondContact O-N 3.38Å; Q788-V791 VanDerWaalsContact O-N 3.09Å; Q788-H792 PolarHBondContact O-CD2 2.99Å; Q788-H792 PolarHBondContact O-N 3.18Å
789	R	86.3	Confident	81.6	Confident	221 Å²	221	54.1 Å²	54.1	83%	0.834	25%	0.252	S	S	*	.	H	α-helix	trans	-57.4	-37.8	177.5	-69.4	-174.8	177.5	-177.3	-0.8	112.6	P787 Y793	P787-R789 VanDerWaalsContact C-N 3.28Å; P787-R789 PolarHBondContact O-N 3.15Å; P787-R789 VanDerWaalsContact O-N 3.14Å; R789-Y793 WeakPolarHBondContact O-CB 3.35Å; R789-Y793 PolarHBondContact O-N 3.21Å
790	K	86.4	Confident	82.7	Confident	72 Å²	72	54.6 Å²	54.6	31%	0.313	25%	0.249	S	C	.	.	H	α-helix	trans	-72.3	-35	178.5	-66.2	-66.3	-167.7	173.9	0	111.4	V786 P787 Q788 Y793 F794 M838 I839	V786-K790 HydrophobicContact CG1-CB 4.11Å; P787-K790 HydrophobicContact CG-CB 4.19Å; P787-K790 HydrophobicContact CG-CG 3.8Å; P787-K790 WeakPolarHBondContact O-CB 3.21Å; P787-K790 PolarHBondContact O-N 3.47Å; Q788-K790 VanDerWaalsContact C-N 3.25Å; Q788-K790 PolarHBondContact O-N 3.05Å; K790-Y793 PolarHBondContact O-N 2.96Å; K790-F794 WeakPolarHBondContact O-CB 3.24Å; K790-F794 PolarHBondContact O-N 3.26Å; K790-M838 PolarHBondContact NZ-O 3.36Å; K790-M838 VanDerWaalsContact NZ-O 3.07Å; K790-I839 HydrophobicContact CD-CG1 4.41Å
791	V	86.7	Confident	83.5	Confident	6 Å²	6	54.3 Å²	54.3	4%	0.036	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-46.1	173.6	-178.5	0	0	0	0	111	R766 V786 P787 Q788 F794 T795 M847	R766-V791 HydrophobicContact CG-CG1 4.38Å; V786-V791 HydrophobicContact CB-CG2 3.95Å; V786-V791 HydrophobicContact CG1-CG2 3.78Å; P787-V791 PolarHBondContact O-N 3.45Å; Q788-V791 WeakPolarHBondContact O-CB 3.02Å; Q788-V791 PolarHBondContact O-N 3.38Å; Q788-V791 VanDerWaalsContact O-N 3.09Å; V791-F794 PolarHBondContact O-N 2.96Å; V791-T795 WeakPolarHBondContact O-CB 3.43Å; V791-T795 PolarHBondContact O-N 3.37Å; V791-T795 PolarHBondContact O-OG1 3.3Å; V791-M847 HydrophobicContact CG1-CE 4.26Å
792	H	88.5	Confident	84.8	Confident	41 Å²	41	53.5 Å²	53.5	19%	0.19	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-39.6	177.2	-65.6	-57.1	0	0	0	112.2	L770 Y777 Q788 T795 A796	L770-H792 HydrophobicContact CD2-CB 4.11Å; L770-H792 WeakPolarHBondContact CD2-ND1 3.44Å; Y777-H792 PolarHBondContact OH-CE1 3.45Å; Y777-H792 VanDerWaalsContact OH-CE1 3.25Å; Y777-H792 PolarHBondContact OH-NE2 3.28Å; Y777-H792 VanDerWaalsContact OH-NE2 3.14Å; Q788-H792 PolarHBondContact O-CD2 2.99Å; Q788-H792 PolarHBondContact O-N 3.18Å; H792-T795 PolarHBondContact O-N 3.01Å; H792-A796 WeakPolarHBondContact O-CB 3.25Å; H792-A796 PolarHBondContact O-N 3.44Å
793	Y	87.6	Confident	85.7	Confident	109 Å²	109	58 Å²	58	43%	0.427	27%	0.266	S	S	.	.	H	α-helix	trans	-61.2	-46.4	176	-167.3	-104.4	0	0	0	112.7	R789 K790 T795 A796 V797 M838 I839	R789-Y793 WeakPolarHBondContact O-CB 3.35Å; R789-Y793 PolarHBondContact O-N 3.21Å; K790-Y793 PolarHBondContact O-N 2.96Å; Y793-T795 VanDerWaalsContact C-N 3.33Å; Y793-T795 PolarHBondContact O-N 2.89Å; Y793-A796 PolarHBondContact O-N 3.48Å; Y793-V797 HydrophobicContact CE1-CG2 4.28Å; Y793-V797 WeakPolarHBondContact O-CG2 3.43Å; Y793-V797 PolarHBondContact O-N 2.91Å; Y793-V797 VanDerWaalsContact O-N 3.09Å; Y793-M838 HydrophobicContact CE1-CB 3.82Å; Y793-M838 HydrophobicContact CE1-CE 3.51Å; Y793-M838 HydrophobicContact CE1-CG 4.23Å; Y793-M838 HydrophobicContact CE1-SD 3.83Å; Y793-M838 VanDerWaalsContact CZ-CE 3.48Å; Y793-M838 WeakPolarHBondContact OH-CE 3.27Å; Y793-I839 HydrophobicContact CD1-CD1 4.28Å; Y793-I839 HydrophobicContact CD1-CG1 4.34Å
794	F	88.2	Confident	86.4	Confident	1 Å²	1	60.5 Å²	60.5	0%	0.004	28%	0.279	C	S	.	.	H	α-helix	trans	-57.8	-46.9	174.8	177	-89.2	0	0	0	111.7	R766 K790 V791 A796 V797 Q798 L835 I839 L844 M847	R766-F794 VanDerWaalsContact CZ-CE1 3.46Å; K790-F794 WeakPolarHBondContact O-CB 3.24Å; K790-F794 PolarHBondContact O-N 3.26Å; V791-F794 PolarHBondContact O-N 2.96Å; F794-A796 VanDerWaalsContact C-N 3.31Å; F794-A796 PolarHBondContact O-N 3.37Å; F794-V797 PolarHBondContact O-N 3.23Å; F794-Q798 HydrophobicContact CD1-CG 4.32Å; F794-Q798 HydrophobicContact CE1-CG 3.98Å; F794-Q798 VanDerWaalsContact CE1-NE2 3.34Å; F794-Q798 HydrophobicContact CZ-CG 4.35Å; F794-Q798 PolarHBondContact O-N 3.47Å; F794-L835 HydrophobicContact CD2-CD2 3.25Å; F794-L835 HydrophobicContact CE2-CD2 3.34Å; F794-L835 HydrophobicContact CG-CD2 4.41Å; F794-I839 HydrophobicContact CB-CD1 3.73Å; F794-I839 HydrophobicContact CD2-CD1 4.12Å; F794-I839 HydrophobicContact CG-CD1 4.45Å; F794-L844 HydrophobicContact CD2-CD2 3.92Å; F794-L844 HydrophobicContact CE2-CD2 3.77Å; F794-M847 HydrophobicContact CB-CE 3.63Å; F794-M847 HydrophobicContact CB-SD 4.19Å; F794-M847 HydrophobicContact CD1-CE 3.15Å; F794-M847 HydrophobicContact CD1-SD 4.41Å; F794-M847 HydrophobicContact CD2-CE 4Å; F794-M847 HydrophobicContact CD2-SD 4.29Å; F794-M847 HydrophobicContact CE1-CE 3.68Å; F794-M847 HydrophobicContact CE2-CE 4.45Å; F794-M847 HydrophobicContact CG-CE 3.32Å; F794-M847 HydrophobicContact CG-SD 4.06Å; F794-M847 HydrophobicContact CZ-CE 4.29Å
795	T	89.8	Confident	87.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64	-38.2	179.9	-49.2	0	0	0	0	111	R766 L770 V791 H792 Y793 V797 Q798 M799	R766-T795 HydrophobicContact CB-CG2 4.04Å; L770-T795 HydrophobicContact CD1-CG2 4.25Å; V791-T795 WeakPolarHBondContact O-CB 3.43Å; V791-T795 PolarHBondContact O-N 3.37Å; V791-T795 PolarHBondContact O-OG1 3.3Å; H792-T795 PolarHBondContact O-N 3.01Å; Y793-T795 VanDerWaalsContact C-N 3.33Å; Y793-T795 PolarHBondContact O-N 2.89Å; T795-V797 PolarHBondContact O-N 3.08Å; T795-Q798 PolarHBondContact O-N 3.44Å; T795-M799 VanDerWaalsContact O-CG 3.31Å; T795-M799 WeakPolarHBondContact O-CG 3.46Å; T795-M799 PolarHBondContact O-N 2.84Å
796	A	89.4	Confident	87.8	Confident	45 Å²	45	49.1 Å²	49.1	37%	0.372	24%	0.238	S	C	.	.	H	α-helix	trans	-62.8	-41.5	175.5	0	0	0	0	0	112.4	H792 Y793 F794 M799 I800	H792-A796 WeakPolarHBondContact O-CB 3.25Å; H792-A796 PolarHBondContact O-N 3.44Å; Y793-A796 PolarHBondContact O-N 3.48Å; F794-A796 VanDerWaalsContact C-N 3.31Å; F794-A796 PolarHBondContact O-N 3.37Å; A796-M799 PolarHBondContact O-N 2.97Å; A796-I800 WeakPolarHBondContact O-CG1 3.38Å; A796-I800 PolarHBondContact O-N 2.99Å
797	V	87.9	Confident	88.1	Confident	17 Å²	17	51.6 Å²	51.6	10%	0.103	26%	0.26	C	S	.	.	H	α-helix	trans	-62.8	-43.3	175	173.9	0	0	0	0	111	Y793 F794 T795 M799 I800 Q801 L835	Y793-V797 HydrophobicContact CE1-CG2 4.28Å; Y793-V797 WeakPolarHBondContact O-CG2 3.43Å; Y793-V797 PolarHBondContact O-N 2.91Å; Y793-V797 VanDerWaalsContact O-N 3.09Å; F794-V797 PolarHBondContact O-N 3.23Å; T795-V797 PolarHBondContact O-N 3.08Å; V797-M799 PolarHBondContact O-N 3.08Å; V797-I800 PolarHBondContact O-N 3.01Å; V797-Q801 WeakPolarHBondContact O-CG 3.31Å; V797-Q801 PolarHBondContact O-N 2.99Å; V797-L835 HydrophobicContact CG1-CD1 4.27Å
798	Q	89.4	Confident	88.1	Confident	3 Å²	3	52 Å²	52	1%	0.014	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-39.9	175.3	-71	-175	-48.2	0	0	112.5	S442 V446 M763 F794 T795 Q801 L802	S442-Q798 PolarHBondContact O-NE2 3.27Å; S442-Q798 VanDerWaalsContact O-NE2 3.1Å; V446-Q798 HydrophobicContact CG2-CB 4.06Å; V446-Q798 HydrophobicContact CG2-CG 4.12Å; M763-Q798 HydrophobicContact CE-CB 3.85Å; M763-Q798 HydrophobicContact SD-CB 4.09Å; F794-Q798 HydrophobicContact CD1-CG 4.32Å; F794-Q798 HydrophobicContact CE1-CG 3.98Å; F794-Q798 VanDerWaalsContact CE1-NE2 3.34Å; F794-Q798 HydrophobicContact CZ-CG 4.35Å; F794-Q798 PolarHBondContact O-N 3.47Å; T795-Q798 PolarHBondContact O-N 3.44Å; Q798-Q801 WeakPolarHBondContact O-CB 3.4Å; Q798-Q801 PolarHBondContact O-N 3.07Å; Q798-L802 WeakPolarHBondContact O-CB 3.4Å; Q798-L802 PolarHBondContact O-N 3.13Å
799	M	90.8	Very high	87.9	Confident	50 Å²	50	48.8 Å²	48.8	25%	0.246	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-41.2	175.7	-73.2	-60.7	-64.6	0	0	111.7	M763 M767 T795 A796 V797 L802 I803	M763-M799 HydrophobicContact CE-CG 4.24Å; M763-M799 HydrophobicContact CE-SD 3.53Å; M763-M799 VanDerWaalsContact CE-SD 3.53Å; M767-M799 HydrophobicContact CG-SD 4.41Å; M767-M799 HydrophobicContact SD-CE 3.84Å; M767-M799 HydrophobicContact SD-SD 3.73Å; T795-M799 VanDerWaalsContact O-CG 3.31Å; T795-M799 WeakPolarHBondContact O-CG 3.46Å; T795-M799 PolarHBondContact O-N 2.84Å; A796-M799 PolarHBondContact O-N 2.97Å; V797-M799 PolarHBondContact O-N 3.08Å; M799-L802 PolarHBondContact O-N 2.93Å; M799-L802 HydrophobicContact SD-CD2 4.38Å; M799-I803 WeakPolarHBondContact O-CB 3.41Å; M799-I803 VanDerWaalsContact O-CG1 3.23Å; M799-I803 WeakPolarHBondContact O-CG1 3.26Å; M799-I803 PolarHBondContact O-N 3.4Å
800	I	90.4	Very high	87.6	Confident	100 Å²	100	42.7 Å²	42.7	51%	0.513	23%	0.225	S	C	.	.	H	α-helix	trans	-62	-44.8	174.8	-69	166	0	0	0	110.6	A796 V797 L802 I803 I804	A796-I800 WeakPolarHBondContact O-CG1 3.38Å; A796-I800 PolarHBondContact O-N 2.99Å; V797-I800 PolarHBondContact O-N 3.01Å; I800-L802 VanDerWaalsContact C-N 3.34Å; I800-L802 PolarHBondContact O-N 3.34Å; I800-I803 PolarHBondContact O-N 3.25Å; I800-I804 HydrophobicContact CG2-CD1 3.9Å; I800-I804 VanDerWaalsContact O-CG1 3.31Å; I800-I804 WeakPolarHBondContact O-CG1 3.48Å; I800-I804 PolarHBondContact O-N 3.08Å
801	Q	89	Confident	87.5	Confident	14 Å²	14	44.1 Å²	44.1	7%	0.065	23%	0.229	C	C	.	.	H	α-helix	trans	-59.3	-45	175.9	-73.7	173.7	-8.8	0	0	112	V797 Q798 I804 L805 L827	V797-Q801 WeakPolarHBondContact O-CG 3.31Å; V797-Q801 PolarHBondContact O-N 2.99Å; Q798-Q801 WeakPolarHBondContact O-CB 3.4Å; Q798-Q801 PolarHBondContact O-N 3.07Å; Q801-I804 PolarHBondContact O-N 3.02Å; Q801-L805 WeakPolarHBondContact O-CB 3.28Å; Q801-L805 PolarHBondContact O-N 3.35Å; Q801-L827 HydrophobicContact CB-CD2 3.78Å; Q801-L827 HydrophobicContact CG-CD2 3.87Å
802	L	90.2	Very high	87	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-43.6	177	179.7	65.1	0	0	0	112	V446 L449 F450 I453 M763 Q798 M799 I800 L805 C806	V446-L802 HydrophobicContact CG1-CB 4.35Å; V446-L802 HydrophobicContact CG1-CD1 4.48Å; L449-L802 HydrophobicContact CB-CD1 4.5Å; L449-L802 HydrophobicContact CB-CD2 4.49Å; L449-L802 HydrophobicContact CD2-CD2 3.5Å; L449-L802 VanDerWaalsContact CD2-CD2 3.5Å; L449-L802 HydrophobicContact CG-CD1 4.48Å; L449-L802 HydrophobicContact CG-CD2 3.77Å; F450-L802 HydrophobicContact CB-CD1 3.76Å; I453-L802 HydrophobicContact CD1-CD1 4.22Å; I453-L802 HydrophobicContact CD1-CD2 3.91Å; I453-L802 HydrophobicContact CD1-CG 4.25Å; M763-L802 HydrophobicContact CE-CB 4.2Å; M763-L802 HydrophobicContact CE-CD2 3.84Å; Q798-L802 WeakPolarHBondContact O-CB 3.4Å; Q798-L802 PolarHBondContact O-N 3.13Å; M799-L802 PolarHBondContact O-N 2.93Å; M799-L802 HydrophobicContact SD-CD2 4.38Å; I800-L802 VanDerWaalsContact C-N 3.34Å; I800-L802 PolarHBondContact O-N 3.34Å; L802-L805 PolarHBondContact O-N 3.26Å; L802-C806 WeakPolarHBondContact O-CB 3.5Å; L802-C806 PolarHBondContact O-N 2.95Å; L802-C806 PolarHBondContact O-SG 3.48Å
803	I	91.3	Very high	86.5	Confident	104 Å²	104	51.5 Å²	51.5	53%	0.533	28%	0.275	S	S	.	.	H	α-helix	trans	-62.3	-45.4	178.3	-71.5	164.8	0	0	0	110.7	M799 I800 L805 C806 A807	M799-I803 WeakPolarHBondContact O-CB 3.41Å; M799-I803 VanDerWaalsContact O-CG1 3.23Å; M799-I803 WeakPolarHBondContact O-CG1 3.26Å; M799-I803 PolarHBondContact O-N 3.4Å; I800-I803 PolarHBondContact O-N 3.25Å; I803-L805 VanDerWaalsContact C-N 3.31Å; I803-L805 PolarHBondContact O-N 3.44Å; I803-C806 PolarHBondContact O-N 3.02Å; I803-A807 WeakPolarHBondContact O-CB 3.49Å; I803-A807 PolarHBondContact O-N 3.49Å
804	I	89.4	Confident	85.7	Confident	82 Å²	82	48.7 Å²	48.7	42%	0.421	27%	0.27	S	S	.	.	H	α-helix	trans	-57.6	-48.6	175.8	-69.5	167.1	0	0	0	109.5	I800 Q801 C806 A807 F808	I800-I804 HydrophobicContact CG2-CD1 3.9Å; I800-I804 VanDerWaalsContact O-CG1 3.31Å; I800-I804 WeakPolarHBondContact O-CG1 3.48Å; I800-I804 PolarHBondContact O-N 3.08Å; Q801-I804 PolarHBondContact O-N 3.02Å; I804-C806 PolarHBondContact O-N 2.64Å; I804-A807 PolarHBondContact O-N 3.5Å; I804-F808 HydrophobicContact CG2-CD2 4.09Å; I804-F808 HydrophobicContact CG2-CE2 4.07Å; I804-F808 VanDerWaalsContact O-CD2 3.27Å; I804-F808 WeakPolarHBondContact O-CD2 3.39Å; I804-F808 PolarHBondContact O-N 2.96Å
805	L	86.8	Confident	85.1	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-62.2	-41.9	-179.8	-168.8	68.8	0	0	0	112.8	F450 Q801 L802 I803 F808 G809 F820 L823 M824	F450-L805 HydrophobicContact CB-CD2 3.54Å; F450-L805 HydrophobicContact CD1-CD2 3.91Å; F450-L805 HydrophobicContact CD1-CG 4.47Å; F450-L805 HydrophobicContact CD2-CB 4.23Å; F450-L805 HydrophobicContact CD2-CD2 3.54Å; F450-L805 HydrophobicContact CD2-CG 3.61Å; F450-L805 HydrophobicContact CE2-CD2 4.24Å; F450-L805 HydrophobicContact CE2-CG 3.89Å; F450-L805 HydrophobicContact CG-CD2 3.34Å; F450-L805 HydrophobicContact CG-CG 3.92Å; F450-L805 HydrophobicContact CZ-CG 4.46Å; Q801-L805 WeakPolarHBondContact O-CB 3.28Å; Q801-L805 PolarHBondContact O-N 3.35Å; L802-L805 PolarHBondContact O-N 3.26Å; I803-L805 VanDerWaalsContact C-N 3.31Å; I803-L805 PolarHBondContact O-N 3.44Å; L805-F808 PolarHBondContact O-N 3.27Å; L805-G809 PolarHBondContact O-N 3.44Å; L805-F820 HydrophobicContact CD1-CD2 3.65Å; L805-F820 HydrophobicContact CD1-CE2 3.49Å; L805-F820 VanDerWaalsContact CD1-CE2 3.49Å; L805-F820 HydrophobicContact CD2-CE2 4.23Å; L805-F820 HydrophobicContact CG-CD2 4.27Å; L805-F820 HydrophobicContact CG-CE2 3.84Å; L805-L823 HydrophobicContact CD1-CB 4.17Å; L805-M824 HydrophobicContact CD1-CE 3.57Å; L805-M824 HydrophobicContact CD1-CG 4.14Å; L805-M824 HydrophobicContact CD1-SD 4.1Å; L805-M824 HydrophobicContact CD2-CE 3.14Å; L805-M824 HydrophobicContact CD2-SD 3.91Å; L805-M824 HydrophobicContact CG-CE 3.97Å
806	C	87.4	Confident	84.6	Confident	16 Å²	16	57 Å²	57	11%	0.108	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-42.2	175.3	-72.1	0	0	0	0	112	L802 I803 I804 F808 G809 M810	L802-C806 WeakPolarHBondContact O-CB 3.5Å; L802-C806 PolarHBondContact O-N 2.95Å; L802-C806 PolarHBondContact O-SG 3.48Å; I803-C806 PolarHBondContact O-N 3.02Å; I804-C806 PolarHBondContact O-N 2.64Å; C806-F808 VanDerWaalsContact C-N 3.34Å; C806-F808 PolarHBondContact O-N 2.94Å; C806-G809 PolarHBondContact O-N 2.61Å; C806-M810 HydrophobicContact CB-CE 3.65Å; C806-M810 WeakPolarHBondContact O-CB 3.37Å; C806-M810 PolarHBondContact O-N 3.12Å
807	A	87.4	Confident	84	Confident	58 Å²	58	56.9 Å²	56.9	48%	0.479	30%	0.297	S	S	.	.	H	α-helix	trans	-61.9	-39.8	-179	0	0	0	0	0	112.5	I803 I804 Y811	I803-A807 WeakPolarHBondContact O-CB 3.49Å; I803-A807 PolarHBondContact O-N 3.49Å; I804-A807 PolarHBondContact O-N 3.5Å; A807-Y811 WeakPolarHBondContact O-CB 3.39Å
808	F	85.4	Confident	83.5	Confident	70 Å²	70	57.2 Å²	57.2	31%	0.307	30%	0.298	S	S	.	.	H	α-helix	trans	-81.8	-39.8	176.6	-73.7	-81.9	0	0	0	112.8	I804 L805 C806 M816 L823	I804-F808 HydrophobicContact CG2-CD2 4.09Å; I804-F808 HydrophobicContact CG2-CE2 4.07Å; I804-F808 VanDerWaalsContact O-CD2 3.27Å; I804-F808 WeakPolarHBondContact O-CD2 3.39Å; I804-F808 PolarHBondContact O-N 2.96Å; L805-F808 PolarHBondContact O-N 3.27Å; C806-F808 VanDerWaalsContact C-N 3.34Å; C806-F808 PolarHBondContact O-N 2.94Å; F808-M816 HydrophobicContact CE1-SD 4.47Å; F808-L823 HydrophobicContact CB-CD1 3.48Å; F808-L823 VanDerWaalsContact CB-CD1 3.48Å; F808-L823 HydrophobicContact CD1-CD1 4.1Å; F808-L823 HydrophobicContact CD2-CD1 3.44Å; F808-L823 VanDerWaalsContact CD2-CD1 3.44Å; F808-L823 HydrophobicContact CE2-CD1 4.19Å; F808-L823 HydrophobicContact CG-CD1 3.4Å; F808-L823 VanDerWaalsContact CG-CD1 3.4Å
809	G	78.7	Confident	83.2	Confident	8 Å²	8	59.9 Å²	59.9	8%	0.082	31%	0.314	C	S	.	.	H	α-helix	trans	-68.8	-37.8	-177.4	0	0	0	0	0	113.9	L805 C806	L805-G809 PolarHBondContact O-N 3.44Å; C806-G809 PolarHBondContact O-N 2.61Å
810	M	79.2	Confident	82.6	Confident	93 Å²	93	58.3 Å²	58.3	46%	0.458	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	9.7	-179.9	-62.6	-171.6	-73	0	0	113.4	I453 C806	I453-M810 HydrophobicContact CG2-CE 3.81Å; I453-M810 HydrophobicContact CG2-SD 4.13Å; C806-M810 HydrophobicContact CB-CE 3.65Å; C806-M810 WeakPolarHBondContact O-CB 3.37Å; C806-M810 PolarHBondContact O-N 3.12Å
811	Y	83.8	Confident	82.2	Confident	102 Å²	102	53.6 Å²	53.6	40%	0.4	28%	0.282	S	S	.	.			trans	-65.5	140.7	-179.6	-155.3	-98.6	0	0	0	111.2	A807 L813 M816 K817	A807-Y811 WeakPolarHBondContact O-CB 3.39Å; Y811-L813 VanDerWaalsContact C-N 3.32Å; Y811-L813 HydrophobicContact CD1-CB 3.76Å; Y811-L813 HydrophobicContact CD1-CD1 4.35Å; Y811-L813 HydrophobicContact CD1-CG 4Å; Y811-L813 HydrophobicContact CE1-CB 3.91Å; Y811-L813 HydrophobicContact CE1-CD1 3.65Å; Y811-L813 HydrophobicContact CE1-CG 3.62Å; Y811-L813 PolarHBondContact O-N 3.04Å; Y811-M816 HydrophobicContact CD1-CB 3.73Å; Y811-M816 HydrophobicContact CD1-CG 3.64Å; Y811-M816 HydrophobicContact CE1-CG 4.02Å; Y811-M816 HydrophobicContact CG-CB 4.08Å; Y811-M816 HydrophobicContact CG-CG 4.27Å; Y811-K817 WeakPolarHBondContact O-CE 3.47Å
812	P	76.2	Confident	82	Confident	110 Å²	110	56.8 Å²	56.8	71%	0.714	30%	0.299	S	S	*	.	S	Bend	trans	-66.4	-29.7	-176.8	23.2	-33.5	0	0	0	113.7
813	L	77.5	Confident	81.8	Confident	92 Å²	92	57.8 Å²	57.8	48%	0.482	30%	0.304	S	S	.	.	S	Bend	trans	-74.5	126.6	-179.5	-62.4	178	0	0	0	112.1	Y811 Y815 M816	Y811-L813 VanDerWaalsContact C-N 3.32Å; Y811-L813 HydrophobicContact CD1-CB 3.76Å; Y811-L813 HydrophobicContact CD1-CD1 4.35Å; Y811-L813 HydrophobicContact CD1-CG 4Å; Y811-L813 HydrophobicContact CE1-CB 3.91Å; Y811-L813 HydrophobicContact CE1-CD1 3.65Å; Y811-L813 HydrophobicContact CE1-CG 3.62Å; Y811-L813 PolarHBondContact O-N 3.04Å; L813-Y815 VanDerWaalsContact C-N 3.28Å; L813-Y815 PolarHBondContact O-N 2.8Å; L813-M816 HydrophobicContact CB-CG 4.31Å; L813-M816 PolarHBondContact O-N 3.43Å
814	P	71.1	Confident	81.3	Confident	50 Å²	50	52.9 Å²	52.9	33%	0.325	28%	0.279	S	S	.	.	H	α-helix	trans	-55.2	-40.4	178.4	-26.9	34.8	0	0	0	113.6	V397 M816 K817 M818	V397-P814 HydrophobicContact CB-CB 4.5Å; V397-P814 HydrophobicContact CG1-CB 4.21Å; V397-P814 HydrophobicContact CG2-CB 4.06Å; P814-M816 VanDerWaalsContact C-N 3.35Å; P814-M816 PolarHBondContact O-N 3.35Å; P814-K817 WeakPolarHBondContact O-CB 3.31Å; P814-K817 PolarHBondContact O-N 3.31Å; P814-K817 VanDerWaalsContact O-N 3.15Å; P814-M818 PolarHBondContact O-N 3Å
815	Y	75.4	Confident	81	Confident	102 Å²	102	50.8 Å²	50.8	40%	0.4	27%	0.268	S	S	.	.	H	α-helix	trans	-62.3	-37.4	-178.9	-60.8	-78.6	0	0	0	113.2	D404 L813 K817 M818	D404-Y815 PolarHBondContact OD2-OH 3.47Å; L813-Y815 VanDerWaalsContact C-N 3.28Å; L813-Y815 PolarHBondContact O-N 2.8Å; Y815-K817 VanDerWaalsContact C-N 3.3Å; Y815-K817 PolarHBondContact O-N 2.87Å; Y815-M818 HydrophobicContact CD1-CE 3.87Å; Y815-M818 HydrophobicContact CD1-SD 4.32Å; Y815-M818 HydrophobicContact CE1-CE 4.25Å; Y815-M818 WeakPolarHBondContact O-CB 3.45Å; Y815-M818 PolarHBondContact O-N 3.41Å
816	M	79.9	Confident	80.8	Confident	74 Å²	74	54.9 Å²	54.9	37%	0.365	29%	0.29	S	S	.	.	H	α-helix	trans	-68.6	-31.5	177.2	-72.6	-60.9	-143.3	0	0	112	F808 Y811 L813 P814 M818 V819	F808-M816 HydrophobicContact CE1-SD 4.47Å; Y811-M816 HydrophobicContact CD1-CB 3.73Å; Y811-M816 HydrophobicContact CD1-CG 3.64Å; Y811-M816 HydrophobicContact CE1-CG 4.02Å; Y811-M816 HydrophobicContact CG-CB 4.08Å; Y811-M816 HydrophobicContact CG-CG 4.27Å; L813-M816 HydrophobicContact CB-CG 4.31Å; L813-M816 PolarHBondContact O-N 3.43Å; P814-M816 VanDerWaalsContact C-N 3.35Å; P814-M816 PolarHBondContact O-N 3.35Å; M816-M818 PolarHBondContact O-N 2.98Å; M816-V819 PolarHBondContact O-N 3.4Å
817	K	77	Confident	80.6	Confident	41 Å²	41	54.7 Å²	54.7	18%	0.178	29%	0.287	C	S	.	.	H	α-helix	trans	-67.9	-24	175.8	-57.5	-171.8	-175.7	-177.1	0	112.7	I393 V397 Y811 P814 Y815 V819 F820	I393-K817 HydrophobicContact CG2-CB 4.2Å; I393-K817 HydrophobicContact CG2-CD 3.58Å; I393-K817 HydrophobicContact CG2-CG 4.47Å; V397-K817 HydrophobicContact CG2-CB 4.12Å; V397-K817 HydrophobicContact CG2-CD 4.38Å; Y811-K817 WeakPolarHBondContact O-CE 3.47Å; P814-K817 WeakPolarHBondContact O-CB 3.31Å; P814-K817 PolarHBondContact O-N 3.31Å; P814-K817 VanDerWaalsContact O-N 3.15Å; Y815-K817 VanDerWaalsContact C-N 3.3Å; Y815-K817 PolarHBondContact O-N 2.87Å; K817-V819 PolarHBondContact O-N 3.38Å; K817-F820 WeakPolarHBondContact O-CB 3.48Å; K817-F820 PolarHBondContact O-N 3.12Å
818	M	76.9	Confident	80.1	Confident	25 Å²	25	52.2 Å²	52.2	12%	0.123	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-26	177.3	-61.4	178.3	-173.9	0	0	113.2	V397 I401 L626 P814 Y815 M816 F820 P821	V397-M818 HydrophobicContact CG1-CE 3.18Å; V397-M818 HydrophobicContact CG1-CG 3.65Å; V397-M818 HydrophobicContact CG1-SD 4.27Å; I401-M818 HydrophobicContact CD1-CE 3.22Å; I401-M818 HydrophobicContact CG1-CE 3.63Å; L626-M818 HydrophobicContact CD2-SD 4.11Å; P814-M818 PolarHBondContact O-N 3Å; Y815-M818 HydrophobicContact CD1-CE 3.87Å; Y815-M818 HydrophobicContact CD1-SD 4.32Å; Y815-M818 HydrophobicContact CE1-CE 4.25Å; Y815-M818 WeakPolarHBondContact O-CB 3.45Å; Y815-M818 PolarHBondContact O-N 3.41Å; M816-M818 PolarHBondContact O-N 2.98Å; M818-F820 PolarHBondContact O-N 3.49Å; M818-P821 WeakPolarHBondContact O-CD 3.4Å
819	V	82.6	Confident	79.8	Confident	59 Å²	59	51.7 Å²	51.7	36%	0.358	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-13.2	-178.2	-173.8	0	0	0	0	111.5	M816 K817 L822 L823	M816-V819 PolarHBondContact O-N 3.4Å; K817-V819 PolarHBondContact O-N 3.38Å; V819-L822 WeakPolarHBondContact O-CB 3.37Å; V819-L822 PolarHBondContact O-N 3.03Å; V819-L822 VanDerWaalsContact O-N 3.1Å; V819-L823 HydrophobicContact CG1-CD1 4.41Å; V819-L823 HydrophobicContact CG1-CG 4.19Å; V819-L823 PolarHBondContact O-N 2.94Å; V819-L823 VanDerWaalsContact O-N 3.13Å
820	F	79.1	Confident	79.8	Confident	16 Å²	16	53.9 Å²	53.9	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-53.1	-48.2	-175.9	165.8	-99.6	0	0	0	114.6	P390 F450 L633 L805 K817 M818 L822 L823 M824	P390-F820 HydrophobicContact CB-CE1 4.23Å; F450-F820 AromaticContact CD1-CE2 3.81Å; F450-F820 HydrophobicContact CD1-CE2 3.81Å; F450-F820 AromaticContact CD1-CZ 3.89Å; F450-F820 HydrophobicContact CD1-CZ 3.89Å; F450-F820 HydrophobicContact CE1-CD2 4.17Å; F450-F820 HydrophobicContact CE1-CE1 4.28Å; F450-F820 AromaticContact CE1-CE2 3.11Å; F450-F820 HydrophobicContact CE1-CE2 3.11Å; F450-F820 AromaticContact CE1-CZ 3.19Å; F450-F820 HydrophobicContact CE1-CZ 3.19Å; F450-F820 AromaticContact CE2-CE2 3.96Å; F450-F820 HydrophobicContact CE2-CE2 3.96Å; F450-F820 AromaticContact CZ-CD2 3.85Å; F450-F820 HydrophobicContact CZ-CD2 3.85Å; F450-F820 AromaticContact CZ-CE2 3.19Å; F450-F820 HydrophobicContact CZ-CE2 3.19Å; F450-F820 AromaticContact CZ-CZ 3.74Å; F450-F820 HydrophobicContact CZ-CZ 3.74Å; L633-F820 HydrophobicContact CD1-CD1 4.32Å; L633-F820 HydrophobicContact CD1-CE1 3.79Å; L805-F820 HydrophobicContact CD1-CD2 3.65Å; L805-F820 HydrophobicContact CD1-CE2 3.49Å; L805-F820 VanDerWaalsContact CD1-CE2 3.49Å; L805-F820 HydrophobicContact CD2-CE2 4.23Å; L805-F820 HydrophobicContact CG-CD2 4.27Å; L805-F820 HydrophobicContact CG-CE2 3.84Å; K817-F820 WeakPolarHBondContact O-CB 3.48Å; K817-F820 PolarHBondContact O-N 3.12Å; M818-F820 PolarHBondContact O-N 3.49Å; F820-L822 VanDerWaalsContact C-N 3.27Å; F820-L822 PolarHBondContact O-N 3.29Å; F820-L823 WeakPolarHBondContact O-CB 3.42Å; F820-L823 PolarHBondContact O-N 3.43Å; F820-L823 VanDerWaalsContact O-N 3.13Å; F820-M824 HydrophobicContact CD2-CG 4.29Å; F820-M824 HydrophobicContact CE1-CG 3.98Å; F820-M824 HydrophobicContact CE1-SD 4.34Å; F820-M824 HydrophobicContact CE2-CG 3.73Å; F820-M824 HydrophobicContact CE2-SD 3.69Å; F820-M824 HydrophobicContact CZ-CG 3.55Å; F820-M824 HydrophobicContact CZ-SD 3.44Å; F820-M824 WeakPolarHBondContact CZ-SD 3.44Å; F820-M824 WeakPolarHBondContact O-CG 3.37Å; F820-M824 PolarHBondContact O-N 3.29Å
821	P	81.2	Confident	79.9	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-62.2	-33.1	179.1	-23.3	35.4	0	0	0	113.3	L632 L633 M818 M824 I825	L632-P821 HydrophobicContact CB-CB 4.4Å; L632-P821 HydrophobicContact CD2-CB 4.31Å; L633-P821 HydrophobicContact CB-CB 4.05Å; L633-P821 HydrophobicContact CB-CG 3.93Å; L633-P821 HydrophobicContact CD1-CG 4.33Å; L633-P821 HydrophobicContact CG-CG 4.5Å; M818-P821 WeakPolarHBondContact O-CD 3.4Å; P821-M824 PolarHBondContact O-N 3.42Å; P821-I825 PolarHBondContact O-N 3.32Å
822	L	85.9	Confident	79.5	Confident	82 Å²	82	49 Å²	49	43%	0.429	26%	0.26	S	S	.	.	H	α-helix	trans	-68.5	-40.1	176.1	-66.9	170.2	0	0	0	111.4	L629 L632 V819 F820 M824 I825 L826	L629-L822 HydrophobicContact CD2-CD1 3.8Å; L629-L822 HydrophobicContact CD2-CD2 4.07Å; L629-L822 HydrophobicContact CD2-CG 3.68Å; L632-L822 HydrophobicContact CD2-CD2 3.73Å; L632-L822 HydrophobicContact CD2-CG 4.4Å; V819-L822 WeakPolarHBondContact O-CB 3.37Å; V819-L822 PolarHBondContact O-N 3.03Å; V819-L822 VanDerWaalsContact O-N 3.1Å; F820-L822 VanDerWaalsContact C-N 3.27Å; F820-L822 PolarHBondContact O-N 3.29Å; L822-M824 VanDerWaalsContact C-N 3.3Å; L822-M824 PolarHBondContact O-N 3.37Å; L822-I825 PolarHBondContact O-N 2.95Å; L822-L826 WeakPolarHBondContact O-CB 3.34Å; L822-L826 PolarHBondContact O-N 2.92Å
823	L	85	Confident	79.5	Confident	27 Å²	27	46.9 Å²	46.9	14%	0.141	25%	0.247	C	C	.	.	H	α-helix	trans	-63.8	-38	175.4	-67.5	172.6	0	0	0	111.5	L805 F808 V819 F820 I825 L826 L827	L805-L823 HydrophobicContact CD1-CB 4.17Å; F808-L823 HydrophobicContact CB-CD1 3.48Å; F808-L823 VanDerWaalsContact CB-CD1 3.48Å; F808-L823 HydrophobicContact CD1-CD1 4.1Å; F808-L823 HydrophobicContact CD2-CD1 3.44Å; F808-L823 VanDerWaalsContact CD2-CD1 3.44Å; F808-L823 HydrophobicContact CE2-CD1 4.19Å; F808-L823 HydrophobicContact CG-CD1 3.4Å; F808-L823 VanDerWaalsContact CG-CD1 3.4Å; V819-L823 HydrophobicContact CG1-CD1 4.41Å; V819-L823 HydrophobicContact CG1-CG 4.19Å; V819-L823 PolarHBondContact O-N 2.94Å; V819-L823 VanDerWaalsContact O-N 3.13Å; F820-L823 WeakPolarHBondContact O-CB 3.42Å; F820-L823 PolarHBondContact O-N 3.43Å; F820-L823 VanDerWaalsContact O-N 3.13Å; L823-I825 VanDerWaalsContact C-N 3.34Å; L823-I825 PolarHBondContact O-N 2.94Å; L823-L826 HydrophobicContact CD2-CD2 4.32Å; L823-L826 WeakPolarHBondContact O-CB 3.34Å; L823-L826 PolarHBondContact O-N 3.44Å; L823-L826 VanDerWaalsContact O-N 3.16Å; L823-L827 WeakPolarHBondContact O-CG 3.38Å; L823-L827 PolarHBondContact O-N 3.01Å
824	M	81.1	Confident	79.5	Confident	1 Å²	1	46 Å²	46	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-59.5	-43.6	175.5	-65.9	-90.8	59.3	0	0	112.2	I447 I636 L805 F820 P821 L822 L827	I447-M824 HydrophobicContact CD1-CE 4.05Å; I447-M824 HydrophobicContact CD1-SD 4.33Å; I447-M824 HydrophobicContact CG1-CE 3.43Å; I447-M824 VanDerWaalsContact CG1-CE 3.43Å; I447-M824 HydrophobicContact CG1-SD 3.87Å; I447-M824 HydrophobicContact CG2-SD 4.28Å; I636-M824 HydrophobicContact CD1-CB 3.88Å; L805-M824 HydrophobicContact CD1-CE 3.57Å; L805-M824 HydrophobicContact CD1-CG 4.14Å; L805-M824 HydrophobicContact CD1-SD 4.1Å; L805-M824 HydrophobicContact CD2-CE 3.14Å; L805-M824 HydrophobicContact CD2-SD 3.91Å; L805-M824 HydrophobicContact CG-CE 3.97Å; F820-M824 HydrophobicContact CD2-CG 4.29Å; F820-M824 HydrophobicContact CE1-CG 3.98Å; F820-M824 HydrophobicContact CE1-SD 4.34Å; F820-M824 HydrophobicContact CE2-CG 3.73Å; F820-M824 HydrophobicContact CE2-SD 3.69Å; F820-M824 HydrophobicContact CZ-CG 3.55Å; F820-M824 HydrophobicContact CZ-SD 3.44Å; F820-M824 WeakPolarHBondContact CZ-SD 3.44Å; F820-M824 WeakPolarHBondContact O-CG 3.37Å; F820-M824 PolarHBondContact O-N 3.29Å; P821-M824 PolarHBondContact O-N 3.42Å; L822-M824 VanDerWaalsContact C-N 3.3Å; L822-M824 PolarHBondContact O-N 3.37Å; M824-L827 HydrophobicContact CE-CD1 3.28Å; M824-L827 HydrophobicContact CE-CG 4.38Å; M824-L827 WeakPolarHBondContact O-CB 2.99Å; M824-L827 PolarHBondContact O-N 2.94Å
825	I	82.6	Confident	79.7	Confident	38 Å²	38	44 Å²	44	20%	0.195	23%	0.229	C	C	.	.	H	α-helix	trans	-66.5	-40.8	174.1	-65.1	-152.5	0	0	0	111.5	M435 L632 I636 P821 L822 L823 L827 V828 P829	M435-I825 HydrophobicContact CE-CD1 4Å; L632-I825 HydrophobicContact CD1-CD1 3.22Å; L632-I825 HydrophobicContact CD1-CG1 4.37Å; L632-I825 HydrophobicContact CD2-CD1 3.65Å; L632-I825 HydrophobicContact CD2-CG1 3.99Å; L632-I825 HydrophobicContact CG-CD1 3.39Å; L632-I825 HydrophobicContact CG-CG1 4.05Å; I636-I825 HydrophobicContact CD1-CD1 3.94Å; I636-I825 HydrophobicContact CD1-CG1 3.28Å; I636-I825 HydrophobicContact CG1-CD1 4.23Å; I636-I825 HydrophobicContact CG1-CG1 3.95Å; P821-I825 PolarHBondContact O-N 3.32Å; L822-I825 PolarHBondContact O-N 2.95Å; L823-I825 VanDerWaalsContact C-N 3.34Å; L823-I825 PolarHBondContact O-N 2.94Å; I825-L827 PolarHBondContact O-N 3.3Å; I825-L827 VanDerWaalsContact O-N 3.13Å; I825-V828 WeakPolarHBondContact O-CB 3.1Å; I825-V828 PolarHBondContact O-N 2.9Å; I825-P829 WeakPolarHBondContact O-CD 3.44Å
826	L	84.2	Confident	79.9	Confident	88 Å²	88	42.2 Å²	42.2	46%	0.461	23%	0.23	S	C	.	.	H	α-helix	trans	-59.7	-25.1	-178.4	-171.6	66.3	0	0	0	112.7	L822 L823 V828 P829 I830	L822-L826 WeakPolarHBondContact O-CB 3.34Å; L822-L826 PolarHBondContact O-N 2.92Å; L823-L826 HydrophobicContact CD2-CD2 4.32Å; L823-L826 WeakPolarHBondContact O-CB 3.34Å; L823-L826 PolarHBondContact O-N 3.44Å; L823-L826 VanDerWaalsContact O-N 3.16Å; L826-V828 PolarHBondContact O-N 3.36Å; L826-P829 HydrophobicContact CD1-CG 4.3Å; L826-P829 WeakPolarHBondContact O-CD 3.33Å; L826-P829 WeakPolarHBondContact O-CG 3.5Å; L826-I830 HydrophobicContact CD2-CD1 4.32Å; L826-I830 HydrophobicContact CG-CD1 3.86Å; L826-I830 HydrophobicContact CG-CG1 4.37Å; L826-I830 WeakPolarHBondContact O-CB 3.48Å; L826-I830 WeakPolarHBondContact O-CD1 3.41Å; L826-I830 WeakPolarHBondContact O-CG1 3.33Å; L826-I830 PolarHBondContact O-N 3.5Å
827	L	81.4	Confident	79.8	Confident	11 Å²	11	48.9 Å²	48.9	6%	0.058	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-31.8	173.4	-63.8	179.8	0	0	0	113.1	T443 V446 Q801 L823 M824 I825 R831	T443-L827 HydrophobicContact CG2-CB 4.15Å; V446-L827 HydrophobicContact CG1-CD1 4.17Å; Q801-L827 HydrophobicContact CB-CD2 3.78Å; Q801-L827 HydrophobicContact CG-CD2 3.87Å; L823-L827 WeakPolarHBondContact O-CG 3.38Å; L823-L827 PolarHBondContact O-N 3.01Å; M824-L827 HydrophobicContact CE-CD1 3.28Å; M824-L827 HydrophobicContact CE-CG 4.38Å; M824-L827 WeakPolarHBondContact O-CB 2.99Å; M824-L827 PolarHBondContact O-N 2.94Å; I825-L827 PolarHBondContact O-N 3.3Å; I825-L827 VanDerWaalsContact O-N 3.13Å; L827-R831 WeakPolarHBondContact O-CB 3.34Å; L827-R831 PolarHBondContact O-N 3.19Å
828	V	78.6	Confident	79.6	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.042	26%	0.256	C	S	.	.	H	α-helix	trans	-68.2	-55.7	-177.9	-179.8	0	0	0	0	112.8	L438 F439 T443 I825 L826 I830 R831 I832	L438-V828 HydrophobicContact CB-CG1 3.5Å; L438-V828 VanDerWaalsContact CB-CG1 3.5Å; L438-V828 HydrophobicContact CD1-CG1 4.46Å; F439-V828 HydrophobicContact CD1-CG2 3.75Å; F439-V828 HydrophobicContact CD2-CG2 4.3Å; F439-V828 HydrophobicContact CE1-CG2 3.46Å; F439-V828 VanDerWaalsContact CE1-CG2 3.46Å; F439-V828 HydrophobicContact CE2-CG2 4.06Å; F439-V828 HydrophobicContact CG-CG2 4.17Å; F439-V828 HydrophobicContact CZ-CG2 3.64Å; T443-V828 HydrophobicContact CG2-CG2 4.26Å; I825-V828 WeakPolarHBondContact O-CB 3.1Å; I825-V828 PolarHBondContact O-N 2.9Å; L826-V828 PolarHBondContact O-N 3.36Å; V828-I830 VanDerWaalsContact C-N 3.29Å; V828-I830 PolarHBondContact O-N 3.41Å; V828-R831 WeakPolarHBondContact O-CB 3.31Å; V828-R831 PolarHBondContact O-N 2.78Å; V828-R831 VanDerWaalsContact O-N 3.08Å; V828-I832 HydrophobicContact CG1-CD1 3.97Å; V828-I832 WeakPolarHBondContact O-CG1 3.26Å; V828-I832 PolarHBondContact O-N 3.11Å
829	P	77.9	Confident	79.8	Confident	58 Å²	58	48.6 Å²	48.6	38%	0.377	25%	0.251	S	S	.	.	H	α-helix	trans	-66.6	-30.5	176.4	26.8	-34.2	0	0	0	112.3	I825 L826 R831 I832 S833	I825-P829 WeakPolarHBondContact O-CD 3.44Å; L826-P829 HydrophobicContact CD1-CG 4.3Å; L826-P829 WeakPolarHBondContact O-CD 3.33Å; L826-P829 WeakPolarHBondContact O-CG 3.5Å; P829-R831 VanDerWaalsContact C-N 3.3Å; P829-R831 PolarHBondContact O-N 3.12Å; P829-I832 PolarHBondContact O-N 3.18Å; P829-S833 VanDerWaalsContact O-CB 3.24Å; P829-S833 WeakPolarHBondContact O-CB 3.28Å; P829-S833 PolarHBondContact O-N 3.3Å; P829-S833 PolarHBondContact O-OG 2.93Å
830	I	79.6	Confident	79.6	Confident	55 Å²	55	50.3 Å²	50.3	28%	0.282	26%	0.258	S	S	.	.	H	α-helix	trans	-58.7	-47.3	169.6	-68.4	168.7	0	0	0	109	L826 V828 I832 S833 L834	L826-I830 HydrophobicContact CD2-CD1 4.32Å; L826-I830 HydrophobicContact CG-CD1 3.86Å; L826-I830 HydrophobicContact CG-CG1 4.37Å; L826-I830 WeakPolarHBondContact O-CB 3.48Å; L826-I830 WeakPolarHBondContact O-CD1 3.41Å; L826-I830 WeakPolarHBondContact O-CG1 3.33Å; L826-I830 PolarHBondContact O-N 3.5Å; V828-I830 VanDerWaalsContact C-N 3.29Å; V828-I830 PolarHBondContact O-N 3.41Å; I830-I832 PolarHBondContact O-N 3.25Å; I830-S833 PolarHBondContact O-N 2.69Å; I830-L834 HydrophobicContact CG2-CB 4.15Å; I830-L834 HydrophobicContact CG2-CD2 3.85Å; I830-L834 WeakPolarHBondContact O-CA 3.32Å; I830-L834 WeakPolarHBondContact O-CB 3.44Å; I830-L834 PolarHBondContact O-N 3.28Å
831	R	80.4	Confident	79.4	Confident	24 Å²	24	52.5 Å²	52.5	9%	0.091	28%	0.279	C	S	.	.	H	α-helix	trans	-63.4	-38.7	177.9	-176.6	-96.9	174.8	-151.5	-8.6	113.3	K440 L827 V828 P829 L835 P836 D848	K440-R831 VanDerWaalsContact CG-NH1 3.33Å; L827-R831 WeakPolarHBondContact O-CB 3.34Å; L827-R831 PolarHBondContact O-N 3.19Å; V828-R831 WeakPolarHBondContact O-CB 3.31Å; V828-R831 PolarHBondContact O-N 2.78Å; V828-R831 VanDerWaalsContact O-N 3.08Å; P829-R831 VanDerWaalsContact C-N 3.3Å; P829-R831 PolarHBondContact O-N 3.12Å; R831-L835 HydrophobicContact CB-CD1 4.16Å; R831-L835 HydrophobicContact CG-CD1 4.09Å; R831-L835 WeakPolarHBondContact O-CB 3.34Å; R831-P836 WeakPolarHBondContact O-CD 3.06Å; R831-D848 IonicContact CZ-OD2 3.3Å; R831-D848 IonicContact NE-OD2 3.83Å; R831-D848 IonicContact NH2-OD2 3.16Å; R831-D848 PolarHBondContact NH2-OD2 3.19Å
832	I	75.6	Confident	79.2	Confident	68 Å²	68	59.9 Å²	59.9	35%	0.349	31%	0.311	S	S	.	.	H	α-helix	trans	-77.8	-31.7	-178.1	-66.4	168.9	0	0	0	112.3	L438 V828 P829 I830 P836	L438-I832 HydrophobicContact CB-CD1 3.91Å; L438-I832 HydrophobicContact CD1-CD1 4.48Å; L438-I832 HydrophobicContact CD2-CD1 3.78Å; L438-I832 HydrophobicContact CG-CD1 4.27Å; V828-I832 HydrophobicContact CG1-CD1 3.97Å; V828-I832 WeakPolarHBondContact O-CG1 3.26Å; V828-I832 PolarHBondContact O-N 3.11Å; P829-I832 PolarHBondContact O-N 3.18Å; I830-I832 PolarHBondContact O-N 3.25Å; I832-P836 VanDerWaalsContact O-CD 3.32Å; I832-P836 WeakPolarHBondContact O-CD 3.28Å; I832-P836 VanDerWaalsContact O-CG 3.24Å; I832-P836 WeakPolarHBondContact O-CG 3.45Å
833	S	76.6	Confident	78.8	Confident	66 Å²	66	59 Å²	59	46%	0.462	30%	0.303	S	S	.	.	H	α-helix	trans	-101	-37.8	-172.9	-49.9	0	0	0	0	113.4	P829 I830 R837	P829-S833 VanDerWaalsContact O-CB 3.24Å; P829-S833 WeakPolarHBondContact O-CB 3.28Å; P829-S833 PolarHBondContact O-N 3.3Å; P829-S833 PolarHBondContact O-OG 2.93Å; I830-S833 PolarHBondContact O-N 2.69Å; S833-R837 WeakPolarHBondContact O-CD 3.36Å; S833-R837 WeakPolarHBondContact O-CG 3.28Å
834	L	77.3	Confident	78.4	Confident	74 Å²	74	58 Å²	58	39%	0.387	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-47.9	-174.6	-170.9	66.1	0	0	0	111.2	I830 R837 M838	I830-L834 HydrophobicContact CG2-CB 4.15Å; I830-L834 HydrophobicContact CG2-CD2 3.85Å; I830-L834 WeakPolarHBondContact O-CA 3.32Å; I830-L834 WeakPolarHBondContact O-CB 3.44Å; I830-L834 PolarHBondContact O-N 3.28Å; L834-R837 WeakPolarHBondContact O-CB 3.02Å; L834-R837 PolarHBondContact O-N 3.08Å; L834-M838 HydrophobicContact CD1-SD 4.23Å; L834-M838 HydrophobicContact CG-SD 3.84Å; L834-M838 WeakPolarHBondContact O-CG 3.45Å
835	L	76.1	Confident	78	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-66.3	-42.5	-173.9	-86.5	108.3	0	0	0	114.6	F794 V797 R831 R837 M838 I839 L844	F794-L835 HydrophobicContact CD2-CD2 3.25Å; F794-L835 HydrophobicContact CE2-CD2 3.34Å; F794-L835 HydrophobicContact CG-CD2 4.41Å; V797-L835 HydrophobicContact CG1-CD1 4.27Å; R831-L835 HydrophobicContact CB-CD1 4.16Å; R831-L835 HydrophobicContact CG-CD1 4.09Å; R831-L835 WeakPolarHBondContact O-CB 3.34Å; L835-R837 PolarHBondContact O-N 2.98Å; L835-M838 PolarHBondContact O-N 3.39Å; L835-I839 PolarHBondContact O-N 2.9Å; L835-L844 HydrophobicContact CB-CD1 4.23Å; L835-L844 HydrophobicContact CB-CD2 4.06Å; L835-L844 HydrophobicContact CD2-CD2 3.55Å; L835-L844 HydrophobicContact CG-CD2 4.47Å
836	P	78.1	Confident	77.7	Confident	65 Å²	65	62 Å²	62	42%	0.422	32%	0.318	S	S	.	.	H	α-helix	trans	-65.4	-19.9	177.1	-25.9	37.7	0	0	0	113.9	R831 I832 M838 L844	R831-P836 WeakPolarHBondContact O-CD 3.06Å; I832-P836 VanDerWaalsContact O-CD 3.32Å; I832-P836 WeakPolarHBondContact O-CD 3.28Å; I832-P836 VanDerWaalsContact O-CG 3.24Å; I832-P836 WeakPolarHBondContact O-CG 3.45Å; P836-M838 VanDerWaalsContact C-N 3.3Å; P836-L844 HydrophobicContact CG-CD1 4.27Å
837	R	78.8	Confident	77.2	Confident	215 Å²	215	57.8 Å²	57.8	81%	0.811	30%	0.297	S	S	*	.	H	α-helix	trans	-76.1	-18.9	172.6	-72	179.6	175.9	166	0.3	112.8	S833 L834 L835	S833-R837 WeakPolarHBondContact O-CD 3.36Å; S833-R837 WeakPolarHBondContact O-CG 3.28Å; L834-R837 WeakPolarHBondContact O-CB 3.02Å; L834-R837 PolarHBondContact O-N 3.08Å; L835-R837 PolarHBondContact O-N 2.98Å
838	M	73.4	Confident	76.7	Confident	57 Å²	57	58.2 Å²	58.2	28%	0.281	30%	0.299	S	S	.	.	H	α-helix	trans	-110.9	-30	-172.7	-56	168.6	110.9	0	0	113.3	K790 Y793 L834 L835 P836	K790-M838 PolarHBondContact NZ-O 3.36Å; K790-M838 VanDerWaalsContact NZ-O 3.07Å; Y793-M838 HydrophobicContact CE1-CB 3.82Å; Y793-M838 HydrophobicContact CE1-CE 3.51Å; Y793-M838 HydrophobicContact CE1-CG 4.23Å; Y793-M838 HydrophobicContact CE1-SD 3.83Å; Y793-M838 VanDerWaalsContact CZ-CE 3.48Å; Y793-M838 WeakPolarHBondContact OH-CE 3.27Å; L834-M838 HydrophobicContact CD1-SD 4.23Å; L834-M838 HydrophobicContact CG-SD 3.84Å; L834-M838 WeakPolarHBondContact O-CG 3.45Å; L835-M838 PolarHBondContact O-N 3.39Å; P836-M838 VanDerWaalsContact C-N 3.3Å
839	I	79.4	Confident	76	Confident	3 Å²	3	59.8 Å²	59.8	2%	0.015	31%	0.31	C	S	.	.	S	Bend	trans	-133.5	135.4	-176.3	-54.3	180	0	0	0	108.3	K790 Y793 F794 L835 A841 Y843 L844	K790-I839 HydrophobicContact CD-CG1 4.41Å; Y793-I839 HydrophobicContact CD1-CD1 4.28Å; Y793-I839 HydrophobicContact CD1-CG1 4.34Å; F794-I839 HydrophobicContact CB-CD1 3.73Å; F794-I839 HydrophobicContact CD2-CD1 4.12Å; F794-I839 HydrophobicContact CG-CD1 4.45Å; L835-I839 PolarHBondContact O-N 2.9Å; I839-A841 PolarHBondContact O-N 3.46Å; I839-Y843 HydrophobicContact CG2-CD2 4.37Å; I839-L844 HydrophobicContact CB-CD1 4.28Å; I839-L844 HydrophobicContact CB-CG 4.2Å; I839-L844 HydrophobicContact CG2-CG 4.11Å; I839-L844 WeakPolarHBondContact O-CD1 3.35Å
840	D	78.6	Confident	75	Confident	95 Å²	95	59.1 Å²	59.1	51%	0.508	30%	0.302	S	S	.	.			trans	-57.8	138	178.1	-56.5	-44.7	0	0	0	111	K842 Y843 L844	D840-K842 PolarHBondContact O-N 3.31Å; D840-K842 VanDerWaalsContact O-N 3.08Å; D840-Y843 HydrophobicContact CB-CD2 3.73Å; D840-Y843 HydrophobicContact CB-CE2 4.05Å; D840-Y843 PolarHBondContact O-N 3.02Å; D840-Y843 VanDerWaalsContact OD2-CE2 3.25Å; D840-Y843 WeakPolarHBondContact OD2-CE2 3.47Å; D840-L844 PolarHBondContact O-N 3.46Å
841	A	74.6	Confident	73.2	Confident	61 Å²	61	62.9 Å²	62.9	50%	0.504	31%	0.314	S	S	.	.	H	α-helix	trans	-53.2	-34.9	-178.3	0	0	0	0	0	112.8	I839 Y843 L844 D845	I839-A841 PolarHBondContact O-N 3.46Å; A841-Y843 VanDerWaalsContact C-N 3.33Å; A841-Y843 PolarHBondContact O-N 3.22Å; A841-L844 PolarHBondContact O-N 3.35Å; A841-D845 PolarHBondContact O-N 3.21Å
842	K	77.3	Confident	70.9	Confident	156 Å²	156	70.3 Å²	70.3	68%	0.678	35%	0.352	S	S	*	.	H	α-helix	trans	-58.6	-41.6	176	-175.5	179.6	179.3	-178.1	0	112.8	D840 I846	D840-K842 PolarHBondContact O-N 3.31Å; D840-K842 VanDerWaalsContact O-N 3.08Å; K842-I846 HydrophobicContact CG-CD1 4.23Å; K842-I846 VanDerWaalsContact O-CD1 3.3Å; K842-I846 WeakPolarHBondContact O-CD1 3.4Å; K842-I846 WeakPolarHBondContact O-CG1 3.42Å; K842-I846 PolarHBondContact O-N 3.31Å
843	Y	79.3	Confident	70.6	Confident	65 Å²	65	70.4 Å²	70.4	26%	0.255	35%	0.352	S	S	.	.	H	α-helix	trans	-75	-36.5	179.6	-61.3	-51.8	0	0	0	111.4	V786 I839 D840 A841 I846 M847	V786-Y843 HydrophobicContact CB-CD1 4.24Å; V786-Y843 HydrophobicContact CG1-CD1 3.98Å; V786-Y843 HydrophobicContact CG1-CG 4.05Å; V786-Y843 HydrophobicContact CG2-CD1 3.99Å; I839-Y843 HydrophobicContact CG2-CD2 4.37Å; D840-Y843 HydrophobicContact CB-CD2 3.73Å; D840-Y843 HydrophobicContact CB-CE2 4.05Å; D840-Y843 PolarHBondContact O-N 3.02Å; D840-Y843 VanDerWaalsContact OD2-CE2 3.25Å; D840-Y843 WeakPolarHBondContact OD2-CE2 3.47Å; A841-Y843 VanDerWaalsContact C-N 3.33Å; A841-Y843 PolarHBondContact O-N 3.22Å; Y843-I846 PolarHBondContact O-N 3.44Å; Y843-M847 WeakPolarHBondContact O-CB 3.5Å; Y843-M847 VanDerWaalsContact O-CG 3.24Å; Y843-M847 WeakPolarHBondContact O-CG 3.41Å; Y843-M847 PolarHBondContact O-N 3.02Å
844	L	76.1	Confident	70.3	Confident	4 Å²	4	70.6 Å²	70.6	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-60.7	-46.5	175	-75.6	161.1	0	0	0	111.6	F794 L835 P836 I839 D840 A841 I846 M847 D848	F794-L844 HydrophobicContact CD2-CD2 3.92Å; F794-L844 HydrophobicContact CE2-CD2 3.77Å; L835-L844 HydrophobicContact CB-CD1 4.23Å; L835-L844 HydrophobicContact CB-CD2 4.06Å; L835-L844 HydrophobicContact CD2-CD2 3.55Å; L835-L844 HydrophobicContact CG-CD2 4.47Å; P836-L844 HydrophobicContact CG-CD1 4.27Å; I839-L844 HydrophobicContact CB-CD1 4.28Å; I839-L844 HydrophobicContact CB-CG 4.2Å; I839-L844 HydrophobicContact CG2-CG 4.11Å; I839-L844 WeakPolarHBondContact O-CD1 3.35Å; D840-L844 PolarHBondContact O-N 3.46Å; A841-L844 PolarHBondContact O-N 3.35Å; L844-I846 VanDerWaalsContact C-N 3.28Å; L844-I846 PolarHBondContact O-N 3.37Å; L844-M847 PolarHBondContact O-N 3.13Å; L844-M847 VanDerWaalsContact O-N 3.13Å; L844-D848 WeakPolarHBondContact O-CB 3.47Å; L844-D848 PolarHBondContact O-N 3.08Å
845	D	73.1	Confident	69.9	Low	101 Å²	101	70.4 Å²	70.4	54%	0.54	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-35.1	178	-73	-18.8	0	0	0	112.1	A841 D848 S849	A841-D845 PolarHBondContact O-N 3.21Å; D845-D848 PolarHBondContact O-N 3.13Å; D845-S849 VanDerWaalsContact O-CB 3.23Å; D845-S849 WeakPolarHBondContact O-CB 3.49Å; D845-S849 PolarHBondContact O-N 3.21Å; D845-S849 PolarHBondContact O-OG 3.12Å
846	I	74.4	Confident	69.6	Low	22 Å²	22	74.2 Å²	74.2	11%	0.113	36%	0.362	C	S	.	.	H	α-helix	trans	-69.2	-37.4	175.2	-68.1	165.4	0	0	0	111.2	R785 V786 K842 Y843 L844 S849	R785-I846 HydrophobicContact CB-CD1 4.2Å; R785-I846 HydrophobicContact CB-CG2 3.86Å; V786-I846 HydrophobicContact CG2-CB 4.19Å; V786-I846 HydrophobicContact CG2-CG2 3.78Å; K842-I846 HydrophobicContact CG-CD1 4.23Å; K842-I846 VanDerWaalsContact O-CD1 3.3Å; K842-I846 WeakPolarHBondContact O-CD1 3.4Å; K842-I846 WeakPolarHBondContact O-CG1 3.42Å; K842-I846 PolarHBondContact O-N 3.31Å; Y843-I846 PolarHBondContact O-N 3.44Å; L844-I846 VanDerWaalsContact C-N 3.28Å; L844-I846 PolarHBondContact O-N 3.37Å; I846-S849 PolarHBondContact O-OG 2.78Å
847	M	73.9	Confident	69	Low	1 Å²	1	74.8 Å²	74.8	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-73.7	-28.2	177.8	-70.1	-177.1	69.2	0	0	113.1	V786 V791 F794 Y843 L844	V786-M847 HydrophobicContact CG1-SD 4.32Å; V786-M847 HydrophobicContact CG2-CG 4.14Å; V791-M847 HydrophobicContact CG1-CE 4.26Å; F794-M847 HydrophobicContact CB-CE 3.63Å; F794-M847 HydrophobicContact CB-SD 4.19Å; F794-M847 HydrophobicContact CD1-CE 3.15Å; F794-M847 HydrophobicContact CD1-SD 4.41Å; F794-M847 HydrophobicContact CD2-CE 4Å; F794-M847 HydrophobicContact CD2-SD 4.29Å; F794-M847 HydrophobicContact CE1-CE 3.68Å; F794-M847 HydrophobicContact CE2-CE 4.45Å; F794-M847 HydrophobicContact CG-CE 3.32Å; F794-M847 HydrophobicContact CG-SD 4.06Å; F794-M847 HydrophobicContact CZ-CE 4.29Å; Y843-M847 WeakPolarHBondContact O-CB 3.5Å; Y843-M847 VanDerWaalsContact O-CG 3.24Å; Y843-M847 WeakPolarHBondContact O-CG 3.41Å; Y843-M847 PolarHBondContact O-N 3.02Å; L844-M847 PolarHBondContact O-N 3.13Å; L844-M847 VanDerWaalsContact O-N 3.13Å
848	D	72.1	Confident	68.4	Low	19 Å²	19	65.5 Å²	65.5	10%	0.102	33%	0.328	C	S	.	.	H	α-helix	trans	-88.8	-17.1	174.6	-77.5	-39	0	0	0	112.9	S442 R831 L844 D845	S442-D848 WeakPolarHBondContact CB-OD1 3.45Å; S442-D848 PolarHBondContact N-OD1 3.24Å; R831-D848 IonicContact CZ-OD2 3.3Å; R831-D848 IonicContact NE-OD2 3.83Å; R831-D848 IonicContact NH2-OD2 3.16Å; R831-D848 PolarHBondContact NH2-OD2 3.19Å; L844-D848 WeakPolarHBondContact O-CB 3.47Å; L844-D848 PolarHBondContact O-N 3.08Å; D845-D848 PolarHBondContact O-N 3.13Å
849	S	64.3	Low	68	Low	40 Å²	40	66.1 Å²	66.1	28%	0.28	33%	0.331	S	S	.	.	S	Bend	trans	-67.1	134.1	178.2	66.1	0	0	0	0	112.4	H781 D845 I846	H781-S849 PolarHBondContact CE1-OG 3.24Å; D845-S849 VanDerWaalsContact O-CB 3.23Å; D845-S849 WeakPolarHBondContact O-CB 3.49Å; D845-S849 PolarHBondContact O-N 3.21Å; D845-S849 PolarHBondContact O-OG 3.12Å; I846-S849 PolarHBondContact O-OG 2.78Å
850	Q	55.1	Low	67.2	Low	45 Å²	45	70.9 Å²	70.9	21%	0.21	36%	0.356	C	S	.	.			trans	-72.8	137.2	164.8	-80.2	166.3	-11.6	0	0	108.9	V647 M852	V647-Q850 VanDerWaalsContact CG1-NE2 3.35Å; Q850-M852 PolarHBondContact O-N 3.48Å
851	Y	43.6	Very low	66.2	Low	134 Å²	134	68.9 Å²	68.9	53%	0.525	34%	0.343	S	S	.	.			trans	-18.4	110.2	-178.8	-68.7	-89.8	0	0	0	113.4
852	M	30.7	Very low	65.4	Low	179 Å²	179	69.6 Å²	69.6	88%	0.882	33%	0.328	S	S	*	.			trans	-87.3	0	171.4	-128.9	-169.1	-172.7	0	0	110.8	H781 Q850	H781-M852 WeakPolarHBondContact NE2-CB 3.37Å; Q850-M852 PolarHBondContact O-N 3.48Å

Retrieved 852 of 852 residues in 500.9 ms (Link to these results)

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