A0A087XYY1_POEFO Loading...

Rho GTPase activating protein 4a

AlphaFold DB , UniProt , Accession A0A087XYY1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 838 aa.

						>A0A087XYY1_POEFO|A0A087XYY1
MTSAKLRKERVGVVDYDTQIKEMRCQLLDQLKVLDVQLEQKTQQLQDMTDYLRRRGEIENEYSRSLEKLAERFALRIKRKEPSSHSVSQVWLALLSQTRQESRDHSGLSESCSNILITPVMHCLDYTQRLAKKSRDLCTQLQDGLLKVTTELQTAWRTYHQYHSEFVCAEGKLREAEKQEEKQKQSAAKKLERLIEKRQIKVQEIQLKCSKARNDYLLNLSAANSSMNKYYLQDITTLIDCADVGYHFSLGRVMKAYLSRQSWSQQNLSTGLQQLQEAVAGLDQSRDRDALLQDHGNTFSMPLRFPYQPHEEDQISEVSAECEMRCEMETRFKQIQARLKTVTEETEEAGKSMSTAKSALLDNIGENDLESSMSSGPSQVGSTENLNVKPSVARRRASILEIENVYFTKVKEYLVGSSLVSKLQAKHDLLKVAVEKAEASNGHQPRFSGKSLRIRKNHSSANLIHNHKLFSGDMLSFIKASGQRIPYVVESCVRFINLYGLHHEGIFRVPGSQMEVNVLRDAFERGEDPLSERRYDMDSVAGVLKLYFRCLDNPLFPVSSTSQLLECNQIKDDAERAARLKAIVSTYPEPVIVVMRYLFAFLHHVSQYSDENMMQPYNLAVCFGPSLVRGLQDDEVVTVQPQINALVKGIILQHESIFPSQSEVEGPMYEKCMTLEQDDCEVIIEGEVEADYSQSRDDLEMGFPAGIGPDVSAAPALTKAERPRANSSGCLDYSKVPAGGVLSASGKLTLQIPVGPQYRQKKVLSPSYTRKEYQHSSSEDLFVKVDKEVCNNMESVFKELLTRQTQQDASAQAQQKKAKRDGRKGKVTSLFRSTDQLD
					

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(Predicted Aligned Error values between residue pairs)

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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	32.5	Very low	34.5	Very low	233 Å²	233	177.9 Å²	177.9	100%	1.148	89%	0.886	S	S	*	*				0	169.9	0	-81.4	-174.6	167.2	0	0	109.8
2	T	33.7	Very low	35.1	Very low	139 Å²	139	168 Å²	168	85%	0.853	86%	0.862	S	S	*	*			trans	47.9	69.9	149.3	50.1	0	0	0	0	119.7
3	S	29.7	Very low	36.5	Very low	125 Å²	125	164 Å²	164	87%	0.874	85%	0.85	S	S	*	*			trans	-146.2	29	141.1	-158.4	0	0	0	0	112.4
4	A	32.7	Very low	38.1	Very low	101 Å²	101	157.9 Å²	157.9	84%	0.835	82%	0.823	S	S	*	*			trans	-99.2	16.8	-172.3	0	0	0	0	0	114.2
5	K	38.3	Very low	40.8	Very low	202 Å²	202	152.5 Å²	152.5	88%	0.878	80%	0.796	S	S	*	*	S	Bend	trans	-130	66.2	-176.1	-74.4	-171.6	174.4	-177.3	0	112.2
6	L	37.4	Very low	43.5	Very low	177 Å²	177	144.7 Å²	144.7	93%	0.927	75%	0.753	S	S	*	*	S	Bend	trans	-178.8	45.9	153.4	-101.5	160.6	0	0	0	111.7
7	R	29.8	Very low	45.8	Very low	239 Å²	239	139.6 Å²	139.6	90%	0.902	73%	0.727	S	S	*	*			trans	-141.9	36.3	178.4	-139.8	178.4	-161.1	176.9	5.8	112.4
8	K	36.6	Very low	48.2	Very low	193 Å²	193	135 Å²	135	84%	0.839	71%	0.706	S	S	*	*			trans	-123.8	19	-173.9	-144.2	-177.9	-177.5	-176.8	0	114.2
9	E	36.3	Very low	50.3	Low	183 Å²	183	132.9 Å²	132.9	86%	0.855	69%	0.692	S	S	*	*	S	Bend	trans	-112.3	136.2	159.4	-65.9	-176.3	129	0	0	107.1
10	R	34.2	Very low	52.3	Low	254 Å²	254	126.8 Å²	126.8	96%	0.958	66%	0.66	S	S	*	*			trans	58.9	43.5	-168.2	-44.7	-172.1	-153.9	-165.5	6.6	115.5
11	V	38.7	Very low	54.1	Low	111 Å²	111	126.5 Å²	126.5	67%	0.673	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-66.6	129.2	137	177.8	0	0	0	0	105.5
12	G	41.6	Very low	57	Low	59 Å²	59	120.6 Å²	120.6	61%	0.608	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-58.3	144.2	-176.7	0	0	0	0	0	111.9	V14	G12-V14 PolarHBondContact O-N 2.8Å
13	V	52.4	Low	59.8	Low	116 Å²	116	114.4 Å²	114.4	70%	0.703	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-61.6	120.8	167.4	179.5	0	0	0	0	106.9	D15 W156	V13-D15 PolarHBondContact O-N 2.81Å; V13-W156 HydrophobicContact CG1-CH2 4.28Å; V13-W156 HydrophobicContact CG1-CZ2 4.26Å
14	V	59.7	Low	62.9	Low	78 Å²	78	114.2 Å²	114.2	47%	0.473	57%	0.565	S	S	.	*			trans	-68.7	105	178.4	176.7	0	0	0	0	107.9	G12 Y16	G12-V14 PolarHBondContact O-N 2.8Å; V14-Y16 HydrophobicContact CB-CE2 4.46Å; V14-Y16 HydrophobicContact CG1-CD1 4.27Å; V14-Y16 HydrophobicContact CG1-CD2 4.34Å; V14-Y16 HydrophobicContact CG1-CE1 3.96Å; V14-Y16 HydrophobicContact CG1-CE2 4.03Å; V14-Y16 HydrophobicContact CG1-CG 4.46Å; V14-Y16 PolarHBondContact O-N 3.29Å; V14-Y16 VanDerWaalsContact O-N 3.08Å
15	D	77.7	Confident	65.9	Low	78 Å²	78	112.9 Å²	112.9	42%	0.417	55%	0.549	S	S	.	.			trans	-81.5	87.5	-179.9	-177.9	15.1	0	0	0	111.2	V13 D17 T18 Q19	V13-D15 PolarHBondContact O-N 2.81Å; D15-D17 PolarHBondContact O-N 3.06Å; D15-D17 WeakPolarHBondContact OD1-CA 3.48Å; D15-D17 VanDerWaalsContact OD1-CB 3.3Å; D15-D17 WeakPolarHBondContact OD1-CB 3.15Å; D15-D17 PolarHBondContact OD1-N 2.83Å; D15-T18 PolarHBondContact O-N 3.38Å; D15-T18 VanDerWaalsContact O-N 3.1Å; D15-T18 PolarHBondContact OD1-N 3.39Å; D15-T18 VanDerWaalsContact OD2-CB 3.22Å; D15-T18 WeakPolarHBondContact OD2-CB 3.16Å; D15-T18 PolarHBondContact OD2-N 3.34Å; D15-T18 PolarHBondContact OD2-OG1 3.27Å; D15-Q19 PolarHBondContact O-N 3.2Å; D15-Q19 VanDerWaalsContact O-N 3.07Å
16	Y	84.1	Confident	68.7	Low	27 Å²	27	107.8 Å²	107.8	11%	0.106	53%	0.528	C	S	.	.	H	α-helix	trans	-61.5	-22.9	172.2	-69.7	-65.6	0	0	0	113.2	V14 T18 I20 L152 W156 Y216	V14-Y16 HydrophobicContact CB-CE2 4.46Å; V14-Y16 HydrophobicContact CG1-CD1 4.27Å; V14-Y16 HydrophobicContact CG1-CD2 4.34Å; V14-Y16 HydrophobicContact CG1-CE1 3.96Å; V14-Y16 HydrophobicContact CG1-CE2 4.03Å; V14-Y16 HydrophobicContact CG1-CG 4.46Å; V14-Y16 PolarHBondContact O-N 3.29Å; V14-Y16 VanDerWaalsContact O-N 3.08Å; Y16-T18 VanDerWaalsContact C-N 3.33Å; Y16-I20 VanDerWaalsContact O-CB 3.28Å; Y16-I20 WeakPolarHBondContact O-CB 3.35Å; Y16-I20 WeakPolarHBondContact O-CD1 3.41Å; Y16-I20 WeakPolarHBondContact O-CG1 3.34Å; Y16-I20 PolarHBondContact O-N 2.82Å; Y16-L152 HydrophobicContact CE1-CD2 4.43Å; Y16-W156 HydrophobicContact CD2-CB 4.43Å; Y16-W156 AromaticContact CD2-CD2 3.73Å; Y16-W156 HydrophobicContact CD2-CD2 3.73Å; Y16-W156 HydrophobicContact CD2-CE3 4.06Å; Y16-W156 AromaticContact CD2-CG 3.87Å; Y16-W156 HydrophobicContact CD2-CG 3.87Å; Y16-W156 HydrophobicContact CE2-CB 4.37Å; Y16-W156 AromaticContact CE2-CD1 3.66Å; Y16-W156 AromaticContact CE2-CD2 3.99Å; Y16-W156 HydrophobicContact CE2-CD2 3.99Å; Y16-W156 AromaticContact CE2-CG 3.74Å; Y16-W156 HydrophobicContact CE2-CG 3.74Å; Y16-W156 AromaticContact CE2-NE1 3.83Å; Y16-Y216 PolarHBondContact OH-OH 2.76Å
17	D	84	Confident	71.5	Confident	58 Å²	58	99.5 Å²	99.5	31%	0.31	49%	0.485	S	S	.	.	H	α-helix	trans	-69.9	-30.4	173	-78.3	-67.5	0	0	0	112.1	D15 K21 Q153 R157	D15-D17 PolarHBondContact O-N 3.06Å; D15-D17 WeakPolarHBondContact OD1-CA 3.48Å; D15-D17 VanDerWaalsContact OD1-CB 3.3Å; D15-D17 WeakPolarHBondContact OD1-CB 3.15Å; D15-D17 PolarHBondContact OD1-N 2.83Å; D17-K21 WeakPolarHBondContact O-CD 3.29Å; D17-K21 WeakPolarHBondContact O-CE 3.41Å; D17-K21 WeakPolarHBondContact O-CG 3.45Å; D17-K21 PolarHBondContact O-NZ 3.16Å; D17-Q153 PolarHBondContact OD1-NE2 2.83Å; D17-Q153 PolarHBondContact OD2-NE2 3.32Å; D17-R157 IonicContact OD1-NH2 3.47Å; D17-R157 PolarHBondContact OD1-NH2 3Å; D17-R157 IonicContact OD2-CZ 3.89Å; D17-R157 IonicContact OD2-NH2 3.5Å; D17-R157 PolarHBondContact OD2-NH2 3.37Å
18	T	88.1	Confident	74.7	Confident	57 Å²	57	93 Å²	93	35%	0.35	47%	0.467	S	S	.	.	H	α-helix	trans	-77	-47.6	171.4	-68.9	0	0	0	0	111.2	D15 Y16 I20 K21 E22	D15-T18 PolarHBondContact O-N 3.38Å; D15-T18 VanDerWaalsContact O-N 3.1Å; D15-T18 PolarHBondContact OD1-N 3.39Å; D15-T18 VanDerWaalsContact OD2-CB 3.22Å; D15-T18 WeakPolarHBondContact OD2-CB 3.16Å; D15-T18 PolarHBondContact OD2-N 3.34Å; D15-T18 PolarHBondContact OD2-OG1 3.27Å; Y16-T18 VanDerWaalsContact C-N 3.33Å; T18-I20 VanDerWaalsContact C-N 3.29Å; T18-I20 PolarHBondContact O-N 3.49Å; T18-K21 WeakPolarHBondContact O-CB 3.21Å; T18-K21 PolarHBondContact O-N 3.32Å; T18-E22 HydrophobicContact CG2-CG 4.41Å; T18-E22 PolarHBondContact O-N 3.09Å
19	Q	88.6	Confident	77.6	Confident	96 Å²	96	87.3 Å²	87.3	45%	0.449	45%	0.446	S	S	.	.	H	α-helix	trans	-59.1	-37.7	179.6	-166.4	-179.1	11.2	0	0	112.7	D15 E22 M23	D15-Q19 PolarHBondContact O-N 3.2Å; D15-Q19 VanDerWaalsContact O-N 3.07Å; Q19-E22 PolarHBondContact O-N 3.33Å; Q19-M23 WeakPolarHBondContact O-CB 3.4Å; Q19-M23 PolarHBondContact O-N 2.88Å
20	I	89.8	Confident	80.5	Confident	10 Å²	10	80.3 Å²	80.3	5%	0.051	41%	0.413	C	S	.	.	H	α-helix	trans	-70.2	-32	176.4	-71	170.3	0	0	0	112	Y16 T18 R24 T149 Q153	Y16-I20 VanDerWaalsContact O-CB 3.28Å; Y16-I20 WeakPolarHBondContact O-CB 3.35Å; Y16-I20 WeakPolarHBondContact O-CD1 3.41Å; Y16-I20 WeakPolarHBondContact O-CG1 3.34Å; Y16-I20 PolarHBondContact O-N 2.82Å; T18-I20 VanDerWaalsContact C-N 3.29Å; T18-I20 PolarHBondContact O-N 3.49Å; I20-R24 WeakPolarHBondContact O-CB 3.47Å; I20-R24 VanDerWaalsContact O-CG 3.24Å; I20-R24 WeakPolarHBondContact O-CG 3.33Å; I20-R24 PolarHBondContact O-N 3.47Å; I20-T149 HydrophobicContact CD1-CG2 3.9Å; I20-T149 HydrophobicContact CG1-CG2 3.65Å; I20-Q153 HydrophobicContact CD1-CB 3.92Å; I20-Q153 HydrophobicContact CD1-CG 4.05Å
21	K	91	Very high	83.5	Confident	121 Å²	121	69.4 Å²	69.4	53%	0.526	37%	0.374	S	S	.	.	H	α-helix	trans	-68.7	-46.4	173.3	-70.1	161.7	-162.8	154.8	0	111	D17 T18 M23 R24 C25	D17-K21 WeakPolarHBondContact O-CD 3.29Å; D17-K21 WeakPolarHBondContact O-CE 3.41Å; D17-K21 WeakPolarHBondContact O-CG 3.45Å; D17-K21 PolarHBondContact O-NZ 3.16Å; T18-K21 WeakPolarHBondContact O-CB 3.21Å; T18-K21 PolarHBondContact O-N 3.32Å; K21-M23 VanDerWaalsContact C-N 3.33Å; K21-M23 PolarHBondContact O-N 3.04Å; K21-R24 WeakPolarHBondContact O-CB 3.13Å; K21-R24 PolarHBondContact O-N 3.15Å; K21-C25 PolarHBondContact O-N 2.7Å; K21-C25 PolarHBondContact O-SG 3.42Å
22	E	91.8	Very high	86.3	Confident	109 Å²	109	69.8 Å²	69.8	51%	0.509	37%	0.367	S	S	.	.	H	α-helix	trans	-57.9	-45.7	176	-69.4	175.5	171.5	0	0	111.3	T18 Q19 R24 C25 Q26	T18-E22 HydrophobicContact CG2-CG 4.41Å; T18-E22 PolarHBondContact O-N 3.09Å; Q19-E22 PolarHBondContact O-N 3.33Å; E22-R24 PolarHBondContact O-N 3.29Å; E22-C25 PolarHBondContact O-N 3.49Å; E22-Q26 WeakPolarHBondContact O-CG 3.33Å; E22-Q26 PolarHBondContact O-N 3.09Å
23	M	93.8	Very high	88.9	Confident	9 Å²	9	71.3 Å²	71.3	4%	0.044	36%	0.364	C	S	.	.	H	α-helix	trans	-61.1	-45.2	174.9	-167.2	-179.9	76.6	0	0	111.8	Q19 K21 C25 Q26 L27 L145 L146 T149 M227	Q19-M23 WeakPolarHBondContact O-CB 3.4Å; Q19-M23 PolarHBondContact O-N 2.88Å; K21-M23 VanDerWaalsContact C-N 3.33Å; K21-M23 PolarHBondContact O-N 3.04Å; M23-C25 VanDerWaalsContact C-N 3.3Å; M23-C25 PolarHBondContact O-N 3.39Å; M23-Q26 PolarHBondContact O-N 2.89Å; M23-L27 HydrophobicContact CE-CD1 4.4Å; M23-L27 HydrophobicContact CG-CD1 4.33Å; M23-L27 HydrophobicContact CG-CG 4.33Å; M23-L27 VanDerWaalsContact O-CG 3.31Å; M23-L27 WeakPolarHBondContact O-CG 3.43Å; M23-L27 PolarHBondContact O-N 3.4Å; M23-L145 HydrophobicContact CE-CD2 4.49Å; M23-L145 HydrophobicContact CE-CG 4.13Å; M23-L145 HydrophobicContact SD-CD2 4.14Å; M23-L145 HydrophobicContact SD-CG 4.25Å; M23-L146 HydrophobicContact CE-CD2 3.63Å; M23-L146 HydrophobicContact CE-CG 4.33Å; M23-T149 HydrophobicContact CE-CG2 4.16Å; M23-M227 HydrophobicContact CG-CE 4.36Å; M23-M227 HydrophobicContact SD-CE 3.91Å; M23-M227 HydrophobicContact SD-SD 4.44Å
24	R	94.3	Very high	91	Very high	120 Å²	120	67.9 Å²	67.9	45%	0.453	34%	0.341	S	S	.	.	H	α-helix	trans	-57.8	-40.7	175.9	-77	170.1	-175.6	-161.2	-1.1	112.6	I20 K21 E22 L28 L146	I20-R24 WeakPolarHBondContact O-CB 3.47Å; I20-R24 VanDerWaalsContact O-CG 3.24Å; I20-R24 WeakPolarHBondContact O-CG 3.33Å; I20-R24 PolarHBondContact O-N 3.47Å; K21-R24 WeakPolarHBondContact O-CB 3.13Å; K21-R24 PolarHBondContact O-N 3.15Å; E22-R24 PolarHBondContact O-N 3.29Å; R24-L28 WeakPolarHBondContact O-CG 3.44Å; R24-L28 PolarHBondContact O-N 2.7Å; R24-L28 VanDerWaalsContact O-N 3.14Å; R24-L146 HydrophobicContact CG-CD1 4.43Å; R24-L146 HydrophobicContact CG-CD2 3.35Å
25	C	96.3	Very high	92.7	Very high	73 Å²	73	67 Å²	67	49%	0.493	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-48.9	174.5	-68.1	0	0	0	0	111.4	K21 E22 M23 L27 L28 D29	K21-C25 PolarHBondContact O-N 2.7Å; K21-C25 PolarHBondContact O-SG 3.42Å; E22-C25 PolarHBondContact O-N 3.49Å; M23-C25 VanDerWaalsContact C-N 3.3Å; M23-C25 PolarHBondContact O-N 3.39Å; C25-L27 VanDerWaalsContact C-N 3.34Å; C25-L27 PolarHBondContact O-N 2.99Å; C25-L28 PolarHBondContact O-N 3.31Å; C25-D29 PolarHBondContact O-N 3.41Å
26	Q	96.4	Very high	93.6	Very high	96 Å²	96	66.4 Å²	66.4	45%	0.449	33%	0.333	S	S	.	.	H	α-helix	trans	-58.8	-42.1	178.1	-69.9	175	10	0	0	112.9	E22 M23 D29 Q30	E22-Q26 WeakPolarHBondContact O-CG 3.33Å; E22-Q26 PolarHBondContact O-N 3.09Å; M23-Q26 PolarHBondContact O-N 2.89Å; Q26-D29 PolarHBondContact O-N 3.39Å; Q26-Q30 VanDerWaalsContact O-CG 3.27Å; Q26-Q30 WeakPolarHBondContact O-CG 3.37Å; Q26-Q30 PolarHBondContact O-N 3.05Å
27	L	97.1	Very high	94.2	Very high	2 Å²	2	68.9 Å²	68.9	1%	0.01	35%	0.346	C	S	.	.	H	α-helix	trans	-64.9	-40.8	178	-66.6	-174.4	0	0	0	112	M23 C25 Q30 L31 Q142 L145 L146 Y230	M23-L27 HydrophobicContact CE-CD1 4.4Å; M23-L27 HydrophobicContact CG-CD1 4.33Å; M23-L27 HydrophobicContact CG-CG 4.33Å; M23-L27 VanDerWaalsContact O-CG 3.31Å; M23-L27 WeakPolarHBondContact O-CG 3.43Å; M23-L27 PolarHBondContact O-N 3.4Å; C25-L27 VanDerWaalsContact C-N 3.34Å; C25-L27 PolarHBondContact O-N 2.99Å; L27-Q30 VanDerWaalsContact CD2-OE1 3.3Å; L27-Q30 PolarHBondContact O-N 3.17Å; L27-L31 PolarHBondContact O-N 2.81Å; L27-Q142 HydrophobicContact CB-CG 4.22Å; L27-Q142 HydrophobicContact CD1-CB 4.07Å; L27-Q142 HydrophobicContact CD1-CG 4.15Å; L27-Q142 HydrophobicContact CD2-CG 4.04Å; L27-Q142 HydrophobicContact CG-CG 4.33Å; L27-Q142 PolarHBondContact O-NE2 2.96Å; L27-Q142 PolarHBondContact O-OE1 3.2Å; L27-L145 HydrophobicContact CD1-CD2 4.37Å; L27-L145 HydrophobicContact CD2-CD2 4.46Å; L27-L146 HydrophobicContact CD1-CD1 4.21Å; L27-L146 HydrophobicContact CD1-CD2 4.2Å; L27-L146 HydrophobicContact CD1-CG 3.95Å; L27-Y230 HydrophobicContact CD2-CD1 4.33Å; L27-Y230 HydrophobicContact CD2-CE1 3.53Å
28	L	96.6	Very high	94.8	Very high	102 Å²	102	67.8 Å²	67.8	53%	0.534	34%	0.34	S	S	.	.	H	α-helix	trans	-66.7	-37	173.5	-71.1	171	0	0	0	112.5	R24 C25 L31 K32	R24-L28 WeakPolarHBondContact O-CG 3.44Å; R24-L28 PolarHBondContact O-N 2.7Å; R24-L28 VanDerWaalsContact O-N 3.14Å; C25-L28 PolarHBondContact O-N 3.31Å; L28-L31 PolarHBondContact O-N 2.87Å; L28-K32 WeakPolarHBondContact O-CG 3.44Å; L28-K32 PolarHBondContact O-N 3.4Å
29	D	97.5	Very high	95.2	Very high	74 Å²	74	71.6 Å²	71.6	40%	0.396	35%	0.353	S	S	.	.	H	α-helix	trans	-71.4	-32.5	178.1	-69.4	-29.7	0	0	0	112.2	C25 Q26 L31 K32 V33	C25-D29 PolarHBondContact O-N 3.41Å; Q26-D29 PolarHBondContact O-N 3.39Å; D29-L31 PolarHBondContact O-N 2.77Å; D29-K32 PolarHBondContact O-N 3.39Å; D29-K32 WeakPolarHBondContact OD1-CE 3.3Å; D29-K32 IonicContact OD1-NZ 3.74Å; D29-K32 PolarHBondContact OD1-NZ 3.35Å; D29-V33 WeakPolarHBondContact O-CG2 3.44Å; D29-V33 PolarHBondContact O-N 3.37Å
30	Q	97.4	Very high	95.6	Very high	36 Å²	36	71.4 Å²	71.4	17%	0.168	35%	0.353	C	S	.	.	H	α-helix	trans	-59	-44.3	170.3	-73.9	162.2	6.8	0	0	112	Q26 L27 K32 V33 L34 Y230 Y231 I235	Q26-Q30 VanDerWaalsContact O-CG 3.27Å; Q26-Q30 WeakPolarHBondContact O-CG 3.37Å; Q26-Q30 PolarHBondContact O-N 3.05Å; L27-Q30 VanDerWaalsContact CD2-OE1 3.3Å; L27-Q30 PolarHBondContact O-N 3.17Å; Q30-K32 PolarHBondContact O-N 3.3Å; Q30-V33 PolarHBondContact O-N 3.23Å; Q30-L34 WeakPolarHBondContact O-CG 3.47Å; Q30-L34 PolarHBondContact O-N 3.1Å; Q30-Y230 PolarHBondContact OE1-OH 2.91Å; Q30-Y231 VanDerWaalsContact NE2-CE1 3.3Å; Q30-I235 HydrophobicContact CG-CD1 4.06Å
31	L	96.6	Very high	96	Very high	26 Å²	26	72.2 Å²	72.2	14%	0.136	36%	0.356	C	S	.	.	H	α-helix	trans	-62.1	-42.4	177.5	-65.8	175.8	0	0	0	111.6	L27 L28 D29 V33 L34 D35 R135 C138	L27-L31 PolarHBondContact O-N 2.81Å; L28-L31 PolarHBondContact O-N 2.87Å; D29-L31 PolarHBondContact O-N 2.77Å; L31-V33 VanDerWaalsContact C-N 3.33Å; L31-V33 PolarHBondContact O-N 3.07Å; L31-L34 PolarHBondContact O-N 3.45Å; L31-D35 PolarHBondContact O-N 2.71Å; L31-R135 HydrophobicContact CD2-CG 4.01Å; L31-C138 HydrophobicContact CD2-CB 4.11Å
32	K	97.3	Very high	96.3	Very high	118 Å²	118	67.5 Å²	67.5	51%	0.513	34%	0.337	S	S	.	.	H	α-helix	trans	-59.9	-41.8	174.9	-62.7	169.7	-162.3	165.4	0	112.2	L28 D29 Q30 L34 D35 V36	L28-K32 WeakPolarHBondContact O-CG 3.44Å; L28-K32 PolarHBondContact O-N 3.4Å; D29-K32 PolarHBondContact O-N 3.39Å; D29-K32 WeakPolarHBondContact OD1-CE 3.3Å; D29-K32 IonicContact OD1-NZ 3.74Å; D29-K32 PolarHBondContact OD1-NZ 3.35Å; Q30-K32 PolarHBondContact O-N 3.3Å; K32-L34 VanDerWaalsContact C-N 3.33Å; K32-D35 PolarHBondContact O-N 3.45Å; K32-V36 WeakPolarHBondContact O-CB 3.37Å; K32-V36 WeakPolarHBondContact O-CG2 3.37Å; K32-V36 PolarHBondContact O-N 3.35Å
33	V	96.8	Very high	96.6	Very high	92 Å²	92	66.8 Å²	66.8	56%	0.558	33%	0.334	S	S	*	.	H	α-helix	trans	-63.5	-40.4	177.2	170.9	0	0	0	0	111	D29 Q30 L31 Q37	D29-V33 WeakPolarHBondContact O-CG2 3.44Å; D29-V33 PolarHBondContact O-N 3.37Å; Q30-V33 PolarHBondContact O-N 3.23Å; L31-V33 VanDerWaalsContact C-N 3.33Å; L31-V33 PolarHBondContact O-N 3.07Å; V33-Q37 WeakPolarHBondContact O-CB 3.38Å; V33-Q37 VanDerWaalsContact O-CG 3.31Å; V33-Q37 WeakPolarHBondContact O-CG 3.35Å; V33-Q37 PolarHBondContact O-N 3.2Å
34	L	95.6	Very high	96.8	Very high	43 Å²	43	71.5 Å²	71.5	23%	0.225	36%	0.356	C	S	.	.	H	α-helix	trans	-66.6	-41.8	176.1	-66.9	173.7	0	0	0	112.6	Q30 L31 K32 Q37 L38 I239	Q30-L34 WeakPolarHBondContact O-CG 3.47Å; Q30-L34 PolarHBondContact O-N 3.1Å; L31-L34 PolarHBondContact O-N 3.45Å; K32-L34 VanDerWaalsContact C-N 3.33Å; L34-Q37 PolarHBondContact O-N 3.04Å; L34-L38 PolarHBondContact O-N 3.32Å; L34-I239 HydrophobicContact CD2-CG1 3.96Å
35	D	96.3	Very high	96.9	Very high	61 Å²	61	65.8 Å²	65.8	33%	0.326	33%	0.334	S	S	.	.	H	α-helix	trans	-63.7	-43.3	175.7	-76.6	-37.5	0	0	0	111.5	L31 K32 Q37 L38 E39 R135	L31-D35 PolarHBondContact O-N 2.71Å; K32-D35 PolarHBondContact O-N 3.45Å; D35-Q37 PolarHBondContact O-N 3.37Å; D35-L38 WeakPolarHBondContact O-CB 3.36Å; D35-L38 PolarHBondContact O-N 3.26Å; D35-E39 PolarHBondContact O-N 3.15Å; D35-R135 WeakPolarHBondContact OD1-CD 3.39Å; D35-R135 IonicContact OD1-CZ 3.02Å; D35-R135 IonicContact OD1-NE 2.89Å; D35-R135 IonicContact OD1-NH1 2.64Å; D35-R135 PolarHBondContact OD1-NH1 3.29Å; D35-R135 IonicContact OD2-NH1 2.68Å
36	V	97.2	Very high	97	Very high	65 Å²	65	66 Å²	66	39%	0.394	33%	0.328	S	S	.	.	H	α-helix	trans	-65.1	-36	175	170.3	0	0	0	0	112.1	K32 L38 E39 Q40	K32-V36 WeakPolarHBondContact O-CB 3.37Å; K32-V36 WeakPolarHBondContact O-CG2 3.37Å; K32-V36 PolarHBondContact O-N 3.35Å; V36-L38 VanDerWaalsContact C-N 3.34Å; V36-E39 PolarHBondContact O-N 2.72Å; V36-Q40 WeakPolarHBondContact O-CG 3.14Å; V36-Q40 PolarHBondContact O-N 3.19Å
37	Q	95.4	Very high	97.1	Very high	78 Å²	78	65.6 Å²	65.6	36%	0.364	33%	0.329	S	S	.	.	H	α-helix	trans	-65.1	-36.8	172.9	-78.3	-62.4	-66.6	0	0	112.3	V33 L34 D35 K41	V33-Q37 WeakPolarHBondContact O-CB 3.38Å; V33-Q37 VanDerWaalsContact O-CG 3.31Å; V33-Q37 WeakPolarHBondContact O-CG 3.35Å; V33-Q37 PolarHBondContact O-N 3.2Å; L34-Q37 PolarHBondContact O-N 3.04Å; D35-Q37 PolarHBondContact O-N 3.37Å; Q37-K41 WeakPolarHBondContact O-CB 3.46Å; Q37-K41 WeakPolarHBondContact O-CD 3.48Å; Q37-K41 WeakPolarHBondContact O-CG 3.34Å; Q37-K41 PolarHBondContact O-N 2.88Å; Q37-K41 VanDerWaalsContact O-N 3.07Å
38	L	96.3	Very high	97.1	Very high	35 Å²	35	66.7 Å²	66.7	18%	0.183	33%	0.334	C	S	.	.	H	α-helix	trans	-68.6	-38.6	174.2	177.1	59.8	0	0	0	112.3	L34 D35 V36 K41 T42 T127 Q128 A131	L34-L38 PolarHBondContact O-N 3.32Å; D35-L38 WeakPolarHBondContact O-CB 3.36Å; D35-L38 PolarHBondContact O-N 3.26Å; V36-L38 VanDerWaalsContact C-N 3.34Å; L38-K41 PolarHBondContact O-N 2.91Å; L38-T42 VanDerWaalsContact O-CB 3.24Å; L38-T42 WeakPolarHBondContact O-CB 3.4Å; L38-T42 PolarHBondContact O-N 3.44Å; L38-T42 PolarHBondContact O-OG1 3.24Å; L38-T127 HydrophobicContact CD1-CG2 4.24Å; L38-Q128 HydrophobicContact CD1-CG 4.17Å; L38-A131 HydrophobicContact CB-CB 4.41Å; L38-A131 HydrophobicContact CD1-CB 3.67Å; L38-A131 HydrophobicContact CD2-CB 3.74Å; L38-A131 HydrophobicContact CG-CB 4.13Å
39	E	97.6	Very high	97.1	Very high	137 Å²	137	62 Å²	62	64%	0.64	31%	0.31	S	S	*	.	H	α-helix	trans	-61.6	-48	174.9	-173.9	173.4	-147.6	0	0	111	D35 V36 K41 T42 Q43	D35-E39 PolarHBondContact O-N 3.15Å; V36-E39 PolarHBondContact O-N 2.72Å; E39-K41 PolarHBondContact O-N 3.21Å; E39-T42 WeakPolarHBondContact O-CB 3.48Å; E39-T42 PolarHBondContact O-N 3.03Å; E39-Q43 PolarHBondContact O-N 2.89Å
40	Q	97.3	Very high	97.1	Very high	93 Å²	93	62.5 Å²	62.5	44%	0.435	31%	0.313	S	S	.	.	H	α-helix	trans	-59.7	-45.7	176	-71.7	174.7	6.5	0	0	112.6	V36 T42 Q43 Q44	V36-Q40 WeakPolarHBondContact O-CG 3.14Å; V36-Q40 PolarHBondContact O-N 3.19Å; Q40-T42 VanDerWaalsContact C-N 3.34Å; Q40-Q43 PolarHBondContact O-N 2.67Å; Q40-Q44 WeakPolarHBondContact O-CB 3.33Å; Q40-Q44 VanDerWaalsContact O-CG 3.27Å; Q40-Q44 WeakPolarHBondContact O-CG 3.43Å; Q40-Q44 PolarHBondContact O-N 2.97Å
41	K	96.8	Very high	97.1	Very high	26 Å²	26	67 Å²	67	11%	0.113	33%	0.329	C	S	.	.	H	α-helix	trans	-66.6	-34.3	176.6	-72.6	165.8	176.6	169.2	0	112.4	Q37 L38 E39 L45 D243 Y246	Q37-K41 WeakPolarHBondContact O-CB 3.46Å; Q37-K41 WeakPolarHBondContact O-CD 3.48Å; Q37-K41 WeakPolarHBondContact O-CG 3.34Å; Q37-K41 PolarHBondContact O-N 2.88Å; Q37-K41 VanDerWaalsContact O-N 3.07Å; L38-K41 PolarHBondContact O-N 2.91Å; E39-K41 PolarHBondContact O-N 3.21Å; K41-L45 VanDerWaalsContact O-CG 3.31Å; K41-L45 WeakPolarHBondContact O-CG 3.16Å; K41-L45 PolarHBondContact O-N 3.25Å; K41-D243 IonicContact NZ-OD1 3.55Å; K41-D243 PolarHBondContact NZ-OD1 3.27Å; K41-D243 IonicContact NZ-OD2 3.11Å; K41-D243 PolarHBondContact NZ-OD2 3.02Å; K41-Y246 HydrophobicContact CB-CE2 4.17Å; K41-Y246 HydrophobicContact CG-CE1 4.39Å; K41-Y246 HydrophobicContact CG-CE2 4.29Å
42	T	97.7	Very high	97.1	Very high	22 Å²	22	66 Å²	66	14%	0.135	32%	0.324	C	S	.	.	H	α-helix	trans	-63.5	-50.6	173.6	-70.4	0	0	0	0	110.8	L38 E39 Q40 L45 Q46 L124 Q128	L38-T42 VanDerWaalsContact O-CB 3.24Å; L38-T42 WeakPolarHBondContact O-CB 3.4Å; L38-T42 PolarHBondContact O-N 3.44Å; L38-T42 PolarHBondContact O-OG1 3.24Å; E39-T42 WeakPolarHBondContact O-CB 3.48Å; E39-T42 PolarHBondContact O-N 3.03Å; Q40-T42 VanDerWaalsContact C-N 3.34Å; T42-L45 PolarHBondContact O-N 2.67Å; T42-Q46 WeakPolarHBondContact O-CG 3.44Å; T42-Q46 PolarHBondContact O-N 3.31Å; T42-Q46 VanDerWaalsContact O-N 3.14Å; T42-L124 HydrophobicContact CG2-CD1 4.01Å; T42-Q128 PolarHBondContact OG1-NE2 3.21Å; T42-Q128 VanDerWaalsContact OG1-NE2 3.11Å
43	Q	98.1	Very high	97.1	Very high	95 Å²	95	65.4 Å²	65.4	44%	0.444	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-47.7	179.2	-170	64.2	57	0	0	111.2	E39 Q40 L45 Q46 D47	E39-Q43 PolarHBondContact O-N 2.89Å; Q40-Q43 PolarHBondContact O-N 2.67Å; Q43-L45 VanDerWaalsContact C-N 3.29Å; Q43-L45 PolarHBondContact O-N 3.47Å; Q43-Q46 WeakPolarHBondContact O-CB 3.37Å; Q43-Q46 PolarHBondContact O-N 2.96Å; Q43-D47 PolarHBondContact NE2-OD1 2.8Å; Q43-D47 WeakPolarHBondContact O-CB 3.43Å; Q43-D47 PolarHBondContact O-N 3.29Å
44	Q	97.5	Very high	97.2	Very high	107 Å²	107	66 Å²	66	50%	0.5	31%	0.311	S	S	.	.	H	α-helix	trans	-56.8	-38.7	178.7	-74.7	171.5	-1.9	0	0	113.4	Q40 M48 Y246	Q40-Q44 WeakPolarHBondContact O-CB 3.33Å; Q40-Q44 VanDerWaalsContact O-CG 3.27Å; Q40-Q44 WeakPolarHBondContact O-CG 3.43Å; Q40-Q44 PolarHBondContact O-N 2.97Å; Q44-M48 WeakPolarHBondContact O-CB 3.28Å; Q44-M48 PolarHBondContact O-N 3.33Å; Q44-Y246 PolarHBondContact OE1-OH 2.71Å; Q44-Y246 VanDerWaalsContact OE1-OH 3.09Å
45	L	97.9	Very high	97.3	Very high	1 Å²	1	68 Å²	68	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-73	-31.7	177.3	-70.2	170.5	0	0	0	112.7	K41 T42 Q43 T49 V120 C123 L124 Y246 L250	K41-L45 VanDerWaalsContact O-CG 3.31Å; K41-L45 WeakPolarHBondContact O-CG 3.16Å; K41-L45 PolarHBondContact O-N 3.25Å; T42-L45 PolarHBondContact O-N 2.67Å; Q43-L45 VanDerWaalsContact C-N 3.29Å; Q43-L45 PolarHBondContact O-N 3.47Å; L45-T49 WeakPolarHBondContact O-CB 3.28Å; L45-T49 PolarHBondContact O-N 3Å; L45-T49 PolarHBondContact O-OG1 3.14Å; L45-V120 HydrophobicContact CB-CG1 4.32Å; L45-V120 HydrophobicContact CD2-CG1 3.85Å; L45-V120 WeakPolarHBondContact O-CG1 3.35Å; L45-C123 HydrophobicContact CD2-CB 4.26Å; L45-L124 HydrophobicContact CB-CB 4.31Å; L45-L124 HydrophobicContact CB-CD1 4.23Å; L45-L124 HydrophobicContact CD1-CB 3.94Å; L45-L124 HydrophobicContact CD1-CD1 3.99Å; L45-Y246 HydrophobicContact CD1-CD2 4.24Å; L45-Y246 HydrophobicContact CD1-CE2 3.84Å; L45-Y246 HydrophobicContact CD2-CE2 4.08Å; L45-Y246 HydrophobicContact CG-CE2 3.96Å; L45-L250 HydrophobicContact CD2-CD1 3.49Å; L45-L250 VanDerWaalsContact CD2-CD1 3.49Å
46	Q	97.9	Very high	97.3	Very high	78 Å²	78	65.1 Å²	65.1	36%	0.364	30%	0.299	S	S	.	.	H	α-helix	trans	-71.8	-51	174	-69.5	173.2	-6.1	0	0	110.8	T42 Q43 M48 T49 D50 L124	T42-Q46 WeakPolarHBondContact O-CG 3.44Å; T42-Q46 PolarHBondContact O-N 3.31Å; T42-Q46 VanDerWaalsContact O-N 3.14Å; Q43-Q46 WeakPolarHBondContact O-CB 3.37Å; Q43-Q46 PolarHBondContact O-N 2.96Å; Q46-M48 VanDerWaalsContact C-N 3.27Å; Q46-M48 PolarHBondContact O-N 3.31Å; Q46-T49 WeakPolarHBondContact O-CA 3.45Å; Q46-T49 WeakPolarHBondContact O-CB 3.45Å; Q46-T49 PolarHBondContact O-N 3.34Å; Q46-D50 PolarHBondContact O-N 3.02Å; Q46-L124 HydrophobicContact CG-CD2 4.09Å
47	D	98.1	Very high	97.4	Very high	86 Å²	86	65.7 Å²	65.7	46%	0.46	30%	0.298	S	S	.	.	H	α-helix	trans	-53.4	-44.9	175.6	-63.9	-17.7	0	0	0	111.4	Q43 T49 D50 Y51	Q43-D47 PolarHBondContact NE2-OD1 2.8Å; Q43-D47 WeakPolarHBondContact O-CB 3.43Å; Q43-D47 PolarHBondContact O-N 3.29Å; D47-T49 VanDerWaalsContact C-N 3.33Å; D47-T49 PolarHBondContact O-N 3.23Å; D47-D50 PolarHBondContact O-N 3.45Å; D47-Y51 VanDerWaalsContact O-CB 3.23Å; D47-Y51 WeakPolarHBondContact O-CB 3.32Å; D47-Y51 PolarHBondContact O-N 3.41Å
48	M	96.9	Very high	97.5	Very high	26 Å²	26	65.5 Å²	65.5	13%	0.128	30%	0.299	C	S	.	.	H	α-helix	trans	-69.3	-31.1	179.4	-162.4	177.2	91.2	0	0	112.6	Q44 Q46 L52 V120 L250 V253 M254	Q44-M48 WeakPolarHBondContact O-CB 3.28Å; Q44-M48 PolarHBondContact O-N 3.33Å; Q46-M48 VanDerWaalsContact C-N 3.27Å; Q46-M48 PolarHBondContact O-N 3.31Å; M48-L52 WeakPolarHBondContact O-CB 3.21Å; M48-L52 VanDerWaalsContact O-CG 3.26Å; M48-L52 WeakPolarHBondContact O-CG 3.42Å; M48-L52 PolarHBondContact O-N 3.17Å; M48-L52 VanDerWaalsContact O-N 3.09Å; M48-V120 HydrophobicContact CE-CB 4.27Å; M48-V120 HydrophobicContact CE-CG1 3.84Å; M48-V120 HydrophobicContact CE-CG2 3.32Å; M48-L250 HydrophobicContact CE-CD1 3.5Å; M48-L250 VanDerWaalsContact CE-CD1 3.5Å; M48-L250 HydrophobicContact CE-CG 4.08Å; M48-L250 HydrophobicContact SD-CD1 3.97Å; M48-L250 HydrophobicContact SD-CG 4.2Å; M48-V253 HydrophobicContact CE-CG1 4.17Å; M48-M254 HydrophobicContact CE-CE 4.06Å; M48-M254 HydrophobicContact CG-CE 3.99Å; M48-M254 HydrophobicContact SD-CE 3.25Å; M48-M254 WeakPolarHBondContact SD-CE 3.44Å
49	T	97.3	Very high	97.6	Very high	4 Å²	4	64 Å²	64	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-70.4	-45	174.6	-65.7	0	0	0	0	111.2	L45 Q46 D47 L52 R53 I117 V120 M121	L45-T49 WeakPolarHBondContact O-CB 3.28Å; L45-T49 PolarHBondContact O-N 3Å; L45-T49 PolarHBondContact O-OG1 3.14Å; Q46-T49 WeakPolarHBondContact O-CA 3.45Å; Q46-T49 WeakPolarHBondContact O-CB 3.45Å; Q46-T49 PolarHBondContact O-N 3.34Å; D47-T49 VanDerWaalsContact C-N 3.33Å; D47-T49 PolarHBondContact O-N 3.23Å; T49-L52 PolarHBondContact O-N 2.92Å; T49-R53 PolarHBondContact O-N 3.49Å; T49-I117 HydrophobicContact CG2-CD1 4.27Å; T49-I117 HydrophobicContact CG2-CG1 4.17Å; T49-I117 HydrophobicContact CG2-CG2 3.79Å; T49-I117 WeakPolarHBondContact O-CD1 3.49Å; T49-V120 VanDerWaalsContact OG1-CG1 3.27Å; T49-V120 WeakPolarHBondContact OG1-CG1 3.43Å; T49-M121 HydrophobicContact CG2-CG 4.46Å; T49-M121 HydrophobicContact CG2-SD 3.95Å
50	D	97.2	Very high	97.6	Very high	84 Å²	84	60.1 Å²	60.1	45%	0.449	27%	0.274	S	S	.	.	H	α-helix	trans	-71.5	-36.2	179.5	-71.8	-8.6	0	0	0	111.8	Q46 D47 R53 R54	Q46-D50 PolarHBondContact O-N 3.02Å; D47-D50 PolarHBondContact O-N 3.45Å; D50-R53 PolarHBondContact O-N 3.2Å; D50-R53 IonicContact OD1-CZ 2.75Å; D50-R53 IonicContact OD1-NH1 3.62Å; D50-R53 PolarHBondContact OD1-NH1 2.99Å; D50-R53 IonicContact OD1-NH2 3.73Å; D50-R53 PolarHBondContact OD1-NH2 3.09Å; D50-R54 PolarHBondContact O-N 3.15Å
51	Y	97.4	Very high	97.6	Very high	131 Å²	131	59.7 Å²	59.7	51%	0.514	27%	0.272	S	S	.	.	H	α-helix	trans	-58.5	-48.7	169.1	173.7	-93.4	0	0	0	112	D47 R53 R54 R55	D47-Y51 VanDerWaalsContact O-CB 3.23Å; D47-Y51 WeakPolarHBondContact O-CB 3.32Å; D47-Y51 PolarHBondContact O-N 3.41Å; Y51-R53 VanDerWaalsContact C-N 3.29Å; Y51-R53 PolarHBondContact O-N 2.95Å; Y51-R54 PolarHBondContact O-N 3.47Å; Y51-R55 VanDerWaalsContact O-CB 3.3Å; Y51-R55 WeakPolarHBondContact O-CB 3.46Å; Y51-R55 PolarHBondContact O-N 3.15Å
52	L	97.3	Very high	97.7	Very high	4 Å²	4	63.3 Å²	63.3	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-61.8	-37.8	178	-78.2	169	0	0	0	111.6	M48 T49 G56 C112 L116 I117 V120 Y257	M48-L52 WeakPolarHBondContact O-CB 3.21Å; M48-L52 VanDerWaalsContact O-CG 3.26Å; M48-L52 WeakPolarHBondContact O-CG 3.42Å; M48-L52 PolarHBondContact O-N 3.17Å; M48-L52 VanDerWaalsContact O-N 3.09Å; T49-L52 PolarHBondContact O-N 2.92Å; L52-G56 PolarHBondContact O-N 3.14Å; L52-C112 HydrophobicContact CD2-CB 4.42Å; L52-C112 WeakPolarHBondContact O-CB 3.46Å; L52-L116 HydrophobicContact CD1-CB 3.99Å; L52-L116 HydrophobicContact CD2-CB 4.28Å; L52-L116 HydrophobicContact CD2-CD1 4.15Å; L52-I117 HydrophobicContact CB-CD1 4.12Å; L52-I117 HydrophobicContact CB-CG1 3.77Å; L52-I117 HydrophobicContact CD1-CG1 4.28Å; L52-V120 HydrophobicContact CD1-CG2 4.41Å; L52-Y257 HydrophobicContact CD2-CD2 4.21Å; L52-Y257 HydrophobicContact CD2-CE2 4.47Å
53	R	97.4	Very high	97.7	Very high	105 Å²	105	62.5 Å²	62.5	40%	0.396	28%	0.281	S	S	.	.	H	α-helix	trans	-64.4	-54.1	176.5	-162.9	-173.4	-51.9	108	12	111.1	T49 D50 Y51 R55 G56 E57 I117	T49-R53 PolarHBondContact O-N 3.49Å; D50-R53 PolarHBondContact O-N 3.2Å; D50-R53 IonicContact OD1-CZ 2.75Å; D50-R53 IonicContact OD1-NH1 3.62Å; D50-R53 PolarHBondContact OD1-NH1 2.99Å; D50-R53 IonicContact OD1-NH2 3.73Å; D50-R53 PolarHBondContact OD1-NH2 3.09Å; Y51-R53 VanDerWaalsContact C-N 3.29Å; Y51-R53 PolarHBondContact O-N 2.95Å; R53-R55 VanDerWaalsContact C-N 3.3Å; R53-R55 PolarHBondContact O-N 2.83Å; R53-G56 PolarHBondContact O-N 3.1Å; R53-G56 VanDerWaalsContact O-N 3.09Å; R53-E57 PolarHBondContact O-N 3.42Å; R53-I117 HydrophobicContact CB-CD1 3.86Å; R53-I117 HydrophobicContact CG-CD1 4.48Å
54	R	97.8	Very high	97.7	Very high	106 Å²	106	63.7 Å²	63.7	40%	0.4	28%	0.282	S	S	.	.	H	α-helix	trans	-67.2	-30.6	-179.1	-175	57	-165.8	151.1	12.1	112.3	D50 Y51 E57 I58 E61	D50-R54 PolarHBondContact O-N 3.15Å; Y51-R54 PolarHBondContact O-N 3.47Å; R54-E57 WeakPolarHBondContact CD-OE2 3.5Å; R54-E57 IonicContact CZ-OE2 2.67Å; R54-E57 IonicContact NE-OE2 3.85Å; R54-E57 IonicContact NH1-OE2 3.55Å; R54-E57 PolarHBondContact NH1-OE2 3.16Å; R54-I58 HydrophobicContact CG-CD1 4.17Å; R54-I58 WeakPolarHBondContact O-CD1 3.41Å; R54-I58 VanDerWaalsContact O-CG1 3.3Å; R54-I58 WeakPolarHBondContact O-CG1 3.34Å; R54-I58 PolarHBondContact O-N 3Å; R54-E61 IonicContact CZ-OE1 2.84Å; R54-E61 IonicContact NH1-OE1 2.66Å; R54-E61 PolarHBondContact NH1-OE1 2.85Å; R54-E61 IonicContact NH2-OE1 2.78Å; R54-E61 PolarHBondContact NH2-OE1 3.18Å; R54-E61 IonicContact NH2-OE2 3.06Å; R54-E61 PolarHBondContact NH2-OE2 3Å
55	R	97.3	Very high	97.8	Very high	84 Å²	84	62 Å²	62	32%	0.317	28%	0.282	S	S	.	.	H	α-helix	trans	-62	-48.3	169.9	-175.2	66.9	-168.3	-165.9	8.8	110.5	Y51 R53 E57 I58 E59	Y51-R55 VanDerWaalsContact O-CB 3.3Å; Y51-R55 WeakPolarHBondContact O-CB 3.46Å; Y51-R55 PolarHBondContact O-N 3.15Å; R53-R55 VanDerWaalsContact C-N 3.3Å; R53-R55 PolarHBondContact O-N 2.83Å; R55-E57 VanDerWaalsContact C-N 3.33Å; R55-E57 PolarHBondContact O-N 2.82Å; R55-I58 PolarHBondContact O-N 3.01Å; R55-I58 VanDerWaalsContact O-N 3.14Å; R55-E59 HydrophobicContact CG-CG 4.43Å; R55-E59 IonicContact CZ-OE1 2.68Å; R55-E59 IonicContact NE-OE1 2.72Å; R55-E59 PolarHBondContact NE-OE1 3.06Å; R55-E59 IonicContact NH2-OE1 3.85Å; R55-E59 PolarHBondContact NH2-OE1 3.03Å; R55-E59 IonicContact NH2-OE2 2.85Å; R55-E59 WeakPolarHBondContact O-CG 3.43Å; R55-E59 PolarHBondContact O-N 3.21Å
56	G	97.6	Very high	97.8	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-57.1	-42.8	177.7	0	0	0	0	0	113.4	L52 R53 I58 E59 N60 S109	L52-G56 PolarHBondContact O-N 3.14Å; R53-G56 PolarHBondContact O-N 3.1Å; R53-G56 VanDerWaalsContact O-N 3.09Å; G56-I58 PolarHBondContact O-N 3.18Å; G56-E59 PolarHBondContact O-N 3.44Å; G56-N60 WeakPolarHBondContact O-CB 3.47Å; G56-N60 PolarHBondContact O-N 3.44Å; G56-S109 WeakPolarHBondContact O-CB 3.41Å
57	E	97.9	Very high	97.8	Very high	77 Å²	77	62.1 Å²	62.1	36%	0.36	28%	0.283	S	S	.	.	H	α-helix	trans	-58.1	-44.9	174.2	-67.5	165.4	-158.7	0	0	112.6	R53 R54 R55 N60 E61	R53-E57 PolarHBondContact O-N 3.42Å; R54-E57 WeakPolarHBondContact CD-OE2 3.5Å; R54-E57 IonicContact CZ-OE2 2.67Å; R54-E57 IonicContact NE-OE2 3.85Å; R54-E57 IonicContact NH1-OE2 3.55Å; R54-E57 PolarHBondContact NH1-OE2 3.16Å; R55-E57 VanDerWaalsContact C-N 3.33Å; R55-E57 PolarHBondContact O-N 2.82Å; E57-N60 WeakPolarHBondContact O-CB 3.49Å; E57-N60 PolarHBondContact O-N 3.38Å; E57-E61 WeakPolarHBondContact O-CG 3.49Å; E57-E61 PolarHBondContact O-N 3.48Å
58	I	98.3	Very high	97.8	Very high	74 Å²	74	64.6 Å²	64.6	38%	0.379	29%	0.29	S	S	.	.	H	α-helix	trans	-66.1	-44.3	179.8	-67.5	164.7	0	0	0	111.5	R54 R55 G56 N60 E61 Y62	R54-I58 HydrophobicContact CG-CD1 4.17Å; R54-I58 WeakPolarHBondContact O-CD1 3.41Å; R54-I58 VanDerWaalsContact O-CG1 3.3Å; R54-I58 WeakPolarHBondContact O-CG1 3.34Å; R54-I58 PolarHBondContact O-N 3Å; R55-I58 PolarHBondContact O-N 3.01Å; R55-I58 VanDerWaalsContact O-N 3.14Å; G56-I58 PolarHBondContact O-N 3.18Å; I58-N60 PolarHBondContact O-N 3.35Å; I58-E61 PolarHBondContact O-N 3.5Å; I58-Y62 PolarHBondContact O-N 2.98Å
59	E	97.6	Very high	97.8	Very high	5 Å²	5	67.3 Å²	67.3	2%	0.023	30%	0.304	C	S	.	.	H	α-helix	trans	-59.9	-37.7	175.7	-58	-69.5	-173.2	0	0	111	R55 G56 Y62 S63 H105 L108	R55-E59 HydrophobicContact CG-CG 4.43Å; R55-E59 IonicContact CZ-OE1 2.68Å; R55-E59 IonicContact NE-OE1 2.72Å; R55-E59 PolarHBondContact NE-OE1 3.06Å; R55-E59 IonicContact NH2-OE1 3.85Å; R55-E59 PolarHBondContact NH2-OE1 3.03Å; R55-E59 IonicContact NH2-OE2 2.85Å; R55-E59 WeakPolarHBondContact O-CG 3.43Å; R55-E59 PolarHBondContact O-N 3.21Å; G56-E59 PolarHBondContact O-N 3.44Å; E59-Y62 PolarHBondContact O-N 3.4Å; E59-S63 VanDerWaalsContact O-CB 3.27Å; E59-S63 WeakPolarHBondContact O-CB 3.37Å; E59-S63 PolarHBondContact O-N 3.48Å; E59-H105 IonicContact OE2-CE1 3.97Å; E59-H105 PolarHBondContact OE2-CE1 2.8Å; E59-H105 IonicContact OE2-CG 2.6Å; E59-H105 IonicContact OE2-ND1 2.64Å; E59-H105 PolarHBondContact OE2-ND1 2.93Å; E59-L108 HydrophobicContact CB-CB 4.49Å; E59-L108 HydrophobicContact CG-CB 4.2Å
60	N	98	Very high	97.8	Very high	55 Å²	55	67.1 Å²	67.1	29%	0.294	30%	0.303	S	S	.	.	H	α-helix	trans	-71	-38.6	176.7	-169.9	2.8	0	0	0	112.5	G56 E57 I58 Y62 R64	G56-N60 WeakPolarHBondContact O-CB 3.47Å; G56-N60 PolarHBondContact O-N 3.44Å; E57-N60 WeakPolarHBondContact O-CB 3.49Å; E57-N60 PolarHBondContact O-N 3.38Å; I58-N60 PolarHBondContact O-N 3.35Å; N60-Y62 VanDerWaalsContact C-N 3.34Å; N60-R64 WeakPolarHBondContact O-CB 3.32Å; N60-R64 WeakPolarHBondContact O-CG 3.15Å; N60-R64 PolarHBondContact O-N 3.43Å; N60-R64 VanDerWaalsContact O-N 3.09Å; N60-R64 PolarHBondContact O-NE 3.05Å; N60-R64 PolarHBondContact O-NH2 3.26Å; N60-R64 WeakPolarHBondContact OD1-CD 3.38Å; N60-R64 PolarHBondContact OD1-NE 3.07Å
61	E	98.4	Very high	97.7	Very high	83 Å²	83	67.9 Å²	67.9	39%	0.388	30%	0.304	S	S	.	.	H	α-helix	trans	-61	-41.6	172.4	-73.6	165.1	-160	0	0	111.2	R54 E57 I58 R64 S65	R54-E61 IonicContact CZ-OE1 2.84Å; R54-E61 IonicContact NH1-OE1 2.66Å; R54-E61 PolarHBondContact NH1-OE1 2.85Å; R54-E61 IonicContact NH2-OE1 2.78Å; R54-E61 PolarHBondContact NH2-OE1 3.18Å; R54-E61 IonicContact NH2-OE2 3.06Å; R54-E61 PolarHBondContact NH2-OE2 3Å; E57-E61 WeakPolarHBondContact O-CG 3.49Å; E57-E61 PolarHBondContact O-N 3.48Å; I58-E61 PolarHBondContact O-N 3.5Å; E61-R64 VanDerWaalsContact CA-NH2 3.35Å; E61-R64 VanDerWaalsContact CG-NH2 3.31Å; E61-S65 PolarHBondContact O-N 3.13Å; E61-S65 PolarHBondContact O-OG 3.33Å
62	Y	98.4	Very high	97.6	Very high	102 Å²	102	69.2 Å²	69.2	40%	0.4	31%	0.308	S	S	.	.	H	α-helix	trans	-69.2	-50.9	176.4	-172.7	-123	0	0	0	112.5	I58 E59 N60 R64 S65 L66 E101 H105	I58-Y62 PolarHBondContact O-N 2.98Å; E59-Y62 PolarHBondContact O-N 3.4Å; N60-Y62 VanDerWaalsContact C-N 3.34Å; Y62-R64 PolarHBondContact O-N 3.3Å; Y62-S65 WeakPolarHBondContact O-CA 3.49Å; Y62-S65 VanDerWaalsContact O-CB 3.32Å; Y62-S65 WeakPolarHBondContact O-CB 3.31Å; Y62-S65 PolarHBondContact O-N 2.95Å; Y62-L66 HydrophobicContact CD1-CD1 4.04Å; Y62-L66 HydrophobicContact CE1-CD1 3.62Å; Y62-L66 HydrophobicContact CE1-CG 4.23Å; Y62-L66 HydrophobicContact CE2-CD2 4.16Å; Y62-L66 HydrophobicContact CE2-CG 4.26Å; Y62-L66 PolarHBondContact O-N 3.14Å; Y62-E101 PolarHBondContact OH-OE1 2.86Å; Y62-H105 HydrophobicContact CD1-CB 4.43Å; Y62-H105 AromaticContact CD1-CD2 3.9Å; Y62-H105 AromaticContact CD1-CE1 3.85Å; Y62-H105 AromaticContact CD1-CG 3.77Å; Y62-H105 AromaticContact CD1-ND1 3.74Å; Y62-H105 AromaticContact CD1-NE2 3.96Å; Y62-H105 AromaticContact CE1-CD2 3.89Å; Y62-H105 AromaticContact CE1-CE1 3.94Å; Y62-H105 AromaticContact CE1-NE2 3.7Å
63	S	98.3	Very high	97.4	Very high	6 Å²	6	71.8 Å²	71.8	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-49.9	-53.3	175.4	168.6	0	0	0	0	112.5	E59 S65 L66 E67 S102 S106	E59-S63 VanDerWaalsContact O-CB 3.27Å; E59-S63 WeakPolarHBondContact O-CB 3.37Å; E59-S63 PolarHBondContact O-N 3.48Å; S63-S65 PolarHBondContact O-N 3.23Å; S63-S65 VanDerWaalsContact O-N 3.13Å; S63-L66 PolarHBondContact O-N 2.98Å; S63-L66 VanDerWaalsContact O-N 3.16Å; S63-E67 PolarHBondContact O-N 3.13Å; S63-S102 WeakPolarHBondContact CB-O 3.37Å; S63-S102 PolarHBondContact OG-O 3.3Å; S63-S106 WeakPolarHBondContact OG-CB 3.07Å
64	R	98.3	Very high	97	Very high	120 Å²	120	68 Å²	68	45%	0.453	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-18.2	177.9	-73.3	175	-69.9	148	0	113.9	N60 E61 Y62 K68	N60-R64 WeakPolarHBondContact O-CB 3.32Å; N60-R64 WeakPolarHBondContact O-CG 3.15Å; N60-R64 PolarHBondContact O-N 3.43Å; N60-R64 VanDerWaalsContact O-N 3.09Å; N60-R64 PolarHBondContact O-NE 3.05Å; N60-R64 PolarHBondContact O-NH2 3.26Å; N60-R64 WeakPolarHBondContact OD1-CD 3.38Å; N60-R64 PolarHBondContact OD1-NE 3.07Å; E61-R64 VanDerWaalsContact CA-NH2 3.35Å; E61-R64 VanDerWaalsContact CG-NH2 3.31Å; Y62-R64 PolarHBondContact O-N 3.3Å; R64-K68 VanDerWaalsContact O-CD 3.28Å; R64-K68 WeakPolarHBondContact O-CD 3.41Å; R64-K68 VanDerWaalsContact O-CG 3.23Å; R64-K68 WeakPolarHBondContact O-CG 3.25Å
65	S	98.5	Very high	96.6	Very high	72 Å²	72	69.5 Å²	69.5	50%	0.503	33%	0.325	S	S	.	.	H	α-helix	trans	-84.8	-39.8	175.4	-58.9	0	0	0	0	111.4	E61 Y62 S63 L69	E61-S65 PolarHBondContact O-N 3.13Å; E61-S65 PolarHBondContact O-OG 3.33Å; Y62-S65 WeakPolarHBondContact O-CA 3.49Å; Y62-S65 VanDerWaalsContact O-CB 3.32Å; Y62-S65 WeakPolarHBondContact O-CB 3.31Å; Y62-S65 PolarHBondContact O-N 2.95Å; S63-S65 PolarHBondContact O-N 3.23Å; S63-S65 VanDerWaalsContact O-N 3.13Å; S65-L69 PolarHBondContact O-N 3.01Å; S65-L69 VanDerWaalsContact O-N 3.1Å
66	L	98.3	Very high	96.1	Very high	17 Å²	17	72.7 Å²	72.7	9%	0.089	34%	0.337	C	S	.	.	H	α-helix	trans	-64.1	-43.5	172.9	-66.7	-179.2	0	0	0	112.2	Y62 S63 K68 L69 A70 T98 E101	Y62-L66 HydrophobicContact CD1-CD1 4.04Å; Y62-L66 HydrophobicContact CE1-CD1 3.62Å; Y62-L66 HydrophobicContact CE1-CG 4.23Å; Y62-L66 HydrophobicContact CE2-CD2 4.16Å; Y62-L66 HydrophobicContact CE2-CG 4.26Å; Y62-L66 PolarHBondContact O-N 3.14Å; S63-L66 PolarHBondContact O-N 2.98Å; S63-L66 VanDerWaalsContact O-N 3.16Å; L66-K68 PolarHBondContact O-N 3.43Å; L66-L69 WeakPolarHBondContact O-CB 3.34Å; L66-L69 PolarHBondContact O-N 2.83Å; L66-A70 PolarHBondContact O-N 3.03Å; L66-T98 HydrophobicContact CB-CG2 4.18Å; L66-T98 HydrophobicContact CD2-CG2 4.15Å; L66-E101 HydrophobicContact CD1-CB 4Å; L66-E101 HydrophobicContact CD1-CG 3.66Å
67	E	97.8	Very high	95.4	Very high	64 Å²	64	76.4 Å²	76.4	30%	0.299	36%	0.356	S	S	.	.	H	α-helix	trans	-62.2	-46.2	179.3	-162.4	57.3	-136.4	0	0	111.5	S63 L69 A70 E71 R99 S102	S63-E67 PolarHBondContact O-N 3.13Å; E67-L69 VanDerWaalsContact C-N 3.26Å; E67-L69 PolarHBondContact O-N 2.98Å; E67-A70 PolarHBondContact O-N 2.9Å; E67-E71 VanDerWaalsContact O-CB 3.27Å; E67-E71 WeakPolarHBondContact O-CB 3.39Å; E67-E71 PolarHBondContact O-N 3.13Å; E67-R99 IonicContact OE1-NE 3.67Å; E67-R99 PolarHBondContact OE1-NE 2.87Å; E67-S102 WeakPolarHBondContact CB-OG 3.5Å; E67-S102 WeakPolarHBondContact OE2-CB 3.11Å; E67-S102 PolarHBondContact OE2-OG 2.98Å
68	K	97.8	Very high	93.9	Very high	138 Å²	138	82.5 Å²	82.5	60%	0.6	38%	0.382	S	S	*	.	H	α-helix	trans	-60.9	-34.5	176.2	-72.6	173.6	-173.7	176.6	0	112.5	R64 L66 R72	R64-K68 VanDerWaalsContact O-CD 3.28Å; R64-K68 WeakPolarHBondContact O-CD 3.41Å; R64-K68 VanDerWaalsContact O-CG 3.23Å; R64-K68 WeakPolarHBondContact O-CG 3.25Å; L66-K68 PolarHBondContact O-N 3.43Å; K68-R72 WeakPolarHBondContact O-CB 3.25Å; K68-R72 PolarHBondContact O-N 2.71Å
69	L	97.8	Very high	92.2	Very high	83 Å²	83	86.7 Å²	86.7	44%	0.435	39%	0.393	S	S	.	.	H	α-helix	trans	-64.5	-53.1	174.9	177.9	62.7	0	0	0	110.4	S65 L66 E67 R72 F73 T98	S65-L69 PolarHBondContact O-N 3.01Å; S65-L69 VanDerWaalsContact O-N 3.1Å; L66-L69 WeakPolarHBondContact O-CB 3.34Å; L66-L69 PolarHBondContact O-N 2.83Å; E67-L69 VanDerWaalsContact C-N 3.26Å; E67-L69 PolarHBondContact O-N 2.98Å; L69-R72 PolarHBondContact O-N 3.15Å; L69-F73 HydrophobicContact CD1-CD2 4.03Å; L69-F73 HydrophobicContact CD1-CE2 3.8Å; L69-F73 WeakPolarHBondContact O-CD2 3.49Å; L69-F73 PolarHBondContact O-N 3.04Å; L69-T98 HydrophobicContact CD2-CG2 4.31Å
70	A	96.3	Very high	90.3	Very high	0 Å²	0	96.9 Å²	96.9	0%	0	44%	0.437	C	S	.	.	H	α-helix	trans	-64.6	-42.3	-179.7	0	0	0	0	0	113	L66 E67 F73 A74 T98 R99	L66-A70 PolarHBondContact O-N 3.03Å; E67-A70 PolarHBondContact O-N 2.9Å; A70-F73 PolarHBondContact O-N 3.13Å; A70-A74 WeakPolarHBondContact O-CB 3.34Å; A70-A74 PolarHBondContact O-N 3.39Å; A70-T98 HydrophobicContact CB-CG2 4.13Å; A70-R99 HydrophobicContact CB-CG 3.59Å
71	E	94.9	Very high	88.4	Confident	99 Å²	99	101.9 Å²	101.9	46%	0.463	46%	0.458	S	S	.	.	H	α-helix	trans	-61.5	-48.8	176.8	-176.7	179.6	-140.8	0	0	111.8	E67 F73 A74 L75	E67-E71 VanDerWaalsContact O-CB 3.27Å; E67-E71 WeakPolarHBondContact O-CB 3.39Å; E67-E71 PolarHBondContact O-N 3.13Å; E71-F73 PolarHBondContact O-N 2.85Å; E71-F73 VanDerWaalsContact O-N 3.13Å; E71-A74 PolarHBondContact O-N 3.29Å; E71-A74 VanDerWaalsContact O-N 3.14Å; E71-L75 HydrophobicContact CG-CD1 3.9Å; E71-L75 HydrophobicContact CG-CG 4.23Å; E71-L75 WeakPolarHBondContact O-CG 3.22Å; E71-L75 PolarHBondContact O-N 3.12Å
72	R	95.1	Very high	86.8	Confident	159 Å²	159	102.8 Å²	102.8	60%	0.6	47%	0.472	S	S	*	.	H	α-helix	trans	-55.6	-32.8	179.2	-177.6	-176.9	-171.6	-158.3	4.3	113	K68 L69	K68-R72 WeakPolarHBondContact O-CB 3.25Å; K68-R72 PolarHBondContact O-N 2.71Å; L69-R72 PolarHBondContact O-N 3.15Å
73	F	93.6	Very high	85.4	Confident	59 Å²	59	99.3 Å²	99.3	26%	0.259	46%	0.462	S	S	.	.	H	α-helix	trans	-88.4	-36.3	177.2	-80.9	-72.3	0	0	0	113.2	L69 A70 E71 L75 R76 W91 L95	L69-F73 HydrophobicContact CD1-CD2 4.03Å; L69-F73 HydrophobicContact CD1-CE2 3.8Å; L69-F73 WeakPolarHBondContact O-CD2 3.49Å; L69-F73 PolarHBondContact O-N 3.04Å; A70-F73 PolarHBondContact O-N 3.13Å; E71-F73 PolarHBondContact O-N 2.85Å; E71-F73 VanDerWaalsContact O-N 3.13Å; F73-L75 VanDerWaalsContact C-N 3.35Å; F73-L75 PolarHBondContact O-N 2.73Å; F73-R76 WeakPolarHBondContact O-CB 3.4Å; F73-R76 PolarHBondContact O-N 3.43Å; F73-R76 VanDerWaalsContact O-N 3.15Å; F73-W91 HydrophobicContact CB-CH2 4.4Å; F73-W91 HydrophobicContact CB-CZ2 3.84Å; F73-W91 AromaticContact CD1-CH2 3.92Å; F73-W91 HydrophobicContact CD1-CH2 3.92Å; F73-W91 AromaticContact CD1-CZ2 3.63Å; F73-W91 HydrophobicContact CD1-CZ2 3.63Å; F73-W91 HydrophobicContact CE1-CH2 4.3Å; F73-W91 HydrophobicContact CE1-CZ2 4.36Å; F73-W91 HydrophobicContact CG-CH2 4.05Å; F73-W91 AromaticContact CG-CZ2 3.84Å; F73-W91 HydrophobicContact CG-CZ2 3.84Å; F73-L95 HydrophobicContact CB-CD1 4.18Å; F73-L95 HydrophobicContact CB-CD2 3.71Å
74	A	89.6	Confident	84.3	Confident	24 Å²	24	102 Å²	102	20%	0.198	48%	0.481	C	S	.	.	H	α-helix	trans	-61.7	-40.3	174.1	0	0	0	0	0	112.4	A70 E71 R76 I77 R99	A70-A74 WeakPolarHBondContact O-CB 3.34Å; A70-A74 PolarHBondContact O-N 3.39Å; E71-A74 PolarHBondContact O-N 3.29Å; E71-A74 VanDerWaalsContact O-N 3.14Å; A74-R76 PolarHBondContact O-N 3.14Å; A74-I77 WeakPolarHBondContact O-CB 3.32Å; A74-I77 PolarHBondContact O-N 3.27Å; A74-R99 VanDerWaalsContact CB-NH2 3.28Å
75	L	88.3	Confident	83.9	Confident	138 Å²	138	98.4 Å²	98.4	72%	0.723	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-12.1	176.4	-70.5	172.5	0	0	0	114.2	E71 F73	E71-L75 HydrophobicContact CG-CD1 3.9Å; E71-L75 HydrophobicContact CG-CG 4.23Å; E71-L75 WeakPolarHBondContact O-CG 3.22Å; E71-L75 PolarHBondContact O-N 3.12Å; F73-L75 VanDerWaalsContact C-N 3.35Å; F73-L75 PolarHBondContact O-N 2.73Å
76	R	88.3	Confident	83.7	Confident	151 Å²	151	95.1 Å²	95.1	57%	0.57	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-10.6	175.1	-65.1	172.3	167.5	-168.8	-10.1	113.1	F73 A74 K78	F73-R76 WeakPolarHBondContact O-CB 3.4Å; F73-R76 PolarHBondContact O-N 3.43Å; F73-R76 VanDerWaalsContact O-N 3.15Å; A74-R76 PolarHBondContact O-N 3.14Å; R76-K78 PolarHBondContact O-N 3.15Å; R76-K78 VanDerWaalsContact O-N 3.08Å
77	I	82.8	Confident	83.5	Confident	79 Å²	79	98.9 Å²	98.9	41%	0.405	47%	0.47	S	S	.	.			trans	-80.7	90.2	-178.3	-54.8	179.4	0	0	0	108.5	A74 R79 L92 L95	A74-I77 WeakPolarHBondContact O-CB 3.32Å; A74-I77 PolarHBondContact O-N 3.27Å; I77-R79 PolarHBondContact O-N 3.23Å; I77-L92 HydrophobicContact CD1-CD2 3.76Å; I77-L95 HydrophobicContact CD1-CD1 4.28Å
78	K	65.1	Low	83.1	Confident	205 Å²	205	97.6 Å²	97.6	89%	0.891	47%	0.468	S	S	*	.			trans	-75.8	-16	-171.9	-67.5	-175.7	178.3	-178	0	115.5	R76	R76-K78 PolarHBondContact O-N 3.15Å; R76-K78 VanDerWaalsContact O-N 3.08Å
79	R	63.9	Low	82.9	Confident	162 Å²	162	94.7 Å²	94.7	61%	0.611	46%	0.456	S	S	*	.			trans	-83.9	135.4	-179.5	-69.1	-171.3	177.7	-166.2	0.1	110	I77 E81	I77-R79 PolarHBondContact O-N 3.23Å; R79-E81 VanDerWaalsContact C-N 3.33Å
80	K	56.2	Low	82.8	Confident	218 Å²	218	92.1 Å²	92.1	95%	0.948	44%	0.444	S	S	*	.	S	Bend	trans	-69.7	-30.3	172.6	-88.1	-172.7	172.5	-178	0	112.8
81	E	59.3	Low	82.7	Confident	160 Å²	160	96.9 Å²	96.9	75%	0.748	46%	0.462	S	S	*	.	S	Bend	trans	-95.5	136.2	177.1	-64.6	-174.3	149.3	0	0	110.3	R79 S83	R79-E81 VanDerWaalsContact C-N 3.33Å; E81-S83 PolarHBondContact O-N 3.41Å
82	P	63.9	Low	82.6	Confident	103 Å²	103	95 Å²	95	67%	0.669	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-64.5	126.1	170.9	-15.2	29.1	0	0	0	109.6	S84	P82-S84 PolarHBondContact O-N 2.74Å
83	S	69.2	Low	82.6	Confident	29 Å²	29	88.5 Å²	88.5	20%	0.203	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-64.9	126.9	172.7	57.8	0	0	0	0	110.2	E81 H85 S88 Q89	E81-S83 PolarHBondContact O-N 3.41Å; S83-H85 PolarHBondContact O-N 3.1Å; S83-H85 VanDerWaalsContact O-N 3.14Å; S83-S88 WeakPolarHBondContact OG-CB 3.41Å; S83-S88 PolarHBondContact OG-OG 3.22Å; S83-Q89 PolarHBondContact O-NE2 3.47Å
84	S	76	Confident	82.7	Confident	62 Å²	62	89.1 Å²	89.1	43%	0.434	44%	0.441	S	S	.	.			trans	-57.2	-21.9	175.9	50.2	0	0	0	0	114.4	P82	P82-S84 PolarHBondContact O-N 2.74Å
85	H	88.6	Confident	83	Confident	44 Å²	44	88.4 Å²	88.4	20%	0.204	43%	0.434	C	S	.	.			trans	-51.9	131.3	-179.5	-66.4	-113.6	0	0	0	113.7	S83 V87 S88 Q89 D287	S83-H85 PolarHBondContact O-N 3.1Å; S83-H85 VanDerWaalsContact O-N 3.14Å; H85-V87 PolarHBondContact O-N 2.8Å; H85-S88 WeakPolarHBondContact O-CB 3.36Å; H85-S88 PolarHBondContact O-N 3.3Å; H85-S88 VanDerWaalsContact O-N 3.12Å; H85-Q89 PolarHBondContact O-N 2.68Å; H85-D287 WeakPolarHBondContact CA-OD1 3.37Å
86	S	94.4	Very high	83.3	Confident	3 Å²	3	85 Å²	85	2%	0.021	42%	0.421	C	S	.	.	H	α-helix	trans	-57.5	-44.4	-175.3	72.9	0	0	0	0	113.9	S88 Q89 V90 G281 D283 R286 D287	S86-S88 VanDerWaalsContact C-N 3.27Å; S86-S88 PolarHBondContact O-N 2.94Å; S86-Q89 WeakPolarHBondContact O-CB 3.25Å; S86-Q89 PolarHBondContact O-N 3.31Å; S86-V90 PolarHBondContact O-N 3.2Å; S86-V90 VanDerWaalsContact O-N 3.11Å; S86-G281 WeakPolarHBondContact CB-O 3.35Å; S86-D283 PolarHBondContact OG-N 2.69Å; S86-R286 VanDerWaalsContact CB-NH2 3.25Å; S86-D287 WeakPolarHBondContact CB-OD1 3.26Å; S86-D287 WeakPolarHBondContact CB-OD2 3.37Å; S86-D287 PolarHBondContact N-OD1 3.26Å; S86-D287 PolarHBondContact N-OD2 2.9Å; S86-D287 VanDerWaalsContact OG-CG 3.29Å; S86-D287 PolarHBondContact OG-OD1 2.91Å; S86-D287 PolarHBondContact OG-OD2 2.97Å
87	V	94.3	Very high	83.7	Confident	96 Å²	96	78.4 Å²	78.4	58%	0.582	40%	0.397	S	S	*	.	H	α-helix	trans	-61.7	-36.8	178.6	-177.6	0	0	0	0	111.4	H85 Q89 V90 W91 L282	H85-V87 PolarHBondContact O-N 2.8Å; V87-Q89 VanDerWaalsContact C-N 3.34Å; V87-V90 PolarHBondContact O-N 2.87Å; V87-W91 PolarHBondContact O-N 3.12Å; V87-W91 VanDerWaalsContact O-N 3.1Å; V87-L282 HydrophobicContact CB-CD2 4.44Å; V87-L282 HydrophobicContact CG2-CD2 3.89Å
88	S	90.9	Very high	84.4	Confident	38 Å²	38	75.6 Å²	75.6	27%	0.266	38%	0.384	S	S	.	.	H	α-helix	trans	-68.8	-32.8	175.1	-61.3	0	0	0	0	112.4	S83 H85 S86 W91 L92	S83-S88 WeakPolarHBondContact OG-CB 3.41Å; S83-S88 PolarHBondContact OG-OG 3.22Å; H85-S88 WeakPolarHBondContact O-CB 3.36Å; H85-S88 PolarHBondContact O-N 3.3Å; H85-S88 VanDerWaalsContact O-N 3.12Å; S86-S88 VanDerWaalsContact C-N 3.27Å; S86-S88 PolarHBondContact O-N 2.94Å; S88-W91 PolarHBondContact O-N 3.46Å; S88-L92 WeakPolarHBondContact O-CB 3.36Å; S88-L92 VanDerWaalsContact O-CG 3.27Å; S88-L92 WeakPolarHBondContact O-CG 3.43Å; S88-L92 PolarHBondContact O-N 3.44Å
89	Q	91.9	Very high	85.9	Confident	76 Å²	76	69.4 Å²	69.4	36%	0.355	36%	0.355	S	S	.	.	H	α-helix	trans	-68.3	-40.5	175.8	-60.2	-56.9	-38.6	0	0	111.4	S83 H85 S86 V87 W91 L92 A93	S83-Q89 PolarHBondContact O-NE2 3.47Å; H85-Q89 PolarHBondContact O-N 2.68Å; S86-Q89 WeakPolarHBondContact O-CB 3.25Å; S86-Q89 PolarHBondContact O-N 3.31Å; V87-Q89 VanDerWaalsContact C-N 3.34Å; Q89-W91 VanDerWaalsContact C-N 3.34Å; Q89-W91 PolarHBondContact O-N 3.34Å; Q89-L92 PolarHBondContact O-N 2.89Å; Q89-A93 WeakPolarHBondContact O-CB 3.5Å; Q89-A93 PolarHBondContact O-N 3.33Å
90	V	96.2	Very high	87.4	Confident	29 Å²	29	64.1 Å²	64.1	18%	0.176	34%	0.337	C	S	.	.	H	α-helix	trans	-58.9	-45	171	175.8	0	0	0	0	111.3	S86 V87 A93 L94 L275 A278 V279 L282	S86-V90 PolarHBondContact O-N 3.2Å; S86-V90 VanDerWaalsContact O-N 3.11Å; V87-V90 PolarHBondContact O-N 2.87Å; V90-A93 PolarHBondContact O-N 3.4Å; V90-L94 WeakPolarHBondContact O-CB 3.34Å; V90-L94 PolarHBondContact O-N 3.35Å; V90-L275 HydrophobicContact CG1-CD1 4.2Å; V90-A278 HydrophobicContact CG2-CB 4.2Å; V90-A278 VanDerWaalsContact CG2-O 3.31Å; V90-A278 WeakPolarHBondContact CG2-O 3.31Å; V90-V279 HydrophobicContact CG1-CG2 3.75Å; V90-V279 HydrophobicContact CG2-CG2 4.04Å; V90-L282 HydrophobicContact CG2-CD1 4.36Å; V90-L282 HydrophobicContact CG2-CD2 3.72Å; V90-L282 HydrophobicContact CG2-CG 3.93Å
91	W	94.6	Very high	89.4	Confident	101 Å²	101	55.8 Å²	55.8	38%	0.383	30%	0.301	S	S	.	.	H	α-helix	trans	-64.1	-41.8	178	178.5	-116.5	0	0	0	113	F73 V87 S88 Q89 L94 L95	F73-W91 HydrophobicContact CB-CH2 4.4Å; F73-W91 HydrophobicContact CB-CZ2 3.84Å; F73-W91 AromaticContact CD1-CH2 3.92Å; F73-W91 HydrophobicContact CD1-CH2 3.92Å; F73-W91 AromaticContact CD1-CZ2 3.63Å; F73-W91 HydrophobicContact CD1-CZ2 3.63Å; F73-W91 HydrophobicContact CE1-CH2 4.3Å; F73-W91 HydrophobicContact CE1-CZ2 4.36Å; F73-W91 HydrophobicContact CG-CH2 4.05Å; F73-W91 AromaticContact CG-CZ2 3.84Å; F73-W91 HydrophobicContact CG-CZ2 3.84Å; V87-W91 PolarHBondContact O-N 3.12Å; V87-W91 VanDerWaalsContact O-N 3.1Å; S88-W91 PolarHBondContact O-N 3.46Å; Q89-W91 VanDerWaalsContact C-N 3.34Å; Q89-W91 PolarHBondContact O-N 3.34Å; W91-L94 HydrophobicContact CE3-CD2 4.14Å; W91-L94 HydrophobicContact CZ3-CD2 4.07Å; W91-L94 PolarHBondContact O-N 3.01Å; W91-L95 HydrophobicContact CD2-CD1 4.38Å; W91-L95 HydrophobicContact CD2-CG 4.44Å; W91-L95 HydrophobicContact CH2-CD2 4.26Å; W91-L95 HydrophobicContact CZ2-CD1 4.01Å; W91-L95 HydrophobicContact CZ2-CD2 4.12Å; W91-L95 HydrophobicContact CZ2-CG 4.25Å; W91-L95 WeakPolarHBondContact O-CG 3.42Å; W91-L95 PolarHBondContact O-N 2.92Å; W91-L95 VanDerWaalsContact O-N 3.08Å
92	L	92.7	Very high	91.2	Very high	59 Å²	59	48.4 Å²	48.4	31%	0.309	27%	0.267	S	S	.	.	H	α-helix	trans	-66.8	-40.1	175.5	-73.5	170.1	0	0	0	112.1	I77 S88 Q89 L95 S96	I77-L92 HydrophobicContact CD1-CD2 3.76Å; S88-L92 WeakPolarHBondContact O-CB 3.36Å; S88-L92 VanDerWaalsContact O-CG 3.27Å; S88-L92 WeakPolarHBondContact O-CG 3.43Å; S88-L92 PolarHBondContact O-N 3.44Å; Q89-L92 PolarHBondContact O-N 2.89Å; L92-L95 PolarHBondContact O-N 3.5Å; L92-S96 WeakPolarHBondContact O-CB 3.45Å; L92-S96 PolarHBondContact O-N 2.81Å
93	A	94.3	Very high	92.8	Very high	23 Å²	23	50.2 Å²	50.2	19%	0.19	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-44.2	174.5	0	0	0	0	0	111.4	Q89 V90 S96 Q97 L275 A278	Q89-A93 WeakPolarHBondContact O-CB 3.5Å; Q89-A93 PolarHBondContact O-N 3.33Å; V90-A93 PolarHBondContact O-N 3.4Å; A93-S96 WeakPolarHBondContact O-CB 3.31Å; A93-S96 PolarHBondContact O-N 2.82Å; A93-Q97 PolarHBondContact O-N 3.15Å; A93-L275 HydrophobicContact CB-CD1 3.97Å; A93-A278 HydrophobicContact CB-CB 3.87Å
94	L	96.8	Very high	94.1	Very high	71 Å²	71	49.3 Å²	49.3	37%	0.372	25%	0.254	S	S	.	.	H	α-helix	trans	-60.4	-49.2	176.3	-180	61.9	0	0	0	111.9	V90 W91 S96 Q97 T98 L275	V90-L94 WeakPolarHBondContact O-CB 3.34Å; V90-L94 PolarHBondContact O-N 3.35Å; W91-L94 HydrophobicContact CE3-CD2 4.14Å; W91-L94 HydrophobicContact CZ3-CD2 4.07Å; W91-L94 PolarHBondContact O-N 3.01Å; L94-S96 VanDerWaalsContact C-N 3.3Å; L94-S96 PolarHBondContact O-N 2.64Å; L94-Q97 PolarHBondContact O-N 3.37Å; L94-T98 PolarHBondContact O-N 3.39Å; L94-T98 PolarHBondContact O-OG1 2.96Å; L94-T98 VanDerWaalsContact O-OG1 3.06Å; L94-L275 HydrophobicContact CB-CD1 4.1Å; L94-L275 HydrophobicContact CD1-CD2 3.94Å
95	L	95.3	Very high	95.1	Very high	9 Å²	9	48 Å²	48	5%	0.047	24%	0.241	C	C	.	.	H	α-helix	trans	-65.1	-32	177	-67	177.1	0	0	0	112.9	F73 I77 W91 L92 R99	F73-L95 HydrophobicContact CB-CD1 4.18Å; F73-L95 HydrophobicContact CB-CD2 3.71Å; I77-L95 HydrophobicContact CD1-CD1 4.28Å; W91-L95 HydrophobicContact CD2-CD1 4.38Å; W91-L95 HydrophobicContact CD2-CG 4.44Å; W91-L95 HydrophobicContact CH2-CD2 4.26Å; W91-L95 HydrophobicContact CZ2-CD1 4.01Å; W91-L95 HydrophobicContact CZ2-CD2 4.12Å; W91-L95 HydrophobicContact CZ2-CG 4.25Å; W91-L95 WeakPolarHBondContact O-CG 3.42Å; W91-L95 PolarHBondContact O-N 2.92Å; W91-L95 VanDerWaalsContact O-N 3.08Å; L92-L95 PolarHBondContact O-N 3.5Å; L95-R99 WeakPolarHBondContact O-CG 3.43Å; L95-R99 PolarHBondContact O-N 3.03Å
96	S	94.7	Very high	95.5	Very high	66 Å²	66	48.4 Å²	48.4	46%	0.462	25%	0.249	S	C	.	.	H	α-helix	trans	-65.6	-44.3	172.8	-168.3	0	0	0	0	110.9	L92 A93 L94 R99 Q100	L92-S96 WeakPolarHBondContact O-CB 3.45Å; L92-S96 PolarHBondContact O-N 2.81Å; A93-S96 WeakPolarHBondContact O-CB 3.31Å; A93-S96 PolarHBondContact O-N 2.82Å; L94-S96 VanDerWaalsContact C-N 3.3Å; L94-S96 PolarHBondContact O-N 2.64Å; S96-R99 WeakPolarHBondContact O-CB 3Å; S96-R99 PolarHBondContact O-N 2.99Å; S96-Q100 PolarHBondContact O-N 3.11Å
97	Q	96.7	Very high	95.6	Very high	14 Å²	14	49.7 Å²	49.7	7%	0.065	26%	0.262	C	S	.	.	H	α-helix	trans	-66.7	-41.5	179.4	178.4	51.1	20.2	0	0	112.4	A93 L94 R99 Q100 E101	A93-Q97 PolarHBondContact O-N 3.15Å; L94-Q97 PolarHBondContact O-N 3.37Å; Q97-R99 PolarHBondContact O-N 3.34Å; Q97-Q100 PolarHBondContact O-N 2.85Å; Q97-E101 WeakPolarHBondContact O-CB 3.24Å; Q97-E101 PolarHBondContact O-N 3.29Å
98	T	97.6	Very high	95.7	Very high	20 Å²	20	45.4 Å²	45.4	12%	0.123	24%	0.236	C	C	.	.	H	α-helix	trans	-57.6	-34.6	173.6	-52	0	0	0	0	112.2	L66 L69 A70 L94 S102	L66-T98 HydrophobicContact CB-CG2 4.18Å; L66-T98 HydrophobicContact CD2-CG2 4.15Å; L69-T98 HydrophobicContact CD2-CG2 4.31Å; A70-T98 HydrophobicContact CB-CG2 4.13Å; L94-T98 PolarHBondContact O-N 3.39Å; L94-T98 PolarHBondContact O-OG1 2.96Å; L94-T98 VanDerWaalsContact O-OG1 3.06Å; T98-S102 VanDerWaalsContact O-CB 3.31Å; T98-S102 WeakPolarHBondContact O-CB 3.34Å; T98-S102 PolarHBondContact O-N 3.49Å
99	R	96.7	Very high	96	Very high	75 Å²	75	44.1 Å²	44.1	28%	0.283	23%	0.227	S	C	.	.	H	α-helix	trans	-73.7	-34	173	-72.7	-177.6	167.6	126.2	-8.5	113.6	E67 A70 A74 L95 S96 Q97 S102 R103	E67-R99 IonicContact OE1-NE 3.67Å; E67-R99 PolarHBondContact OE1-NE 2.87Å; A70-R99 HydrophobicContact CB-CG 3.59Å; A74-R99 VanDerWaalsContact CB-NH2 3.28Å; L95-R99 WeakPolarHBondContact O-CG 3.43Å; L95-R99 PolarHBondContact O-N 3.03Å; S96-R99 WeakPolarHBondContact O-CB 3Å; S96-R99 PolarHBondContact O-N 2.99Å; Q97-R99 PolarHBondContact O-N 3.34Å; R99-S102 WeakPolarHBondContact O-CB 3.13Å; R99-R103 WeakPolarHBondContact O-CG 3.41Å; R99-R103 PolarHBondContact O-N 3.33Å
100	Q	96.3	Very high	96.2	Very high	50 Å²	50	45.9 Å²	45.9	23%	0.234	24%	0.235	C	C	.	.	H	α-helix	trans	-67.6	-45.3	176.3	-175.4	50.6	40	0	0	110.7	S96 Q97 S102 R103 D104	S96-Q100 PolarHBondContact O-N 3.11Å; Q97-Q100 PolarHBondContact O-N 2.85Å; Q100-S102 PolarHBondContact O-N 3.24Å; Q100-R103 PolarHBondContact O-N 3.34Å; Q100-R103 VanDerWaalsContact O-N 3.13Å; Q100-D104 PolarHBondContact NE2-OD1 2.78Å; Q100-D104 PolarHBondContact NE2-OD2 3.37Å; Q100-D104 PolarHBondContact O-N 2.84Å
101	E	96.9	Very high	96.1	Very high	43 Å²	43	44.6 Å²	44.6	20%	0.201	23%	0.227	C	C	.	.	H	α-helix	trans	-59.3	-45.7	173.5	-166.8	177.8	160.3	0	0	111.6	Y62 L66 Q97 R103 D104 H105	Y62-E101 PolarHBondContact OH-OE1 2.86Å; L66-E101 HydrophobicContact CD1-CB 4Å; L66-E101 HydrophobicContact CD1-CG 3.66Å; Q97-E101 WeakPolarHBondContact O-CB 3.24Å; Q97-E101 PolarHBondContact O-N 3.29Å; E101-R103 VanDerWaalsContact C-N 3.33Å; E101-R103 PolarHBondContact O-N 3.48Å; E101-D104 PolarHBondContact O-N 3.42Å; E101-H105 PolarHBondContact O-CD2 2.71Å; E101-H105 VanDerWaalsContact O-CD2 3.29Å; E101-H105 PolarHBondContact O-N 3.07Å
102	S	98	Very high	96.2	Very high	5 Å²	5	39.9 Å²	39.9	4%	0.035	21%	0.21	C	C	.	.	H	α-helix	trans	-48.7	-49.8	169.5	161.5	0	0	0	0	112.9	S63 E67 T98 R99 Q100 S106	S63-S102 WeakPolarHBondContact CB-O 3.37Å; S63-S102 PolarHBondContact OG-O 3.3Å; E67-S102 WeakPolarHBondContact CB-OG 3.5Å; E67-S102 WeakPolarHBondContact OE2-CB 3.11Å; E67-S102 PolarHBondContact OE2-OG 2.98Å; T98-S102 VanDerWaalsContact O-CB 3.31Å; T98-S102 WeakPolarHBondContact O-CB 3.34Å; T98-S102 PolarHBondContact O-N 3.49Å; R99-S102 WeakPolarHBondContact O-CB 3.13Å; Q100-S102 PolarHBondContact O-N 3.24Å; S102-S106 PolarHBondContact O-N 3.48Å; S102-S106 VanDerWaalsContact O-N 3.14Å
103	R	97	Very high	96.1	Very high	141 Å²	141	38.8 Å²	38.8	53%	0.532	21%	0.207	S	C	.	.	H	α-helix	trans	-67.7	-41.1	179.5	-71.8	-174.3	-65	-128.5	3.9	112.7	R99 Q100 E101 S106 G107	R99-R103 WeakPolarHBondContact O-CG 3.41Å; R99-R103 PolarHBondContact O-N 3.33Å; Q100-R103 PolarHBondContact O-N 3.34Å; Q100-R103 VanDerWaalsContact O-N 3.13Å; E101-R103 VanDerWaalsContact C-N 3.33Å; E101-R103 PolarHBondContact O-N 3.48Å; R103-S106 WeakPolarHBondContact O-CB 3.41Å; R103-S106 PolarHBondContact O-N 2.95Å; R103-G107 PolarHBondContact O-N 3.47Å
104	D	96.4	Very high	95.8	Very high	10 Å²	10	42.2 Å²	42.2	5%	0.053	22%	0.222	C	C	.	.	H	α-helix	trans	-68	-42.1	-178.3	-70.3	-29.5	0	0	0	111.6	Q100 E101 S106 G107 L108 W263 N267	Q100-D104 PolarHBondContact NE2-OD1 2.78Å; Q100-D104 PolarHBondContact NE2-OD2 3.37Å; Q100-D104 PolarHBondContact O-N 2.84Å; E101-D104 PolarHBondContact O-N 3.42Å; D104-S106 VanDerWaalsContact C-N 3.31Å; D104-S106 PolarHBondContact O-N 3.31Å; D104-G107 PolarHBondContact O-N 3.32Å; D104-G107 VanDerWaalsContact O-N 3.14Å; D104-L108 PolarHBondContact O-N 2.99Å; D104-W263 WeakPolarHBondContact OD1-CH2 3.37Å; D104-W263 WeakPolarHBondContact OD1-CZ3 3.43Å; D104-N267 PolarHBondContact OD1-ND2 3.07Å; D104-N267 WeakPolarHBondContact OD2-CB 3.42Å; D104-N267 PolarHBondContact OD2-ND2 3.39Å
105	H	97.3	Very high	95.7	Very high	35 Å²	35	42.6 Å²	42.6	16%	0.162	22%	0.224	C	C	.	.	H	α-helix	trans	-64.5	-32.5	171.9	-79.1	-85.2	0	0	0	112.9	E59 Y62 E101 L108 S109	E59-H105 IonicContact OE2-CE1 3.97Å; E59-H105 PolarHBondContact OE2-CE1 2.8Å; E59-H105 IonicContact OE2-CG 2.6Å; E59-H105 IonicContact OE2-ND1 2.64Å; E59-H105 PolarHBondContact OE2-ND1 2.93Å; Y62-H105 HydrophobicContact CD1-CB 4.43Å; Y62-H105 AromaticContact CD1-CD2 3.9Å; Y62-H105 AromaticContact CD1-CE1 3.85Å; Y62-H105 AromaticContact CD1-CG 3.77Å; Y62-H105 AromaticContact CD1-ND1 3.74Å; Y62-H105 AromaticContact CD1-NE2 3.96Å; Y62-H105 AromaticContact CE1-CD2 3.89Å; Y62-H105 AromaticContact CE1-CE1 3.94Å; Y62-H105 AromaticContact CE1-NE2 3.7Å; E101-H105 PolarHBondContact O-CD2 2.71Å; E101-H105 VanDerWaalsContact O-CD2 3.29Å; E101-H105 PolarHBondContact O-N 3.07Å; H105-L108 PolarHBondContact O-N 2.95Å; H105-S109 WeakPolarHBondContact O-CB 3.32Å; H105-S109 PolarHBondContact O-N 3.15Å
106	S	97.2	Very high	95.7	Very high	53 Å²	53	42.4 Å²	42.4	37%	0.371	22%	0.223	S	C	.	.	H	α-helix	trans	-62	-43	171	-166.6	0	0	0	0	111.7	S63 S102 R103 D104 S109 E110	S63-S106 WeakPolarHBondContact OG-CB 3.07Å; S102-S106 PolarHBondContact O-N 3.48Å; S102-S106 VanDerWaalsContact O-N 3.14Å; R103-S106 WeakPolarHBondContact O-CB 3.41Å; R103-S106 PolarHBondContact O-N 2.95Å; D104-S106 VanDerWaalsContact C-N 3.31Å; D104-S106 PolarHBondContact O-N 3.31Å; S106-S109 WeakPolarHBondContact O-CB 3.47Å; S106-S109 PolarHBondContact O-N 3.2Å; S106-S109 PolarHBondContact O-OG 3Å; S106-E110 PolarHBondContact O-N 2.94Å
107	G	95.8	Very high	95.8	Very high	29 Å²	29	40.2 Å²	40.2	30%	0.299	21%	0.205	S	C	.	.	H	α-helix	trans	-66.6	-35.4	175	0	0	0	0	0	114	R103 D104 S111	R103-G107 PolarHBondContact O-N 3.47Å; D104-G107 PolarHBondContact O-N 3.32Å; D104-G107 VanDerWaalsContact O-N 3.14Å; G107-S111 VanDerWaalsContact O-CB 3.32Å; G107-S111 WeakPolarHBondContact O-CB 3.3Å; G107-S111 PolarHBondContact O-N 2.67Å
108	L	96.1	Very high	95.7	Very high	6 Å²	6	42.8 Å²	42.8	3%	0.031	22%	0.223	C	C	.	.	H	α-helix	trans	-63.5	-42.8	169.5	-68.5	179.7	0	0	0	111.2	E59 D104 H105 S111 C112 R260	E59-L108 HydrophobicContact CB-CB 4.49Å; E59-L108 HydrophobicContact CG-CB 4.2Å; D104-L108 PolarHBondContact O-N 2.99Å; H105-L108 PolarHBondContact O-N 2.95Å; L108-S111 PolarHBondContact O-N 3.02Å; L108-C112 WeakPolarHBondContact O-CB 3.34Å; L108-C112 PolarHBondContact O-N 2.85Å; L108-C112 PolarHBondContact O-SG 3.44Å; L108-R260 HydrophobicContact CD2-CB 3.98Å
109	S	97.6	Very high	95.7	Very high	12 Å²	12	43.4 Å²	43.4	8%	0.084	23%	0.227	C	C	.	.	H	α-helix	trans	-56	-52	174.8	135.1	0	0	0	0	112.2	G56 H105 S106 S111 C112 S113	G56-S109 WeakPolarHBondContact O-CB 3.41Å; H105-S109 WeakPolarHBondContact O-CB 3.32Å; H105-S109 PolarHBondContact O-N 3.15Å; S106-S109 WeakPolarHBondContact O-CB 3.47Å; S106-S109 PolarHBondContact O-N 3.2Å; S106-S109 PolarHBondContact O-OG 3Å; S109-S111 PolarHBondContact O-N 3.47Å; S109-C112 PolarHBondContact O-N 3.1Å; S109-S113 WeakPolarHBondContact O-CB 3.2Å; S109-S113 PolarHBondContact O-N 2.86Å; S109-S113 PolarHBondContact O-OG 2.84Å
110	E	95.9	Very high	95.7	Very high	113 Å²	113	39.9 Å²	39.9	53%	0.528	21%	0.213	S	C	.	.	H	α-helix	trans	-63.7	-42.3	178.6	-178.5	177.8	-150.2	0	0	111.3	S106 C112 S113 N114	S106-E110 PolarHBondContact O-N 2.94Å; E110-C112 PolarHBondContact O-N 3.36Å; E110-S113 PolarHBondContact O-N 3.01Å; E110-N114 WeakPolarHBondContact O-CB 3.27Å; E110-N114 PolarHBondContact O-N 3.37Å
111	S	95.2	Very high	95.7	Very high	2 Å²	2	41 Å²	41	1%	0.014	22%	0.22	C	C	.	.	I	π-helix	trans	-64.5	-39.6	179.9	-163.3	0	0	0	0	112.1	G107 L108 S109 I115 L116 R260	G107-S111 VanDerWaalsContact O-CB 3.32Å; G107-S111 WeakPolarHBondContact O-CB 3.3Å; G107-S111 PolarHBondContact O-N 2.67Å; L108-S111 PolarHBondContact O-N 3.02Å; S109-S111 PolarHBondContact O-N 3.47Å; S111-I115 PolarHBondContact O-N 2.65Å; S111-L116 WeakPolarHBondContact O-CB 3.21Å; S111-L116 VanDerWaalsContact O-CG 3.22Å; S111-L116 WeakPolarHBondContact O-CG 3.24Å; S111-L116 PolarHBondContact O-N 2.78Å; S111-R260 PolarHBondContact OG-NE 3.31Å
112	C	95.4	Very high	95.7	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.014	23%	0.234	C	C	.	.	I	π-helix	trans	-69.7	-47	176	-63.3	0	0	0	0	111.7	L52 L108 S109 E110	L52-C112 HydrophobicContact CD2-CB 4.42Å; L52-C112 WeakPolarHBondContact O-CB 3.46Å; L108-C112 WeakPolarHBondContact O-CB 3.34Å; L108-C112 PolarHBondContact O-N 2.85Å; L108-C112 PolarHBondContact O-SG 3.44Å; S109-C112 PolarHBondContact O-N 3.1Å; E110-C112 PolarHBondContact O-N 3.36Å
113	S	91.7	Very high	95.7	Very high	35 Å²	35	44 Å²	44	25%	0.245	23%	0.233	C	C	.	.	I	π-helix	trans	-72.7	-40	-172.6	-49.6	0	0	0	0	113.6	S109 E110	S109-S113 WeakPolarHBondContact O-CB 3.2Å; S109-S113 PolarHBondContact O-N 2.86Å; S109-S113 PolarHBondContact O-OG 2.84Å; E110-S113 PolarHBondContact O-N 3.01Å
114	N	87.9	Confident	95.8	Very high	95 Å²	95	37.7 Å²	37.7	51%	0.508	21%	0.21	S	C	.	.	I	π-helix	trans	-111.1	-50.7	-169.5	-60.9	-20.1	0	0	0	112.1	E110 T118	E110-N114 WeakPolarHBondContact O-CB 3.27Å; E110-N114 PolarHBondContact O-N 3.37Å; N114-T118 PolarHBondContact O-OG1 3.16Å; N114-T118 VanDerWaalsContact O-OG1 3.06Å
115	I	93.4	Very high	95.8	Very high	80 Å²	80	40.7 Å²	40.7	41%	0.41	23%	0.226	S	C	.	.	I	π-helix	trans	-78	-42.4	-168.1	-54.6	-179.7	0	0	0	111.8	S111 P119	S111-I115 PolarHBondContact O-N 2.65Å; I115-P119 WeakPolarHBondContact O-CD 3.47Å
116	L	96.4	Very high	95.8	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	23%	0.227	C	C	.	.	I	π-helix	trans	-86.8	-30	-173.8	-66.3	173.6	0	0	0	113.7	L52 S111 P119 V120 V253 A256 Y257	L52-L116 HydrophobicContact CD1-CB 3.99Å; L52-L116 HydrophobicContact CD2-CB 4.28Å; L52-L116 HydrophobicContact CD2-CD1 4.15Å; S111-L116 WeakPolarHBondContact O-CB 3.21Å; S111-L116 VanDerWaalsContact O-CG 3.22Å; S111-L116 WeakPolarHBondContact O-CG 3.24Å; S111-L116 PolarHBondContact O-N 2.78Å; L116-P119 WeakPolarHBondContact O-CD 3.49Å; L116-V120 WeakPolarHBondContact O-CG2 3.29Å; L116-V253 HydrophobicContact CB-CG1 4.31Å; L116-V253 HydrophobicContact CD2-CG1 4.13Å; L116-A256 HydrophobicContact CD2-CB 3.67Å; L116-Y257 HydrophobicContact CD1-CD2 3.79Å; L116-Y257 HydrophobicContact CD1-CG 4.34Å
117	I	96.4	Very high	95.8	Very high	20 Å²	20	39 Å²	39	10%	0.103	21%	0.21	C	C	.	.	H	α-helix	trans	-67.5	-43.9	177.9	-77.7	176.6	0	0	0	112.2	T49 L52 R53 V120 M121	T49-I117 HydrophobicContact CG2-CD1 4.27Å; T49-I117 HydrophobicContact CG2-CG1 4.17Å; T49-I117 HydrophobicContact CG2-CG2 3.79Å; T49-I117 WeakPolarHBondContact O-CD1 3.49Å; L52-I117 HydrophobicContact CB-CD1 4.12Å; L52-I117 HydrophobicContact CB-CG1 3.77Å; L52-I117 HydrophobicContact CD1-CG1 4.28Å; R53-I117 HydrophobicContact CB-CD1 3.86Å; R53-I117 HydrophobicContact CG-CD1 4.48Å; I117-V120 WeakPolarHBondContact O-CA 3.37Å; I117-V120 WeakPolarHBondContact O-CB 3.41Å; I117-V120 PolarHBondContact O-N 3.39Å; I117-M121 HydrophobicContact CG2-CG 4.08Å; I117-M121 PolarHBondContact O-N 3.41Å
118	T	95.7	Very high	95.9	Very high	69 Å²	69	41.3 Å²	41.3	42%	0.423	21%	0.213	S	C	.	.	H	α-helix	trans	-57.3	-45	-173	-57	0	0	0	0	113	N114 V120 M121 H122	N114-T118 PolarHBondContact O-OG1 3.16Å; N114-T118 VanDerWaalsContact O-OG1 3.06Å; T118-V120 VanDerWaalsContact C-N 3.3Å; T118-V120 PolarHBondContact O-N 3.08Å; T118-M121 PolarHBondContact O-N 3.14Å; T118-H122 PolarHBondContact O-N 2.9Å; T118-H122 VanDerWaalsContact O-N 3.1Å
119	P	96.4	Very high	95.9	Very high	32 Å²	32	48.6 Å²	48.6	21%	0.208	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-22	173	-22.7	34.4	0	0	0	115.8	I115 L116 C123 V253	I115-P119 WeakPolarHBondContact O-CD 3.47Å; L116-P119 WeakPolarHBondContact O-CD 3.49Å; P119-C123 WeakPolarHBondContact O-CB 3.34Å; P119-C123 PolarHBondContact O-N 2.98Å; P119-C123 VanDerWaalsContact O-N 3.16Å; P119-V253 HydrophobicContact CB-CG2 3.76Å; P119-V253 HydrophobicContact CG-CG2 4.46Å
120	V	97.4	Very high	95.9	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.006	25%	0.249	C	C	.	.	H	α-helix	trans	-78.5	-43.7	176.9	-178.9	0	0	0	0	110.2	L45 M48 T49 L52 L116 I117 T118 H122 C123 L124 V253	L45-V120 HydrophobicContact CB-CG1 4.32Å; L45-V120 HydrophobicContact CD2-CG1 3.85Å; L45-V120 WeakPolarHBondContact O-CG1 3.35Å; M48-V120 HydrophobicContact CE-CB 4.27Å; M48-V120 HydrophobicContact CE-CG1 3.84Å; M48-V120 HydrophobicContact CE-CG2 3.32Å; T49-V120 VanDerWaalsContact OG1-CG1 3.27Å; T49-V120 WeakPolarHBondContact OG1-CG1 3.43Å; L52-V120 HydrophobicContact CD1-CG2 4.41Å; L116-V120 WeakPolarHBondContact O-CG2 3.29Å; I117-V120 WeakPolarHBondContact O-CA 3.37Å; I117-V120 WeakPolarHBondContact O-CB 3.41Å; I117-V120 PolarHBondContact O-N 3.39Å; T118-V120 VanDerWaalsContact C-N 3.3Å; T118-V120 PolarHBondContact O-N 3.08Å; V120-H122 PolarHBondContact O-N 3.26Å; V120-C123 WeakPolarHBondContact O-CA 3.19Å; V120-C123 VanDerWaalsContact O-CB 3.23Å; V120-C123 WeakPolarHBondContact O-CB 3.48Å; V120-C123 PolarHBondContact O-N 3Å; V120-L124 PolarHBondContact O-N 3.05Å; V120-V253 HydrophobicContact CG2-CB 4.4Å; V120-V253 HydrophobicContact CG2-CG1 3.89Å; V120-V253 HydrophobicContact CG2-CG2 3.93Å
121	M	96.4	Very high	95.9	Very high	74 Å²	74	45.8 Å²	45.8	37%	0.365	23%	0.23	S	C	.	.	H	α-helix	trans	-59.3	-45.7	171.8	-68.1	-57.4	-56.9	0	0	111.5	T49 I117 T118 C123 L124 D125	T49-M121 HydrophobicContact CG2-CG 4.46Å; T49-M121 HydrophobicContact CG2-SD 3.95Å; I117-M121 HydrophobicContact CG2-CG 4.08Å; I117-M121 PolarHBondContact O-N 3.41Å; T118-M121 PolarHBondContact O-N 3.14Å; M121-C123 PolarHBondContact O-N 3.01Å; M121-L124 HydrophobicContact CE-CD2 4.36Å; M121-L124 WeakPolarHBondContact O-CB 3.42Å; M121-L124 PolarHBondContact O-N 3.43Å; M121-L124 VanDerWaalsContact O-N 3.13Å; M121-D125 PolarHBondContact O-N 2.99Å
122	H	96.9	Very high	95.9	Very high	109 Å²	109	51.5 Å²	51.5	51%	0.505	26%	0.255	S	S	.	.	H	α-helix	trans	-60.5	-32	173.2	-66.4	168.4	0	0	0	113	T118 V120 Y126	T118-H122 PolarHBondContact O-N 2.9Å; T118-H122 VanDerWaalsContact O-N 3.1Å; V120-H122 PolarHBondContact O-N 3.26Å; H122-Y126 WeakPolarHBondContact O-CD1 3.32Å; H122-Y126 WeakPolarHBondContact O-CE1 3.47Å; H122-Y126 PolarHBondContact O-N 3.34Å
123	C	97.8	Very high	96	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.007	29%	0.286	C	S	.	.	H	α-helix	trans	-67.2	-42.7	175.2	-168.9	0	0	0	0	111.6	L45 P119 V120 M121 Y126 T127	L45-C123 HydrophobicContact CD2-CB 4.26Å; P119-C123 WeakPolarHBondContact O-CB 3.34Å; P119-C123 PolarHBondContact O-N 2.98Å; P119-C123 VanDerWaalsContact O-N 3.16Å; V120-C123 WeakPolarHBondContact O-CA 3.19Å; V120-C123 VanDerWaalsContact O-CB 3.23Å; V120-C123 WeakPolarHBondContact O-CB 3.48Å; V120-C123 PolarHBondContact O-N 3Å; M121-C123 PolarHBondContact O-N 3.01Å; C123-Y126 HydrophobicContact CB-CE1 4.36Å; C123-Y126 PolarHBondContact SG-OH 3.37Å; C123-Y126 VanDerWaalsContact SG-OH 3.37Å; C123-T127 VanDerWaalsContact O-CB 3.26Å; C123-T127 WeakPolarHBondContact O-CB 3.48Å; C123-T127 PolarHBondContact O-N 3.46Å; C123-T127 PolarHBondContact O-OG1 3.46Å
124	L	97.6	Very high	96.2	Very high	10 Å²	10	57.4 Å²	57.4	5%	0.052	28%	0.277	C	S	.	.	H	α-helix	trans	-58.8	-50.2	174	-179	61.7	0	0	0	111.2	T42 L45 Q46 V120 M121 Y126 T127 Q128	T42-L124 HydrophobicContact CG2-CD1 4.01Å; L45-L124 HydrophobicContact CB-CB 4.31Å; L45-L124 HydrophobicContact CB-CD1 4.23Å; L45-L124 HydrophobicContact CD1-CB 3.94Å; L45-L124 HydrophobicContact CD1-CD1 3.99Å; Q46-L124 HydrophobicContact CG-CD2 4.09Å; V120-L124 PolarHBondContact O-N 3.05Å; M121-L124 HydrophobicContact CE-CD2 4.36Å; M121-L124 WeakPolarHBondContact O-CB 3.42Å; M121-L124 PolarHBondContact O-N 3.43Å; M121-L124 VanDerWaalsContact O-N 3.13Å; L124-Y126 PolarHBondContact O-N 2.89Å; L124-T127 PolarHBondContact O-N 3.27Å; L124-Q128 HydrophobicContact CD1-CG 4.18Å; L124-Q128 PolarHBondContact O-N 2.88Å
125	D	97.4	Very high	96.6	Very high	72 Å²	72	57 Å²	57	39%	0.385	27%	0.268	S	S	.	.	H	α-helix	trans	-57.1	-44.5	-178	-68.9	-30	0	0	0	113	M121 R129	M121-D125 PolarHBondContact O-N 2.99Å; D125-R129 VanDerWaalsContact O-CG 3.29Å; D125-R129 WeakPolarHBondContact O-CG 3.47Å; D125-R129 PolarHBondContact O-N 3.46Å; D125-R129 PolarHBondContact O-NE 3.34Å
126	Y	97.3	Very high	96.7	Very high	50 Å²	50	56.5 Å²	56.5	20%	0.196	27%	0.267	C	S	.	.	H	α-helix	trans	-80.1	-33	177.9	70.2	-117.4	0	0	0	112.9	H122 C123 L124 Q128 R129 L130 G245 S249	H122-Y126 WeakPolarHBondContact O-CD1 3.32Å; H122-Y126 WeakPolarHBondContact O-CE1 3.47Å; H122-Y126 PolarHBondContact O-N 3.34Å; C123-Y126 HydrophobicContact CB-CE1 4.36Å; C123-Y126 PolarHBondContact SG-OH 3.37Å; C123-Y126 VanDerWaalsContact SG-OH 3.37Å; L124-Y126 PolarHBondContact O-N 2.89Å; Y126-Q128 PolarHBondContact O-N 3.34Å; Y126-R129 PolarHBondContact O-N 2.93Å; Y126-L130 HydrophobicContact CD2-CD1 4.09Å; Y126-L130 WeakPolarHBondContact O-CB 3.24Å; Y126-L130 VanDerWaalsContact O-CG 3.3Å; Y126-L130 WeakPolarHBondContact O-CG 3.44Å; Y126-L130 PolarHBondContact O-N 3.46Å; Y126-G245 PolarHBondContact OH-O 3.45Å; Y126-S249 WeakPolarHBondContact OH-CB 3.44Å; Y126-S249 PolarHBondContact OH-OG 3.18Å
127	T	97.4	Very high	96.7	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-60.6	-46.4	178.3	-58.2	0	0	0	0	110.4	L38 C123 L124 R129 L130 A131 Y246	L38-T127 HydrophobicContact CD1-CG2 4.24Å; C123-T127 VanDerWaalsContact O-CB 3.26Å; C123-T127 WeakPolarHBondContact O-CB 3.48Å; C123-T127 PolarHBondContact O-N 3.46Å; C123-T127 PolarHBondContact O-OG1 3.46Å; L124-T127 PolarHBondContact O-N 3.27Å; T127-R129 PolarHBondContact O-N 3.02Å; T127-L130 PolarHBondContact O-N 2.81Å; T127-A131 VanDerWaalsContact O-CB 3.27Å; T127-A131 WeakPolarHBondContact O-CB 3.32Å; T127-A131 PolarHBondContact O-N 3.5Å; T127-Y246 HydrophobicContact CG2-CD2 4.22Å
128	Q	97.1	Very high	96.8	Very high	78 Å²	78	59.4 Å²	59.4	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-63.7	-40.2	175.5	-67.7	-176.7	-13.1	0	0	113	L38 T42 L124 Y126 K132	L38-Q128 HydrophobicContact CD1-CG 4.17Å; T42-Q128 PolarHBondContact OG1-NE2 3.21Å; T42-Q128 VanDerWaalsContact OG1-NE2 3.11Å; L124-Q128 HydrophobicContact CD1-CG 4.18Å; L124-Q128 PolarHBondContact O-N 2.88Å; Y126-Q128 PolarHBondContact O-N 3.34Å; Q128-K132 WeakPolarHBondContact O-CB 3.41Å; Q128-K132 PolarHBondContact O-N 2.95Å; Q128-K132 VanDerWaalsContact O-N 3.1Å
129	R	97.5	Very high	96.9	Very high	159 Å²	159	58.5 Å²	58.5	60%	0.6	28%	0.277	S	S	*	.	H	α-helix	trans	-69.9	-34.5	177.7	-74.2	179.1	-66.1	164.7	-0.2	113.4	D125 Y126 T127 K133	D125-R129 VanDerWaalsContact O-CG 3.29Å; D125-R129 WeakPolarHBondContact O-CG 3.47Å; D125-R129 PolarHBondContact O-N 3.46Å; D125-R129 PolarHBondContact O-NE 3.34Å; Y126-R129 PolarHBondContact O-N 2.93Å; T127-R129 PolarHBondContact O-N 3.02Å; R129-K133 WeakPolarHBondContact O-CG 3.3Å; R129-K133 PolarHBondContact O-N 2.93Å
130	L	97	Very high	96.9	Very high	50 Å²	50	63 Å²	63	26%	0.262	30%	0.295	S	S	.	.	H	α-helix	trans	-75.4	-47.4	177.4	-71.9	176.7	0	0	0	111.2	Y126 T127 K132 K133 S134 V244	Y126-L130 HydrophobicContact CD2-CD1 4.09Å; Y126-L130 WeakPolarHBondContact O-CB 3.24Å; Y126-L130 VanDerWaalsContact O-CG 3.3Å; Y126-L130 WeakPolarHBondContact O-CG 3.44Å; Y126-L130 PolarHBondContact O-N 3.46Å; T127-L130 PolarHBondContact O-N 2.81Å; L130-K132 VanDerWaalsContact C-N 3.32Å; L130-K132 PolarHBondContact O-N 3.34Å; L130-K133 PolarHBondContact O-N 3Å; L130-K133 VanDerWaalsContact O-N 3.12Å; L130-S134 PolarHBondContact O-N 2.99Å; L130-V244 HydrophobicContact CD1-CB 4.09Å; L130-V244 WeakPolarHBondContact CD1-O 3.45Å
131	A	95.9	Very high	96.9	Very high	17 Å²	17	65.5 Å²	65.5	14%	0.14	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-41.4	176.8	0	0	0	0	0	112.1	L38 T127 K133 S134 R135 A242	L38-A131 HydrophobicContact CB-CB 4.41Å; L38-A131 HydrophobicContact CD1-CB 3.67Å; L38-A131 HydrophobicContact CD2-CB 3.74Å; L38-A131 HydrophobicContact CG-CB 4.13Å; T127-A131 VanDerWaalsContact O-CB 3.27Å; T127-A131 WeakPolarHBondContact O-CB 3.32Å; T127-A131 PolarHBondContact O-N 3.5Å; A131-K133 PolarHBondContact O-N 3.37Å; A131-S134 PolarHBondContact O-N 3.46Å; A131-R135 WeakPolarHBondContact O-CB 3.15Å; A131-R135 PolarHBondContact O-N 2.86Å; A131-A242 HydrophobicContact CB-CB 4.41Å
132	K	95.7	Very high	96.9	Very high	121 Å²	121	62.5 Å²	62.5	53%	0.526	29%	0.293	S	S	.	.	H	α-helix	trans	-57.2	-50.6	172.2	-178.8	175.3	177.6	178.6	0	112	Q128 L130 S134 R135 D136	Q128-K132 WeakPolarHBondContact O-CB 3.41Å; Q128-K132 PolarHBondContact O-N 2.95Å; Q128-K132 VanDerWaalsContact O-N 3.1Å; L130-K132 VanDerWaalsContact C-N 3.32Å; L130-K132 PolarHBondContact O-N 3.34Å; K132-S134 VanDerWaalsContact C-N 3.34Å; K132-S134 PolarHBondContact O-N 3.33Å; K132-R135 PolarHBondContact O-N 3.33Å; K132-D136 WeakPolarHBondContact O-CB 3.39Å; K132-D136 PolarHBondContact O-N 2.97Å
133	K	96.6	Very high	96.9	Very high	152 Å²	152	62 Å²	62	66%	0.661	29%	0.294	S	S	*	.	H	α-helix	trans	-61.9	-39.4	178.7	-74.4	177.5	176.2	-173.6	0	112.7	R129 L130 A131 D136 L137	R129-K133 WeakPolarHBondContact O-CG 3.3Å; R129-K133 PolarHBondContact O-N 2.93Å; L130-K133 PolarHBondContact O-N 3Å; L130-K133 VanDerWaalsContact O-N 3.12Å; A131-K133 PolarHBondContact O-N 3.37Å; K133-D136 PolarHBondContact O-N 3.2Å; K133-L137 WeakPolarHBondContact O-CB 3.28Å; K133-L137 PolarHBondContact O-N 3.43Å
134	S	96.3	Very high	96.9	Very high	10 Å²	10	63.5 Å²	63.5	7%	0.07	31%	0.31	C	S	.	.	H	α-helix	trans	-65.3	-44.5	176.6	-176.7	0	0	0	0	111.1	L130 A131 K132 D136 L137 C138 L238	L130-S134 PolarHBondContact O-N 2.99Å; A131-S134 PolarHBondContact O-N 3.46Å; K132-S134 VanDerWaalsContact C-N 3.34Å; K132-S134 PolarHBondContact O-N 3.33Å; S134-D136 PolarHBondContact O-N 3.42Å; S134-L137 CarbonylContact O-C 3.6Å; S134-L137 PolarHBondContact O-N 3.48Å; S134-C138 WeakPolarHBondContact O-CB 3.28Å; S134-C138 PolarHBondContact O-N 2.99Å; S134-L238 PolarHBondContact OG-O 3.33Å
135	R	95.6	Very high	96.8	Very high	85 Å²	85	63.1 Å²	63.1	32%	0.321	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-44.8	174.5	-166.4	-173.6	67.8	-175.3	2.9	112.2	L31 D35 A131 K132 L137 C138 T139	L31-R135 HydrophobicContact CD2-CG 4.01Å; D35-R135 WeakPolarHBondContact OD1-CD 3.39Å; D35-R135 IonicContact OD1-CZ 3.02Å; D35-R135 IonicContact OD1-NE 2.89Å; D35-R135 IonicContact OD1-NH1 2.64Å; D35-R135 PolarHBondContact OD1-NH1 3.29Å; D35-R135 IonicContact OD2-NH1 2.68Å; A131-R135 WeakPolarHBondContact O-CB 3.15Å; A131-R135 PolarHBondContact O-N 2.86Å; K132-R135 PolarHBondContact O-N 3.33Å; R135-L137 PolarHBondContact O-N 3.09Å; R135-C138 WeakPolarHBondContact O-CB 3.36Å; R135-C138 PolarHBondContact O-N 3.24Å; R135-C138 VanDerWaalsContact O-N 3.12Å; R135-T139 PolarHBondContact O-N 3.47Å; R135-T139 PolarHBondContact O-OG1 3.42Å
136	D	96.1	Very high	96.7	Very high	71 Å²	71	61.2 Å²	61.2	38%	0.38	30%	0.297	S	S	.	.	H	α-helix	trans	-62.8	-30.5	178	-63.6	-16.1	0	0	0	111.7	K132 K133 S134 Q140	K132-D136 WeakPolarHBondContact O-CB 3.39Å; K132-D136 PolarHBondContact O-N 2.97Å; K133-D136 PolarHBondContact O-N 3.2Å; S134-D136 PolarHBondContact O-N 3.42Å; D136-Q140 PolarHBondContact O-NE2 3.22Å
137	L	97.1	Very high	96.7	Very high	84 Å²	84	64.9 Å²	64.9	44%	0.44	31%	0.314	S	S	.	.	H	α-helix	trans	-79.6	-35.7	171.7	-178.3	61.2	0	0	0	112.8	K133 S134 R135 T139 Q140 L141 L238	K133-L137 WeakPolarHBondContact O-CB 3.28Å; K133-L137 PolarHBondContact O-N 3.43Å; S134-L137 CarbonylContact O-C 3.6Å; S134-L137 PolarHBondContact O-N 3.48Å; R135-L137 PolarHBondContact O-N 3.09Å; L137-T139 PolarHBondContact O-N 3.1Å; L137-Q140 PolarHBondContact O-N 3.45Å; L137-L141 HydrophobicContact CG-CD1 4.17Å; L137-L141 PolarHBondContact O-N 3.07Å; L137-L141 VanDerWaalsContact O-N 3.11Å; L137-L238 HydrophobicContact CB-CD2 4.06Å; L137-L238 HydrophobicContact CD2-CD2 3.86Å; L137-L238 HydrophobicContact CG-CD2 3.92Å
138	C	97.6	Very high	96.6	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-58.3	-48	175.5	-170.3	0	0	0	0	110.7	L31 S134 R135 Q140 L141 Q142 L238	L31-C138 HydrophobicContact CD2-CB 4.11Å; S134-C138 WeakPolarHBondContact O-CB 3.28Å; S134-C138 PolarHBondContact O-N 2.99Å; R135-C138 WeakPolarHBondContact O-CB 3.36Å; R135-C138 PolarHBondContact O-N 3.24Å; R135-C138 VanDerWaalsContact O-N 3.12Å; C138-Q140 VanDerWaalsContact C-N 3.32Å; C138-Q140 PolarHBondContact O-N 3.49Å; C138-L141 PolarHBondContact O-N 3.02Å; C138-L141 VanDerWaalsContact O-N 3.11Å; C138-Q142 WeakPolarHBondContact O-CG 3.35Å; C138-Q142 PolarHBondContact O-N 3.27Å; C138-L238 HydrophobicContact CB-CD1 3.77Å; C138-L238 HydrophobicContact CB-CD2 4.48Å
139	T	97.1	Very high	96.4	Very high	51 Å²	51	63.5 Å²	63.5	31%	0.313	31%	0.311	S	S	.	.	H	α-helix	trans	-56	-43.9	175.9	-52.5	0	0	0	0	112	R135 L137 L141 Q142 D143	R135-T139 PolarHBondContact O-N 3.47Å; R135-T139 PolarHBondContact O-OG1 3.42Å; L137-T139 PolarHBondContact O-N 3.1Å; T139-L141 VanDerWaalsContact C-N 3.33Å; T139-L141 PolarHBondContact O-N 3.09Å; T139-Q142 PolarHBondContact O-N 3.46Å; T139-D143 WeakPolarHBondContact O-CB 3.43Å; T139-D143 PolarHBondContact O-N 2.94Å
140	Q	97.1	Very high	96.2	Very high	126 Å²	126	58 Å²	58	59%	0.589	30%	0.296	S	S	*	.	H	α-helix	trans	-62.6	-37.7	177.9	-69.9	168	68.3	0	0	112.7	D136 L137 C138 G144	D136-Q140 PolarHBondContact O-NE2 3.22Å; L137-Q140 PolarHBondContact O-N 3.45Å; C138-Q140 VanDerWaalsContact C-N 3.32Å; C138-Q140 PolarHBondContact O-N 3.49Å; Q140-G144 PolarHBondContact O-N 3.28Å; Q140-G144 VanDerWaalsContact O-N 3.07Å
141	L	97	Very high	96.1	Very high	54 Å²	54	59.1 Å²	59.1	28%	0.283	30%	0.299	S	S	.	.	H	α-helix	trans	-72.1	-37.4	176	-70.9	162.6	0	0	0	111.8	L137 C138 T139 G144 L145 Y230 D234 L238	L137-L141 HydrophobicContact CG-CD1 4.17Å; L137-L141 PolarHBondContact O-N 3.07Å; L137-L141 VanDerWaalsContact O-N 3.11Å; C138-L141 PolarHBondContact O-N 3.02Å; C138-L141 VanDerWaalsContact O-N 3.11Å; T139-L141 VanDerWaalsContact C-N 3.33Å; T139-L141 PolarHBondContact O-N 3.09Å; L141-G144 PolarHBondContact O-N 2.79Å; L141-L145 WeakPolarHBondContact O-CB 3.3Å; L141-L145 PolarHBondContact O-N 2.85Å; L141-Y230 HydrophobicContact CB-CD2 4.16Å; L141-Y230 HydrophobicContact CB-CE2 4.05Å; L141-D234 HydrophobicContact CD1-CB 4.35Å; L141-L238 HydrophobicContact CD1-CD1 3.92Å; L141-L238 HydrophobicContact CD1-CD2 4.35Å; L141-L238 HydrophobicContact CD1-CG 4.39Å
142	Q	97.4	Very high	96	Very high	10 Å²	10	58.7 Å²	58.7	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-64.8	-45	173.7	-71.2	-172.2	-9.9	0	0	111.9	L27 C138 T139 G144 L145 L146 Y230	L27-Q142 HydrophobicContact CB-CG 4.22Å; L27-Q142 HydrophobicContact CD1-CB 4.07Å; L27-Q142 HydrophobicContact CD1-CG 4.15Å; L27-Q142 HydrophobicContact CD2-CG 4.04Å; L27-Q142 HydrophobicContact CG-CG 4.33Å; L27-Q142 PolarHBondContact O-NE2 2.96Å; L27-Q142 PolarHBondContact O-OE1 3.2Å; C138-Q142 WeakPolarHBondContact O-CG 3.35Å; C138-Q142 PolarHBondContact O-N 3.27Å; T139-Q142 PolarHBondContact O-N 3.46Å; Q142-G144 VanDerWaalsContact C-N 3.32Å; Q142-G144 PolarHBondContact O-N 3.4Å; Q142-L145 PolarHBondContact O-N 3.11Å; Q142-L146 WeakPolarHBondContact O-CB 3.4Å; Q142-L146 VanDerWaalsContact O-CG 3.24Å; Q142-L146 WeakPolarHBondContact O-CG 3.5Å; Q142-L146 PolarHBondContact O-N 3.24Å; Q142-Y230 HydrophobicContact CG-CE2 4.1Å; Q142-Y230 VanDerWaalsContact CG-OH 3.28Å; Q142-Y230 WeakPolarHBondContact CG-OH 3.4Å; Q142-Y230 PolarHBondContact NE2-OH 3.35Å
143	D	96.9	Very high	95.8	Very high	99 Å²	99	53.6 Å²	53.6	53%	0.529	27%	0.272	S	S	.	.	H	α-helix	trans	-60.7	-41.2	174.2	-77.1	-30.1	0	0	0	111.6	T139 L146 K147	T139-D143 WeakPolarHBondContact O-CB 3.43Å; T139-D143 PolarHBondContact O-N 2.94Å; D143-L146 PolarHBondContact O-N 3.36Å; D143-K147 WeakPolarHBondContact O-CB 3.3Å; D143-K147 PolarHBondContact O-N 2.97Å
144	G	96.6	Very high	95.7	Very high	32 Å²	32	50 Å²	50	33%	0.33	26%	0.264	S	S	.	.	H	α-helix	trans	-60.4	-49	173.7	0	0	0	0	0	112.9	Q140 L141 Q142 L146 K147 V148	Q140-G144 PolarHBondContact O-N 3.28Å; Q140-G144 VanDerWaalsContact O-N 3.07Å; L141-G144 PolarHBondContact O-N 2.79Å; Q142-G144 VanDerWaalsContact C-N 3.32Å; Q142-G144 PolarHBondContact O-N 3.4Å; G144-L146 VanDerWaalsContact C-N 3.35Å; G144-L146 PolarHBondContact O-N 3.2Å; G144-K147 PolarHBondContact O-N 3.12Å; G144-V148 PolarHBondContact O-N 2.96Å; G144-V148 VanDerWaalsContact O-N 3.14Å
145	L	96.7	Very high	95.6	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-43.3	176.1	178.2	61.5	0	0	0	111.4	M23 L27 L141 Q142 K147 V148 T149 M227 Y230 Y231	M23-L145 HydrophobicContact CE-CD2 4.49Å; M23-L145 HydrophobicContact CE-CG 4.13Å; M23-L145 HydrophobicContact SD-CD2 4.14Å; M23-L145 HydrophobicContact SD-CG 4.25Å; L27-L145 HydrophobicContact CD1-CD2 4.37Å; L27-L145 HydrophobicContact CD2-CD2 4.46Å; L141-L145 WeakPolarHBondContact O-CB 3.3Å; L141-L145 PolarHBondContact O-N 2.85Å; Q142-L145 PolarHBondContact O-N 3.11Å; L145-K147 VanDerWaalsContact C-N 3.35Å; L145-K147 PolarHBondContact O-N 2.82Å; L145-V148 PolarHBondContact O-N 3.38Å; L145-T149 WeakPolarHBondContact O-CB 3.08Å; L145-T149 PolarHBondContact O-N 2.95Å; L145-T149 PolarHBondContact O-OG1 2.81Å; L145-M227 HydrophobicContact CD1-CB 3.96Å; L145-M227 HydrophobicContact CD1-CG 4.4Å; L145-Y230 HydrophobicContact CD2-CD1 3.78Å; L145-Y230 HydrophobicContact CD2-CE1 4.47Å; L145-Y230 HydrophobicContact CD2-CG 3.94Å; L145-Y231 HydrophobicContact CD2-CE2 4.13Å
146	L	95.1	Very high	95.5	Very high	33 Å²	33	48.4 Å²	48.4	17%	0.173	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-41.5	177.4	-74.7	167.6	0	0	0	112	M23 R24 L27 Q142 D143 G144 T149 T150	M23-L146 HydrophobicContact CE-CD2 3.63Å; M23-L146 HydrophobicContact CE-CG 4.33Å; R24-L146 HydrophobicContact CG-CD1 4.43Å; R24-L146 HydrophobicContact CG-CD2 3.35Å; L27-L146 HydrophobicContact CD1-CD1 4.21Å; L27-L146 HydrophobicContact CD1-CD2 4.2Å; L27-L146 HydrophobicContact CD1-CG 3.95Å; Q142-L146 WeakPolarHBondContact O-CB 3.4Å; Q142-L146 VanDerWaalsContact O-CG 3.24Å; Q142-L146 WeakPolarHBondContact O-CG 3.5Å; Q142-L146 PolarHBondContact O-N 3.24Å; D143-L146 PolarHBondContact O-N 3.36Å; G144-L146 VanDerWaalsContact C-N 3.35Å; G144-L146 PolarHBondContact O-N 3.2Å; L146-T149 PolarHBondContact O-N 3.1Å; L146-T150 WeakPolarHBondContact O-CG2 3.29Å; L146-T150 PolarHBondContact O-N 3.33Å; L146-T150 PolarHBondContact O-OG1 2.96Å
147	K	96.3	Very high	95.3	Very high	126 Å²	126	49.7 Å²	49.7	55%	0.548	26%	0.259	S	S	.	.	H	α-helix	trans	-59.5	-56.4	175.8	179.5	-178.9	167.5	-176.9	0	111.7	D143 G144 L145 T149 T150 E151	D143-K147 WeakPolarHBondContact O-CB 3.3Å; D143-K147 PolarHBondContact O-N 2.97Å; G144-K147 PolarHBondContact O-N 3.12Å; L145-K147 VanDerWaalsContact C-N 3.35Å; L145-K147 PolarHBondContact O-N 2.82Å; K147-T149 PolarHBondContact O-N 2.82Å; K147-T150 PolarHBondContact O-N 3.09Å; K147-T150 PolarHBondContact O-OG1 3.3Å; K147-E151 WeakPolarHBondContact CE-OE1 3.45Å; K147-E151 IonicContact NZ-OE1 2.67Å; K147-E151 WeakPolarHBondContact O-CG 3.28Å; K147-E151 PolarHBondContact O-N 3Å
148	V	96	Very high	95.1	Very high	33 Å²	33	48.8 Å²	48.8	20%	0.2	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-35.2	-179.7	-177.8	0	0	0	0	111.3	G144 L145 E151 L152 A222 A223	G144-V148 PolarHBondContact O-N 2.96Å; G144-V148 VanDerWaalsContact O-N 3.14Å; L145-V148 PolarHBondContact O-N 3.38Å; V148-E151 PolarHBondContact O-N 2.97Å; V148-L152 PolarHBondContact O-N 2.67Å; V148-A222 HydrophobicContact CG1-CB 4.34Å; V148-A223 HydrophobicContact CG1-CB 4.03Å
149	T	93.5	Very high	95	Very high	18 Å²	18	51.1 Å²	51.1	11%	0.11	27%	0.266	C	S	.	.	H	α-helix	trans	-71.8	-31.2	177	-44.3	0	0	0	0	112.5	I20 M23 L145 L146 K147 Q153	I20-T149 HydrophobicContact CD1-CG2 3.9Å; I20-T149 HydrophobicContact CG1-CG2 3.65Å; M23-T149 HydrophobicContact CE-CG2 4.16Å; L145-T149 WeakPolarHBondContact O-CB 3.08Å; L145-T149 PolarHBondContact O-N 2.95Å; L145-T149 PolarHBondContact O-OG1 2.81Å; L146-T149 PolarHBondContact O-N 3.1Å; K147-T149 PolarHBondContact O-N 2.82Å; T149-Q153 PolarHBondContact O-N 3.02Å; T149-Q153 VanDerWaalsContact O-N 3.15Å
150	T	92.1	Very high	94.7	Very high	45 Å²	45	53.4 Å²	53.4	28%	0.276	27%	0.273	S	S	.	.	H	α-helix	trans	-72.8	-30	169.5	55.6	0	0	0	0	113.5	L146 K147 Q153 T154	L146-T150 WeakPolarHBondContact O-CG2 3.29Å; L146-T150 PolarHBondContact O-N 3.33Å; L146-T150 PolarHBondContact O-OG1 2.96Å; K147-T150 PolarHBondContact O-N 3.09Å; K147-T150 PolarHBondContact O-OG1 3.3Å; T150-Q153 WeakPolarHBondContact O-CB 3.4Å; T150-Q153 PolarHBondContact O-N 2.98Å; T150-T154 PolarHBondContact O-N 3.23Å; T150-T154 PolarHBondContact O-OG1 3.07Å
151	E	94.8	Very high	94.5	Very high	73 Å²	73	52.3 Å²	52.3	34%	0.341	27%	0.268	S	S	.	.	H	α-helix	trans	-68.1	-40.3	173.6	-69.4	168.6	167.6	0	0	111.3	K147 V148 Q153 T154 A155	K147-E151 WeakPolarHBondContact CE-OE1 3.45Å; K147-E151 IonicContact NZ-OE1 2.67Å; K147-E151 WeakPolarHBondContact O-CG 3.28Å; K147-E151 PolarHBondContact O-N 3Å; V148-E151 PolarHBondContact O-N 2.97Å; E151-Q153 VanDerWaalsContact C-N 3.33Å; E151-Q153 PolarHBondContact O-N 3.14Å; E151-T154 PolarHBondContact O-N 3.1Å; E151-T154 PolarHBondContact O-OG1 3.43Å; E151-T154 VanDerWaalsContact O-OG1 3.09Å; E151-A155 WeakPolarHBondContact O-CB 3.44Å; E151-A155 PolarHBondContact O-N 3.46Å; E151-A155 VanDerWaalsContact O-N 3.07Å
152	L	94.6	Very high	94.4	Very high	7 Å²	7	53.2 Å²	53.2	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-55.8	-46.2	165.9	169	58.6	0	0	0	111.9	Y16 V148 T154 A155 W156 Y216 N219 L220 A223	Y16-L152 HydrophobicContact CE1-CD2 4.43Å; V148-L152 PolarHBondContact O-N 2.67Å; L152-T154 PolarHBondContact O-N 3.44Å; L152-A155 PolarHBondContact O-N 3.37Å; L152-W156 WeakPolarHBondContact O-CB 3.42Å; L152-W156 PolarHBondContact O-N 3.07Å; L152-Y216 HydrophobicContact CD1-CD2 3.81Å; L152-Y216 HydrophobicContact CD1-CE2 3.6Å; L152-N219 HydrophobicContact CB-CB 4.43Å; L152-N219 HydrophobicContact CD1-CB 4.49Å; L152-L220 HydrophobicContact CD1-CB 3.82Å; L152-L220 HydrophobicContact CD1-CD1 4.07Å; L152-L220 HydrophobicContact CD2-CD1 3.96Å; L152-A223 HydrophobicContact CB-CB 4.08Å; L152-A223 HydrophobicContact CD2-CB 3.76Å
153	Q	92.1	Very high	94.2	Very high	14 Å²	14	56.3 Å²	56.3	7%	0.065	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-40.7	-176.5	-159.4	-168	50.7	0	0	112.7	D17 I20 T149 T150 E151 R157	D17-Q153 PolarHBondContact OD1-NE2 2.83Å; D17-Q153 PolarHBondContact OD2-NE2 3.32Å; I20-Q153 HydrophobicContact CD1-CB 3.92Å; I20-Q153 HydrophobicContact CD1-CG 4.05Å; T149-Q153 PolarHBondContact O-N 3.02Å; T149-Q153 VanDerWaalsContact O-N 3.15Å; T150-Q153 WeakPolarHBondContact O-CB 3.4Å; T150-Q153 PolarHBondContact O-N 2.98Å; E151-Q153 VanDerWaalsContact C-N 3.33Å; E151-Q153 PolarHBondContact O-N 3.14Å; Q153-R157 VanDerWaalsContact CD-CZ 3.44Å; Q153-R157 VanDerWaalsContact CD-NH1 3.29Å; Q153-R157 WeakPolarHBondContact O-CG 3.48Å; Q153-R157 PolarHBondContact O-N 2.8Å; Q153-R157 VanDerWaalsContact OE1-CZ 3.27Å
154	T	93	Very high	94	Very high	77 Å²	77	54.9 Å²	54.9	47%	0.472	28%	0.28	S	S	.	.	H	α-helix	trans	-71.9	-38.3	177.5	55.8	0	0	0	0	112	T150 E151 L152 R157 T158	T150-T154 PolarHBondContact O-N 3.23Å; T150-T154 PolarHBondContact O-OG1 3.07Å; E151-T154 PolarHBondContact O-N 3.1Å; E151-T154 PolarHBondContact O-OG1 3.43Å; E151-T154 VanDerWaalsContact O-OG1 3.09Å; L152-T154 PolarHBondContact O-N 3.44Å; T154-R157 PolarHBondContact O-N 3.2Å; T154-T158 WeakPolarHBondContact O-CB 3.37Å; T154-T158 PolarHBondContact O-N 3.38Å; T154-T158 PolarHBondContact O-OG1 2.89Å
155	A	94.4	Very high	93.8	Very high	15 Å²	15	56.7 Å²	56.7	12%	0.124	28%	0.28	C	S	.	.	H	α-helix	trans	-61.8	-43.1	172.3	0	0	0	0	0	111.8	E151 L152 T158 Y159 N219	E151-A155 WeakPolarHBondContact O-CB 3.44Å; E151-A155 PolarHBondContact O-N 3.46Å; E151-A155 VanDerWaalsContact O-N 3.07Å; L152-A155 PolarHBondContact O-N 3.37Å; A155-T158 PolarHBondContact O-N 2.9Å; A155-Y159 PolarHBondContact O-N 2.9Å; A155-N219 HydrophobicContact CB-CB 4.19Å
156	W	93.8	Very high	93.6	Very high	47 Å²	47	58.1 Å²	58.1	18%	0.178	29%	0.286	C	S	.	.	H	α-helix	trans	-61.8	-48.9	175.8	175.9	79.2	0	0	0	112.7	V13 Y16 L152 T158 Y159 H160 Y216	V13-W156 HydrophobicContact CG1-CH2 4.28Å; V13-W156 HydrophobicContact CG1-CZ2 4.26Å; Y16-W156 HydrophobicContact CD2-CB 4.43Å; Y16-W156 AromaticContact CD2-CD2 3.73Å; Y16-W156 HydrophobicContact CD2-CD2 3.73Å; Y16-W156 HydrophobicContact CD2-CE3 4.06Å; Y16-W156 AromaticContact CD2-CG 3.87Å; Y16-W156 HydrophobicContact CD2-CG 3.87Å; Y16-W156 HydrophobicContact CE2-CB 4.37Å; Y16-W156 AromaticContact CE2-CD1 3.66Å; Y16-W156 AromaticContact CE2-CD2 3.99Å; Y16-W156 HydrophobicContact CE2-CD2 3.99Å; Y16-W156 AromaticContact CE2-CG 3.74Å; Y16-W156 HydrophobicContact CE2-CG 3.74Å; Y16-W156 AromaticContact CE2-NE1 3.83Å; L152-W156 WeakPolarHBondContact O-CB 3.42Å; L152-W156 PolarHBondContact O-N 3.07Å; W156-T158 VanDerWaalsContact C-N 3.27Å; W156-T158 PolarHBondContact O-N 2.94Å; W156-Y159 PolarHBondContact O-N 2.83Å; W156-H160 WeakPolarHBondContact O-CB 3.48Å; W156-H160 PolarHBondContact O-N 3.18Å; W156-Y216 HydrophobicContact CB-CD2 3.68Å; W156-Y216 HydrophobicContact CB-CE2 3.69Å; W156-Y216 AromaticContact CD1-CE2 3.57Å; W156-Y216 AromaticContact CD1-CZ 3.82Å; W156-Y216 HydrophobicContact CG-CD2 4.36Å; W156-Y216 HydrophobicContact CG-CE2 4.01Å
157	R	91.4	Very high	93.5	Very high	98 Å²	98	60 Å²	60	37%	0.37	30%	0.299	S	S	.	.	H	α-helix	trans	-57.5	-42.3	176.6	-73.1	-176.7	-175	119.1	-4.2	111.3	D17 Q153 T154 H160 Q161	D17-R157 IonicContact OD1-NH2 3.47Å; D17-R157 PolarHBondContact OD1-NH2 3Å; D17-R157 IonicContact OD2-CZ 3.89Å; D17-R157 IonicContact OD2-NH2 3.5Å; D17-R157 PolarHBondContact OD2-NH2 3.37Å; Q153-R157 VanDerWaalsContact CD-CZ 3.44Å; Q153-R157 VanDerWaalsContact CD-NH1 3.29Å; Q153-R157 WeakPolarHBondContact O-CG 3.48Å; Q153-R157 PolarHBondContact O-N 2.8Å; Q153-R157 VanDerWaalsContact OE1-CZ 3.27Å; T154-R157 PolarHBondContact O-N 3.2Å; R157-H160 PolarHBondContact O-N 3.33Å; R157-Q161 WeakPolarHBondContact O-CB 3.4Å; R157-Q161 PolarHBondContact O-N 2.69Å
158	T	93.7	Very high	93.3	Very high	65 Å²	65	57 Å²	57	40%	0.399	29%	0.293	S	S	.	.	H	α-helix	trans	-64.3	-44.6	178.4	-55.7	0	0	0	0	112	T154 A155 W156 Y162 A212	T154-T158 WeakPolarHBondContact O-CB 3.37Å; T154-T158 PolarHBondContact O-N 3.38Å; T154-T158 PolarHBondContact O-OG1 2.89Å; A155-T158 PolarHBondContact O-N 2.9Å; W156-T158 VanDerWaalsContact C-N 3.27Å; W156-T158 PolarHBondContact O-N 2.94Å; T158-Y162 HydrophobicContact CG2-CD2 3.92Å; T158-Y162 HydrophobicContact CG2-CE2 3.58Å; T158-Y162 VanDerWaalsContact O-CD2 3.28Å; T158-Y162 WeakPolarHBondContact O-CD2 3.37Å; T158-Y162 PolarHBondContact O-N 3.15Å; T158-A212 HydrophobicContact CG2-CB 4.3Å
159	Y	94.8	Very high	93.1	Very high	49 Å²	49	56.1 Å²	56.1	19%	0.192	29%	0.289	C	S	.	.	H	α-helix	trans	-61.9	-46.2	173.5	166.3	-117.4	0	0	0	112	A155 W156 Q161 Y162 H163 R213 Y216	A155-Y159 PolarHBondContact O-N 2.9Å; W156-Y159 PolarHBondContact O-N 2.83Å; Y159-Q161 PolarHBondContact O-N 2.81Å; Y159-Y162 PolarHBondContact O-N 2.79Å; Y159-H163 HydrophobicContact CE2-CB 4.23Å; Y159-H163 VanDerWaalsContact O-CB 3.32Å; Y159-H163 WeakPolarHBondContact O-CB 3.45Å; Y159-H163 PolarHBondContact O-N 3.23Å; Y159-R213 HydrophobicContact CD2-CB 3.54Å; Y159-R213 HydrophobicContact CD2-CG 4.09Å; Y159-R213 HydrophobicContact CE2-CB 3.5Å; Y159-R213 HydrophobicContact CE2-CG 3.68Å; Y159-R213 HydrophobicContact CG-CB 4.41Å; Y159-Y216 HydrophobicContact CD1-CD1 4.01Å; Y159-Y216 HydrophobicContact CD1-CE1 4.47Å; Y159-Y216 HydrophobicContact CD1-CG 4.43Å
160	H	91.4	Very high	93	Very high	98 Å²	98	57.8 Å²	57.8	45%	0.454	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-41.9	-178.9	-169.6	82.4	0	0	0	112.1	W156 R157 H163 S164	W156-H160 WeakPolarHBondContact O-CB 3.48Å; W156-H160 PolarHBondContact O-N 3.18Å; R157-H160 PolarHBondContact O-N 3.33Å; H160-H163 PolarHBondContact O-N 2.71Å; H160-S164 PolarHBondContact O-N 2.85Å
161	Q	92.7	Very high	92.9	Very high	104 Å²	104	56.9 Å²	56.9	49%	0.486	30%	0.295	S	S	.	.	H	α-helix	trans	-59.5	-54.1	174.8	178.2	58.4	30	0	0	111.7	R157 Y159 H163 S164 E165	R157-Q161 WeakPolarHBondContact O-CB 3.4Å; R157-Q161 PolarHBondContact O-N 2.69Å; Y159-Q161 PolarHBondContact O-N 2.81Å; Q161-H163 VanDerWaalsContact C-N 3.25Å; Q161-H163 PolarHBondContact O-N 3.25Å; Q161-S164 WeakPolarHBondContact O-CB 3.35Å; Q161-S164 PolarHBondContact O-N 3.26Å; Q161-E165 PolarHBondContact NE2-OE1 3.49Å; Q161-E165 PolarHBondContact O-N 3.39Å
162	Y	94.3	Very high	92.7	Very high	73 Å²	73	58.4 Å²	58.4	29%	0.286	30%	0.301	S	S	.	.	H	α-helix	trans	-66.4	-26	179	-68.7	-48.1	0	0	0	113.4	T158 Y159 F166 K208 A212	T158-Y162 HydrophobicContact CG2-CD2 3.92Å; T158-Y162 HydrophobicContact CG2-CE2 3.58Å; T158-Y162 VanDerWaalsContact O-CD2 3.28Å; T158-Y162 WeakPolarHBondContact O-CD2 3.37Å; T158-Y162 PolarHBondContact O-N 3.15Å; Y159-Y162 PolarHBondContact O-N 2.79Å; Y162-F166 VanDerWaalsContact O-CB 3.31Å; Y162-F166 WeakPolarHBondContact O-CB 3.38Å; Y162-F166 PolarHBondContact O-N 3.3Å; Y162-K208 HydrophobicContact CD1-CB 4.48Å; Y162-K208 HydrophobicContact CE1-CD 4.3Å; Y162-K208 HydrophobicContact CG-CB 4.5Å; Y162-A212 HydrophobicContact CD2-CB 3.72Å; Y162-A212 HydrophobicContact CE2-CB 4.31Å
163	H	93.3	Very high	92.4	Very high	74 Å²	74	58.5 Å²	58.5	34%	0.343	30%	0.302	S	S	.	.	H	α-helix	trans	-70.8	-40.4	172.9	-172.2	56.3	0	0	0	112	Y159 H160 Q161 F166 V167	Y159-H163 HydrophobicContact CE2-CB 4.23Å; Y159-H163 VanDerWaalsContact O-CB 3.32Å; Y159-H163 WeakPolarHBondContact O-CB 3.45Å; Y159-H163 PolarHBondContact O-N 3.23Å; H160-H163 PolarHBondContact O-N 2.71Å; Q161-H163 VanDerWaalsContact C-N 3.25Å; Q161-H163 PolarHBondContact O-N 3.25Å; H163-F166 PolarHBondContact O-N 3.47Å; H163-V167 WeakPolarHBondContact O-CG2 3.32Å; H163-V167 PolarHBondContact O-N 3.28Å
164	S	92.6	Very high	92.2	Very high	70 Å²	70	63.7 Å²	63.7	49%	0.49	32%	0.32	S	S	.	.	H	α-helix	trans	-62.4	-44.8	172.3	-171.3	0	0	0	0	111.6	H160 Q161 F166 V167 C168	H160-S164 PolarHBondContact O-N 2.85Å; Q161-S164 WeakPolarHBondContact O-CB 3.35Å; Q161-S164 PolarHBondContact O-N 3.26Å; S164-F166 PolarHBondContact O-N 2.91Å; S164-V167 PolarHBondContact O-N 3.1Å; S164-C168 VanDerWaalsContact O-CB 3.27Å; S164-C168 WeakPolarHBondContact O-CB 3.42Å; S164-C168 PolarHBondContact O-N 2.91Å
165	E	93.1	Very high	91.9	Very high	69 Å²	69	65.3 Å²	65.3	32%	0.322	32%	0.323	S	S	.	.	H	α-helix	trans	-60.5	-41.5	173	-72.3	175.2	-155.1	0	0	112.4	Q161 C168 A169 I205	Q161-E165 PolarHBondContact NE2-OE1 3.49Å; Q161-E165 PolarHBondContact O-N 3.39Å; E165-C168 PolarHBondContact O-N 2.78Å; E165-A169 WeakPolarHBondContact O-CB 3.18Å; E165-A169 PolarHBondContact O-N 2.96Å; E165-I205 HydrophobicContact CB-CG2 4.06Å
166	F	93.5	Very high	91.4	Very high	32 Å²	32	64.6 Å²	64.6	14%	0.14	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-51.2	176.2	171.6	-100.9	0	0	0	111.7	Y162 H163 S164 C168 A169 E170 V202 I205 Q206 C209	Y162-F166 VanDerWaalsContact O-CB 3.31Å; Y162-F166 WeakPolarHBondContact O-CB 3.38Å; Y162-F166 PolarHBondContact O-N 3.3Å; H163-F166 PolarHBondContact O-N 3.47Å; S164-F166 PolarHBondContact O-N 2.91Å; F166-C168 VanDerWaalsContact C-N 3.28Å; F166-C168 PolarHBondContact O-N 3.45Å; F166-A169 PolarHBondContact O-N 3.37Å; F166-A169 VanDerWaalsContact O-N 3.15Å; F166-E170 HydrophobicContact CZ-CB 4.43Å; F166-E170 WeakPolarHBondContact O-CB 3.49Å; F166-E170 PolarHBondContact O-N 3.05Å; F166-V202 HydrophobicContact CE2-CG1 3.89Å; F166-I205 HydrophobicContact CB-CG2 3.93Å; F166-Q206 HydrophobicContact CD2-CB 3.85Å; F166-Q206 HydrophobicContact CD2-CG 4.31Å; F166-Q206 HydrophobicContact CE2-CB 3.68Å; F166-Q206 HydrophobicContact CE2-CG 3.82Å; F166-Q206 HydrophobicContact CZ-CG 4.48Å; F166-C209 HydrophobicContact CB-CB 4.33Å
167	V	92.6	Very high	90.9	Very high	74 Å²	74	65.7 Å²	65.7	45%	0.448	32%	0.324	S	S	.	.	H	α-helix	trans	-62.9	-36.8	179.1	173.3	0	0	0	0	111.1	H163 S164 G171	H163-V167 WeakPolarHBondContact O-CG2 3.32Å; H163-V167 PolarHBondContact O-N 3.28Å; S164-V167 PolarHBondContact O-N 3.1Å; V167-G171 PolarHBondContact O-N 2.83Å
168	C	92.5	Very high	90.5	Very high	61 Å²	61	67.1 Å²	67.1	41%	0.412	33%	0.333	S	S	.	.	H	α-helix	trans	-65.8	-39.8	174.4	-171	0	0	0	0	112.6	S164 E165 F166 K172	S164-C168 VanDerWaalsContact O-CB 3.27Å; S164-C168 WeakPolarHBondContact O-CB 3.42Å; S164-C168 PolarHBondContact O-N 2.91Å; E165-C168 PolarHBondContact O-N 2.78Å; F166-C168 VanDerWaalsContact C-N 3.28Å; F166-C168 PolarHBondContact O-N 3.45Å; C168-K172 WeakPolarHBondContact O-CD 3.44Å; C168-K172 VanDerWaalsContact O-CG 3.29Å; C168-K172 WeakPolarHBondContact O-CG 3.12Å; C168-K172 PolarHBondContact O-N 3.46Å; C168-K172 PolarHBondContact SG-NZ 2.87Å
169	A	91.2	Very high	89.7	Confident	16 Å²	16	68.5 Å²	68.5	13%	0.132	34%	0.335	C	S	.	.	H	α-helix	trans	-71.1	-42	176.1	0	0	0	0	0	112.1	E165 F166 K172 L173 V202 I205	E165-A169 WeakPolarHBondContact O-CB 3.18Å; E165-A169 PolarHBondContact O-N 2.96Å; F166-A169 PolarHBondContact O-N 3.37Å; F166-A169 VanDerWaalsContact O-N 3.15Å; A169-K172 PolarHBondContact O-N 2.67Å; A169-L173 PolarHBondContact O-N 2.79Å; A169-V202 HydrophobicContact CB-CG2 3.9Å; A169-V202 WeakPolarHBondContact O-CG2 3.49Å; A169-I205 HydrophobicContact CB-CD1 3.79Å
170	E	91.1	Very high	88.7	Confident	52 Å²	52	69.8 Å²	69.8	24%	0.243	34%	0.343	C	S	.	.	H	α-helix	trans	-64.6	-41.7	176.9	-168.3	-169.7	-154.6	0	0	111.5	F166 K172 L173 R174	F166-E170 HydrophobicContact CZ-CB 4.43Å; F166-E170 WeakPolarHBondContact O-CB 3.49Å; F166-E170 PolarHBondContact O-N 3.05Å; E170-K172 PolarHBondContact O-N 3.14Å; E170-L173 WeakPolarHBondContact O-CB 3.38Å; E170-L173 PolarHBondContact O-N 3.28Å; E170-R174 VanDerWaalsContact CD-CZ 3.47Å; E170-R174 WeakPolarHBondContact O-CG 3.34Å; E170-R174 PolarHBondContact O-N 2.94Å; E170-R174 IonicContact OE1-CZ 3.18Å; E170-R174 IonicContact OE1-NE 2.71Å; E170-R174 IonicContact OE1-NH2 2.71Å; E170-R174 PolarHBondContact OE1-NH2 2.92Å; E170-R174 IonicContact OE2-CZ 2.64Å; E170-R174 IonicContact OE2-NH2 3.08Å; E170-R174 PolarHBondContact OE2-NH2 3.42Å
171	G	91.2	Very high	87.6	Confident	26 Å²	26	73 Å²	73	27%	0.268	36%	0.358	S	S	.	.	H	α-helix	trans	-57.1	-48.2	172.2	0	0	0	0	0	111.9	V167 L173 R174 E175	V167-G171 PolarHBondContact O-N 2.83Å; G171-L173 VanDerWaalsContact C-N 3.32Å; G171-L173 PolarHBondContact O-N 3.42Å; G171-R174 PolarHBondContact O-N 3.34Å; G171-E175 WeakPolarHBondContact O-CG 3.46Å; G171-E175 PolarHBondContact O-N 3.22Å
172	K	90.6	Very high	86.5	Confident	105 Å²	105	76.2 Å²	76.2	46%	0.457	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-33.6	176.2	-71.7	163.9	-176.4	163.9	0	112.7	C168 A169 E170 A176 R198	C168-K172 WeakPolarHBondContact O-CD 3.44Å; C168-K172 VanDerWaalsContact O-CG 3.29Å; C168-K172 WeakPolarHBondContact O-CG 3.12Å; C168-K172 PolarHBondContact O-N 3.46Å; C168-K172 PolarHBondContact SG-NZ 2.87Å; A169-K172 PolarHBondContact O-N 2.67Å; E170-K172 PolarHBondContact O-N 3.14Å; K172-A176 PolarHBondContact O-N 3.48Å; K172-R198 WeakPolarHBondContact O-CD 3.3Å; K172-R198 PolarHBondContact O-NH1 3.25Å
173	L	88.2	Confident	84.9	Confident	10 Å²	10	77 Å²	77	5%	0.052	38%	0.377	C	S	.	.	H	α-helix	trans	-64.3	-54.4	172.7	172.2	66.4	0	0	0	110.4	A169 E170 G171 E175 A176 E177 I195 R198 Q199 V202	A169-L173 PolarHBondContact O-N 2.79Å; E170-L173 WeakPolarHBondContact O-CB 3.38Å; E170-L173 PolarHBondContact O-N 3.28Å; G171-L173 VanDerWaalsContact C-N 3.32Å; G171-L173 PolarHBondContact O-N 3.42Å; L173-E175 PolarHBondContact O-N 2.91Å; L173-A176 WeakPolarHBondContact O-CA 3.34Å; L173-A176 WeakPolarHBondContact O-CB 3.47Å; L173-A176 PolarHBondContact O-N 2.72Å; L173-E177 HydrophobicContact CD1-CG 4.38Å; L173-E177 PolarHBondContact O-N 2.76Å; L173-I195 HydrophobicContact CD1-CG2 4.15Å; L173-R198 HydrophobicContact CB-CB 4.39Å; L173-R198 HydrophobicContact CD1-CB 3.9Å; L173-Q199 HydrophobicContact CD1-CB 4.46Å; L173-V202 HydrophobicContact CB-CG2 3.94Å; L173-V202 HydrophobicContact CD2-CB 4.3Å; L173-V202 HydrophobicContact CD2-CG1 4.38Å; L173-V202 HydrophobicContact CD2-CG2 3.98Å
174	R	87.6	Confident	83	Confident	122 Å²	122	82.7 Å²	82.7	46%	0.46	40%	0.4	S	S	.	.	H	α-helix	trans	-59.1	-29.6	178.9	-66.1	174.7	-173.9	170.7	3.6	113.7	E170 G171 E177 K178	E170-R174 VanDerWaalsContact CD-CZ 3.47Å; E170-R174 WeakPolarHBondContact O-CG 3.34Å; E170-R174 PolarHBondContact O-N 2.94Å; E170-R174 IonicContact OE1-CZ 3.18Å; E170-R174 IonicContact OE1-NE 2.71Å; E170-R174 IonicContact OE1-NH2 2.71Å; E170-R174 PolarHBondContact OE1-NH2 2.92Å; E170-R174 IonicContact OE2-CZ 2.64Å; E170-R174 IonicContact OE2-NH2 3.08Å; E170-R174 PolarHBondContact OE2-NH2 3.42Å; G171-R174 PolarHBondContact O-N 3.34Å; R174-E177 WeakPolarHBondContact CA-OE2 3.34Å; R174-K178 WeakPolarHBondContact O-CB 3.35Å; R174-K178 VanDerWaalsContact O-CG 3.24Å; R174-K178 WeakPolarHBondContact O-CG 3.45Å; R174-K178 PolarHBondContact O-N 3.37Å; R174-K178 VanDerWaalsContact O-N 3.17Å
175	E	86.8	Confident	81.3	Confident	111 Å²	111	88.2 Å²	88.2	52%	0.519	42%	0.418	S	S	.	.	H	α-helix	trans	-69.5	-33.5	172	-77.3	172.1	178.5	0	0	113.3	G171 L173 Q179	G171-E175 WeakPolarHBondContact O-CG 3.46Å; G171-E175 PolarHBondContact O-N 3.22Å; L173-E175 PolarHBondContact O-N 2.91Å; E175-Q179 WeakPolarHBondContact O-CG 3.43Å; E175-Q179 PolarHBondContact O-N 3.43Å; E175-Q179 PolarHBondContact O-NE2 3.27Å
176	A	83.9	Confident	79.5	Confident	0 Å²	0	90.7 Å²	90.7	0%	0	44%	0.443	C	S	.	.	H	α-helix	trans	-76.2	-43	176.5	0	0	0	0	0	111.4	K172 L173 K178 Q179 E180 L191 I195	K172-A176 PolarHBondContact O-N 3.48Å; L173-A176 WeakPolarHBondContact O-CA 3.34Å; L173-A176 WeakPolarHBondContact O-CB 3.47Å; L173-A176 PolarHBondContact O-N 2.72Å; A176-K178 VanDerWaalsContact C-N 3.33Å; A176-K178 PolarHBondContact O-N 2.83Å; A176-Q179 WeakPolarHBondContact O-CA 3.31Å; A176-Q179 WeakPolarHBondContact O-CB 3.5Å; A176-Q179 PolarHBondContact O-N 3.4Å; A176-E180 PolarHBondContact O-N 3.31Å; A176-L191 HydrophobicContact CB-CD1 4.44Å; A176-I195 HydrophobicContact CB-CD1 4.43Å; A176-I195 HydrophobicContact CB-CG1 3.65Å
177	E	82.3	Confident	77.8	Confident	71 Å²	71	91 Å²	91	33%	0.332	45%	0.452	S	S	.	.	H	α-helix	trans	-54	-49.1	173	-64.6	168.5	159.2	0	0	110.7	L173 R174 Q179 E180 E181 I195	L173-E177 HydrophobicContact CD1-CG 4.38Å; L173-E177 PolarHBondContact O-N 2.76Å; R174-E177 WeakPolarHBondContact CA-OE2 3.34Å; E177-Q179 PolarHBondContact O-N 3.15Å; E177-Q179 VanDerWaalsContact O-N 3.15Å; E177-E180 WeakPolarHBondContact O-CB 3.4Å; E177-E180 PolarHBondContact O-N 3.44Å; E177-E181 PolarHBondContact O-N 3.23Å; E177-I195 HydrophobicContact CG-CG2 4.35Å
178	K	83.4	Confident	76.4	Confident	128 Å²	128	88.9 Å²	88.9	56%	0.557	44%	0.442	S	S	*	.	H	α-helix	trans	-68.3	-8.1	175.4	-71.8	175.6	-179.1	-178.4	0	115.4	R174 A176 K182	R174-K178 WeakPolarHBondContact O-CB 3.35Å; R174-K178 VanDerWaalsContact O-CG 3.24Å; R174-K178 WeakPolarHBondContact O-CG 3.45Å; R174-K178 PolarHBondContact O-N 3.37Å; R174-K178 VanDerWaalsContact O-N 3.17Å; A176-K178 VanDerWaalsContact C-N 3.33Å; A176-K178 PolarHBondContact O-N 2.83Å; K178-K182 VanDerWaalsContact O-CD 3.32Å; K178-K182 WeakPolarHBondContact O-CD 3.47Å; K178-K182 WeakPolarHBondContact O-CE 3.41Å; K178-K182 WeakPolarHBondContact O-CG 3.45Å
179	Q	77.2	Confident	75.4	Confident	93 Å²	93	93.6 Å²	93.6	44%	0.435	46%	0.455	S	S	.	.	H	α-helix	trans	-93.2	-29.5	170.4	-74.4	168.1	21.5	0	0	111.1	E175 A176 E177 K182 Q183 L191	E175-Q179 WeakPolarHBondContact O-CG 3.43Å; E175-Q179 PolarHBondContact O-N 3.43Å; E175-Q179 PolarHBondContact O-NE2 3.27Å; A176-Q179 WeakPolarHBondContact O-CA 3.31Å; A176-Q179 WeakPolarHBondContact O-CB 3.5Å; A176-Q179 PolarHBondContact O-N 3.4Å; E177-Q179 PolarHBondContact O-N 3.15Å; E177-Q179 VanDerWaalsContact O-N 3.15Å; Q179-K182 PolarHBondContact O-N 2.85Å; Q179-Q183 WeakPolarHBondContact O-CG 3.26Å; Q179-Q183 PolarHBondContact O-N 3.06Å; Q179-L191 HydrophobicContact CB-CD2 4Å
180	E	73.6	Confident	74.6	Confident	77 Å²	77	101.3 Å²	101.3	36%	0.36	49%	0.486	S	S	.	.	H	α-helix	trans	-67.8	-46.1	176.1	-177.4	168.6	-123.2	0	0	111.6	A176 E177 K182 Q183 L191 I195	A176-E180 PolarHBondContact O-N 3.31Å; E177-E180 WeakPolarHBondContact O-CB 3.4Å; E177-E180 PolarHBondContact O-N 3.44Å; E180-K182 PolarHBondContact O-N 2.66Å; E180-Q183 PolarHBondContact O-N 3.31Å; E180-Q183 VanDerWaalsContact O-N 3.11Å; E180-L191 HydrophobicContact CB-CD2 4.06Å; E180-L191 HydrophobicContact CB-CG 4.19Å; E180-I195 HydrophobicContact CB-CD1 3.73Å; E180-I195 HydrophobicContact CG-CD1 4.28Å; E180-I195 VanDerWaalsContact OE2-CD1 3.22Å; E180-I195 WeakPolarHBondContact OE2-CD1 3.47Å
181	E	68.1	Low	73.8	Confident	165 Å²	165	99.4 Å²	99.4	77%	0.771	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-18.5	172.6	-66.1	-177.4	136.4	0	0	113.9	E177	E177-E181 PolarHBondContact O-N 3.23Å
182	K	69	Low	73.2	Confident	171 Å²	171	103.1 Å²	103.1	74%	0.743	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-4.5	-174	-61.8	-178	-175.6	178.3	0	114.5	K178 Q179 E180	K178-K182 VanDerWaalsContact O-CD 3.32Å; K178-K182 WeakPolarHBondContact O-CD 3.47Å; K178-K182 WeakPolarHBondContact O-CE 3.41Å; K178-K182 WeakPolarHBondContact O-CG 3.45Å; Q179-K182 PolarHBondContact O-N 2.85Å; E180-K182 PolarHBondContact O-N 2.66Å
183	Q	60.3	Low	72.7	Confident	91 Å²	91	106.8 Å²	106.8	43%	0.425	50%	0.499	S	S	.	.	S	Bend	trans	-111.9	128	-175.4	-72	-173.3	11.9	0	0	113.1	Q179 E180 Q185	Q179-Q183 WeakPolarHBondContact O-CG 3.26Å; Q179-Q183 PolarHBondContact O-N 3.06Å; E180-Q183 PolarHBondContact O-N 3.31Å; E180-Q183 VanDerWaalsContact O-N 3.11Å; Q183-Q185 PolarHBondContact O-N 3.06Å
184	K	55.3	Low	72.4	Confident	192 Å²	192	109.4 Å²	109.4	84%	0.835	51%	0.513	S	S	*	.			trans	-81.9	113.5	178.6	-70.3	-172.5	177.2	-176.7	0	112	S186	K184-S186 VanDerWaalsContact C-N 3.3Å; K184-S186 PolarHBondContact O-N 2.78Å
185	Q	56	Low	72.2	Confident	186 Å²	186	104.7 Å²	104.7	87%	0.869	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	-48.4	156.8	-70.5	-177.7	-16.5	0	0	120.9	Q183	Q183-Q185 PolarHBondContact O-N 3.06Å
186	S	55.6	Low	72.1	Confident	122 Å²	122	105.2 Å²	105.2	85%	0.853	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-32	-175.3	60.3	0	0	0	0	113.8	K184	K184-S186 VanDerWaalsContact C-N 3.3Å; K184-S186 PolarHBondContact O-N 2.78Å
187	A	57.6	Low	72.3	Confident	39 Å²	39	112.7 Å²	112.7	32%	0.322	53%	0.531	S	S	.	.	S	Bend	trans	-86.5	-18.7	177	0	0	0	0	0	113.8	K189 K190	A187-K189 PolarHBondContact O-N 2.68Å; A187-K190 PolarHBondContact O-N 3.34Å; A187-K190 VanDerWaalsContact O-N 3.07Å
188	A	63.9	Low	72.6	Confident	29 Å²	29	112.7 Å²	112.7	24%	0.24	53%	0.528	C	S	.	.	H	α-helix	trans	-50.7	-53.5	-167.7	0	0	0	0	0	113.4	K190 L191 E192	A188-K190 PolarHBondContact O-N 3.47Å; A188-L191 CarbonylContact O-C 3.58Å; A188-L191 WeakPolarHBondContact O-CA 3.48Å; A188-L191 PolarHBondContact O-N 3.48Å; A188-E192 WeakPolarHBondContact O-CB 3.44Å; A188-E192 PolarHBondContact O-N 2.85Å
189	K	70.4	Confident	72.9	Confident	159 Å²	159	110.3 Å²	110.3	69%	0.691	52%	0.519	S	S	*	.	H	α-helix	trans	-60	-17.3	-177.2	-66.9	-171.3	174.3	-176.6	0	115.7	A187 E192 R193	A187-K189 PolarHBondContact O-N 2.68Å; K189-E192 WeakPolarHBondContact CA-OE2 3.45Å; K189-R193 WeakPolarHBondContact O-CD 3.11Å; K189-R193 WeakPolarHBondContact O-CG 3.5Å
190	K	73.9	Confident	73.6	Confident	179 Å²	179	110.1 Å²	110.1	78%	0.778	52%	0.52	S	S	*	.	H	α-helix	trans	-87.7	-29.2	174	-171.7	177	178.5	-178.3	0	111.9	A187 A188 L194	A187-K190 PolarHBondContact O-N 3.34Å; A187-K190 VanDerWaalsContact O-N 3.07Å; A188-K190 PolarHBondContact O-N 3.47Å; K190-L194 PolarHBondContact O-N 3.3Å
191	L	75.2	Confident	74.4	Confident	12 Å²	12	111.3 Å²	111.3	6%	0.063	52%	0.524	C	S	.	.	H	α-helix	trans	-84.7	-40.6	178.8	-173.6	46.8	0	0	0	111.4	A176 Q179 E180 A188 R193 L194 I195	A176-L191 HydrophobicContact CB-CD1 4.44Å; Q179-L191 HydrophobicContact CB-CD2 4Å; E180-L191 HydrophobicContact CB-CD2 4.06Å; E180-L191 HydrophobicContact CB-CG 4.19Å; A188-L191 CarbonylContact O-C 3.58Å; A188-L191 WeakPolarHBondContact O-CA 3.48Å; A188-L191 PolarHBondContact O-N 3.48Å; L191-R193 PolarHBondContact O-N 3.45Å; L191-L194 HydrophobicContact CD1-CB 4.44Å; L191-L194 HydrophobicContact CD1-CD2 4.11Å; L191-L194 CarbonylContact O-C 3.57Å; L191-L194 WeakPolarHBondContact O-CA 3.29Å; L191-L194 WeakPolarHBondContact O-CB 3.31Å; L191-L194 PolarHBondContact O-N 3.38Å; L191-I195 HydrophobicContact CD1-CD1 4.47Å; L191-I195 HydrophobicContact CG-CD1 4.26Å; L191-I195 WeakPolarHBondContact O-CG1 3.26Å; L191-I195 PolarHBondContact O-N 3Å
192	E	78	Confident	75.5	Confident	103 Å²	103	103.9 Å²	103.9	48%	0.481	49%	0.49	S	S	.	.	H	α-helix	trans	-46.6	-54.7	167.4	-178.9	-177.8	-153.4	0	0	111.4	A188 K189 L194 I195 E196	A188-E192 WeakPolarHBondContact O-CB 3.44Å; A188-E192 PolarHBondContact O-N 2.85Å; K189-E192 WeakPolarHBondContact CA-OE2 3.45Å; E192-L194 VanDerWaalsContact C-N 3.28Å; E192-L194 PolarHBondContact O-N 3.36Å; E192-I195 PolarHBondContact O-N 2.64Å; E192-I195 VanDerWaalsContact O-N 3.17Å; E192-E196 PolarHBondContact O-N 3.37Å
193	R	80.5	Confident	76.6	Confident	182 Å²	182	100.8 Å²	100.8	69%	0.687	48%	0.478	S	S	*	.	H	α-helix	trans	-64.4	-26.1	175.1	-70.2	176.7	177.1	-175.8	-1.6	114.3	K189 L191 K197	K189-R193 WeakPolarHBondContact O-CD 3.11Å; K189-R193 WeakPolarHBondContact O-CG 3.5Å; L191-R193 PolarHBondContact O-N 3.45Å; R193-K197 WeakPolarHBondContact O-CB 3.25Å; R193-K197 PolarHBondContact O-N 3.4Å; R193-K197 VanDerWaalsContact O-N 3.14Å
194	L	82.5	Confident	78.2	Confident	66 Å²	66	100.7 Å²	100.7	35%	0.346	48%	0.478	S	S	.	.	H	α-helix	trans	-77.8	-35.8	175.1	179	62	0	0	0	110.9	K190 L191 E192 R198	K190-L194 PolarHBondContact O-N 3.3Å; L191-L194 HydrophobicContact CD1-CB 4.44Å; L191-L194 HydrophobicContact CD1-CD2 4.11Å; L191-L194 CarbonylContact O-C 3.57Å; L191-L194 WeakPolarHBondContact O-CA 3.29Å; L191-L194 WeakPolarHBondContact O-CB 3.31Å; L191-L194 PolarHBondContact O-N 3.38Å; E192-L194 VanDerWaalsContact C-N 3.28Å; E192-L194 PolarHBondContact O-N 3.36Å; L194-R198 WeakPolarHBondContact O-CB 3.28Å; L194-R198 VanDerWaalsContact O-CG 3.28Å; L194-R198 WeakPolarHBondContact O-CG 3.28Å; L194-R198 PolarHBondContact O-N 3.34Å
195	I	82.3	Confident	80	Confident	22 Å²	22	92.5 Å²	92.5	11%	0.113	44%	0.443	C	S	.	.	H	α-helix	trans	-67	-49.9	172.8	-69.8	165.2	0	0	0	109.4	L173 A176 E177 E180 L191 E192 K197 R198 Q199	L173-I195 HydrophobicContact CD1-CG2 4.15Å; A176-I195 HydrophobicContact CB-CD1 4.43Å; A176-I195 HydrophobicContact CB-CG1 3.65Å; E177-I195 HydrophobicContact CG-CG2 4.35Å; E180-I195 HydrophobicContact CB-CD1 3.73Å; E180-I195 HydrophobicContact CG-CD1 4.28Å; E180-I195 VanDerWaalsContact OE2-CD1 3.22Å; E180-I195 WeakPolarHBondContact OE2-CD1 3.47Å; L191-I195 HydrophobicContact CD1-CD1 4.47Å; L191-I195 HydrophobicContact CG-CD1 4.26Å; L191-I195 WeakPolarHBondContact O-CG1 3.26Å; L191-I195 PolarHBondContact O-N 3Å; E192-I195 PolarHBondContact O-N 2.64Å; E192-I195 VanDerWaalsContact O-N 3.17Å; I195-K197 VanDerWaalsContact C-N 3.31Å; I195-K197 PolarHBondContact O-N 3.43Å; I195-R198 CarbonylContact O-C 3.59Å; I195-R198 WeakPolarHBondContact O-CA 3.3Å; I195-R198 PolarHBondContact O-N 2.91Å; I195-Q199 WeakPolarHBondContact O-CB 3.4Å; I195-Q199 PolarHBondContact O-N 3.29Å
196	E	85.6	Confident	81.7	Confident	122 Å²	122	88.2 Å²	88.2	57%	0.57	42%	0.423	S	S	*	.	H	α-helix	trans	-52.4	-47	173.3	-176.7	-176.5	-148	0	0	111.9	E192 R198 Q199 I200	E192-E196 PolarHBondContact O-N 3.37Å; E196-R198 PolarHBondContact O-N 3.27Å; E196-Q199 WeakPolarHBondContact O-CB 3.4Å; E196-Q199 PolarHBondContact O-N 2.79Å; E196-I200 HydrophobicContact CG-CD1 4.31Å; E196-I200 WeakPolarHBondContact O-CG1 3.35Å; E196-I200 PolarHBondContact O-N 2.75Å
197	K	87.8	Confident	83.6	Confident	157 Å²	157	87.3 Å²	87.3	68%	0.683	41%	0.408	S	S	*	.	H	α-helix	trans	-66.1	-33.4	176.4	-172.7	170.5	-177.8	173.2	0	113.3	R193 I195 K201	R193-K197 WeakPolarHBondContact O-CB 3.25Å; R193-K197 PolarHBondContact O-N 3.4Å; R193-K197 VanDerWaalsContact O-N 3.14Å; I195-K197 VanDerWaalsContact C-N 3.31Å; I195-K197 PolarHBondContact O-N 3.43Å; K197-K201 WeakPolarHBondContact O-CB 3.4Å; K197-K201 PolarHBondContact O-N 2.93Å
198	R	89	Confident	85.4	Confident	72 Å²	72	90.4 Å²	90.4	27%	0.272	41%	0.414	S	S	.	.	H	α-helix	trans	-72.5	-36.5	172.6	-74.3	177.2	-169.8	-155.6	2.2	111.2	K172 L173 L194 I195 E196 K201 V202	K172-R198 WeakPolarHBondContact O-CD 3.3Å; K172-R198 PolarHBondContact O-NH1 3.25Å; L173-R198 HydrophobicContact CB-CB 4.39Å; L173-R198 HydrophobicContact CD1-CB 3.9Å; L194-R198 WeakPolarHBondContact O-CB 3.28Å; L194-R198 VanDerWaalsContact O-CG 3.28Å; L194-R198 WeakPolarHBondContact O-CG 3.28Å; L194-R198 PolarHBondContact O-N 3.34Å; I195-R198 CarbonylContact O-C 3.59Å; I195-R198 WeakPolarHBondContact O-CA 3.3Å; I195-R198 PolarHBondContact O-N 2.91Å; E196-R198 PolarHBondContact O-N 3.27Å; R198-K201 CarbonylContact O-C 3.51Å; R198-K201 PolarHBondContact O-N 3.36Å; R198-V202 WeakPolarHBondContact O-CG2 3.48Å; R198-V202 PolarHBondContact O-N 3.3Å
199	Q	89.4	Confident	86.8	Confident	78 Å²	78	89.5 Å²	89.5	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-62.4	-51.1	178.6	-171.3	73.3	-32.5	0	0	111.1	L173 I195 E196 K201 V202 Q203	L173-Q199 HydrophobicContact CD1-CB 4.46Å; I195-Q199 WeakPolarHBondContact O-CB 3.4Å; I195-Q199 PolarHBondContact O-N 3.29Å; E196-Q199 WeakPolarHBondContact O-CB 3.4Å; E196-Q199 PolarHBondContact O-N 2.79Å; Q199-K201 VanDerWaalsContact C-N 3.27Å; Q199-K201 PolarHBondContact O-N 3.41Å; Q199-V202 PolarHBondContact O-N 3.47Å; Q199-Q203 WeakPolarHBondContact O-CG 3.32Å; Q199-Q203 PolarHBondContact O-N 3.37Å
200	I	91.6	Very high	88	Confident	89 Å²	89	83.7 Å²	83.7	46%	0.456	39%	0.385	S	S	.	.	H	α-helix	trans	-57.2	-42.8	173.7	-65.5	165.3	0	0	0	110.3	E196 Q203 E204	E196-I200 HydrophobicContact CG-CD1 4.31Å; E196-I200 WeakPolarHBondContact O-CG1 3.35Å; E196-I200 PolarHBondContact O-N 2.75Å; I200-Q203 PolarHBondContact O-N 2.88Å; I200-E204 PolarHBondContact O-N 2.95Å
201	K	90.3	Very high	89.1	Confident	101 Å²	101	81.2 Å²	81.2	44%	0.439	38%	0.375	S	S	.	.	H	α-helix	trans	-69.2	-35.9	-179.7	-160.3	71.2	-163.7	169.3	0	113.4	K197 R198 Q199 E204 I205	K197-K201 WeakPolarHBondContact O-CB 3.4Å; K197-K201 PolarHBondContact O-N 2.93Å; R198-K201 CarbonylContact O-C 3.51Å; R198-K201 PolarHBondContact O-N 3.36Å; Q199-K201 VanDerWaalsContact C-N 3.27Å; Q199-K201 PolarHBondContact O-N 3.41Å; K201-E204 WeakPolarHBondContact CE-OE2 3.39Å; K201-E204 IonicContact NZ-OE1 3.94Å; K201-E204 IonicContact NZ-OE2 2.66Å; K201-E204 PolarHBondContact NZ-OE2 3.41Å; K201-I205 HydrophobicContact CG-CD1 4.09Å; K201-I205 VanDerWaalsContact O-CG1 3.28Å; K201-I205 WeakPolarHBondContact O-CG1 3.49Å; K201-I205 PolarHBondContact O-N 3.33Å; K201-I205 VanDerWaalsContact O-N 3.13Å
202	V	92	Very high	90	Very high	10 Å²	10	81 Å²	81	6%	0.061	37%	0.374	C	S	.	.	H	α-helix	trans	-64.3	-44.3	171.5	168.4	0	0	0	0	110	F166 A169 L173 R198 Q199 E204 I205 Q206	F166-V202 HydrophobicContact CE2-CG1 3.89Å; A169-V202 HydrophobicContact CB-CG2 3.9Å; A169-V202 WeakPolarHBondContact O-CG2 3.49Å; L173-V202 HydrophobicContact CB-CG2 3.94Å; L173-V202 HydrophobicContact CD2-CB 4.3Å; L173-V202 HydrophobicContact CD2-CG1 4.38Å; L173-V202 HydrophobicContact CD2-CG2 3.98Å; R198-V202 WeakPolarHBondContact O-CG2 3.48Å; R198-V202 PolarHBondContact O-N 3.3Å; Q199-V202 PolarHBondContact O-N 3.47Å; V202-E204 PolarHBondContact O-N 3.06Å; V202-I205 PolarHBondContact O-N 3.45Å; V202-Q206 WeakPolarHBondContact O-CB 3.32Å; V202-Q206 PolarHBondContact O-N 2.97Å
203	Q	92.2	Very high	90.9	Very high	106 Å²	106	81.1 Å²	81.1	50%	0.495	37%	0.37	S	S	.	.	H	α-helix	trans	-61.6	-43.2	176.8	-70.3	172.8	2.4	0	0	112.8	Q199 I200 I205 Q206 L207	Q199-Q203 WeakPolarHBondContact O-CG 3.32Å; Q199-Q203 PolarHBondContact O-N 3.37Å; I200-Q203 PolarHBondContact O-N 2.88Å; Q203-I205 PolarHBondContact O-N 2.72Å; Q203-Q206 PolarHBondContact O-N 2.8Å; Q203-L207 WeakPolarHBondContact O-CB 3.45Å; Q203-L207 PolarHBondContact O-N 3.44Å
204	E	92.9	Very high	91.7	Very high	88 Å²	88	76.2 Å²	76.2	41%	0.411	36%	0.357	S	S	.	.	H	α-helix	trans	-56.9	-49	173.1	-77.5	-178.7	-150.3	0	0	112.3	I200 K201 V202 L207 K208	I200-E204 PolarHBondContact O-N 2.95Å; K201-E204 WeakPolarHBondContact CE-OE2 3.39Å; K201-E204 IonicContact NZ-OE1 3.94Å; K201-E204 IonicContact NZ-OE2 2.66Å; K201-E204 PolarHBondContact NZ-OE2 3.41Å; V202-E204 PolarHBondContact O-N 3.06Å; E204-L207 PolarHBondContact O-N 3.36Å; E204-K208 PolarHBondContact O-N 3.09Å; E204-K208 VanDerWaalsContact O-N 3.09Å
205	I	92.6	Very high	92.4	Very high	20 Å²	20	77 Å²	77	10%	0.103	36%	0.362	C	S	.	.	H	α-helix	trans	-73.6	-34.8	-176.1	-62.5	167.9	0	0	0	110.3	E165 F166 A169 K201 V202 Q203 L207 K208 C209	E165-I205 HydrophobicContact CB-CG2 4.06Å; F166-I205 HydrophobicContact CB-CG2 3.93Å; A169-I205 HydrophobicContact CB-CD1 3.79Å; K201-I205 HydrophobicContact CG-CD1 4.09Å; K201-I205 VanDerWaalsContact O-CG1 3.28Å; K201-I205 WeakPolarHBondContact O-CG1 3.49Å; K201-I205 PolarHBondContact O-N 3.33Å; K201-I205 VanDerWaalsContact O-N 3.13Å; V202-I205 PolarHBondContact O-N 3.45Å; Q203-I205 PolarHBondContact O-N 2.72Å; I205-L207 VanDerWaalsContact C-N 3.33Å; I205-L207 PolarHBondContact O-N 3.11Å; I205-K208 PolarHBondContact O-N 3.08Å; I205-C209 VanDerWaalsContact O-CB 3.27Å; I205-C209 WeakPolarHBondContact O-CB 3.08Å; I205-C209 PolarHBondContact O-N 3.04Å
206	Q	93.3	Very high	93.1	Very high	96 Å²	96	77.5 Å²	77.5	45%	0.449	36%	0.363	S	S	.	.	H	α-helix	trans	-60.2	-41.5	171.8	-170.6	-179.1	11.2	0	0	111.3	F166 V202 Q203 S210	F166-Q206 HydrophobicContact CD2-CB 3.85Å; F166-Q206 HydrophobicContact CD2-CG 4.31Å; F166-Q206 HydrophobicContact CE2-CB 3.68Å; F166-Q206 HydrophobicContact CE2-CG 3.82Å; F166-Q206 HydrophobicContact CZ-CG 4.48Å; V202-Q206 WeakPolarHBondContact O-CB 3.32Å; V202-Q206 PolarHBondContact O-N 2.97Å; Q203-Q206 PolarHBondContact O-N 2.8Å; Q206-S210 VanDerWaalsContact O-CB 3.23Å; Q206-S210 WeakPolarHBondContact O-CB 3.43Å; Q206-S210 PolarHBondContact O-N 2.97Å; Q206-S210 PolarHBondContact O-OG 3.05Å
207	L	94.4	Very high	93.6	Very high	103 Å²	103	75.9 Å²	75.9	54%	0.539	36%	0.358	S	S	.	.	H	α-helix	trans	-66.2	-43.2	175.6	-178.8	60	0	0	0	111.7	Q203 E204 I205 S210 K211	Q203-L207 WeakPolarHBondContact O-CB 3.45Å; Q203-L207 PolarHBondContact O-N 3.44Å; E204-L207 PolarHBondContact O-N 3.36Å; I205-L207 VanDerWaalsContact C-N 3.33Å; I205-L207 PolarHBondContact O-N 3.11Å; L207-S210 PolarHBondContact O-N 3.03Å; L207-K211 WeakPolarHBondContact O-CG 3.34Å; L207-K211 PolarHBondContact O-N 3.5Å
208	K	94.5	Very high	94	Very high	104 Å²	104	74 Å²	74	45%	0.452	36%	0.355	S	S	.	.	H	α-helix	trans	-61.2	-49.6	174	-71.6	-175.4	178.7	-169.3	0	112.1	Y162 E204 I205 S210 K211 A212	Y162-K208 HydrophobicContact CD1-CB 4.48Å; Y162-K208 HydrophobicContact CE1-CD 4.3Å; Y162-K208 HydrophobicContact CG-CB 4.5Å; E204-K208 PolarHBondContact O-N 3.09Å; E204-K208 VanDerWaalsContact O-N 3.09Å; I205-K208 PolarHBondContact O-N 3.08Å; K208-S210 VanDerWaalsContact C-N 3.27Å; K208-S210 PolarHBondContact O-N 3.3Å; K208-K211 PolarHBondContact O-N 3.44Å; K208-A212 PolarHBondContact O-N 3.46Å
209	C	95.1	Very high	94.4	Very high	11 Å²	11	72.8 Å²	72.8	7%	0.074	35%	0.353	C	S	.	.	H	α-helix	trans	-59	-38.2	175.9	-177.5	0	0	0	0	111.6	F166 I205 R213	F166-C209 HydrophobicContact CB-CB 4.33Å; I205-C209 VanDerWaalsContact O-CB 3.27Å; I205-C209 WeakPolarHBondContact O-CB 3.08Å; I205-C209 PolarHBondContact O-N 3.04Å; C209-R213 WeakPolarHBondContact O-CB 3.33Å; C209-R213 PolarHBondContact O-N 3.02Å
210	S	95.2	Very high	94.7	Very high	36 Å²	36	70.9 Å²	70.9	25%	0.252	35%	0.345	S	S	.	.	H	α-helix	trans	-70.2	-38.9	178.6	-62.1	0	0	0	0	112.6	Q206 L207 K208 N214	Q206-S210 VanDerWaalsContact O-CB 3.23Å; Q206-S210 WeakPolarHBondContact O-CB 3.43Å; Q206-S210 PolarHBondContact O-N 2.97Å; Q206-S210 PolarHBondContact O-OG 3.05Å; L207-S210 PolarHBondContact O-N 3.03Å; K208-S210 VanDerWaalsContact C-N 3.27Å; K208-S210 PolarHBondContact O-N 3.3Å; S210-N214 PolarHBondContact O-N 3.21Å; S210-N214 VanDerWaalsContact O-N 3.14Å; S210-N214 PolarHBondContact O-OD1 3.46Å; S210-N214 VanDerWaalsContact O-OD1 3.11Å
211	K	95.9	Very high	94.9	Very high	128 Å²	128	70.5 Å²	70.5	56%	0.557	35%	0.351	S	S	*	.	H	α-helix	trans	-62.9	-56.6	172.8	-72.7	-178.9	177.8	-171.8	0	110.8	L207 K208 R213 N214 D215	L207-K211 WeakPolarHBondContact O-CG 3.34Å; L207-K211 PolarHBondContact O-N 3.5Å; K208-K211 PolarHBondContact O-N 3.44Å; K211-R213 PolarHBondContact O-N 3.34Å; K211-N214 WeakPolarHBondContact O-CA 3.41Å; K211-N214 WeakPolarHBondContact O-CB 3.23Å; K211-N214 PolarHBondContact O-N 2.97Å; K211-D215 VanDerWaalsContact O-CG 3.29Å; K211-D215 PolarHBondContact O-N 3.4Å
212	A	95.4	Very high	95.2	Very high	6 Å²	6	68 Å²	68	5%	0.05	35%	0.349	C	S	.	.	H	α-helix	trans	-59.4	-32.8	179.7	0	0	0	0	0	113.4	T158 Y162 K208 Y216	T158-A212 HydrophobicContact CG2-CB 4.3Å; Y162-A212 HydrophobicContact CD2-CB 3.72Å; Y162-A212 HydrophobicContact CE2-CB 4.31Å; K208-A212 PolarHBondContact O-N 3.46Å; A212-Y216 VanDerWaalsContact O-CB 3.28Å; A212-Y216 WeakPolarHBondContact O-CB 3.47Å; A212-Y216 PolarHBondContact O-N 2.91Å
213	R	96.4	Very high	95.4	Very high	107 Å²	107	67.8 Å²	67.8	40%	0.404	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-44.4	171.2	-173.2	-169.3	64.3	-169.8	-5.2	111.9	Y159 C209 K211 Y216 L217	Y159-R213 HydrophobicContact CD2-CB 3.54Å; Y159-R213 HydrophobicContact CD2-CG 4.09Å; Y159-R213 HydrophobicContact CE2-CB 3.5Å; Y159-R213 HydrophobicContact CE2-CG 3.68Å; Y159-R213 HydrophobicContact CG-CB 4.41Å; C209-R213 WeakPolarHBondContact O-CB 3.33Å; C209-R213 PolarHBondContact O-N 3.02Å; K211-R213 PolarHBondContact O-N 3.34Å; R213-Y216 PolarHBondContact O-N 2.83Å; R213-L217 HydrophobicContact CG-CD1 4.22Å; R213-L217 VanDerWaalsContact O-CG 3.27Å; R213-L217 WeakPolarHBondContact O-CG 3.29Å; R213-L217 PolarHBondContact O-N 3.04Å
214	N	96.8	Very high	95.7	Very high	78 Å²	78	66.4 Å²	66.4	42%	0.417	34%	0.344	S	S	.	.	H	α-helix	trans	-66.9	-42.9	179.1	-65.7	2.2	0	0	0	110.3	S210 K211 Y216 L217 L218	S210-N214 PolarHBondContact O-N 3.21Å; S210-N214 VanDerWaalsContact O-N 3.14Å; S210-N214 PolarHBondContact O-OD1 3.46Å; S210-N214 VanDerWaalsContact O-OD1 3.11Å; K211-N214 WeakPolarHBondContact O-CA 3.41Å; K211-N214 WeakPolarHBondContact O-CB 3.23Å; K211-N214 PolarHBondContact O-N 2.97Å; N214-Y216 VanDerWaalsContact C-N 3.35Å; N214-Y216 PolarHBondContact O-N 3.32Å; N214-L217 PolarHBondContact O-N 2.9Å; N214-L218 WeakPolarHBondContact O-CG 3.42Å; N214-L218 PolarHBondContact O-N 2.84Å
215	D	97.1	Very high	95.9	Very high	84 Å²	84	66 Å²	66	45%	0.449	35%	0.351	S	S	.	.	H	α-helix	trans	-60.7	-43.2	175.3	-56	-35.2	0	0	0	111.4	K211 L218 N219	K211-D215 VanDerWaalsContact O-CG 3.29Å; K211-D215 PolarHBondContact O-N 3.4Å; D215-L218 PolarHBondContact O-N 3.3Å; D215-N219 PolarHBondContact O-N 3.48Å; D215-N219 PolarHBondContact O-ND2 3.11Å
216	Y	96.6	Very high	96.1	Very high	31 Å²	31	66.9 Å²	66.9	12%	0.122	36%	0.359	C	S	.	.	H	α-helix	trans	-59.6	-45.4	172	162.6	-110.9	0	0	0	112.6	Y16 L152 W156 Y159 A212 R213 N214 L218 N219 L220	Y16-Y216 PolarHBondContact OH-OH 2.76Å; L152-Y216 HydrophobicContact CD1-CD2 3.81Å; L152-Y216 HydrophobicContact CD1-CE2 3.6Å; W156-Y216 HydrophobicContact CB-CD2 3.68Å; W156-Y216 HydrophobicContact CB-CE2 3.69Å; W156-Y216 AromaticContact CD1-CE2 3.57Å; W156-Y216 AromaticContact CD1-CZ 3.82Å; W156-Y216 HydrophobicContact CG-CD2 4.36Å; W156-Y216 HydrophobicContact CG-CE2 4.01Å; Y159-Y216 HydrophobicContact CD1-CD1 4.01Å; Y159-Y216 HydrophobicContact CD1-CE1 4.47Å; Y159-Y216 HydrophobicContact CD1-CG 4.43Å; A212-Y216 VanDerWaalsContact O-CB 3.28Å; A212-Y216 WeakPolarHBondContact O-CB 3.47Å; A212-Y216 PolarHBondContact O-N 2.91Å; R213-Y216 PolarHBondContact O-N 2.83Å; N214-Y216 VanDerWaalsContact C-N 3.35Å; N214-Y216 PolarHBondContact O-N 3.32Å; Y216-L218 VanDerWaalsContact C-N 3.34Å; Y216-L218 PolarHBondContact O-N 3.05Å; Y216-N219 PolarHBondContact O-N 3.29Å; Y216-L220 HydrophobicContact CE1-CD2 4.45Å; Y216-L220 VanDerWaalsContact O-CB 3.27Å; Y216-L220 WeakPolarHBondContact O-CB 3.4Å; Y216-L220 PolarHBondContact O-N 3.43Å
217	L	96.8	Very high	96.2	Very high	88 Å²	88	65 Å²	65	46%	0.461	35%	0.351	S	S	.	.	H	α-helix	trans	-65.9	-34.9	178.8	-71.9	169.9	0	0	0	112.6	R213 N214 L220 S221	R213-L217 HydrophobicContact CG-CD1 4.22Å; R213-L217 VanDerWaalsContact O-CG 3.27Å; R213-L217 WeakPolarHBondContact O-CG 3.29Å; R213-L217 PolarHBondContact O-N 3.04Å; N214-L217 PolarHBondContact O-N 2.9Å; L217-L220 HydrophobicContact CD2-CD2 4.42Å; L217-S221 PolarHBondContact O-N 3.33Å
218	L	96.8	Very high	96.4	Very high	119 Å²	119	64.7 Å²	64.7	62%	0.623	35%	0.35	S	S	*	.	H	α-helix	trans	-66	-48.5	173.4	-70.7	170.9	0	0	0	111.4	N214 D215 Y216 L220 S221 A222	N214-L218 WeakPolarHBondContact O-CG 3.42Å; N214-L218 PolarHBondContact O-N 2.84Å; D215-L218 PolarHBondContact O-N 3.3Å; Y216-L218 VanDerWaalsContact C-N 3.34Å; Y216-L218 PolarHBondContact O-N 3.05Å; L218-L220 VanDerWaalsContact C-N 3.31Å; L218-L220 PolarHBondContact O-N 3.26Å; L218-S221 WeakPolarHBondContact O-CB 3.4Å; L218-S221 PolarHBondContact O-N 3.36Å; L218-A222 PolarHBondContact O-N 3.33Å
219	N	96.4	Very high	96.5	Very high	46 Å²	46	64.5 Å²	64.5	25%	0.246	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-35	176.7	-76.9	-85.2	0	0	0	112.3	L152 A155 D215 Y216 A222 A223	L152-N219 HydrophobicContact CB-CB 4.43Å; L152-N219 HydrophobicContact CD1-CB 4.49Å; A155-N219 HydrophobicContact CB-CB 4.19Å; D215-N219 PolarHBondContact O-N 3.48Å; D215-N219 PolarHBondContact O-ND2 3.11Å; Y216-N219 PolarHBondContact O-N 3.29Å; N219-A222 PolarHBondContact O-N 3.03Å; N219-A223 WeakPolarHBondContact O-CB 3.3Å; N219-A223 PolarHBondContact O-N 3Å
220	L	95.8	Very high	96.6	Very high	37 Å²	37	64.1 Å²	64.1	19%	0.194	35%	0.346	C	S	.	.	H	α-helix	trans	-64.1	-42.3	174.8	179.7	64.8	0	0	0	111.4	L152 Y216 L217 L218 N224	L152-L220 HydrophobicContact CD1-CB 3.82Å; L152-L220 HydrophobicContact CD1-CD1 4.07Å; L152-L220 HydrophobicContact CD2-CD1 3.96Å; Y216-L220 HydrophobicContact CE1-CD2 4.45Å; Y216-L220 VanDerWaalsContact O-CB 3.27Å; Y216-L220 WeakPolarHBondContact O-CB 3.4Å; Y216-L220 PolarHBondContact O-N 3.43Å; L217-L220 HydrophobicContact CD2-CD2 4.42Å; L218-L220 VanDerWaalsContact C-N 3.31Å; L218-L220 PolarHBondContact O-N 3.26Å; L220-N224 VanDerWaalsContact O-CB 3.31Å; L220-N224 WeakPolarHBondContact O-CB 3.41Å; L220-N224 PolarHBondContact O-N 2.97Å; L220-N224 PolarHBondContact O-ND2 2.85Å; L220-N224 VanDerWaalsContact O-ND2 3.11Å
221	S	96.8	Very high	96.7	Very high	82 Å²	82	65.4 Å²	65.4	57%	0.573	35%	0.346	S	S	*	.	H	α-helix	trans	-63.5	-45.3	174.1	-166.2	0	0	0	0	111.6	L217 L218 S225	L217-S221 PolarHBondContact O-N 3.33Å; L218-S221 WeakPolarHBondContact O-CB 3.4Å; L218-S221 PolarHBondContact O-N 3.36Å; S221-S225 VanDerWaalsContact O-CB 3.25Å; S221-S225 WeakPolarHBondContact O-CB 3.39Å; S221-S225 PolarHBondContact O-N 2.86Å
222	A	97.1	Very high	96.8	Very high	49 Å²	49	65.5 Å²	65.5	41%	0.405	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-47.5	178.8	0	0	0	0	0	112.8	V148 L218 N219 S225 S226	V148-A222 HydrophobicContact CG1-CB 4.34Å; L218-A222 PolarHBondContact O-N 3.33Å; N219-A222 PolarHBondContact O-N 3.03Å; A222-S225 PolarHBondContact O-N 2.89Å; A222-S226 WeakPolarHBondContact O-CB 3.4Å; A222-S226 PolarHBondContact O-N 3.13Å
223	A	96.5	Very high	96.8	Very high	4 Å²	4	70.6 Å²	70.6	3%	0.033	37%	0.374	C	S	.	.	H	α-helix	trans	-63	-47.5	178.3	0	0	0	0	0	112	V148 L152 N219 S225 S226 M227	V148-A223 HydrophobicContact CG1-CB 4.03Å; L152-A223 HydrophobicContact CB-CB 4.08Å; L152-A223 HydrophobicContact CD2-CB 3.76Å; N219-A223 WeakPolarHBondContact O-CB 3.3Å; N219-A223 PolarHBondContact O-N 3Å; A223-S225 VanDerWaalsContact C-N 3.31Å; A223-S225 PolarHBondContact O-N 2.97Å; A223-S226 PolarHBondContact O-N 2.96Å; A223-M227 WeakPolarHBondContact O-CB 3.49Å; A223-M227 PolarHBondContact O-N 3.47Å
224	N	96.6	Very high	96.8	Very high	78 Å²	78	66.9 Å²	66.9	42%	0.417	36%	0.362	S	S	.	.	H	α-helix	trans	-62	-39.2	176.9	-70.6	-24.4	0	0	0	111.8	L220 M227 N228	L220-N224 VanDerWaalsContact O-CB 3.31Å; L220-N224 WeakPolarHBondContact O-CB 3.41Å; L220-N224 PolarHBondContact O-N 2.97Å; L220-N224 PolarHBondContact O-ND2 2.85Å; L220-N224 VanDerWaalsContact O-ND2 3.11Å; N224-M227 PolarHBondContact O-N 2.88Å; N224-N228 WeakPolarHBondContact O-CB 2.81Å; N224-N228 PolarHBondContact O-N 3.04Å; N224-N228 PolarHBondContact O-ND2 3Å
225	S	97.4	Very high	96.8	Very high	78 Å²	78	64.6 Å²	64.6	55%	0.545	35%	0.35	S	S	.	.	H	α-helix	trans	-64.7	-46.1	175.7	-170.6	0	0	0	0	112	S221 A222 A223 M227 N228 K229	S221-S225 VanDerWaalsContact O-CB 3.25Å; S221-S225 WeakPolarHBondContact O-CB 3.39Å; S221-S225 PolarHBondContact O-N 2.86Å; A222-S225 PolarHBondContact O-N 2.89Å; A223-S225 VanDerWaalsContact C-N 3.31Å; A223-S225 PolarHBondContact O-N 2.97Å; S225-M227 PolarHBondContact O-N 3.32Å; S225-N228 PolarHBondContact O-N 3.38Å; S225-K229 WeakPolarHBondContact O-CB 3.49Å; S225-K229 PolarHBondContact O-N 2.71Å
226	S	97.3	Very high	96.8	Very high	40 Å²	40	64.1 Å²	64.1	28%	0.28	35%	0.35	S	S	.	.	H	α-helix	trans	-63.3	-39.7	176.4	-166	0	0	0	0	112.5	A222 A223 Y230	A222-S226 WeakPolarHBondContact O-CB 3.4Å; A222-S226 PolarHBondContact O-N 3.13Å; A223-S226 PolarHBondContact O-N 2.96Å; S226-Y230 WeakPolarHBondContact O-CB 3.44Å; S226-Y230 PolarHBondContact O-N 2.92Å
227	M	96.3	Very high	96.8	Very high	55 Å²	55	66.2 Å²	66.2	27%	0.271	37%	0.366	S	S	.	.	H	α-helix	trans	-67.7	-47	177.6	-165.5	175.1	-169.6	0	0	111.1	M23 L145 A223 N224 S225 K229 Y230 Y231	M23-M227 HydrophobicContact CG-CE 4.36Å; M23-M227 HydrophobicContact SD-CE 3.91Å; M23-M227 HydrophobicContact SD-SD 4.44Å; L145-M227 HydrophobicContact CD1-CB 3.96Å; L145-M227 HydrophobicContact CD1-CG 4.4Å; A223-M227 WeakPolarHBondContact O-CB 3.49Å; A223-M227 PolarHBondContact O-N 3.47Å; N224-M227 PolarHBondContact O-N 2.88Å; S225-M227 PolarHBondContact O-N 3.32Å; M227-K229 VanDerWaalsContact C-N 3.33Å; M227-K229 PolarHBondContact O-N 3.44Å; M227-Y230 PolarHBondContact O-N 2.96Å; M227-Y231 HydrophobicContact CE-CD2 4.27Å; M227-Y231 HydrophobicContact CE-CE2 3.71Å; M227-Y231 HydrophobicContact CG-CD2 3.71Å; M227-Y231 HydrophobicContact CG-CE2 3.87Å; M227-Y231 WeakPolarHBondContact O-CD2 3.26Å; M227-Y231 PolarHBondContact O-N 3.22Å
228	N	97.3	Very high	96.8	Very high	97 Å²	97	62.4 Å²	62.4	52%	0.519	35%	0.346	S	S	.	.	H	α-helix	trans	-58.5	-43.9	174.9	-73.8	-19.9	0	0	0	111.6	N224 S225 L232	N224-N228 WeakPolarHBondContact O-CB 2.81Å; N224-N228 PolarHBondContact O-N 3.04Å; N224-N228 PolarHBondContact O-ND2 3Å; S225-N228 PolarHBondContact O-N 3.38Å; N228-L232 HydrophobicContact CB-CD1 4.32Å; N228-L232 WeakPolarHBondContact O-CB 3.26Å; N228-L232 WeakPolarHBondContact O-CG 3.5Å; N228-L232 PolarHBondContact O-N 3.38Å
229	K	97.3	Very high	96.8	Very high	100 Å²	100	60.3 Å²	60.3	44%	0.435	34%	0.335	S	S	.	.	H	α-helix	trans	-62.4	-47.2	177.2	-167.7	-175.5	177.3	-91.3	0	111.9	S225 M227 Q233 D234	S225-K229 WeakPolarHBondContact O-CB 3.49Å; S225-K229 PolarHBondContact O-N 2.71Å; M227-K229 VanDerWaalsContact C-N 3.33Å; M227-K229 PolarHBondContact O-N 3.44Å; K229-Q233 WeakPolarHBondContact O-CB 3.49Å; K229-Q233 PolarHBondContact O-N 2.87Å; K229-D234 WeakPolarHBondContact CG-OD2 3.22Å; K229-D234 IonicContact NZ-OD1 2.97Å; K229-D234 PolarHBondContact NZ-OD1 2.95Å; K229-D234 IonicContact NZ-OD2 3.67Å; K229-D234 PolarHBondContact NZ-OD2 2.89Å; K229-D234 PolarHBondContact O-N 3.09Å
230	Y	98.2	Very high	96.7	Very high	3 Å²	3	63.1 Å²	63.1	1%	0.012	35%	0.35	C	S	.	.	I	π-helix	trans	-59.7	-52.8	-179.3	179.7	-99.2	0	0	0	112	L27 Q30 L141 Q142 L145 S226 M227 D234 I235	L27-Y230 HydrophobicContact CD2-CD1 4.33Å; L27-Y230 HydrophobicContact CD2-CE1 3.53Å; Q30-Y230 PolarHBondContact OE1-OH 2.91Å; L141-Y230 HydrophobicContact CB-CD2 4.16Å; L141-Y230 HydrophobicContact CB-CE2 4.05Å; Q142-Y230 HydrophobicContact CG-CE2 4.1Å; Q142-Y230 VanDerWaalsContact CG-OH 3.28Å; Q142-Y230 WeakPolarHBondContact CG-OH 3.4Å; Q142-Y230 PolarHBondContact NE2-OH 3.35Å; L145-Y230 HydrophobicContact CD2-CD1 3.78Å; L145-Y230 HydrophobicContact CD2-CE1 4.47Å; L145-Y230 HydrophobicContact CD2-CG 3.94Å; S226-Y230 WeakPolarHBondContact O-CB 3.44Å; S226-Y230 PolarHBondContact O-N 2.92Å; M227-Y230 PolarHBondContact O-N 2.96Å; Y230-D234 HydrophobicContact CD2-CB 4.36Å; Y230-D234 PolarHBondContact O-N 3.4Å; Y230-I235 HydrophobicContact CE1-CD1 4.3Å; Y230-I235 WeakPolarHBondContact O-CB 3.36Å; Y230-I235 PolarHBondContact O-N 3.15Å
231	Y	96.8	Very high	96.6	Very high	64 Å²	64	64.5 Å²	64.5	25%	0.251	36%	0.362	S	S	.	.	I	π-helix	trans	-76.5	-23.2	-174.5	-80.2	-85.7	0	0	0	114.5	Q30 L145 M227	Q30-Y231 VanDerWaalsContact NE2-CE1 3.3Å; L145-Y231 HydrophobicContact CD2-CE2 4.13Å; M227-Y231 HydrophobicContact CE-CD2 4.27Å; M227-Y231 HydrophobicContact CE-CE2 3.71Å; M227-Y231 HydrophobicContact CG-CD2 3.71Å; M227-Y231 HydrophobicContact CG-CE2 3.87Å; M227-Y231 WeakPolarHBondContact O-CD2 3.26Å; M227-Y231 PolarHBondContact O-N 3.22Å
232	L	96.4	Very high	96.6	Very high	129 Å²	129	61.2 Å²	61.2	68%	0.675	34%	0.34	S	S	*	.	I	π-helix	trans	-105.1	-17	-177.1	-56.5	174.9	0	0	0	114.5	N228	N228-L232 HydrophobicContact CB-CD1 4.32Å; N228-L232 WeakPolarHBondContact O-CB 3.26Å; N228-L232 WeakPolarHBondContact O-CG 3.5Å; N228-L232 PolarHBondContact O-N 3.38Å
233	Q	96.4	Very high	96.4	Very high	114 Å²	114	60.3 Å²	60.3	53%	0.533	33%	0.328	S	S	.	.	I	π-helix	trans	-135.6	-54.7	-173.8	-62.2	-178.6	-14.3	0	0	113	K229 I235 T236 T237	K229-Q233 WeakPolarHBondContact O-CB 3.49Å; K229-Q233 PolarHBondContact O-N 2.87Å; Q233-I235 PolarHBondContact O-N 2.87Å; Q233-T236 PolarHBondContact O-N 2.82Å; Q233-T237 WeakPolarHBondContact O-CB 3.36Å; Q233-T237 PolarHBondContact O-N 2.83Å; Q233-T237 VanDerWaalsContact O-N 3.08Å; Q233-T237 PolarHBondContact O-OG1 2.92Å
234	D	97.3	Very high	96.4	Very high	28 Å²	28	64.4 Å²	64.4	15%	0.15	35%	0.353	C	S	.	.	I	π-helix	trans	-68.3	-41.3	-170.2	-60.9	-39.1	0	0	0	111.6	L141 K229 Y230 T236 T237 L238	L141-D234 HydrophobicContact CD1-CB 4.35Å; K229-D234 WeakPolarHBondContact CG-OD2 3.22Å; K229-D234 IonicContact NZ-OD1 2.97Å; K229-D234 PolarHBondContact NZ-OD1 2.95Å; K229-D234 IonicContact NZ-OD2 3.67Å; K229-D234 PolarHBondContact NZ-OD2 2.89Å; K229-D234 PolarHBondContact O-N 3.09Å; Y230-D234 HydrophobicContact CD2-CB 4.36Å; Y230-D234 PolarHBondContact O-N 3.4Å; D234-T236 PolarHBondContact O-N 3.5Å; D234-T237 PolarHBondContact O-N 3.34Å; D234-L238 VanDerWaalsContact O-CG 3.28Å; D234-L238 WeakPolarHBondContact O-CG 3.39Å; D234-L238 PolarHBondContact O-N 3.43Å
235	I	96.1	Very high	96.3	Very high	31 Å²	31	62 Å²	62	16%	0.159	35%	0.346	C	S	.	.	H	α-helix	trans	-65.7	-36.9	-179	-156.9	172	0	0	0	113.1	Q30 Y230 Q233 I239	Q30-I235 HydrophobicContact CG-CD1 4.06Å; Y230-I235 HydrophobicContact CE1-CD1 4.3Å; Y230-I235 WeakPolarHBondContact O-CB 3.36Å; Y230-I235 PolarHBondContact O-N 3.15Å; Q233-I235 PolarHBondContact O-N 2.87Å; I235-I239 WeakPolarHBondContact O-CG1 3.18Å; I235-I239 PolarHBondContact O-N 2.72Å
236	T	96.7	Very high	96.3	Very high	73 Å²	73	58.8 Å²	58.8	45%	0.448	32%	0.322	S	S	.	.	H	α-helix	trans	-66.3	-46.2	173.7	-47.4	0	0	0	0	110.5	Q233 D234 L238 I239 D240	Q233-T236 PolarHBondContact O-N 2.82Å; D234-T236 PolarHBondContact O-N 3.5Å; T236-L238 VanDerWaalsContact C-N 3.27Å; T236-L238 PolarHBondContact O-N 2.92Å; T236-I239 WeakPolarHBondContact O-CB 3.3Å; T236-I239 PolarHBondContact O-N 3.44Å; T236-D240 PolarHBondContact O-N 3.48Å
237	T	96.7	Very high	96.3	Very high	76 Å²	76	62.9 Å²	62.9	47%	0.466	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-37.5	179.3	-54.2	0	0	0	0	111.6	Q233 D234 D240 C241	Q233-T237 WeakPolarHBondContact O-CB 3.36Å; Q233-T237 PolarHBondContact O-N 2.83Å; Q233-T237 VanDerWaalsContact O-N 3.08Å; Q233-T237 PolarHBondContact O-OG1 2.92Å; D234-T237 PolarHBondContact O-N 3.34Å; T237-D240 PolarHBondContact O-N 3.46Å; T237-C241 VanDerWaalsContact O-CB 3.3Å; T237-C241 WeakPolarHBondContact O-CB 3.33Å; T237-C241 PolarHBondContact O-N 2.89Å; T237-C241 PolarHBondContact O-SG 3.42Å
238	L	96.8	Very high	96.3	Very high	7 Å²	7	67.3 Å²	67.3	4%	0.037	35%	0.354	C	S	.	.	H	α-helix	trans	-63.8	-38.5	174.6	-74.7	166.2	0	0	0	112.9	S134 L137 C138 L141 D234 T236 A242	S134-L238 PolarHBondContact OG-O 3.33Å; L137-L238 HydrophobicContact CB-CD2 4.06Å; L137-L238 HydrophobicContact CD2-CD2 3.86Å; L137-L238 HydrophobicContact CG-CD2 3.92Å; C138-L238 HydrophobicContact CB-CD1 3.77Å; C138-L238 HydrophobicContact CB-CD2 4.48Å; L141-L238 HydrophobicContact CD1-CD1 3.92Å; L141-L238 HydrophobicContact CD1-CD2 4.35Å; L141-L238 HydrophobicContact CD1-CG 4.39Å; D234-L238 VanDerWaalsContact O-CG 3.28Å; D234-L238 WeakPolarHBondContact O-CG 3.39Å; D234-L238 PolarHBondContact O-N 3.43Å; T236-L238 VanDerWaalsContact C-N 3.27Å; T236-L238 PolarHBondContact O-N 2.92Å; L238-A242 PolarHBondContact O-N 2.91Å; L238-A242 VanDerWaalsContact O-N 3.08Å
239	I	96.2	Very high	96.3	Very high	75 Å²	75	63 Å²	63	39%	0.385	33%	0.332	S	S	.	.	H	α-helix	trans	-67.6	-48.6	176.3	-66.8	164.2	0	0	0	109.8	L34 I235 T236 C241 A242 D243	L34-I239 HydrophobicContact CD2-CG1 3.96Å; I235-I239 WeakPolarHBondContact O-CG1 3.18Å; I235-I239 PolarHBondContact O-N 2.72Å; T236-I239 WeakPolarHBondContact O-CB 3.3Å; T236-I239 PolarHBondContact O-N 3.44Å; I239-C241 VanDerWaalsContact C-N 3.28Å; I239-C241 PolarHBondContact O-N 3.09Å; I239-A242 WeakPolarHBondContact O-CB 3.44Å; I239-A242 PolarHBondContact O-N 3.34Å; I239-D243 PolarHBondContact O-N 3.2Å; I239-D243 VanDerWaalsContact O-N 3.1Å
240	D	95.6	Very high	96.3	Very high	105 Å²	105	60.3 Å²	60.3	56%	0.561	32%	0.322	S	S	*	.	H	α-helix	trans	-58.2	-40.6	176.1	-68.5	-32.8	0	0	0	111.6	T236 T237 A242 D243 V244	T236-D240 PolarHBondContact O-N 3.48Å; T237-D240 PolarHBondContact O-N 3.46Å; D240-A242 VanDerWaalsContact C-N 3.33Å; D240-A242 PolarHBondContact O-N 3.4Å; D240-D243 PolarHBondContact O-N 2.96Å; D240-V244 WeakPolarHBondContact O-CG2 3.43Å; D240-V244 PolarHBondContact O-N 3.41Å
241	C	94.1	Very high	96.2	Very high	67 Å²	67	61.6 Å²	61.6	45%	0.453	34%	0.336	S	S	.	.	H	α-helix	trans	-66.7	-26.6	175	-77.7	0	0	0	0	114.4	T237 I239	T237-C241 VanDerWaalsContact O-CB 3.3Å; T237-C241 WeakPolarHBondContact O-CB 3.33Å; T237-C241 PolarHBondContact O-N 2.89Å; T237-C241 PolarHBondContact O-SG 3.42Å; I239-C241 VanDerWaalsContact C-N 3.28Å; I239-C241 PolarHBondContact O-N 3.09Å
242	A	95	Very high	96.3	Very high	12 Å²	12	64.4 Å²	64.4	10%	0.099	35%	0.346	C	S	.	.	H	α-helix	trans	-77.4	-35.9	174.8	0	0	0	0	0	111.9	A131 L238 I239 D240	A131-A242 HydrophobicContact CB-CB 4.41Å; L238-A242 PolarHBondContact O-N 2.91Å; L238-A242 VanDerWaalsContact O-N 3.08Å; I239-A242 WeakPolarHBondContact O-CB 3.44Å; I239-A242 PolarHBondContact O-N 3.34Å; D240-A242 VanDerWaalsContact C-N 3.33Å; D240-A242 PolarHBondContact O-N 3.4Å
243	D	94.6	Very high	96.3	Very high	31 Å²	31	58.5 Å²	58.5	17%	0.166	32%	0.316	C	S	.	.	H	α-helix	trans	-92.4	3.1	-172.9	-78.7	10.4	0	0	0	114.5	K41 I239 D240 G245 Y246 H247	K41-D243 IonicContact NZ-OD1 3.55Å; K41-D243 PolarHBondContact NZ-OD1 3.27Å; K41-D243 IonicContact NZ-OD2 3.11Å; K41-D243 PolarHBondContact NZ-OD2 3.02Å; I239-D243 PolarHBondContact O-N 3.2Å; I239-D243 VanDerWaalsContact O-N 3.1Å; D240-D243 PolarHBondContact O-N 2.96Å; D243-G245 PolarHBondContact O-N 3.4Å; D243-Y246 WeakPolarHBondContact O-CB 3.49Å; D243-Y246 PolarHBondContact O-N 2.92Å; D243-H247 IonicContact OD2-CE1 2.72Å
244	V	95.6	Very high	96.3	Very high	90 Å²	90	56.7 Å²	56.7	55%	0.545	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	115.6	179.3	-176.5	0	0	0	0	110.8	L130 D240 Y246	L130-V244 HydrophobicContact CD1-CB 4.09Å; L130-V244 WeakPolarHBondContact CD1-O 3.45Å; D240-V244 WeakPolarHBondContact O-CG2 3.43Å; D240-V244 PolarHBondContact O-N 3.41Å; V244-Y246 VanDerWaalsContact C-N 3.35Å; V244-Y246 PolarHBondContact O-N 3.3Å
245	G	95.1	Very high	96.3	Very high	27 Å²	27	62.9 Å²	62.9	28%	0.278	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	-20.5	177.1	0	0	0	0	0	115.5	Y126 D243 H247 F248 S249	Y126-G245 PolarHBondContact OH-O 3.45Å; D243-G245 PolarHBondContact O-N 3.4Å; G245-H247 PolarHBondContact O-N 2.99Å; G245-F248 PolarHBondContact O-N 2.67Å; G245-F248 VanDerWaalsContact O-N 3.12Å; G245-S249 PolarHBondContact O-N 2.69Å
246	Y	97.3	Very high	96.3	Very high	11 Å²	11	63.2 Å²	63.2	4%	0.043	34%	0.341	C	S	.	.	H	α-helix	trans	-52	-63.3	-177.5	175.2	-103.8	0	0	0	111.4	K41 Q44 L45 T127 D243 V244 F248 S249 L250	K41-Y246 HydrophobicContact CB-CE2 4.17Å; K41-Y246 HydrophobicContact CG-CE1 4.39Å; K41-Y246 HydrophobicContact CG-CE2 4.29Å; Q44-Y246 PolarHBondContact OE1-OH 2.71Å; Q44-Y246 VanDerWaalsContact OE1-OH 3.09Å; L45-Y246 HydrophobicContact CD1-CD2 4.24Å; L45-Y246 HydrophobicContact CD1-CE2 3.84Å; L45-Y246 HydrophobicContact CD2-CE2 4.08Å; L45-Y246 HydrophobicContact CG-CE2 3.96Å; T127-Y246 HydrophobicContact CG2-CD2 4.22Å; D243-Y246 WeakPolarHBondContact O-CB 3.49Å; D243-Y246 PolarHBondContact O-N 2.92Å; V244-Y246 VanDerWaalsContact C-N 3.35Å; V244-Y246 PolarHBondContact O-N 3.3Å; Y246-F248 VanDerWaalsContact C-N 3.27Å; Y246-F248 PolarHBondContact O-N 2.89Å; Y246-S249 PolarHBondContact O-N 3.03Å; Y246-L250 PolarHBondContact O-N 3.14Å; Y246-L250 VanDerWaalsContact O-N 3.08Å
247	H	96.7	Very high	96.3	Very high	126 Å²	126	61.6 Å²	61.6	58%	0.583	33%	0.327	S	S	*	.	H	α-helix	trans	-58.4	-35.3	177.9	-61.2	97.2	0	0	0	113.1	D243 G245 G251	D243-H247 IonicContact OD2-CE1 2.72Å; G245-H247 PolarHBondContact O-N 2.99Å; H247-G251 PolarHBondContact O-N 3.18Å
248	F	96.9	Very high	96.3	Very high	147 Å²	147	63.3 Å²	63.3	65%	0.645	33%	0.333	S	S	*	.	H	α-helix	trans	-71	-46.9	-178.6	175.5	-97	0	0	0	112.4	G245 Y246 G251 R252	G245-F248 PolarHBondContact O-N 2.67Å; G245-F248 VanDerWaalsContact O-N 3.12Å; Y246-F248 VanDerWaalsContact C-N 3.27Å; Y246-F248 PolarHBondContact O-N 2.89Å; F248-G251 PolarHBondContact O-N 2.98Å; F248-R252 WeakPolarHBondContact O-CB 3.47Å; F248-R252 PolarHBondContact O-N 3.5Å
249	S	96.6	Very high	96.3	Very high	7 Å²	7	66.5 Å²	66.5	5%	0.049	36%	0.355	C	S	.	.	H	α-helix	trans	-64.2	-44.4	175.6	-89.8	0	0	0	0	111.4	Y126 G245 Y246 R252 V253	Y126-S249 WeakPolarHBondContact OH-CB 3.44Å; Y126-S249 PolarHBondContact OH-OG 3.18Å; G245-S249 PolarHBondContact O-N 2.69Å; Y246-S249 PolarHBondContact O-N 3.03Å; S249-R252 PolarHBondContact O-N 2.93Å; S249-R252 PolarHBondContact OG-NH2 3.05Å; S249-V253 WeakPolarHBondContact O-CG2 3.33Å; S249-V253 PolarHBondContact O-N 2.83Å
250	L	96.5	Very high	96.2	Very high	43 Å²	43	67.8 Å²	67.8	23%	0.225	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-47.1	177.9	-138	77.7	0	0	0	111	L45 M48 Y246 R252 V253 M254	L45-L250 HydrophobicContact CD2-CD1 3.49Å; L45-L250 VanDerWaalsContact CD2-CD1 3.49Å; M48-L250 HydrophobicContact CE-CD1 3.5Å; M48-L250 VanDerWaalsContact CE-CD1 3.5Å; M48-L250 HydrophobicContact CE-CG 4.08Å; M48-L250 HydrophobicContact SD-CD1 3.97Å; M48-L250 HydrophobicContact SD-CG 4.2Å; Y246-L250 PolarHBondContact O-N 3.14Å; Y246-L250 VanDerWaalsContact O-N 3.08Å; L250-R252 VanDerWaalsContact C-N 3.31Å; L250-R252 PolarHBondContact O-N 2.85Å; L250-V253 PolarHBondContact O-N 2.64Å; L250-M254 WeakPolarHBondContact O-CG 3.47Å; L250-M254 PolarHBondContact O-N 3.3Å
251	G	97.6	Very high	96.1	Very high	30 Å²	30	65.3 Å²	65.3	31%	0.309	34%	0.341	S	S	.	.	H	α-helix	trans	-62	-34.3	175.7	0	0	0	0	0	113.6	H247 F248 K255	H247-G251 PolarHBondContact O-N 3.18Å; F248-G251 PolarHBondContact O-N 2.98Å; G251-K255 WeakPolarHBondContact O-CB 3.25Å; G251-K255 WeakPolarHBondContact O-CG 3.28Å; G251-K255 PolarHBondContact O-N 2.83Å
252	R	97.4	Very high	96.1	Very high	123 Å²	123	65.4 Å²	65.4	46%	0.464	34%	0.342	S	S	.	.	H	α-helix	trans	-68.6	-44	173.7	-175.1	-177.1	63.7	-157	-7.7	112	F248 S249 L250 A256	F248-R252 WeakPolarHBondContact O-CB 3.47Å; F248-R252 PolarHBondContact O-N 3.5Å; S249-R252 PolarHBondContact O-N 2.93Å; S249-R252 PolarHBondContact OG-NH2 3.05Å; L250-R252 VanDerWaalsContact C-N 3.31Å; L250-R252 PolarHBondContact O-N 2.85Å; R252-A256 WeakPolarHBondContact O-CB 3.32Å; R252-A256 PolarHBondContact O-N 2.9Å; R252-A256 VanDerWaalsContact O-N 3.08Å
253	V	97.1	Very high	96.1	Very high	6 Å²	6	70.7 Å²	70.7	4%	0.036	36%	0.36	C	S	.	.	H	α-helix	trans	-62	-48	176.3	170.6	0	0	0	0	110.4	M48 L116 P119 V120 S249 L250 K255 A256 Y257	M48-V253 HydrophobicContact CE-CG1 4.17Å; L116-V253 HydrophobicContact CB-CG1 4.31Å; L116-V253 HydrophobicContact CD2-CG1 4.13Å; P119-V253 HydrophobicContact CB-CG2 3.76Å; P119-V253 HydrophobicContact CG-CG2 4.46Å; V120-V253 HydrophobicContact CG2-CB 4.4Å; V120-V253 HydrophobicContact CG2-CG1 3.89Å; V120-V253 HydrophobicContact CG2-CG2 3.93Å; S249-V253 WeakPolarHBondContact O-CG2 3.33Å; S249-V253 PolarHBondContact O-N 2.83Å; L250-V253 PolarHBondContact O-N 2.64Å; V253-K255 PolarHBondContact O-N 3.47Å; V253-A256 PolarHBondContact O-N 3.32Å; V253-A256 VanDerWaalsContact O-N 3.13Å; V253-Y257 PolarHBondContact O-N 3.3Å
254	M	96.9	Very high	96.1	Very high	75 Å²	75	69.9 Å²	69.9	37%	0.369	36%	0.356	S	S	.	.	H	α-helix	trans	-65.4	-38.1	179.9	-72.1	-64.9	162.2	0	0	112.9	M48 L250 A256 Y257 L258	M48-M254 HydrophobicContact CE-CE 4.06Å; M48-M254 HydrophobicContact CG-CE 3.99Å; M48-M254 HydrophobicContact SD-CE 3.25Å; M48-M254 WeakPolarHBondContact SD-CE 3.44Å; L250-M254 WeakPolarHBondContact O-CG 3.47Å; L250-M254 PolarHBondContact O-N 3.3Å; M254-A256 VanDerWaalsContact C-N 3.32Å; M254-A256 PolarHBondContact O-N 2.99Å; M254-Y257 PolarHBondContact O-N 2.82Å; M254-L258 WeakPolarHBondContact O-CB 3.43Å; M254-L258 VanDerWaalsContact O-CG 3.28Å; M254-L258 WeakPolarHBondContact O-CG 3.3Å; M254-L258 PolarHBondContact O-N 3.01Å
255	K	97.4	Very high	96	Very high	159 Å²	159	72.4 Å²	72.4	69%	0.691	36%	0.362	S	S	*	.	H	α-helix	trans	-62.9	-37.1	172	-76.3	173.2	-179.5	-177.4	0	112.6	G251 V253 S259	G251-K255 WeakPolarHBondContact O-CB 3.25Å; G251-K255 WeakPolarHBondContact O-CG 3.28Å; G251-K255 PolarHBondContact O-N 2.83Å; V253-K255 PolarHBondContact O-N 3.47Å; K255-S259 PolarHBondContact O-N 3.33Å; K255-S259 PolarHBondContact O-OG 3.4Å
256	A	96.2	Very high	96.1	Very high	37 Å²	37	77 Å²	77	31%	0.306	38%	0.376	S	S	.	.	H	α-helix	trans	-72.9	-32.8	175.9	0	0	0	0	0	113.1	L116 R252 V253 M254 S259 R260	L116-A256 HydrophobicContact CD2-CB 3.67Å; R252-A256 WeakPolarHBondContact O-CB 3.32Å; R252-A256 PolarHBondContact O-N 2.9Å; R252-A256 VanDerWaalsContact O-N 3.08Å; V253-A256 PolarHBondContact O-N 3.32Å; V253-A256 VanDerWaalsContact O-N 3.13Å; M254-A256 VanDerWaalsContact C-N 3.32Å; M254-A256 PolarHBondContact O-N 2.99Å; A256-S259 PolarHBondContact O-OG 2.91Å; A256-R260 VanDerWaalsContact O-CG 3.25Å; A256-R260 WeakPolarHBondContact O-CG 3.26Å; A256-R260 PolarHBondContact O-N 3.41Å
257	Y	96.1	Very high	96	Very high	39 Å²	39	78 Å²	78	15%	0.153	38%	0.382	C	S	.	.	H	α-helix	trans	-64.6	-49	170.2	-179.6	-97.3	0	0	0	111.3	L52 L116 V253 M254 S259 R260 Q261	L52-Y257 HydrophobicContact CD2-CD2 4.21Å; L52-Y257 HydrophobicContact CD2-CE2 4.47Å; L116-Y257 HydrophobicContact CD1-CD2 3.79Å; L116-Y257 HydrophobicContact CD1-CG 4.34Å; V253-Y257 PolarHBondContact O-N 3.3Å; M254-Y257 PolarHBondContact O-N 2.82Å; Y257-S259 PolarHBondContact O-N 2.83Å; Y257-R260 PolarHBondContact O-N 3.46Å; Y257-Q261 HydrophobicContact CD1-CG 4.34Å; Y257-Q261 HydrophobicContact CE1-CG 3.95Å; Y257-Q261 WeakPolarHBondContact O-CG 3.39Å; Y257-Q261 PolarHBondContact O-N 3.08Å; Y257-Q261 VanDerWaalsContact O-N 3.07Å; Y257-Q261 PolarHBondContact OH-NE2 2.77Å
258	L	96.9	Very high	95.9	Very high	113 Å²	113	75 Å²	75	59%	0.592	37%	0.371	S	S	*	.	H	α-helix	trans	-63.2	-39.6	179.8	-70.7	169	0	0	0	112.8	M254 Q261 S262	M254-L258 WeakPolarHBondContact O-CB 3.43Å; M254-L258 VanDerWaalsContact O-CG 3.28Å; M254-L258 WeakPolarHBondContact O-CG 3.3Å; M254-L258 PolarHBondContact O-N 3.01Å; L258-Q261 PolarHBondContact O-N 2.95Å; L258-S262 WeakPolarHBondContact O-CB 3.47Å; L258-S262 PolarHBondContact O-N 3.33Å
259	S	95.9	Very high	95.9	Very high	73 Å²	73	71.7 Å²	71.7	51%	0.51	37%	0.365	S	S	.	.	H	α-helix	trans	-68.4	-34.9	177.9	65.1	0	0	0	0	112.8	K255 A256 Y257 W263	K255-S259 PolarHBondContact O-N 3.33Å; K255-S259 PolarHBondContact O-OG 3.4Å; A256-S259 PolarHBondContact O-OG 2.91Å; Y257-S259 PolarHBondContact O-N 2.83Å; S259-W263 WeakPolarHBondContact O-CB 3.41Å; S259-W263 PolarHBondContact O-N 2.74Å
260	R	94.1	Very high	95.9	Very high	102 Å²	102	74.4 Å²	74.4	39%	0.385	38%	0.382	S	S	.	.	H	α-helix	trans	-65.4	-46	173.5	-74.2	-71.3	-162.4	-168.8	3	112.3	L108 S111 A256 Y257 W263 S264	L108-R260 HydrophobicContact CD2-CB 3.98Å; S111-R260 PolarHBondContact OG-NE 3.31Å; A256-R260 VanDerWaalsContact O-CG 3.25Å; A256-R260 WeakPolarHBondContact O-CG 3.26Å; A256-R260 PolarHBondContact O-N 3.41Å; Y257-R260 PolarHBondContact O-N 3.46Å; R260-W263 PolarHBondContact O-N 2.96Å; R260-S264 PolarHBondContact O-N 3.04Å
261	Q	93.4	Very high	95.8	Very high	54 Å²	54	72.6 Å²	72.6	25%	0.252	37%	0.374	S	S	.	.	H	α-helix	trans	-61	-47	175.8	-70.1	-68.8	-3.8	0	0	111.5	Y257 L258 W263 S264 Q265	Y257-Q261 HydrophobicContact CD1-CG 4.34Å; Y257-Q261 HydrophobicContact CE1-CG 3.95Å; Y257-Q261 WeakPolarHBondContact O-CG 3.39Å; Y257-Q261 PolarHBondContact O-N 3.08Å; Y257-Q261 VanDerWaalsContact O-N 3.07Å; Y257-Q261 PolarHBondContact OH-NE2 2.77Å; L258-Q261 PolarHBondContact O-N 2.95Å; Q261-W263 PolarHBondContact O-N 3.06Å; Q261-S264 PolarHBondContact O-N 3.28Å; Q261-Q265 PolarHBondContact O-N 3.25Å
262	S	95.6	Very high	95.8	Very high	69 Å²	69	75.5 Å²	75.5	48%	0.483	38%	0.381	S	S	.	.	H	α-helix	trans	-59.7	-41.6	177.1	-176.6	0	0	0	0	112.8	L258 Q265 Q266	L258-S262 WeakPolarHBondContact O-CB 3.47Å; L258-S262 PolarHBondContact O-N 3.33Å; S262-Q265 PolarHBondContact O-N 3.2Å; S262-Q266 PolarHBondContact O-N 3.36Å
263	W	95.2	Very high	95.8	Very high	123 Å²	123	74.6 Å²	74.6	47%	0.466	38%	0.383	S	S	.	.	H	α-helix	trans	-64.6	-43.1	176.1	-177.5	75.4	0	0	0	112.7	D104 S259 R260 Q261 Q265 Q266 N267	D104-W263 WeakPolarHBondContact OD1-CH2 3.37Å; D104-W263 WeakPolarHBondContact OD1-CZ3 3.43Å; S259-W263 WeakPolarHBondContact O-CB 3.41Å; S259-W263 PolarHBondContact O-N 2.74Å; R260-W263 PolarHBondContact O-N 2.96Å; Q261-W263 PolarHBondContact O-N 3.06Å; W263-Q265 VanDerWaalsContact C-N 3.32Å; W263-Q265 PolarHBondContact O-N 2.83Å; W263-Q266 WeakPolarHBondContact O-CB 3.45Å; W263-Q266 PolarHBondContact O-N 3.01Å; W263-N267 WeakPolarHBondContact CH2-ND2 3.4Å; W263-N267 WeakPolarHBondContact CZ2-ND2 3.3Å; W263-N267 WeakPolarHBondContact CZ3-ND2 3.2Å; W263-N267 PolarHBondContact O-N 3.07Å; W263-N267 PolarHBondContact O-OD1 2.81Å
264	S	93.1	Very high	95.6	Very high	13 Å²	13	79.8 Å²	79.8	9%	0.091	41%	0.406	C	S	.	.	H	α-helix	trans	-62.3	-39.7	175	-164.1	0	0	0	0	112	R260 Q261 Q266 N267 L268	R260-S264 PolarHBondContact O-N 3.04Å; Q261-S264 PolarHBondContact O-N 3.28Å; S264-Q266 VanDerWaalsContact C-N 3.35Å; S264-N267 PolarHBondContact O-N 3.28Å; S264-L268 PolarHBondContact O-N 3.36Å
265	Q	94.3	Very high	95.6	Very high	143 Å²	143	77.7 Å²	77.7	67%	0.668	40%	0.396	S	S	*	.	H	α-helix	trans	-65.1	-38.1	175	-173.5	180	3.2	0	0	111.9	Q261 S262 W263 S269	Q261-Q265 PolarHBondContact O-N 3.25Å; S262-Q265 PolarHBondContact O-N 3.2Å; W263-Q265 VanDerWaalsContact C-N 3.32Å; W263-Q265 PolarHBondContact O-N 2.83Å; Q265-S269 PolarHBondContact O-N 3.37Å
266	Q	96.3	Very high	95.6	Very high	124 Å²	124	76.7 Å²	76.7	58%	0.579	39%	0.394	S	S	*	.	H	α-helix	trans	-65.1	-45.9	175.3	-173.5	177	1.3	0	0	111.6	S262 W263 S264 L268 S269 T270	S262-Q266 PolarHBondContact O-N 3.36Å; W263-Q266 WeakPolarHBondContact O-CB 3.45Å; W263-Q266 PolarHBondContact O-N 3.01Å; S264-Q266 VanDerWaalsContact C-N 3.35Å; Q266-L268 VanDerWaalsContact C-N 3.34Å; Q266-L268 PolarHBondContact O-N 3.39Å; Q266-S269 WeakPolarHBondContact O-CB 3.47Å; Q266-S269 PolarHBondContact O-N 3.2Å; Q266-S269 VanDerWaalsContact O-N 3.16Å; Q266-T270 PolarHBondContact O-N 3.39Å; Q266-T270 PolarHBondContact O-OG1 2.93Å
267	N	95.1	Very high	95.6	Very high	32 Å²	32	80.3 Å²	80.3	17%	0.171	41%	0.405	C	S	.	.	H	α-helix	trans	-58.7	-45.5	176	-70.4	0.4	0	0	0	111.6	D104 W263 S264 S269 T270 G271	D104-N267 PolarHBondContact OD1-ND2 3.07Å; D104-N267 WeakPolarHBondContact OD2-CB 3.42Å; D104-N267 PolarHBondContact OD2-ND2 3.39Å; W263-N267 WeakPolarHBondContact CH2-ND2 3.4Å; W263-N267 WeakPolarHBondContact CZ2-ND2 3.3Å; W263-N267 WeakPolarHBondContact CZ3-ND2 3.2Å; W263-N267 PolarHBondContact O-N 3.07Å; W263-N267 PolarHBondContact O-OD1 2.81Å; S264-N267 PolarHBondContact O-N 3.28Å; N267-S269 VanDerWaalsContact C-N 3.33Å; N267-S269 PolarHBondContact O-N 3.47Å; N267-T270 PolarHBondContact O-N 3.01Å; N267-G271 PolarHBondContact O-N 3.46Å
268	L	95.9	Very high	95.6	Very high	64 Å²	64	79.4 Å²	79.4	34%	0.335	41%	0.406	S	S	.	.	H	α-helix	trans	-58.3	-44.2	174.9	177.6	59.3	0	0	0	111.4	S264 Q266 T270 G271 L272	S264-L268 PolarHBondContact O-N 3.36Å; Q266-L268 VanDerWaalsContact C-N 3.34Å; Q266-L268 PolarHBondContact O-N 3.39Å; L268-T270 PolarHBondContact O-N 3.28Å; L268-G271 PolarHBondContact O-N 3.41Å; L268-L272 HydrophobicContact CD1-CD1 3.94Å; L268-L272 HydrophobicContact CD1-CG 4.02Å; L268-L272 HydrophobicContact CG-CD1 3.99Å; L268-L272 HydrophobicContact CG-CG 4.47Å; L268-L272 WeakPolarHBondContact O-CB 3.22Å; L268-L272 VanDerWaalsContact O-CG 3.28Å; L268-L272 WeakPolarHBondContact O-CG 3.31Å; L268-L272 PolarHBondContact O-N 2.88Å
269	S	96.9	Very high	95.6	Very high	76 Å²	76	77.4 Å²	77.4	53%	0.531	40%	0.398	S	S	.	.	H	α-helix	trans	-62.3	-42.7	176.9	-167.6	0	0	0	0	112.8	Q265 Q266 N267 Q273	Q265-S269 PolarHBondContact O-N 3.37Å; Q266-S269 WeakPolarHBondContact O-CB 3.47Å; Q266-S269 PolarHBondContact O-N 3.2Å; Q266-S269 VanDerWaalsContact O-N 3.16Å; N267-S269 VanDerWaalsContact C-N 3.33Å; N267-S269 PolarHBondContact O-N 3.47Å; S269-Q273 PolarHBondContact O-N 2.71Å
270	T	96.2	Very high	95.6	Very high	65 Å²	65	78.1 Å²	78.1	40%	0.399	41%	0.408	S	S	.	.	H	α-helix	trans	-68	-38.1	176.9	-61.9	0	0	0	0	112	Q266 N267 L268 Q273 Q274	Q266-T270 PolarHBondContact O-N 3.39Å; Q266-T270 PolarHBondContact O-OG1 2.93Å; N267-T270 PolarHBondContact O-N 3.01Å; L268-T270 PolarHBondContact O-N 3.28Å; T270-Q273 WeakPolarHBondContact O-CB 3.49Å; T270-Q273 PolarHBondContact O-N 2.98Å; T270-Q274 WeakPolarHBondContact O-CG 3.44Å; T270-Q274 PolarHBondContact O-N 3.42Å
271	G	95.1	Very high	95.6	Very high	5 Å²	5	74.6 Å²	74.6	5%	0.052	40%	0.403	C	S	.	.	H	α-helix	trans	-68.5	-39.5	176.7	0	0	0	0	0	113.8	N267 L268 Q273 Q274 L275	N267-G271 PolarHBondContact O-N 3.46Å; L268-G271 PolarHBondContact O-N 3.41Å; G271-Q273 VanDerWaalsContact C-N 3.32Å; G271-Q274 PolarHBondContact O-N 3.26Å; G271-L275 PolarHBondContact O-N 2.71Å
272	L	96.4	Very high	95.8	Very high	91 Å²	91	76 Å²	76	48%	0.476	41%	0.412	S	S	.	.	H	α-helix	trans	-65.1	-35.1	171.5	-70.9	172.2	0	0	0	111.9	L268 L275 Q276	L268-L272 HydrophobicContact CD1-CD1 3.94Å; L268-L272 HydrophobicContact CD1-CG 4.02Å; L268-L272 HydrophobicContact CG-CD1 3.99Å; L268-L272 HydrophobicContact CG-CG 4.47Å; L268-L272 WeakPolarHBondContact O-CB 3.22Å; L268-L272 VanDerWaalsContact O-CG 3.28Å; L268-L272 WeakPolarHBondContact O-CG 3.31Å; L268-L272 PolarHBondContact O-N 2.88Å; L272-L275 PolarHBondContact O-N 3.31Å; L272-Q276 WeakPolarHBondContact O-CB 3.36Å; L272-Q276 PolarHBondContact O-N 3.08Å
273	Q	96.8	Very high	95.7	Very high	104 Å²	104	75.6 Å²	75.6	49%	0.486	41%	0.405	S	S	.	.	H	α-helix	trans	-62.7	-44.3	171.7	-171.4	-169.7	-37.8	0	0	111.6	S269 T270 G271 L275 Q276 E277	S269-Q273 PolarHBondContact O-N 2.71Å; T270-Q273 WeakPolarHBondContact O-CB 3.49Å; T270-Q273 PolarHBondContact O-N 2.98Å; G271-Q273 VanDerWaalsContact C-N 3.32Å; Q273-L275 VanDerWaalsContact C-N 3.3Å; Q273-L275 PolarHBondContact O-N 3.48Å; Q273-Q276 CarbonylContact O-C 3.49Å; Q273-Q276 WeakPolarHBondContact O-CB 3.45Å; Q273-Q276 PolarHBondContact O-N 2.95Å; Q273-Q276 VanDerWaalsContact O-N 3.1Å; Q273-E277 PolarHBondContact NE2-OE1 2.92Å; Q273-E277 WeakPolarHBondContact O-CG 3.46Å; Q273-E277 PolarHBondContact O-N 2.81Å
274	Q	94.6	Very high	95.7	Very high	114 Å²	114	77.8 Å²	77.8	53%	0.533	42%	0.42	S	S	.	.	H	α-helix	trans	-62.1	-37	175.8	-70	173.9	6.7	0	0	112.4	T270 G271 E277 A278	T270-Q274 WeakPolarHBondContact O-CG 3.44Å; T270-Q274 PolarHBondContact O-N 3.42Å; G271-Q274 PolarHBondContact O-N 3.26Å; Q274-E277 PolarHBondContact O-N 3.03Å; Q274-A278 PolarHBondContact O-N 3.05Å
275	L	96.3	Very high	95.8	Very high	31 Å²	31	79.9 Å²	79.9	16%	0.162	44%	0.435	C	S	.	.	H	α-helix	trans	-66.9	-39.5	172.4	-179	59.9	0	0	0	111.8	V90 A93 L94 G271 L272 Q273 A278 V279	V90-L275 HydrophobicContact CG1-CD1 4.2Å; A93-L275 HydrophobicContact CB-CD1 3.97Å; L94-L275 HydrophobicContact CB-CD1 4.1Å; L94-L275 HydrophobicContact CD1-CD2 3.94Å; G271-L275 PolarHBondContact O-N 2.71Å; L272-L275 PolarHBondContact O-N 3.31Å; Q273-L275 VanDerWaalsContact C-N 3.3Å; Q273-L275 PolarHBondContact O-N 3.48Å; L275-A278 PolarHBondContact O-N 3.32Å; L275-V279 WeakPolarHBondContact O-CG2 3.42Å; L275-V279 PolarHBondContact O-N 3.26Å
276	Q	97.3	Very high	95.7	Very high	139 Å²	139	78.3 Å²	78.3	65%	0.65	42%	0.423	S	S	*	.	H	α-helix	trans	-64.6	-39.5	175	-173.3	178.1	6	0	0	112	L272 Q273 V279 A280	L272-Q276 WeakPolarHBondContact O-CB 3.36Å; L272-Q276 PolarHBondContact O-N 3.08Å; Q273-Q276 CarbonylContact O-C 3.49Å; Q273-Q276 WeakPolarHBondContact O-CB 3.45Å; Q273-Q276 PolarHBondContact O-N 2.95Å; Q273-Q276 VanDerWaalsContact O-N 3.1Å; Q276-V279 PolarHBondContact O-N 3.1Å; Q276-A280 WeakPolarHBondContact O-CB 2.8Å; Q276-A280 PolarHBondContact O-N 3.01Å
277	E	96.3	Very high	95.6	Very high	112 Å²	112	73.4 Å²	73.4	52%	0.523	40%	0.401	S	S	.	.	H	α-helix	trans	-63	-41.8	173.2	-73.1	167.7	-166.2	0	0	111.4	Q273 Q274 A280 G281	Q273-E277 PolarHBondContact NE2-OE1 2.92Å; Q273-E277 WeakPolarHBondContact O-CG 3.46Å; Q273-E277 PolarHBondContact O-N 2.81Å; Q274-E277 PolarHBondContact O-N 3.03Å; E277-A280 PolarHBondContact O-N 3.43Å; E277-G281 PolarHBondContact O-N 3.29Å; E277-G281 VanDerWaalsContact O-N 3.07Å
278	A	95.6	Very high	95.6	Very high	21 Å²	21	77.9 Å²	77.9	17%	0.174	42%	0.415	C	S	.	.	H	α-helix	trans	-63.7	-40.4	173.4	0	0	0	0	0	112.5	V90 A93 Q274 L275 G281	V90-A278 HydrophobicContact CG2-CB 4.2Å; V90-A278 VanDerWaalsContact CG2-O 3.31Å; V90-A278 WeakPolarHBondContact CG2-O 3.31Å; A93-A278 HydrophobicContact CB-CB 3.87Å; Q274-A278 PolarHBondContact O-N 3.05Å; L275-A278 PolarHBondContact O-N 3.32Å; A278-G281 WeakPolarHBondContact O-CA 3.23Å; A278-G281 PolarHBondContact O-N 3.06Å; A278-G281 VanDerWaalsContact O-N 3.12Å
279	V	96.7	Very high	95.5	Very high	71 Å²	71	77.8 Å²	77.8	43%	0.43	42%	0.415	S	S	.	.	H	α-helix	trans	-67.4	-39.7	176.7	168.6	0	0	0	0	111.6	V90 L275 Q276 G281 L282	V90-V279 HydrophobicContact CG1-CG2 3.75Å; V90-V279 HydrophobicContact CG2-CG2 4.04Å; L275-V279 WeakPolarHBondContact O-CG2 3.42Å; L275-V279 PolarHBondContact O-N 3.26Å; Q276-V279 PolarHBondContact O-N 3.1Å; V279-G281 PolarHBondContact O-N 3.17Å; V279-L282 HydrophobicContact CG1-CD1 4.27Å; V279-L282 WeakPolarHBondContact O-CB 3.43Å; V279-L282 WeakPolarHBondContact O-CD1 3.36Å; V279-L282 VanDerWaalsContact O-CG 3.27Å; V279-L282 WeakPolarHBondContact O-CG 3.43Å; V279-L282 PolarHBondContact O-N 3.23Å
280	A	96.4	Very high	95.2	Very high	88 Å²	88	74.8 Å²	74.8	73%	0.727	40%	0.395	S	S	*	.	H	α-helix	trans	-65.2	-20.3	171.7	0	0	0	0	0	112.7	Q276 E277 L282	Q276-A280 WeakPolarHBondContact O-CB 2.8Å; Q276-A280 PolarHBondContact O-N 3.01Å; E277-A280 PolarHBondContact O-N 3.43Å; A280-L282 VanDerWaalsContact C-N 3.34Å
281	G	95	Very high	95	Very high	27 Å²	27	75.3 Å²	75.3	28%	0.278	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	3.1	174.3	0	0	0	0	0	115.8	S86 E277 A278 V279 R286	S86-G281 WeakPolarHBondContact CB-O 3.35Å; E277-G281 PolarHBondContact O-N 3.29Å; E277-G281 VanDerWaalsContact O-N 3.07Å; A278-G281 WeakPolarHBondContact O-CA 3.23Å; A278-G281 PolarHBondContact O-N 3.06Å; A278-G281 VanDerWaalsContact O-N 3.12Å; V279-G281 PolarHBondContact O-N 3.17Å; G281-R286 PolarHBondContact O-NH1 3.1Å; G281-R286 PolarHBondContact O-NH2 3.34Å
282	L	96.1	Very high	94.9	Very high	85 Å²	85	78.4 Å²	78.4	45%	0.445	41%	0.41	S	S	.	.			trans	-66	124.8	176.3	-73.4	172.9	0	0	0	112	V87 V90 V279 A280	V87-L282 HydrophobicContact CB-CD2 4.44Å; V87-L282 HydrophobicContact CG2-CD2 3.89Å; V90-L282 HydrophobicContact CG2-CD1 4.36Å; V90-L282 HydrophobicContact CG2-CD2 3.72Å; V90-L282 HydrophobicContact CG2-CG 3.93Å; V279-L282 HydrophobicContact CG1-CD1 4.27Å; V279-L282 WeakPolarHBondContact O-CB 3.43Å; V279-L282 WeakPolarHBondContact O-CD1 3.36Å; V279-L282 VanDerWaalsContact O-CG 3.27Å; V279-L282 WeakPolarHBondContact O-CG 3.43Å; V279-L282 PolarHBondContact O-N 3.23Å; A280-L282 VanDerWaalsContact C-N 3.34Å
283	D	95	Very high	94.6	Very high	60 Å²	60	81.4 Å²	81.4	32%	0.321	42%	0.421	S	S	.	.			trans	-151.2	110.2	-174.9	-176.7	-14.2	0	0	0	112.1	S86 S285 R286 D287	S86-D283 PolarHBondContact OG-N 2.69Å; D283-S285 VanDerWaalsContact C-N 3.33Å; D283-S285 PolarHBondContact O-N 3.24Å; D283-S285 WeakPolarHBondContact OD1-CA 3.46Å; D283-S285 WeakPolarHBondContact OD1-CB 3.44Å; D283-S285 PolarHBondContact OD1-N 3.02Å; D283-R286 HydrophobicContact CB-CB 3.88Å; D283-R286 VanDerWaalsContact CG-CB 3.48Å; D283-R286 PolarHBondContact OD1-N 3.06Å; D283-R286 WeakPolarHBondContact OD2-CB 3.14Å; D283-R286 IonicContact OD2-NH1 2.68Å; D283-D287 WeakPolarHBondContact O-CB 3.42Å; D283-D287 VanDerWaalsContact O-CG 3.29Å; D283-D287 PolarHBondContact O-N 2.75Å; D283-D287 VanDerWaalsContact O-N 3.07Å
284	Q	94.1	Very high	94.3	Very high	169 Å²	169	80.6 Å²	80.6	79%	0.79	42%	0.42	S	S	*	.	H	α-helix	trans	-65.9	-32.2	178.1	-174.4	-176.5	8.5	0	0	113.1	R288	Q284-R288 WeakPolarHBondContact O-CB 3.47Å; Q284-R288 PolarHBondContact O-N 2.84Å
285	S	94.9	Very high	94.1	Very high	57 Å²	57	78.7 Å²	78.7	40%	0.399	41%	0.411	S	S	.	.	H	α-helix	trans	-75.5	-44.7	-178.8	-62.5	0	0	0	0	110.5	D283 D287 R288 D289	D283-S285 VanDerWaalsContact C-N 3.33Å; D283-S285 PolarHBondContact O-N 3.24Å; D283-S285 WeakPolarHBondContact OD1-CA 3.46Å; D283-S285 WeakPolarHBondContact OD1-CB 3.44Å; D283-S285 PolarHBondContact OD1-N 3.02Å; S285-D287 VanDerWaalsContact C-N 3.33Å; S285-D287 PolarHBondContact O-N 2.88Å; S285-R288 WeakPolarHBondContact O-CB 3.43Å; S285-R288 PolarHBondContact O-N 3.08Å; S285-D289 PolarHBondContact O-N 3.34Å
286	R	93.1	Very high	93.8	Very high	109 Å²	109	78.8 Å²	78.8	41%	0.411	42%	0.42	S	S	.	.	H	α-helix	trans	-61.7	-40.8	174.4	-168.9	179	76.9	-125.4	7.4	112	S86 G281 D283 D289 A290	S86-R286 VanDerWaalsContact CB-NH2 3.25Å; G281-R286 PolarHBondContact O-NH1 3.1Å; G281-R286 PolarHBondContact O-NH2 3.34Å; D283-R286 HydrophobicContact CB-CB 3.88Å; D283-R286 VanDerWaalsContact CG-CB 3.48Å; D283-R286 PolarHBondContact OD1-N 3.06Å; D283-R286 WeakPolarHBondContact OD2-CB 3.14Å; D283-R286 IonicContact OD2-NH1 2.68Å; R286-D289 PolarHBondContact O-N 3.45Å; R286-A290 WeakPolarHBondContact O-CB 3.37Å; R286-A290 PolarHBondContact O-N 2.91Å
287	D	94.6	Very high	93.5	Very high	22 Å²	22	79.9 Å²	79.9	12%	0.118	43%	0.43	C	S	.	.	H	α-helix	trans	-70.8	-31.1	178.6	-72.9	4.5	0	0	0	112.6	H85 S86 D283 S285 L291	H85-D287 WeakPolarHBondContact CA-OD1 3.37Å; S86-D287 WeakPolarHBondContact CB-OD1 3.26Å; S86-D287 WeakPolarHBondContact CB-OD2 3.37Å; S86-D287 PolarHBondContact N-OD1 3.26Å; S86-D287 PolarHBondContact N-OD2 2.9Å; S86-D287 VanDerWaalsContact OG-CG 3.29Å; S86-D287 PolarHBondContact OG-OD1 2.91Å; S86-D287 PolarHBondContact OG-OD2 2.97Å; D283-D287 WeakPolarHBondContact O-CB 3.42Å; D283-D287 VanDerWaalsContact O-CG 3.29Å; D283-D287 PolarHBondContact O-N 2.75Å; D283-D287 VanDerWaalsContact O-N 3.07Å; S285-D287 VanDerWaalsContact C-N 3.33Å; S285-D287 PolarHBondContact O-N 2.88Å; D287-L291 WeakPolarHBondContact O-CB 3.47Å; D287-L291 PolarHBondContact O-N 3.43Å; D287-L291 VanDerWaalsContact O-N 3.1Å
288	R	94.5	Very high	93.4	Very high	126 Å²	126	79.8 Å²	79.8	48%	0.475	44%	0.437	S	S	.	.	H	α-helix	trans	-64.6	-48.3	168	175.7	-158.6	68.3	-142.8	-7.4	111.1	Q284 S285 A290 L291 L292	Q284-R288 WeakPolarHBondContact O-CB 3.47Å; Q284-R288 PolarHBondContact O-N 2.84Å; S285-R288 WeakPolarHBondContact O-CB 3.43Å; S285-R288 PolarHBondContact O-N 3.08Å; R288-A290 VanDerWaalsContact C-N 3.35Å; R288-L291 WeakPolarHBondContact O-CB 3.41Å; R288-L291 PolarHBondContact O-N 3.37Å; R288-L292 HydrophobicContact CG-CD1 4.18Å; R288-L292 WeakPolarHBondContact O-CG 3.45Å; R288-L292 PolarHBondContact O-N 3.19Å
289	D	92.9	Very high	93.4	Very high	61 Å²	61	84.4 Å²	84.4	33%	0.326	45%	0.454	S	S	.	.	H	α-helix	trans	-71.1	-33.7	-174	-64.7	-20.7	0	0	0	111.5	S285 R286 L292 Q293	S285-D289 PolarHBondContact O-N 3.34Å; R286-D289 PolarHBondContact O-N 3.45Å; D289-L292 PolarHBondContact O-N 3.27Å; D289-Q293 VanDerWaalsContact O-CG 3.27Å; D289-Q293 WeakPolarHBondContact O-CG 3.35Å; D289-Q293 PolarHBondContact O-N 3.43Å
290	A	91.9	Very high	93.1	Very high	14 Å²	14	84.5 Å²	84.5	12%	0.116	46%	0.457	C	S	.	.	H	α-helix	trans	-61.3	-48.3	166.8	0	0	0	0	0	111.8	R286 R288 L292 Q293 D294	R286-A290 WeakPolarHBondContact O-CB 3.37Å; R286-A290 PolarHBondContact O-N 2.91Å; R288-A290 VanDerWaalsContact C-N 3.35Å; A290-L292 VanDerWaalsContact C-N 3.28Å; A290-L292 PolarHBondContact O-N 2.61Å; A290-Q293 PolarHBondContact O-N 2.85Å; A290-Q293 VanDerWaalsContact O-N 3.11Å; A290-D294 WeakPolarHBondContact O-CB 3.38Å; A290-D294 PolarHBondContact O-N 3.46Å
291	L	91.4	Very high	92.9	Very high	76 Å²	76	88 Å²	88	40%	0.398	46%	0.46	S	S	.	.	H	α-helix	trans	-57.3	-40.2	177.9	-179.9	69.1	0	0	0	112.5	D287 R288 H295	D287-L291 WeakPolarHBondContact O-CB 3.47Å; D287-L291 PolarHBondContact O-N 3.43Å; D287-L291 VanDerWaalsContact O-N 3.1Å; R288-L291 WeakPolarHBondContact O-CB 3.41Å; R288-L291 PolarHBondContact O-N 3.37Å; L291-H295 PolarHBondContact O-N 3.29Å; L291-H295 PolarHBondContact O-ND1 2.97Å
292	L	92.8	Very high	92.8	Very high	70 Å²	70	91.8 Å²	91.8	37%	0.366	48%	0.48	S	S	.	.	H	α-helix	trans	-69.7	-36.2	177.2	-68.7	172.2	0	0	0	112.4	R288 D289 A290 H295 G296 F299	R288-L292 HydrophobicContact CG-CD1 4.18Å; R288-L292 WeakPolarHBondContact O-CG 3.45Å; R288-L292 PolarHBondContact O-N 3.19Å; D289-L292 PolarHBondContact O-N 3.27Å; A290-L292 VanDerWaalsContact C-N 3.28Å; A290-L292 PolarHBondContact O-N 2.61Å; L292-H295 CarbonylContact O-C 3.3Å; L292-G296 WeakPolarHBondContact O-CA 3.42Å; L292-G296 PolarHBondContact O-N 3.27Å; L292-F299 HydrophobicContact CD2-CB 3.94Å; L292-F299 HydrophobicContact CD2-CD1 4.19Å; L292-F299 HydrophobicContact CD2-CD2 3.81Å; L292-F299 HydrophobicContact CD2-CE2 4.36Å; L292-F299 HydrophobicContact CD2-CG 3.71Å
293	Q	90.6	Very high	92.5	Very high	154 Å²	154	95.7 Å²	95.7	72%	0.72	50%	0.501	S	S	*	.	H	α-helix	trans	-71.3	-48.1	176.2	-72.6	172.1	27.5	0	0	112	D289 A290 H295 G296	D289-Q293 VanDerWaalsContact O-CG 3.27Å; D289-Q293 WeakPolarHBondContact O-CG 3.35Å; D289-Q293 PolarHBondContact O-N 3.43Å; A290-Q293 PolarHBondContact O-N 2.85Å; A290-Q293 VanDerWaalsContact O-N 3.11Å; Q293-H295 PolarHBondContact O-N 3.35Å; Q293-H295 VanDerWaalsContact O-N 3.08Å; Q293-G296 PolarHBondContact O-N 3.31Å; Q293-G296 VanDerWaalsContact O-N 3.11Å
294	D	89.6	Confident	92.4	Very high	87 Å²	87	103.5 Å²	103.5	47%	0.465	53%	0.526	S	S	.	.	H	α-helix	trans	-54.4	-28.6	177.1	-82	18.5	0	0	0	112.6	A290	A290-D294 WeakPolarHBondContact O-CB 3.38Å; A290-D294 PolarHBondContact O-N 3.46Å
295	H	90.9	Very high	92.3	Very high	74 Å²	74	105.3 Å²	105.3	34%	0.343	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	31.5	-177.7	-52.4	82.6	0	0	0	112	L291 L292 Q293 N297 T298 F299	L291-H295 PolarHBondContact O-N 3.29Å; L291-H295 PolarHBondContact O-ND1 2.97Å; L292-H295 CarbonylContact O-C 3.3Å; Q293-H295 PolarHBondContact O-N 3.35Å; Q293-H295 VanDerWaalsContact O-N 3.08Å; H295-N297 PolarHBondContact O-N 2.8Å; H295-T298 WeakPolarHBondContact O-CB 3.28Å; H295-T298 PolarHBondContact O-N 2.72Å; H295-F299 HydrophobicContact CB-CD2 3.77Å; H295-F299 HydrophobicContact CB-CE2 3.69Å; H295-F299 PolarHBondContact O-N 2.93Å
296	G	90.2	Very high	92	Very high	33 Å²	33	107.1 Å²	107.1	34%	0.34	54%	0.542	S	S	.	.	H	α-helix	trans	-52.2	-35	-172.2	0	0	0	0	0	115.1	L292 Q293 T298 F299 S300	L292-G296 WeakPolarHBondContact O-CA 3.42Å; L292-G296 PolarHBondContact O-N 3.27Å; Q293-G296 PolarHBondContact O-N 3.31Å; Q293-G296 VanDerWaalsContact O-N 3.11Å; G296-T298 VanDerWaalsContact C-N 3.28Å; G296-T298 PolarHBondContact O-N 3.36Å; G296-F299 PolarHBondContact O-N 3.4Å; G296-S300 VanDerWaalsContact O-CB 3.28Å; G296-S300 WeakPolarHBondContact O-CB 3.36Å; G296-S300 PolarHBondContact O-N 3.29Å
297	N	90.5	Very high	91.8	Very high	161 Å²	161	107.5 Å²	107.5	86%	0.861	54%	0.544	S	S	*	.	H	α-helix	trans	-66.2	-25.4	176.4	-65.7	-7.7	0	0	0	113.8	H295 S300	H295-N297 PolarHBondContact O-N 2.8Å; N297-S300 PolarHBondContact O-OG 3.4Å
298	T	94.9	Very high	91.4	Very high	110 Å²	110	114.1 Å²	114.1	68%	0.675	57%	0.574	S	S	*	*	H	α-helix	trans	-89.4	-30.8	179.9	-55.8	0	0	0	0	111.7	H295 G296	H295-T298 WeakPolarHBondContact O-CB 3.28Å; H295-T298 PolarHBondContact O-N 2.72Å; G296-T298 VanDerWaalsContact C-N 3.28Å; G296-T298 PolarHBondContact O-N 3.36Å
299	F	94.3	Very high	91	Very high	119 Å²	119	111.5 Å²	111.5	52%	0.522	57%	0.574	S	S	.	*	H	α-helix	trans	-103.6	5.4	-178.8	-60.6	-64.2	0	0	0	113.9	L292 H295 G296	L292-F299 HydrophobicContact CD2-CB 3.94Å; L292-F299 HydrophobicContact CD2-CD1 4.19Å; L292-F299 HydrophobicContact CD2-CD2 3.81Å; L292-F299 HydrophobicContact CD2-CE2 4.36Å; L292-F299 HydrophobicContact CD2-CG 3.71Å; H295-F299 HydrophobicContact CB-CD2 3.77Å; H295-F299 HydrophobicContact CB-CE2 3.69Å; H295-F299 PolarHBondContact O-N 2.93Å; G296-F299 PolarHBondContact O-N 3.4Å
300	S	92.3	Very high	90.7	Very high	73 Å²	73	115.3 Å²	115.3	51%	0.51	59%	0.589	S	S	.	*	S	Bend	trans	-65.3	138	174.8	55.9	0	0	0	0	111.9	G296 N297 P302	G296-S300 VanDerWaalsContact O-CB 3.28Å; G296-S300 WeakPolarHBondContact O-CB 3.36Å; G296-S300 PolarHBondContact O-N 3.29Å; N297-S300 PolarHBondContact O-OG 3.4Å; S300-P302 WeakPolarHBondContact O-CD 3.42Å
301	M	90.7	Very high	90	Very high	160 Å²	160	122.9 Å²	122.9	79%	0.788	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-62.6	127.4	173.8	-174.4	177.1	-70.8	0	0	110.7
302	P	92.6	Very high	89.3	Confident	108 Å²	108	127.5 Å²	127.5	70%	0.701	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-60	163.8	171.5	-24.7	35.2	0	0	0	112.9	S300	S300-P302 WeakPolarHBondContact O-CD 3.42Å
303	L	91.3	Very high	89	Confident	166 Å²	166	127.8 Å²	127.8	87%	0.869	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-59.1	140.3	171.6	-63.6	178.2	0	0	0	110.4
304	R	92.8	Very high	88.5	Confident	225 Å²	225	128.9 Å²	128.9	85%	0.849	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-68.1	137.7	173.8	-65.8	-177.2	178.9	-173.3	-1.4	109.7	P306	R304-P306 WeakPolarHBondContact O-CD 3.48Å
305	F	91.9	Very high	88.1	Confident	206 Å²	206	130.2 Å²	130.2	90%	0.904	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-65.5	121.3	173	-54.6	-71.3	0	0	0	110.2
306	P	89.2	Confident	87.7	Confident	96 Å²	96	131 Å²	131	62%	0.623	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-81.1	161.1	169.5	35.3	-34.1	0	0	0	110.5	R304	R304-P306 WeakPolarHBondContact O-CD 3.48Å
307	Y	87.6	Confident	87.4	Confident	117 Å²	117	135.4 Å²	135.4	46%	0.459	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-64.8	140.1	160.4	169.3	-106.3	0	0	0	109.5	P309 D313 I315	Y307-P309 HydrophobicContact CE1-CB 3.73Å; Y307-P309 HydrophobicContact CE1-CG 4.26Å; Y307-D313 VanDerWaalsContact OH-CG 3.31Å; Y307-D313 PolarHBondContact OH-OD2 3.28Å; Y307-I315 PolarHBondContact OH-O 3.19Å
308	Q	87.1	Confident	87.3	Confident	161 Å²	161	130.8 Å²	130.8	75%	0.752	66%	0.658	S	S	*	*			trans	-121.8	105.1	178.1	-68.2	-175.3	-14.2	0	0	107.9
309	P	86.4	Confident	86.7	Confident	71 Å²	71	127.9 Å²	127.9	46%	0.461	64%	0.642	S	S	.	*			trans	-69.9	141.1	178.9	27.1	-32.9	0	0	0	111.3	Y307 D313	Y307-P309 HydrophobicContact CE1-CB 3.73Å; Y307-P309 HydrophobicContact CE1-CG 4.26Å; P309-D313 HydrophobicContact CB-CB 4.07Å; P309-D313 WeakPolarHBondContact CB-O 3.27Å
310	H	85.8	Confident	86.1	Confident	141 Å²	141	122.3 Å²	122.3	65%	0.653	62%	0.618	S	S	*	*	S	Bend	trans	-88.4	136.7	167.3	-167.3	-87.9	0	0	0	108.8	E312 D313	H310-E312 VanDerWaalsContact C-N 3.29Å; H310-E312 PolarHBondContact O-N 3.05Å; H310-E312 VanDerWaalsContact O-N 3.09Å; H310-D313 WeakPolarHBondContact O-CB 3.49Å; H310-D313 PolarHBondContact O-N 3.1Å
311	E	78	Confident	85.4	Confident	173 Å²	173	123.7 Å²	123.7	81%	0.808	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	42.1	49.9	172.3	-70.1	173.8	153.6	0	0	115.2	D313	E311-D313 VanDerWaalsContact C-N 3.34Å; E311-D313 PolarHBondContact O-N 3.4Å
312	E	76.4	Confident	84.7	Confident	173 Å²	173	121.6 Å²	121.6	81%	0.808	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.1	25.8	179.4	-53	-166.6	166.6	0	0	116.2	H310 Q314	H310-E312 VanDerWaalsContact C-N 3.29Å; H310-E312 PolarHBondContact O-N 3.05Å; H310-E312 VanDerWaalsContact O-N 3.09Å; E312-Q314 WeakPolarHBondContact O-CG 3.36Å; E312-Q314 PolarHBondContact O-N 3.1Å
313	D	86.1	Confident	83.6	Confident	75 Å²	75	124.9 Å²	124.9	40%	0.401	62%	0.622	S	S	.	*			trans	-51.3	122.8	169.9	-175.1	8.6	0	0	0	111.8	Y307 P309 H310 E311 I315	Y307-D313 VanDerWaalsContact OH-CG 3.31Å; Y307-D313 PolarHBondContact OH-OD2 3.28Å; P309-D313 HydrophobicContact CB-CB 4.07Å; P309-D313 WeakPolarHBondContact CB-O 3.27Å; H310-D313 WeakPolarHBondContact O-CB 3.49Å; H310-D313 PolarHBondContact O-N 3.1Å; E311-D313 VanDerWaalsContact C-N 3.34Å; E311-D313 PolarHBondContact O-N 3.4Å; D313-I315 WeakPolarHBondContact OD1-CB 3.43Å; D313-I315 PolarHBondContact OD1-N 3Å
314	Q	80.1	Confident	82.8	Confident	177 Å²	177	121.6 Å²	121.6	83%	0.827	60%	0.603	S	S	*	*			trans	-93.4	-8.4	-176.9	-54.7	-175.6	15.9	0	0	111.9	E312 S316	E312-Q314 WeakPolarHBondContact O-CG 3.36Å; E312-Q314 PolarHBondContact O-N 3.1Å; Q314-S316 PolarHBondContact O-N 3.29Å
315	I	80.7	Confident	82.1	Confident	115 Å²	115	113.5 Å²	113.5	59%	0.59	57%	0.573	S	S	*	*			trans	-90.7	100.9	-175.6	-54.9	-179.3	0	0	0	109.9	Y307 D313	Y307-I315 PolarHBondContact OH-O 3.19Å; D313-I315 WeakPolarHBondContact OD1-CB 3.43Å; D313-I315 PolarHBondContact OD1-N 3Å
316	S	82.3	Confident	81.5	Confident	90 Å²	90	108 Å²	108	63%	0.629	56%	0.559	S	S	*	*			trans	-108.5	8.4	176.6	49.7	0	0	0	0	114	Q314	Q314-S316 PolarHBondContact O-N 3.29Å
317	E	85.3	Confident	81.1	Confident	126 Å²	126	107.5 Å²	107.5	59%	0.589	55%	0.548	S	S	*	.	S	Bend	trans	-117.5	151.6	177.3	-66.6	-174.5	176.9	0	0	111.5	S319 K436	E317-S319 PolarHBondContact O-N 3.49Å; E317-K436 IonicContact OE2-NZ 3.34Å; E317-K436 PolarHBondContact OE2-NZ 2.97Å
318	V	86.7	Confident	81.1	Confident	64 Å²	64	103 Å²	103	39%	0.388	53%	0.532	S	S	.	.			trans	-69.7	123.4	174.1	-178.7	0	0	0	0	109.8	L429 L430 A433	V318-L429 HydrophobicContact CG2-CB 4.38Å; V318-L430 HydrophobicContact CG1-CD2 4.47Å; V318-A433 HydrophobicContact CB-CB 4.02Å; V318-A433 HydrophobicContact CG1-CB 3.78Å; V318-A433 VanDerWaalsContact O-CB 3.3Å; V318-A433 WeakPolarHBondContact O-CB 3.39Å
319	S	83.4	Confident	81	Confident	49 Å²	49	97.7 Å²	97.7	34%	0.343	51%	0.507	S	S	.	.			trans	-102	139.1	176.3	-175.2	0	0	0	0	112	E317 E321	E317-S319 PolarHBondContact O-N 3.49Å; S319-E321 WeakPolarHBondContact OG-CG 3.43Å
320	A	82	Confident	80.9	Confident	2 Å²	2	98.1 Å²	98.1	2%	0.017	51%	0.508	C	S	.	.			trans	-122.5	42.2	175.7	0	0	0	0	0	111.1	R325 M328 A433 A437	A320-R325 WeakPolarHBondContact O-CB 3.48Å; A320-R325 WeakPolarHBondContact O-CG 3.31Å; A320-R325 PolarHBondContact O-NE 3.38Å; A320-R325 VanDerWaalsContact O-NE 3.13Å; A320-M328 HydrophobicContact CB-CB 4.16Å; A320-M328 HydrophobicContact CB-CG 4.44Å; A320-A433 HydrophobicContact CB-CB 4.25Å; A320-A437 HydrophobicContact CB-CB 3.84Å; A320-A437 VanDerWaalsContact O-CB 3.26Å; A320-A437 WeakPolarHBondContact O-CB 3.44Å
321	E	78	Confident	81	Confident	102 Å²	102	93.6 Å²	93.6	48%	0.477	49%	0.485	S	S	.	.			trans	-92.1	163.4	-178.6	-68.2	-179.6	176	0	0	113	S319 E323 M324	S319-E321 WeakPolarHBondContact OG-CG 3.43Å; E321-E323 PolarHBondContact O-N 3.38Å; E321-M324 PolarHBondContact O-N 2.9Å
322	C	75	Confident	81.6	Confident	117 Å²	117	86.6 Å²	86.6	79%	0.791	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	46.5	-126	175.9	-62.4	0	0	0	0	113.8	M324	C322-M324 VanDerWaalsContact C-N 3.35Å; C322-M324 PolarHBondContact O-N 2.86Å
323	E	68.6	Low	82.2	Confident	176 Å²	176	83.6 Å²	83.6	82%	0.822	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-73.3	-24.1	-169.2	-55.9	-167.1	168.8	0	0	113.6	E321 R325	E321-E323 PolarHBondContact O-N 3.38Å; E323-R325 VanDerWaalsContact C-N 3.32Å; E323-R325 PolarHBondContact O-N 3.18Å
324	M	74.6	Confident	82.3	Confident	97 Å²	97	82.6 Å²	82.6	48%	0.478	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-76.6	-16	-178.2	-62.1	-170.3	-63.6	0	0	113.4	E321 C322 C326 E327 M328	E321-M324 PolarHBondContact O-N 2.9Å; C322-M324 VanDerWaalsContact C-N 3.35Å; C322-M324 PolarHBondContact O-N 2.86Å; M324-C326 PolarHBondContact O-N 3.13Å; M324-E327 WeakPolarHBondContact O-CB 3.45Å; M324-E327 PolarHBondContact O-N 3.4Å; M324-E327 VanDerWaalsContact O-N 3.15Å; M324-M328 WeakPolarHBondContact O-CG 3.39Å; M324-M328 PolarHBondContact O-N 3.08Å
325	R	78.9	Confident	82.9	Confident	56 Å²	56	74.3 Å²	74.3	21%	0.211	39%	0.391	C	S	.	.	H	α-helix	trans	-55.6	-48	-172.1	-173.9	177.1	-66.9	175.8	-9	113.6	A320 E323 E327 M328 E329 A437 N441	A320-R325 WeakPolarHBondContact O-CB 3.48Å; A320-R325 WeakPolarHBondContact O-CG 3.31Å; A320-R325 PolarHBondContact O-NE 3.38Å; A320-R325 VanDerWaalsContact O-NE 3.13Å; E323-R325 VanDerWaalsContact C-N 3.32Å; E323-R325 PolarHBondContact O-N 3.18Å; R325-E327 VanDerWaalsContact C-N 3.29Å; R325-E327 PolarHBondContact O-N 3.46Å; R325-M328 PolarHBondContact O-N 3.07Å; R325-E329 WeakPolarHBondContact O-CB 3.38Å; R325-E329 PolarHBondContact O-N 3.11Å; R325-A437 PolarHBondContact NH2-O 3.44Å; R325-N441 PolarHBondContact NH1-ND2 3.28Å; R325-N441 PolarHBondContact NH1-OD1 2.93Å
326	C	79.7	Confident	83.5	Confident	91 Å²	91	73.2 Å²	73.2	62%	0.615	38%	0.383	S	S	*	.	H	α-helix	trans	-64.9	-35.2	-177.7	-171.3	0	0	0	0	111.9	M324 T330	M324-C326 PolarHBondContact O-N 3.13Å; C326-T330 WeakPolarHBondContact O-CB 3.39Å; C326-T330 PolarHBondContact O-N 3.01Å; C326-T330 VanDerWaalsContact O-N 3.08Å; C326-T330 PolarHBondContact O-OG1 3.28Å
327	E	81.1	Confident	84	Confident	84 Å²	84	71.8 Å²	71.8	39%	0.393	38%	0.377	S	S	.	.	H	α-helix	trans	-67.8	-50	174.6	-169.5	-167	135	0	0	111	M324 R325 E329 T330 R331	M324-E327 WeakPolarHBondContact O-CB 3.45Å; M324-E327 PolarHBondContact O-N 3.4Å; M324-E327 VanDerWaalsContact O-N 3.15Å; R325-E327 VanDerWaalsContact C-N 3.29Å; R325-E327 PolarHBondContact O-N 3.46Å; E327-E329 PolarHBondContact O-N 3.15Å; E327-T330 PolarHBondContact O-N 3.08Å; E327-T330 VanDerWaalsContact O-N 3.11Å; E327-R331 WeakPolarHBondContact O-CB 3.39Å; E327-R331 PolarHBondContact O-N 3.15Å
328	M	85.9	Confident	84.3	Confident	23 Å²	23	67.7 Å²	67.7	11%	0.113	36%	0.356	C	S	.	.	H	α-helix	trans	-63.4	-39	179.8	-64.8	-56.8	127.2	0	0	112.4	A320 M324 R325 F332 L430	A320-M328 HydrophobicContact CB-CB 4.16Å; A320-M328 HydrophobicContact CB-CG 4.44Å; M324-M328 WeakPolarHBondContact O-CG 3.39Å; M324-M328 PolarHBondContact O-N 3.08Å; R325-M328 PolarHBondContact O-N 3.07Å; M328-F332 VanDerWaalsContact O-CB 3.23Å; M328-F332 WeakPolarHBondContact O-CB 3.34Å; M328-F332 PolarHBondContact O-N 3.26Å; M328-L430 HydrophobicContact CB-CD2 4.37Å; M328-L430 HydrophobicContact SD-CD2 3.84Å
329	E	85.5	Confident	84.7	Confident	50 Å²	50	65.2 Å²	65.2	23%	0.234	34%	0.341	C	S	.	.	H	α-helix	trans	-60.2	-43.9	170.6	-86.6	-170.5	-120.9	0	0	112.9	R325 E327 K333 V434	R325-E329 WeakPolarHBondContact O-CB 3.38Å; R325-E329 PolarHBondContact O-N 3.11Å; E327-E329 PolarHBondContact O-N 3.15Å; E329-K333 VanDerWaalsContact O-CD 3.28Å; E329-K333 WeakPolarHBondContact O-CD 3.27Å; E329-K333 VanDerWaalsContact O-CG 3.25Å; E329-K333 WeakPolarHBondContact O-CG 3.41Å; E329-K333 PolarHBondContact O-N 2.8Å; E329-K333 VanDerWaalsContact O-N 3.09Å; E329-K333 IonicContact OE2-NZ 3.12Å; E329-K333 PolarHBondContact OE2-NZ 2.94Å; E329-V434 HydrophobicContact CG-CG1 4.02Å; E329-V434 HydrophobicContact CG-CG2 4.31Å
330	T	85	Confident	85.3	Confident	79 Å²	79	69.1 Å²	69.1	49%	0.485	35%	0.351	S	S	.	.	H	α-helix	trans	-68.4	-45.6	-178.5	-59.9	0	0	0	0	110.2	C326 E327 F332 K333 Q334	C326-T330 WeakPolarHBondContact O-CB 3.39Å; C326-T330 PolarHBondContact O-N 3.01Å; C326-T330 VanDerWaalsContact O-N 3.08Å; C326-T330 PolarHBondContact O-OG1 3.28Å; E327-T330 PolarHBondContact O-N 3.08Å; E327-T330 VanDerWaalsContact O-N 3.11Å; T330-F332 PolarHBondContact O-N 3.06Å; T330-K333 PolarHBondContact O-N 3.48Å; T330-Q334 WeakPolarHBondContact O-CB 3.02Å; T330-Q334 PolarHBondContact O-N 2.92Å
331	R	87	Confident	86	Confident	47 Å²	47	71.9 Å²	71.9	18%	0.177	37%	0.368	C	S	.	.	H	α-helix	trans	-61.9	-40.7	175.2	-171.6	178.4	-178.6	-174.5	4.8	112.1	E327 Q334 I335 L430 H502 E611	E327-R331 WeakPolarHBondContact O-CB 3.39Å; E327-R331 PolarHBondContact O-N 3.15Å; R331-Q334 PolarHBondContact O-N 3.24Å; R331-I335 HydrophobicContact CG-CD1 3.89Å; R331-I335 HydrophobicContact CG-CG1 4.41Å; R331-I335 WeakPolarHBondContact O-CB 3.37Å; R331-I335 WeakPolarHBondContact O-CG1 3.27Å; R331-I335 PolarHBondContact O-N 2.8Å; R331-L430 HydrophobicContact CG-CD1 4.28Å; R331-H502 PolarHBondContact NE-CD2 3.21Å; R331-H502 PolarHBondContact NE-NE2 3.26Å; R331-H502 PolarHBondContact NH1-NE2 2.75Å; R331-H502 PolarHBondContact NH2-NE2 2.89Å; R331-E611 IonicContact CZ-OE1 3.49Å; R331-E611 IonicContact CZ-OE2 3.14Å; R331-E611 IonicContact NE-OE1 3.9Å; R331-E611 IonicContact NE-OE2 3.88Å; R331-E611 PolarHBondContact NE-OE2 3Å; R331-E611 IonicContact NH2-OE1 2.75Å; R331-E611 PolarHBondContact NH2-OE1 3.48Å; R331-E611 IonicContact NH2-OE2 2.69Å; R331-E611 PolarHBondContact NH2-OE2 3.04Å
332	F	90.3	Very high	86.7	Confident	26 Å²	26	67.1 Å²	67.1	11%	0.114	35%	0.346	C	S	.	.	H	α-helix	trans	-58.6	-49.8	173.5	172.5	-112.9	0	0	0	111.7	M328 T330 Q334 I335 Q336 H427 L430 K431 V434	M328-F332 VanDerWaalsContact O-CB 3.23Å; M328-F332 WeakPolarHBondContact O-CB 3.34Å; M328-F332 PolarHBondContact O-N 3.26Å; T330-F332 PolarHBondContact O-N 3.06Å; F332-Q334 VanDerWaalsContact C-N 3.34Å; F332-Q334 PolarHBondContact O-N 3.01Å; F332-I335 PolarHBondContact O-N 3.11Å; F332-Q336 VanDerWaalsContact CZ-NE2 3.35Å; F332-Q336 VanDerWaalsContact O-CB 3.28Å; F332-Q336 WeakPolarHBondContact O-CB 3.43Å; F332-Q336 PolarHBondContact O-N 3.46Å; F332-H427 AromaticContact CE2-CD2 3.47Å; F332-H427 VanDerWaalsContact CE2-CD2 3.47Å; F332-H427 WeakPolarHBondContact CE2-CD2 3.43Å; F332-H427 AromaticContact CE2-NE2 3.49Å; F332-H427 WeakPolarHBondContact CE2-NE2 3.36Å; F332-H427 AromaticContact CZ-NE2 3.82Å; F332-L430 HydrophobicContact CB-CB 4.21Å; F332-L430 HydrophobicContact CD2-CB 3.96Å; F332-L430 HydrophobicContact CG-CB 4.49Å; F332-K431 HydrophobicContact CD2-CB 4.42Å; F332-K431 HydrophobicContact CE2-CB 3.64Å; F332-K431 HydrophobicContact CE2-CG 4.22Å; F332-K431 HydrophobicContact CZ-CB 4.03Å; F332-K431 HydrophobicContact CZ-CG 4.09Å; F332-V434 HydrophobicContact CB-CG2 4.46Å
333	K	89.8	Confident	87.8	Confident	110 Å²	110	63.8 Å²	63.8	48%	0.478	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-39.8	178.2	-68.1	158.2	-165.7	161.4	0	111.6	E329 T330 A337	E329-K333 VanDerWaalsContact O-CD 3.28Å; E329-K333 WeakPolarHBondContact O-CD 3.27Å; E329-K333 VanDerWaalsContact O-CG 3.25Å; E329-K333 WeakPolarHBondContact O-CG 3.41Å; E329-K333 PolarHBondContact O-N 2.8Å; E329-K333 VanDerWaalsContact O-N 3.09Å; E329-K333 IonicContact OE2-NZ 3.12Å; E329-K333 PolarHBondContact OE2-NZ 2.94Å; T330-K333 PolarHBondContact O-N 3.48Å; K333-A337 PolarHBondContact O-N 3.39Å
334	Q	89	Confident	89.1	Confident	54 Å²	54	60.6 Å²	60.6	25%	0.252	31%	0.307	S	S	.	.	H	α-helix	trans	-66.9	-48.1	176.6	-171.4	-176.5	-1	0	0	112.6	T330 R331 F332 Q336 A337 R338 H502	T330-Q334 WeakPolarHBondContact O-CB 3.02Å; T330-Q334 PolarHBondContact O-N 2.92Å; R331-Q334 PolarHBondContact O-N 3.24Å; F332-Q334 VanDerWaalsContact C-N 3.34Å; F332-Q334 PolarHBondContact O-N 3.01Å; Q334-Q336 VanDerWaalsContact C-N 3.32Å; Q334-Q336 PolarHBondContact O-N 3.07Å; Q334-A337 PolarHBondContact O-N 3.45Å; Q334-R338 PolarHBondContact O-N 3.03Å; Q334-H502 PolarHBondContact NE2-O 3.11Å; Q334-H502 PolarHBondContact OE1-O 3.32Å
335	I	91.5	Very high	90.1	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.015	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-41.9	176.1	-71.4	172.2	0	0	0	110.3	R331 F332 A337 R338 L339 L423 K426 H427 L430 E611	R331-I335 HydrophobicContact CG-CD1 3.89Å; R331-I335 HydrophobicContact CG-CG1 4.41Å; R331-I335 WeakPolarHBondContact O-CB 3.37Å; R331-I335 WeakPolarHBondContact O-CG1 3.27Å; R331-I335 PolarHBondContact O-N 2.8Å; F332-I335 PolarHBondContact O-N 3.11Å; I335-A337 PolarHBondContact O-N 3.1Å; I335-R338 PolarHBondContact O-N 3.33Å; I335-L339 WeakPolarHBondContact O-CB 3.42Å; I335-L339 PolarHBondContact O-N 3.38Å; I335-L423 HydrophobicContact CG2-CB 4.43Å; I335-L423 HydrophobicContact CG2-CD2 4.32Å; I335-K426 HydrophobicContact CD1-CB 4.12Å; I335-K426 HydrophobicContact CD1-CD 4.44Å; I335-H427 HydrophobicContact CG2-CB 3.98Å; I335-L430 HydrophobicContact CD1-CD1 3.64Å; I335-E611 HydrophobicContact CD1-CG 4.36Å; I335-E611 HydrophobicContact CG1-CG 4.12Å
336	Q	94.3	Very high	90.9	Very high	91 Å²	91	58.5 Å²	58.5	43%	0.425	30%	0.299	S	S	.	.	H	α-helix	trans	-60.2	-44.1	177.1	-175.7	171.8	90.6	0	0	112.1	F332 Q334 K340 H427	F332-Q336 VanDerWaalsContact CZ-NE2 3.35Å; F332-Q336 VanDerWaalsContact O-CB 3.28Å; F332-Q336 WeakPolarHBondContact O-CB 3.43Å; F332-Q336 PolarHBondContact O-N 3.46Å; Q334-Q336 VanDerWaalsContact C-N 3.32Å; Q334-Q336 PolarHBondContact O-N 3.07Å; Q336-K340 PolarHBondContact O-N 3.41Å; Q336-H427 PolarHBondContact NE2-NE2 2.97Å
337	A	92.7	Very high	91.7	Very high	60 Å²	60	59.3 Å²	59.3	50%	0.496	29%	0.294	S	S	.	.	H	α-helix	trans	-63.1	-48.4	175.1	0	0	0	0	0	111.8	K333 Q334 I335 K340 T341	K333-A337 PolarHBondContact O-N 3.39Å; Q334-A337 PolarHBondContact O-N 3.45Å; I335-A337 PolarHBondContact O-N 3.1Å; A337-K340 PolarHBondContact O-N 3.11Å; A337-T341 PolarHBondContact O-N 2.78Å; A337-T341 PolarHBondContact O-OG1 3.35Å
338	R	91.9	Very high	92.4	Very high	41 Å²	41	61.7 Å²	61.7	16%	0.155	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-42.3	-179.6	-174.3	63.2	-169.8	133.7	6.2	112.3	Q334 I335 K340 T341 V342 E345 L423 M613	Q334-R338 PolarHBondContact O-N 3.03Å; I335-R338 PolarHBondContact O-N 3.33Å; R338-K340 VanDerWaalsContact C-N 3.31Å; R338-K340 PolarHBondContact O-N 2.63Å; R338-T341 PolarHBondContact O-N 3.45Å; R338-V342 HydrophobicContact CG-CG2 4.18Å; R338-V342 VanDerWaalsContact NH2-CG2 3.31Å; R338-V342 VanDerWaalsContact O-CG2 3.31Å; R338-V342 WeakPolarHBondContact O-CG2 3.32Å; R338-V342 PolarHBondContact O-N 2.89Å; R338-E345 IonicContact NH1-OE1 3.64Å; R338-E345 PolarHBondContact NH1-OE1 2.85Å; R338-E345 IonicContact NH1-OE2 2.78Å; R338-E345 IonicContact NH2-OE2 2.69Å; R338-L423 HydrophobicContact CG-CD1 4.01Å; R338-M613 VanDerWaalsContact CZ-SD 3.53Å; R338-M613 PolarHBondContact NE-SD 2.95Å
339	L	95.3	Very high	92.9	Very high	12 Å²	12	61 Å²	61	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-56.5	-44.1	176.6	173.1	60.2	0	0	0	111.3	I335 T343 V420 L423 Q424 H427	I335-L339 WeakPolarHBondContact O-CB 3.42Å; I335-L339 PolarHBondContact O-N 3.38Å; L339-T343 WeakPolarHBondContact O-CB 3.4Å; L339-T343 PolarHBondContact O-N 3.46Å; L339-T343 PolarHBondContact O-OG1 3.22Å; L339-V420 HydrophobicContact CD1-CG1 3.96Å; L339-L423 HydrophobicContact CB-CB 4.24Å; L339-L423 HydrophobicContact CD1-CB 3.94Å; L339-Q424 HydrophobicContact CD1-CB 4.27Å; L339-Q424 HydrophobicContact CD2-CB 4.5Å; L339-H427 HydrophobicContact CD2-CB 3.89Å
340	K	95.9	Very high	93.4	Very high	130 Å²	130	59.3 Å²	59.3	57%	0.565	30%	0.299	S	S	*	.	H	α-helix	trans	-57.5	-55.6	175.1	-177.7	-172.9	166.8	-174.5	0	111	Q336 A337 R338 V342 T343 E344	Q336-K340 PolarHBondContact O-N 3.41Å; A337-K340 PolarHBondContact O-N 3.11Å; R338-K340 VanDerWaalsContact C-N 3.31Å; R338-K340 PolarHBondContact O-N 2.63Å; K340-V342 PolarHBondContact O-N 3.44Å; K340-T343 WeakPolarHBondContact O-CB 3.13Å; K340-T343 PolarHBondContact O-N 3.37Å; K340-T343 VanDerWaalsContact O-N 3.14Å; K340-E344 WeakPolarHBondContact CE-OE1 3.27Å; K340-E344 IonicContact NZ-OE1 3.14Å; K340-E344 PolarHBondContact O-N 3.12Å
341	T	95.1	Very high	94	Very high	61 Å²	61	61.3 Å²	61.3	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-44.8	-177.6	-53.5	0	0	0	0	112.1	A337 R338 T343 E344 E345	A337-T341 PolarHBondContact O-N 2.78Å; A337-T341 PolarHBondContact O-OG1 3.35Å; R338-T341 PolarHBondContact O-N 3.45Å; T341-T343 VanDerWaalsContact C-N 3.28Å; T341-T343 PolarHBondContact O-N 2.88Å; T341-E344 PolarHBondContact O-N 3.31Å; T341-E345 HydrophobicContact CG2-CG 4.44Å; T341-E345 WeakPolarHBondContact CG2-OE1 3.32Å; T341-E345 WeakPolarHBondContact O-CB 3.34Å; T341-E345 VanDerWaalsContact O-CG 3.29Å; T341-E345 WeakPolarHBondContact O-CG 3.28Å; T341-E345 PolarHBondContact O-N 2.92Å
342	V	94.1	Very high	94.4	Very high	2 Å²	2	61 Å²	61	1%	0.012	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-33.5	177.8	179.4	0	0	0	0	111.8	R338 K340 T346 L419 V420 L423	R338-V342 HydrophobicContact CG-CG2 4.18Å; R338-V342 VanDerWaalsContact NH2-CG2 3.31Å; R338-V342 VanDerWaalsContact O-CG2 3.31Å; R338-V342 WeakPolarHBondContact O-CG2 3.32Å; R338-V342 PolarHBondContact O-N 2.89Å; K340-V342 PolarHBondContact O-N 3.44Å; V342-T346 VanDerWaalsContact O-CB 3.22Å; V342-T346 WeakPolarHBondContact O-CB 3.41Å; V342-T346 PolarHBondContact O-N 3.14Å; V342-T346 PolarHBondContact O-OG1 3.08Å; V342-L419 HydrophobicContact CG1-CB 4.15Å; V342-L419 HydrophobicContact CG1-CD2 3.84Å; V342-L419 HydrophobicContact CG1-CG 3.95Å; V342-L419 HydrophobicContact CG2-CD2 3.89Å; V342-L419 HydrophobicContact CG2-CG 4.44Å; V342-V420 HydrophobicContact CB-CG2 4.4Å; V342-V420 HydrophobicContact CG1-CG2 3.74Å; V342-L423 HydrophobicContact CG2-CD1 4.33Å
343	T	97.1	Very high	94.7	Very high	47 Å²	47	61.7 Å²	61.7	29%	0.288	31%	0.311	S	S	.	.	H	α-helix	trans	-68	-44.2	176.4	-55.7	0	0	0	0	110.9	L339 K340 T341 T346 E347	L339-T343 WeakPolarHBondContact O-CB 3.4Å; L339-T343 PolarHBondContact O-N 3.46Å; L339-T343 PolarHBondContact O-OG1 3.22Å; K340-T343 WeakPolarHBondContact O-CB 3.13Å; K340-T343 PolarHBondContact O-N 3.37Å; K340-T343 VanDerWaalsContact O-N 3.14Å; T341-T343 VanDerWaalsContact C-N 3.28Å; T341-T343 PolarHBondContact O-N 2.88Å; T343-T346 PolarHBondContact O-N 3.32Å; T343-E347 PolarHBondContact O-N 3.11Å
344	E	96.5	Very high	95.1	Very high	108 Å²	108	60.2 Å²	60.2	51%	0.505	31%	0.314	S	S	.	.	H	α-helix	trans	-61.5	-47.2	175.2	-68.6	171.8	164.9	0	0	111.4	K340 T341 T346 E347 E348	K340-E344 WeakPolarHBondContact CE-OE1 3.27Å; K340-E344 IonicContact NZ-OE1 3.14Å; K340-E344 PolarHBondContact O-N 3.12Å; T341-E344 PolarHBondContact O-N 3.31Å; E344-T346 PolarHBondContact O-N 2.91Å; E344-E347 PolarHBondContact O-N 3.06Å; E344-E348 PolarHBondContact O-N 3.22Å
345	E	95	Very high	95.5	Very high	96 Å²	96	62.4 Å²	62.4	45%	0.449	33%	0.331	S	S	.	.	H	α-helix	trans	-56	-45.9	172.6	-71.8	167	-178.3	0	0	111.9	R338 T341 E348 A349	R338-E345 IonicContact NH1-OE1 3.64Å; R338-E345 PolarHBondContact NH1-OE1 2.85Å; R338-E345 IonicContact NH1-OE2 2.78Å; R338-E345 IonicContact NH2-OE2 2.69Å; T341-E345 HydrophobicContact CG2-CG 4.44Å; T341-E345 WeakPolarHBondContact CG2-OE1 3.32Å; T341-E345 WeakPolarHBondContact O-CB 3.34Å; T341-E345 VanDerWaalsContact O-CG 3.29Å; T341-E345 WeakPolarHBondContact O-CG 3.28Å; T341-E345 PolarHBondContact O-N 2.92Å; E345-E348 PolarHBondContact O-N 3.44Å; E345-A349 PolarHBondContact O-N 2.75Å; E345-A349 VanDerWaalsContact O-N 3.09Å
346	T	96.2	Very high	95.7	Very high	13 Å²	13	62.8 Å²	62.8	8%	0.08	34%	0.335	C	S	.	.	H	α-helix	trans	-69.1	-38.6	-177.6	-60.1	0	0	0	0	112	V342 T343 E344 A349 G350 Y413 G416	V342-T346 VanDerWaalsContact O-CB 3.22Å; V342-T346 WeakPolarHBondContact O-CB 3.41Å; V342-T346 PolarHBondContact O-N 3.14Å; V342-T346 PolarHBondContact O-OG1 3.08Å; T343-T346 PolarHBondContact O-N 3.32Å; E344-T346 PolarHBondContact O-N 2.91Å; T346-A349 PolarHBondContact O-N 3.34Å; T346-G350 PolarHBondContact O-N 3.16Å; T346-Y413 HydrophobicContact CG2-CD2 3.92Å; T346-Y413 HydrophobicContact CG2-CE2 4.09Å; T346-Y413 WeakPolarHBondContact O-CD2 3.23Å; T346-G416 VanDerWaalsContact OG1-C 3.27Å; T346-G416 VanDerWaalsContact OG1-CA 3.32Å; T346-G416 WeakPolarHBondContact OG1-CA 3.4Å
347	E	96.8	Very high	95.7	Very high	109 Å²	109	63.2 Å²	63.2	51%	0.509	34%	0.335	S	S	.	.	H	α-helix	trans	-63.3	-40	175.1	-89.1	-160.5	-152.3	0	0	112.5	T343 E344 G350 K351	T343-E347 PolarHBondContact O-N 3.11Å; E344-E347 PolarHBondContact O-N 3.06Å; E347-G350 PolarHBondContact O-N 2.98Å; E347-K351 VanDerWaalsContact O-CD 3.31Å; E347-K351 WeakPolarHBondContact O-CD 3.33Å; E347-K351 VanDerWaalsContact O-CG 3.26Å; E347-K351 WeakPolarHBondContact O-CG 3.4Å; E347-K351 PolarHBondContact O-N 2.85Å; E347-K351 IonicContact OE2-NZ 3.42Å; E347-K351 PolarHBondContact OE2-NZ 3.13Å
348	E	95.9	Very high	95.9	Very high	134 Å²	134	63.1 Å²	63.1	63%	0.626	33%	0.331	S	S	*	.	H	α-helix	trans	-66.8	-42	176.3	-170.6	178	166.8	0	0	111.7	E344 E345 G350 K351 S352	E344-E348 PolarHBondContact O-N 3.22Å; E345-E348 PolarHBondContact O-N 3.44Å; E348-G350 VanDerWaalsContact C-N 3.3Å; E348-G350 PolarHBondContact O-N 3.1Å; E348-K351 PolarHBondContact O-N 3Å; E348-S352 WeakPolarHBondContact O-CB 3.49Å; E348-S352 PolarHBondContact O-N 2.92Å; E348-S352 PolarHBondContact O-OG 3.32Å
349	A	95.1	Very high	95.9	Very high	9 Å²	9	62.9 Å²	62.9	7%	0.074	34%	0.338	C	S	.	.	H	α-helix	trans	-59.9	-40.3	171.9	0	0	0	0	0	111.8	E345 T346 S352 M353 E412	E345-A349 PolarHBondContact O-N 2.75Å; E345-A349 VanDerWaalsContact O-N 3.09Å; T346-A349 PolarHBondContact O-N 3.34Å; A349-S352 PolarHBondContact O-N 3.23Å; A349-M353 VanDerWaalsContact O-CB 3.26Å; A349-M353 WeakPolarHBondContact O-CB 3.48Å; A349-M353 PolarHBondContact O-N 3.18Å; A349-E412 HydrophobicContact CB-CB 4.01Å
350	G	96.8	Very high	95.9	Very high	14 Å²	14	63.5 Å²	63.5	14%	0.144	34%	0.341	C	S	.	.	H	α-helix	trans	-65.5	-41.6	176.6	0	0	0	0	0	113.6	T346 E347 E348 M353 S354 Y413	T346-G350 PolarHBondContact O-N 3.16Å; E347-G350 PolarHBondContact O-N 2.98Å; E348-G350 VanDerWaalsContact C-N 3.3Å; E348-G350 PolarHBondContact O-N 3.1Å; G350-M353 PolarHBondContact O-N 3.07Å; G350-S354 PolarHBondContact O-N 2.89Å; G350-S354 VanDerWaalsContact O-N 3.1Å; G350-Y413 VanDerWaalsContact CA-CD2 3.43Å
351	K	97.3	Very high	95.7	Very high	121 Å²	121	62 Å²	62	53%	0.526	34%	0.339	S	S	.	.	H	α-helix	trans	-61.8	-48.8	173.1	-68.8	154.8	-164.5	162	0	110.4	E347 E348 M353 S354 T355	E347-K351 VanDerWaalsContact O-CD 3.31Å; E347-K351 WeakPolarHBondContact O-CD 3.33Å; E347-K351 VanDerWaalsContact O-CG 3.26Å; E347-K351 WeakPolarHBondContact O-CG 3.4Å; E347-K351 PolarHBondContact O-N 2.85Å; E347-K351 IonicContact OE2-NZ 3.42Å; E347-K351 PolarHBondContact OE2-NZ 3.13Å; E348-K351 PolarHBondContact O-N 3Å; K351-M353 PolarHBondContact O-N 3.46Å; K351-S354 WeakPolarHBondContact O-CB 3.33Å; K351-S354 PolarHBondContact O-N 3.14Å; K351-S354 VanDerWaalsContact O-N 3.17Å; K351-T355 PolarHBondContact O-N 2.93Å; K351-T355 PolarHBondContact O-OG1 3.09Å
352	S	96	Very high	95.5	Very high	41 Å²	41	63.7 Å²	63.7	29%	0.287	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-42.5	176.9	-59.2	0	0	0	0	113.2	E348 A349 S354 T355 A356	E348-S352 WeakPolarHBondContact O-CB 3.49Å; E348-S352 PolarHBondContact O-N 2.92Å; E348-S352 PolarHBondContact O-OG 3.32Å; A349-S352 PolarHBondContact O-N 3.23Å; S352-S354 VanDerWaalsContact C-N 3.32Å; S352-S354 PolarHBondContact O-N 3.01Å; S352-T355 PolarHBondContact O-N 3.5Å; S352-A356 WeakPolarHBondContact O-CB 3.3Å; S352-A356 PolarHBondContact O-N 3.44Å
353	M	97.4	Very high	95.2	Very high	40 Å²	40	65.6 Å²	65.6	20%	0.197	36%	0.355	C	S	.	.	H	α-helix	trans	-59.4	-42.4	174.9	175.8	-173.7	65.7	0	0	111.5	A349 G350 K351 A356 K357 Y406 K409 V410 Y413	A349-M353 VanDerWaalsContact O-CB 3.26Å; A349-M353 WeakPolarHBondContact O-CB 3.48Å; A349-M353 PolarHBondContact O-N 3.18Å; G350-M353 PolarHBondContact O-N 3.07Å; K351-M353 PolarHBondContact O-N 3.46Å; M353-A356 PolarHBondContact O-N 3.37Å; M353-K357 WeakPolarHBondContact O-CB 3.46Å; M353-K357 PolarHBondContact O-N 2.82Å; M353-Y406 HydrophobicContact CG-CD2 4.31Å; M353-Y406 HydrophobicContact CG-CE2 3.9Å; M353-K409 HydrophobicContact CB-CB 3.98Å; M353-V410 HydrophobicContact CG-CG2 3.79Å; M353-V410 HydrophobicContact SD-CB 4.25Å; M353-V410 HydrophobicContact SD-CG2 3.72Å; M353-Y413 HydrophobicContact CE-CD1 3.71Å; M353-Y413 HydrophobicContact CE-CD2 4.46Å; M353-Y413 HydrophobicContact CE-CE1 4.06Å; M353-Y413 HydrophobicContact CE-CG 3.95Å; M353-Y413 HydrophobicContact SD-CD1 3.99Å; M353-Y413 HydrophobicContact SD-CG 4.2Å
354	S	97.2	Very high	94.7	Very high	78 Å²	78	68.7 Å²	68.7	55%	0.545	37%	0.369	S	S	.	.	H	α-helix	trans	-65.3	-43.7	177.6	-163.5	0	0	0	0	112	G350 K351 S352 K357 S358	G350-S354 PolarHBondContact O-N 2.89Å; G350-S354 VanDerWaalsContact O-N 3.1Å; K351-S354 WeakPolarHBondContact O-CB 3.33Å; K351-S354 PolarHBondContact O-N 3.14Å; K351-S354 VanDerWaalsContact O-N 3.17Å; S352-S354 VanDerWaalsContact C-N 3.32Å; S352-S354 PolarHBondContact O-N 3.01Å; S354-K357 WeakPolarHBondContact O-CB 3.45Å; S354-K357 PolarHBondContact O-N 3.38Å; S354-S358 PolarHBondContact O-N 3.38Å
355	T	97.1	Very high	93.9	Very high	101 Å²	101	65.9 Å²	65.9	62%	0.62	37%	0.369	S	S	*	.	H	α-helix	trans	-62.2	-45.9	175.2	-55.2	0	0	0	0	112	K351 S352 K357 S358 A359	K351-T355 PolarHBondContact O-N 2.93Å; K351-T355 PolarHBondContact O-OG1 3.09Å; S352-T355 PolarHBondContact O-N 3.5Å; T355-K357 VanDerWaalsContact C-N 3.31Å; T355-K357 PolarHBondContact O-N 3.21Å; T355-S358 PolarHBondContact O-N 3.37Å; T355-A359 PolarHBondContact O-N 2.93Å
356	A	95.4	Very high	92.9	Very high	11 Å²	11	66 Å²	66	9%	0.091	37%	0.37	C	S	.	.	H	α-helix	trans	-62.9	-36.7	176.4	0	0	0	0	0	112.1	S352 M353 L360 V405 Y406	S352-A356 WeakPolarHBondContact O-CB 3.3Å; S352-A356 PolarHBondContact O-N 3.44Å; M353-A356 PolarHBondContact O-N 3.37Å; A356-L360 WeakPolarHBondContact O-CB 3.42Å; A356-L360 PolarHBondContact O-N 3.05Å; A356-V405 HydrophobicContact CB-CG1 4.37Å; A356-Y406 HydrophobicContact CB-CD2 4.28Å
357	K	95.9	Very high	91	Very high	99 Å²	99	70.1 Å²	70.1	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-62.7	-43.8	173.2	-174.2	-176.4	172.1	-174.1	0	112.2	M353 S354 T355 L360 L361 Y406	M353-K357 WeakPolarHBondContact O-CB 3.46Å; M353-K357 PolarHBondContact O-N 2.82Å; S354-K357 WeakPolarHBondContact O-CB 3.45Å; S354-K357 PolarHBondContact O-N 3.38Å; T355-K357 VanDerWaalsContact C-N 3.31Å; T355-K357 PolarHBondContact O-N 3.21Å; K357-L360 PolarHBondContact O-N 3.28Å; K357-L361 HydrophobicContact CG-CD1 4.19Å; K357-L361 WeakPolarHBondContact O-CG 3.33Å; K357-L361 PolarHBondContact O-N 3.07Å; K357-Y406 HydrophobicContact CB-CD2 4.01Å; K357-Y406 HydrophobicContact CB-CE2 3.7Å; K357-Y406 HydrophobicContact CG-CE2 4.19Å
358	S	95.2	Very high	89.3	Confident	59 Å²	59	68 Å²	68	41%	0.413	38%	0.383	S	S	.	.	H	α-helix	trans	-59.8	-55.9	175.4	-165.7	0	0	0	0	109.8	S354 T355 L360 L361 D362	S354-S358 PolarHBondContact O-N 3.38Å; T355-S358 PolarHBondContact O-N 3.37Å; S358-L360 PolarHBondContact O-N 3.14Å; S358-L360 VanDerWaalsContact O-N 3.1Å; S358-L361 CarbonylContact O-C 3.51Å; S358-L361 WeakPolarHBondContact O-CA 3.31Å; S358-L361 WeakPolarHBondContact O-CB 3.49Å; S358-L361 PolarHBondContact O-N 3.31Å; S358-D362 PolarHBondContact O-N 3.12Å; S358-D362 PolarHBondContact OG-OD2 3.21Å
359	A	93.6	Very high	87.8	Confident	35 Å²	35	69.8 Å²	69.8	29%	0.289	40%	0.396	S	S	.	.	H	α-helix	trans	-55.1	-36.1	-178.8	0	0	0	0	0	113	T355 N363 I402	T355-A359 PolarHBondContact O-N 2.93Å; A359-N363 WeakPolarHBondContact O-CB 3.05Å; A359-N363 PolarHBondContact O-N 3.3Å; A359-N363 PolarHBondContact O-ND2 3.22Å; A359-I402 HydrophobicContact CB-CG2 4.28Å
360	L	94.1	Very high	85.8	Confident	25 Å²	25	75.6 Å²	75.6	13%	0.131	42%	0.422	C	S	.	.	H	α-helix	trans	-66.2	-46.9	174.2	-174.1	58.2	0	0	0	112.1	A356 K357 S358 N363 I364 I399 I402 E403 Y406	A356-L360 WeakPolarHBondContact O-CB 3.42Å; A356-L360 PolarHBondContact O-N 3.05Å; K357-L360 PolarHBondContact O-N 3.28Å; S358-L360 PolarHBondContact O-N 3.14Å; S358-L360 VanDerWaalsContact O-N 3.1Å; L360-N363 PolarHBondContact O-N 2.8Å; L360-I364 HydrophobicContact CD1-CD1 4.12Å; L360-I364 HydrophobicContact CG-CD1 3.98Å; L360-I364 WeakPolarHBondContact O-CD1 3.32Å; L360-I364 VanDerWaalsContact O-CG1 3.23Å; L360-I364 WeakPolarHBondContact O-CG1 3.4Å; L360-I364 PolarHBondContact O-N 3.19Å; L360-I399 HydrophobicContact CD1-CG2 4.09Å; L360-I402 HydrophobicContact CB-CG2 3.84Å; L360-I402 HydrophobicContact CD1-CB 4.49Å; L360-I402 HydrophobicContact CD1-CG2 4.17Å; L360-E403 HydrophobicContact CD1-CB 4.36Å; L360-Y406 HydrophobicContact CD2-CD1 4.11Å; L360-Y406 HydrophobicContact CD2-CG 4.4Å
361	L	92.6	Very high	83.6	Confident	100 Å²	100	78.7 Å²	78.7	52%	0.524	44%	0.441	S	S	.	.	H	α-helix	trans	-64.2	-41.3	176.6	-69.8	171.2	0	0	0	111.8	K357 S358 N363 I364 G365	K357-L361 HydrophobicContact CG-CD1 4.19Å; K357-L361 WeakPolarHBondContact O-CG 3.33Å; K357-L361 PolarHBondContact O-N 3.07Å; S358-L361 CarbonylContact O-C 3.51Å; S358-L361 WeakPolarHBondContact O-CA 3.31Å; S358-L361 WeakPolarHBondContact O-CB 3.49Å; S358-L361 PolarHBondContact O-N 3.31Å; L361-N363 PolarHBondContact O-N 3.03Å; L361-I364 PolarHBondContact O-N 3.02Å; L361-G365 PolarHBondContact O-N 3.42Å
362	D	89.7	Confident	81.2	Confident	96 Å²	96	76.7 Å²	76.7	51%	0.513	44%	0.443	S	S	.	.	H	α-helix	trans	-62.7	-41.2	177.9	-61.6	-43.5	0	0	0	111	S358 G365 E366	S358-D362 PolarHBondContact O-N 3.12Å; S358-D362 PolarHBondContact OG-OD2 3.21Å; D362-G365 PolarHBondContact O-N 3.42Å; D362-E366 PolarHBondContact O-N 2.86Å
363	N	87.4	Confident	78.9	Confident	41 Å²	41	82.7 Å²	82.7	22%	0.219	47%	0.468	C	S	.	.	H	α-helix	trans	-72.3	-28.2	175.8	-85.3	-99.7	0	0	0	113.9	A359 L360 L361 I399 I402	A359-N363 WeakPolarHBondContact O-CB 3.05Å; A359-N363 PolarHBondContact O-N 3.3Å; A359-N363 PolarHBondContact O-ND2 3.22Å; L360-N363 PolarHBondContact O-N 2.8Å; L361-N363 PolarHBondContact O-N 3.03Å; N363-I399 HydrophobicContact CB-CG1 4.03Å; N363-I402 HydrophobicContact CB-CD1 4.39Å; N363-I402 WeakPolarHBondContact ND2-CD1 3.45Å
364	I	88	Confident	76.5	Confident	113 Å²	113	85.9 Å²	85.9	58%	0.579	49%	0.494	S	S	*	.	H	α-helix	trans	-75.6	-31.2	172.1	-70.1	165.3	0	0	0	110.7	L360 L361	L360-I364 HydrophobicContact CD1-CD1 4.12Å; L360-I364 HydrophobicContact CG-CD1 3.98Å; L360-I364 WeakPolarHBondContact O-CD1 3.32Å; L360-I364 VanDerWaalsContact O-CG1 3.23Å; L360-I364 WeakPolarHBondContact O-CG1 3.4Å; L360-I364 PolarHBondContact O-N 3.19Å; L361-I364 PolarHBondContact O-N 3.02Å
365	G	78.6	Confident	74.1	Confident	49 Å²	49	86.8 Å²	86.8	51%	0.505	50%	0.501	S	S	.	.	S	Bend	trans	-88	-3.1	-176	0	0	0	0	0	116.3	L361 D362 N367	L361-G365 PolarHBondContact O-N 3.42Å; D362-G365 PolarHBondContact O-N 3.42Å; G365-N367 PolarHBondContact O-N 2.97Å; G365-N367 PolarHBondContact O-OD1 3.34Å
366	E	74.6	Confident	71.3	Confident	99 Å²	99	84.2 Å²	84.2	46%	0.463	50%	0.495	S	S	.	.			trans	-56.4	131.5	179.6	-77.3	-156.4	134.1	0	0	112.6	D362 D368 R395	D362-E366 PolarHBondContact O-N 2.86Å; E366-D368 VanDerWaalsContact C-N 3.31Å; E366-D368 PolarHBondContact O-N 3.01Å; E366-R395 IonicContact OE2-CZ 3.36Å; E366-R395 IonicContact OE2-NE 2.71Å; E366-R395 PolarHBondContact OE2-NE 3.09Å; E366-R395 IonicContact OE2-NH2 2.66Å; E366-R395 PolarHBondContact OE2-NH2 3.36Å
367	N	56.6	Low	69.1	Low	98 Å²	98	90.5 Å²	90.5	52%	0.524	53%	0.534	S	S	.	.	S	Bend	trans	-68.8	79.1	-174.7	-69.7	6.4	0	0	0	113.5	G365 E370 K389	G365-N367 PolarHBondContact O-N 2.97Å; G365-N367 PolarHBondContact O-OD1 3.34Å; N367-E370 HydrophobicContact CB-CG 4.42Å; N367-E370 VanDerWaalsContact ND2-CD 3.27Å; N367-E370 PolarHBondContact ND2-OE2 3.22Å; N367-K389 PolarHBondContact O-NZ 2.86Å
368	D	61.3	Low	66.5	Low	65 Å²	65	90.6 Å²	90.6	35%	0.348	55%	0.548	S	S	.	.			trans	-81.3	-34.1	160.9	-79.9	-6.6	0	0	0	111.5	E366 E370 S371 K389 R395	E366-D368 VanDerWaalsContact C-N 3.31Å; E366-D368 PolarHBondContact O-N 3.01Å; D368-E370 PolarHBondContact O-N 3.49Å; D368-S371 PolarHBondContact O-N 2.93Å; D368-S371 PolarHBondContact O-OG 3.24Å; D368-K389 IonicContact OD1-NZ 3.71Å; D368-K389 PolarHBondContact OD1-NZ 2.76Å; D368-K389 VanDerWaalsContact OD1-NZ 3.08Å; D368-R395 VanDerWaalsContact CG-NH1 3.27Å; D368-R395 IonicContact OD1-CZ 3.71Å; D368-R395 IonicContact OD1-NH1 3.23Å; D368-R395 PolarHBondContact OD1-NH1 3.07Å; D368-R395 IonicContact OD1-NH2 3.31Å; D368-R395 PolarHBondContact OD1-NH2 2.66Å; D368-R395 IonicContact OD2-CZ 3.83Å; D368-R395 IonicContact OD2-NH1 2.69Å; D368-R395 PolarHBondContact OD2-NH1 2.66Å; D368-R395 IonicContact OD2-NH2 3.98Å
369	L	63.3	Low	63.8	Low	171 Å²	171	96.8 Å²	96.8	90%	0.895	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-65.1	-34.8	-173.5	-62.5	177.6	0	0	0	114.1	S371	L369-S371 VanDerWaalsContact C-N 3.28Å; L369-S371 PolarHBondContact O-N 3.01Å
370	E	52.8	Low	61.4	Low	131 Å²	131	102.6 Å²	102.6	61%	0.612	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-74.1	-18.3	-178.9	-62.4	-172.3	138.4	0	0	113.4	N367 D368 S372 M373	N367-E370 HydrophobicContact CB-CG 4.42Å; N367-E370 VanDerWaalsContact ND2-CD 3.27Å; N367-E370 PolarHBondContact ND2-OE2 3.22Å; D368-E370 PolarHBondContact O-N 3.49Å; E370-S372 PolarHBondContact O-N 2.98Å; E370-M373 PolarHBondContact O-N 3.06Å; E370-M373 VanDerWaalsContact O-N 3.1Å
371	S	52.5	Low	58.7	Low	79 Å²	79	104.4 Å²	104.4	55%	0.552	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-68.8	-1.5	-167.6	66.3	0	0	0	0	115.6	D368 L369	D368-S371 PolarHBondContact O-N 2.93Å; D368-S371 PolarHBondContact O-OG 3.24Å; L369-S371 VanDerWaalsContact C-N 3.28Å; L369-S371 PolarHBondContact O-N 3.01Å
372	S	46.7	Very low	55.9	Low	80 Å²	80	105.7 Å²	105.7	56%	0.559	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-104.1	-2.8	175.7	-169.4	0	0	0	0	114.7	E370	E370-S372 PolarHBondContact O-N 2.98Å
373	M	47	Very low	53.8	Low	166 Å²	166	107.6 Å²	107.6	82%	0.818	66%	0.659	S	S	*	*	S	Bend	trans	-96.2	-8.7	-174.4	-68.7	-64.6	149.8	0	0	114.6	E370	E370-M373 PolarHBondContact O-N 3.06Å; E370-M373 VanDerWaalsContact O-N 3.1Å
374	S	46.9	Very low	51.6	Low	107 Å²	107	114.4 Å²	114.4	75%	0.748	69%	0.689	S	S	*	*	S	Bend	trans	-89	-11	179.7	54	0	0	0	0	114.4	G376	S374-G376 VanDerWaalsContact C-N 3.26Å; S374-G376 PolarHBondContact O-N 3.2Å
375	S	46.2	Very low	49.3	Very low	97 Å²	97	116.7 Å²	116.7	68%	0.678	70%	0.703	S	S	*	*			trans	-82.2	61	-176.4	61.4	0	0	0	0	113.3
376	G	39.9	Very low	47.6	Very low	48 Å²	48	122.1 Å²	122.1	50%	0.495	72%	0.719	S	S	.	*			trans	-65.3	147.1	159.7	0	0	0	0	0	110.4	S374 S378	S374-G376 VanDerWaalsContact C-N 3.26Å; S374-G376 PolarHBondContact O-N 3.2Å; G376-S378 PolarHBondContact O-N 2.89Å
377	P	48.4	Very low	46.3	Very low	142 Å²	142	124.8 Å²	124.8	92%	0.922	74%	0.737	S	S	*	*	S	Bend	trans	-77.8	43.5	-171.5	33.6	-38	0	0	0	113.6
378	S	42.1	Very low	46.1	Very low	102 Å²	102	125.7 Å²	125.7	71%	0.713	75%	0.746	S	S	*	*			trans	-160.5	58.7	-173.5	64.7	0	0	0	0	115.1	G376	G376-S378 PolarHBondContact O-N 2.89Å
379	Q	38.3	Very low	46	Very low	189 Å²	189	128 Å²	128	88%	0.883	75%	0.753	S	S	*	*			trans	-159.6	114.7	144.3	-116	173.2	41.9	0	0	112.2
380	V	41.7	Very low	45.9	Very low	157 Å²	157	122.6 Å²	122.6	95%	0.952	73%	0.728	S	S	*	*			trans	-104.6	121.6	163.9	174.9	0	0	0	0	107
381	G	37.3	Very low	46.8	Very low	63 Å²	63	119.6 Å²	119.6	65%	0.649	72%	0.721	S	S	*	*			trans	116.2	86.5	168.4	0	0	0	0	0	115.6
382	S	34.4	Very low	48	Very low	127 Å²	127	120.1 Å²	120.1	89%	0.888	72%	0.721	S	S	*	*			trans	-172.8	86.5	136.2	-80.5	0	0	0	0	109.3	E384	S382-E384 PolarHBondContact O-N 3.4Å
383	T	46.4	Very low	49.6	Very low	136 Å²	136	119.8 Å²	119.8	83%	0.834	72%	0.723	S	S	*	*			trans	-84.7	102.9	169.6	42.6	0	0	0	0	110.1
384	E	41	Very low	51.3	Low	183 Å²	183	119.9 Å²	119.9	86%	0.855	71%	0.714	S	S	*	*			trans	-159.6	159.5	152.3	-113.7	157.7	-143.8	0	0	109.3	S382	S382-E384 PolarHBondContact O-N 3.4Å
385	N	39.1	Very low	52.9	Low	161 Å²	161	116.2 Å²	116.2	86%	0.861	68%	0.684	S	S	*	*			trans	61.2	47.9	-173.9	-59.3	-30.5	0	0	0	116.2	N387	N385-N387 PolarHBondContact O-N 2.88Å
386	L	42.5	Very low	54.8	Low	163 Å²	163	119.8 Å²	119.8	85%	0.853	68%	0.682	S	S	*	*			trans	-66.9	81.5	154.6	-84.1	170.5	0	0	0	110	V388	L386-V388 PolarHBondContact O-N 3.26Å; L386-V388 VanDerWaalsContact O-N 3.15Å
387	N	48.3	Very low	57.1	Low	156 Å²	156	120.1 Å²	120.1	83%	0.834	68%	0.681	S	S	*	*			trans	-63.9	113.2	160.9	-168.9	14.2	0	0	0	107.2	N385 K389	N385-N387 PolarHBondContact O-N 2.88Å; N387-K389 PolarHBondContact O-N 3.43Å
388	V	52.2	Low	59	Low	117 Å²	117	115.4 Å²	115.4	71%	0.709	65%	0.651	S	S	*	*			trans	-71.1	95.6	-165.3	-178.5	0	0	0	0	109.6	L386	L386-V388 PolarHBondContact O-N 3.26Å; L386-V388 VanDerWaalsContact O-N 3.15Å
389	K	58.4	Low	61.3	Low	114 Å²	114	112.4 Å²	112.4	50%	0.496	63%	0.627	S	S	.	*			trans	-45.3	126.1	172.7	-87.5	-160	167.6	-159.2	0	108.7	N367 D368 N387 S391	N367-K389 PolarHBondContact O-NZ 2.86Å; D368-K389 IonicContact OD1-NZ 3.71Å; D368-K389 PolarHBondContact OD1-NZ 2.76Å; D368-K389 VanDerWaalsContact OD1-NZ 3.08Å; N387-K389 PolarHBondContact O-N 3.43Å; K389-S391 PolarHBondContact O-N 3.45Å
390	P	61.7	Low	63.9	Low	57 Å²	57	108 Å²	108	37%	0.37	61%	0.608	S	S	.	*			trans	-52.2	138.1	178.2	-28	35.3	0	0	0	111	R394	P390-R394 HydrophobicContact CB-CB 4.44Å
391	S	72.8	Confident	66.4	Low	68 Å²	68	106.9 Å²	106.9	48%	0.476	59%	0.593	S	S	.	*			trans	-58.3	146.9	174.5	65.1	0	0	0	0	109.7	K389 A393 R394 R395	K389-S391 PolarHBondContact O-N 3.45Å; S391-A393 PolarHBondContact O-N 3.46Å; S391-R394 WeakPolarHBondContact O-CA 3.27Å; S391-R394 WeakPolarHBondContact O-CB 3.45Å; S391-R394 PolarHBondContact O-N 2.88Å; S391-R394 PolarHBondContact OG-N 2.89Å; S391-R395 PolarHBondContact O-N 3.29Å
392	V	77.1	Confident	69.1	Low	89 Å²	89	105.4 Å²	105.4	54%	0.539	57%	0.57	S	S	.	*	H	α-helix	trans	-53.6	-34	-177	179.3	0	0	0	0	111.9	R396	V392-R396 WeakPolarHBondContact O-CB 3.41Å; V392-R396 VanDerWaalsContact O-CG 3.26Å; V392-R396 WeakPolarHBondContact O-CG 3.41Å; V392-R396 PolarHBondContact O-N 3Å
393	A	79.9	Confident	71.9	Confident	73 Å²	73	102.8 Å²	102.8	60%	0.603	54%	0.544	S	S	*	.	H	α-helix	trans	-65.4	-42.6	172.7	0	0	0	0	0	113.2	S391 R396 A397	S391-A393 PolarHBondContact O-N 3.46Å; A393-R396 PolarHBondContact O-N 3.34Å; A393-A397 PolarHBondContact O-N 2.87Å
394	R	82.8	Confident	74.3	Confident	169 Å²	169	101.4 Å²	101.4	64%	0.638	53%	0.531	S	S	*	.	H	α-helix	trans	-67.2	-42.4	177	-171.3	-177.1	-67.1	162.9	-1.4	111.8	P390 S391 A397 S398	P390-R394 HydrophobicContact CB-CB 4.44Å; S391-R394 WeakPolarHBondContact O-CA 3.27Å; S391-R394 WeakPolarHBondContact O-CB 3.45Å; S391-R394 PolarHBondContact O-N 2.88Å; S391-R394 PolarHBondContact OG-N 2.89Å; R394-A397 PolarHBondContact O-N 2.87Å; R394-S398 PolarHBondContact O-N 3.49Å
395	R	81.3	Confident	76.9	Confident	29 Å²	29	96.3 Å²	96.3	11%	0.109	51%	0.512	C	S	.	.	H	α-helix	trans	-63.2	-43.4	175	-167.2	-172.8	-76	135.1	-27.5	111.1	E366 D368 S391 A397 S398 I399	E366-R395 IonicContact OE2-CZ 3.36Å; E366-R395 IonicContact OE2-NE 2.71Å; E366-R395 PolarHBondContact OE2-NE 3.09Å; E366-R395 IonicContact OE2-NH2 2.66Å; E366-R395 PolarHBondContact OE2-NH2 3.36Å; D368-R395 VanDerWaalsContact CG-NH1 3.27Å; D368-R395 IonicContact OD1-CZ 3.71Å; D368-R395 IonicContact OD1-NH1 3.23Å; D368-R395 PolarHBondContact OD1-NH1 3.07Å; D368-R395 IonicContact OD1-NH2 3.31Å; D368-R395 PolarHBondContact OD1-NH2 2.66Å; D368-R395 IonicContact OD2-CZ 3.83Å; D368-R395 IonicContact OD2-NH1 2.69Å; D368-R395 PolarHBondContact OD2-NH1 2.66Å; D368-R395 IonicContact OD2-NH2 3.98Å; S391-R395 PolarHBondContact O-N 3.29Å; R395-A397 PolarHBondContact O-N 3.39Å; R395-S398 PolarHBondContact O-N 3.16Å; R395-I399 HydrophobicContact CG-CD1 4.07Å; R395-I399 WeakPolarHBondContact O-CG1 3.49Å; R395-I399 PolarHBondContact O-N 3.42Å
396	R	85.4	Confident	79.7	Confident	172 Å²	172	91.1 Å²	91.1	65%	0.649	48%	0.481	S	S	*	.	H	α-helix	trans	-59.4	-42.7	174.5	-76.7	176	-179.7	-173.4	0.4	112.9	V392 A393 I399 L400	V392-R396 WeakPolarHBondContact O-CB 3.41Å; V392-R396 VanDerWaalsContact O-CG 3.26Å; V392-R396 WeakPolarHBondContact O-CG 3.41Å; V392-R396 PolarHBondContact O-N 3Å; A393-R396 PolarHBondContact O-N 3.34Å; R396-I399 PolarHBondContact O-N 3.46Å; R396-L400 WeakPolarHBondContact O-CG 3.32Å; R396-L400 PolarHBondContact O-N 3.13Å
397	A	87.9	Confident	82.3	Confident	56 Å²	56	89 Å²	89	46%	0.463	47%	0.465	S	S	.	.	H	α-helix	trans	-61.5	-44	175.2	0	0	0	0	0	111.8	A393 R394 R395 I399 L400 E401	A393-A397 PolarHBondContact O-N 2.87Å; R394-A397 PolarHBondContact O-N 2.87Å; R395-A397 PolarHBondContact O-N 3.39Å; A397-I399 PolarHBondContact O-N 3.19Å; A397-L400 PolarHBondContact O-N 3.1Å; A397-E401 PolarHBondContact O-N 3.46Å
398	S	88.6	Confident	84.6	Confident	43 Å²	43	85 Å²	85	30%	0.301	45%	0.447	S	S	.	.	H	α-helix	trans	-63.9	-39.5	177.1	-166.7	0	0	0	0	112.8	R394 R395 E401 I402	R394-S398 PolarHBondContact O-N 3.49Å; R395-S398 PolarHBondContact O-N 3.16Å; S398-E401 PolarHBondContact O-N 3.14Å; S398-I402 WeakPolarHBondContact O-CD1 3.43Å; S398-I402 VanDerWaalsContact O-CG1 3.26Å; S398-I402 WeakPolarHBondContact O-CG1 3.48Å; S398-I402 PolarHBondContact O-N 3.23Å
399	I	89.9	Confident	86.7	Confident	38 Å²	38	82.2 Å²	82.2	20%	0.195	43%	0.425	C	S	.	.	H	α-helix	trans	-62.6	-45.4	174.5	-70.4	165.8	0	0	0	110.7	L360 N363 R395 R396 A397 E401 I402 E403	L360-I399 HydrophobicContact CD1-CG2 4.09Å; N363-I399 HydrophobicContact CB-CG1 4.03Å; R395-I399 HydrophobicContact CG-CD1 4.07Å; R395-I399 WeakPolarHBondContact O-CG1 3.49Å; R395-I399 PolarHBondContact O-N 3.42Å; R396-I399 PolarHBondContact O-N 3.46Å; A397-I399 PolarHBondContact O-N 3.19Å; I399-E401 VanDerWaalsContact C-N 3.32Å; I399-E401 PolarHBondContact O-N 3.07Å; I399-I402 PolarHBondContact O-N 2.88Å; I399-E403 VanDerWaalsContact O-CB 3.3Å; I399-E403 WeakPolarHBondContact O-CB 3.33Å; I399-E403 PolarHBondContact O-N 2.84Å
400	L	93	Very high	88.6	Confident	96 Å²	96	78 Å²	78	50%	0.503	41%	0.408	S	S	.	.	H	α-helix	trans	-63.3	-36.3	177.1	-70.5	168	0	0	0	112.3	R396 A397 N404	R396-L400 WeakPolarHBondContact O-CG 3.32Å; R396-L400 PolarHBondContact O-N 3.13Å; A397-L400 PolarHBondContact O-N 3.1Å; L400-N404 PolarHBondContact O-N 3.37Å; L400-N404 PolarHBondContact O-ND2 3.02Å
401	E	94.3	Very high	90.2	Very high	134 Å²	134	82.4 Å²	82.4	63%	0.626	42%	0.422	S	S	*	.	H	α-helix	trans	-64.7	-47.8	174.8	-172.9	171.6	-168.6	0	0	111.4	A397 S398 I399 E403 N404 V405	A397-E401 PolarHBondContact O-N 3.46Å; S398-E401 PolarHBondContact O-N 3.14Å; I399-E401 VanDerWaalsContact C-N 3.32Å; I399-E401 PolarHBondContact O-N 3.07Å; E401-E403 VanDerWaalsContact C-N 3.34Å; E401-E403 PolarHBondContact O-N 3.49Å; E401-N404 PolarHBondContact O-N 3.33Å; E401-V405 WeakPolarHBondContact O-CG2 3.49Å; E401-V405 PolarHBondContact O-N 3.35Å
402	I	93.1	Very high	91.3	Very high	32 Å²	32	83 Å²	83	16%	0.164	42%	0.417	C	S	.	.	H	α-helix	trans	-64.6	-37.9	177	-62.9	164.1	0	0	0	111.3	A359 L360 N363 S398 I399 V405 Y406	A359-I402 HydrophobicContact CB-CG2 4.28Å; L360-I402 HydrophobicContact CB-CG2 3.84Å; L360-I402 HydrophobicContact CD1-CB 4.49Å; L360-I402 HydrophobicContact CD1-CG2 4.17Å; N363-I402 HydrophobicContact CB-CD1 4.39Å; N363-I402 WeakPolarHBondContact ND2-CD1 3.45Å; S398-I402 WeakPolarHBondContact O-CD1 3.43Å; S398-I402 VanDerWaalsContact O-CG1 3.26Å; S398-I402 WeakPolarHBondContact O-CG1 3.48Å; S398-I402 PolarHBondContact O-N 3.23Å; I399-I402 PolarHBondContact O-N 2.88Å; I402-V405 PolarHBondContact O-N 3.39Å; I402-Y406 WeakPolarHBondContact O-CB 3.39Å; I402-Y406 PolarHBondContact O-N 3.35Å
403	E	95.1	Very high	92.3	Very high	73 Å²	73	82.5 Å²	82.5	34%	0.341	41%	0.406	S	S	.	.	H	α-helix	trans	-61.3	-45.3	174.7	-180	175.1	-165.7	0	0	111.7	L360 I399 E401 V405 Y406 F407	L360-E403 HydrophobicContact CD1-CB 4.36Å; I399-E403 VanDerWaalsContact O-CB 3.3Å; I399-E403 WeakPolarHBondContact O-CB 3.33Å; I399-E403 PolarHBondContact O-N 2.84Å; E401-E403 VanDerWaalsContact C-N 3.34Å; E401-E403 PolarHBondContact O-N 3.49Å; E403-V405 PolarHBondContact O-N 2.69Å; E403-Y406 PolarHBondContact O-N 3.5Å; E403-F407 HydrophobicContact CG-CD2 3.78Å; E403-F407 HydrophobicContact CG-CE2 3.87Å; E403-F407 WeakPolarHBondContact O-CD2 3.41Å; E403-F407 PolarHBondContact O-N 2.89Å
404	N	95.6	Very high	93.1	Very high	107 Å²	107	84 Å²	84	57%	0.572	40%	0.403	S	S	*	.	H	α-helix	trans	-63.5	-38.6	175.6	-81.2	-71.1	0	0	0	112.5	L400 E401 T408	L400-N404 PolarHBondContact O-N 3.37Å; L400-N404 PolarHBondContact O-ND2 3.02Å; E401-N404 PolarHBondContact O-N 3.33Å; N404-T408 WeakPolarHBondContact O-CB 3.4Å; N404-T408 PolarHBondContact O-N 3.1Å; N404-T408 PolarHBondContact O-OG1 2.85Å
405	V	95.9	Very high	93.7	Very high	75 Å²	75	80.5 Å²	80.5	46%	0.455	40%	0.401	S	S	.	.	H	α-helix	trans	-65.3	-46.3	173.9	172	0	0	0	0	110.7	A356 E401 I402 E403 T408 K409	A356-V405 HydrophobicContact CB-CG1 4.37Å; E401-V405 WeakPolarHBondContact O-CG2 3.49Å; E401-V405 PolarHBondContact O-N 3.35Å; I402-V405 PolarHBondContact O-N 3.39Å; E403-V405 PolarHBondContact O-N 2.69Å; V405-T408 WeakPolarHBondContact O-CB 3.42Å; V405-T408 PolarHBondContact O-N 3.28Å; V405-K409 PolarHBondContact O-N 2.85Å
406	Y	97.3	Very high	94.4	Very high	52 Å²	52	79.7 Å²	79.7	20%	0.204	40%	0.402	C	S	.	.	H	α-helix	trans	-58.8	-51.7	177.1	171.5	-111.3	0	0	0	111.7	M353 A356 K357 L360 I402 E403 T408 K409 V410	M353-Y406 HydrophobicContact CG-CD2 4.31Å; M353-Y406 HydrophobicContact CG-CE2 3.9Å; A356-Y406 HydrophobicContact CB-CD2 4.28Å; K357-Y406 HydrophobicContact CB-CD2 4.01Å; K357-Y406 HydrophobicContact CB-CE2 3.7Å; K357-Y406 HydrophobicContact CG-CE2 4.19Å; L360-Y406 HydrophobicContact CD2-CD1 4.11Å; L360-Y406 HydrophobicContact CD2-CG 4.4Å; I402-Y406 WeakPolarHBondContact O-CB 3.39Å; I402-Y406 PolarHBondContact O-N 3.35Å; E403-Y406 PolarHBondContact O-N 3.5Å; Y406-T408 VanDerWaalsContact C-N 3.31Å; Y406-T408 PolarHBondContact O-N 3.03Å; Y406-K409 PolarHBondContact O-N 3.36Å; Y406-K409 VanDerWaalsContact O-N 3.11Å; Y406-V410 HydrophobicContact CD1-CG2 4.27Å; Y406-V410 HydrophobicContact CD2-CG2 4Å; Y406-V410 HydrophobicContact CE1-CG2 3.85Å; Y406-V410 HydrophobicContact CE2-CG2 3.54Å; Y406-V410 HydrophobicContact CG-CG2 4.34Å; Y406-V410 VanDerWaalsContact CZ-CG2 3.47Å; Y406-V410 WeakPolarHBondContact O-CG2 3.28Å; Y406-V410 PolarHBondContact O-N 3.39Å
407	F	97.3	Very high	94.9	Very high	118 Å²	118	73.4 Å²	73.4	52%	0.518	38%	0.384	S	S	.	.	H	α-helix	trans	-64.5	-33.4	179.1	-86	-69	0	0	0	113.2	E403 V410 K411	E403-F407 HydrophobicContact CG-CD2 3.78Å; E403-F407 HydrophobicContact CG-CE2 3.87Å; E403-F407 WeakPolarHBondContact O-CD2 3.41Å; E403-F407 PolarHBondContact O-N 2.89Å; F407-V410 PolarHBondContact O-N 2.77Å; F407-K411 WeakPolarHBondContact O-CB 3.44Å; F407-K411 PolarHBondContact O-N 3.04Å
408	T	96.4	Very high	95.3	Very high	74 Å²	74	73.9 Å²	73.9	45%	0.454	38%	0.384	S	S	.	.	H	α-helix	trans	-60	-47.6	170.7	-62.3	0	0	0	0	111.1	N404 V405 Y406 K411 E412	N404-T408 WeakPolarHBondContact O-CB 3.4Å; N404-T408 PolarHBondContact O-N 3.1Å; N404-T408 PolarHBondContact O-OG1 2.85Å; V405-T408 WeakPolarHBondContact O-CB 3.42Å; V405-T408 PolarHBondContact O-N 3.28Å; Y406-T408 VanDerWaalsContact C-N 3.31Å; Y406-T408 PolarHBondContact O-N 3.03Å; T408-K411 WeakPolarHBondContact O-CB 3.39Å; T408-K411 PolarHBondContact O-N 3.06Å; T408-E412 WeakPolarHBondContact CG2-OE1 3.23Å; T408-E412 WeakPolarHBondContact O-CG 3.42Å; T408-E412 PolarHBondContact O-N 2.77Å
409	K	96.9	Very high	95.6	Very high	58 Å²	58	73.1 Å²	73.1	25%	0.252	38%	0.376	S	S	.	.	H	α-helix	trans	-71.7	-32.2	178.4	-63.4	-46.5	-172.1	-172.2	0	114	M353 V405 Y406 K411 E412 Y413	M353-K409 HydrophobicContact CB-CB 3.98Å; V405-K409 PolarHBondContact O-N 2.85Å; Y406-K409 PolarHBondContact O-N 3.36Å; Y406-K409 VanDerWaalsContact O-N 3.11Å; K409-K411 VanDerWaalsContact C-N 3.35Å; K409-E412 WeakPolarHBondContact CD-OE1 3.3Å; K409-E412 WeakPolarHBondContact CD-OE2 3.37Å; K409-E412 WeakPolarHBondContact CE-OE2 3.44Å; K409-E412 IonicContact NZ-OE1 2.97Å; K409-E412 PolarHBondContact NZ-OE1 3.42Å; K409-E412 IonicContact NZ-OE2 3.14Å; K409-E412 PolarHBondContact NZ-OE2 3.49Å; K409-Y413 VanDerWaalsContact O-CB 3.3Å; K409-Y413 WeakPolarHBondContact O-CB 3.42Å; K409-Y413 PolarHBondContact O-N 2.75Å
410	V	97.6	Very high	95.9	Very high	24 Å²	24	72.6 Å²	72.6	15%	0.145	38%	0.375	C	S	.	.	H	α-helix	trans	-59.6	-45.5	167.9	171.3	0	0	0	0	110.7	M353 Y406 F407 Y413 L414	M353-V410 HydrophobicContact CG-CG2 3.79Å; M353-V410 HydrophobicContact SD-CB 4.25Å; M353-V410 HydrophobicContact SD-CG2 3.72Å; Y406-V410 HydrophobicContact CD1-CG2 4.27Å; Y406-V410 HydrophobicContact CD2-CG2 4Å; Y406-V410 HydrophobicContact CE1-CG2 3.85Å; Y406-V410 HydrophobicContact CE2-CG2 3.54Å; Y406-V410 HydrophobicContact CG-CG2 4.34Å; Y406-V410 VanDerWaalsContact CZ-CG2 3.47Å; Y406-V410 WeakPolarHBondContact O-CG2 3.28Å; Y406-V410 PolarHBondContact O-N 3.39Å; F407-V410 PolarHBondContact O-N 2.77Å; V410-Y413 PolarHBondContact O-N 3.29Å; V410-L414 HydrophobicContact CG1-CD1 3.71Å; V410-L414 HydrophobicContact CG1-CG 4.3Å; V410-L414 WeakPolarHBondContact O-CB 3.33Å; V410-L414 VanDerWaalsContact O-CG 3.3Å; V410-L414 WeakPolarHBondContact O-CG 3.5Å; V410-L414 PolarHBondContact O-N 3.22Å
411	K	96.4	Very high	96.1	Very high	151 Å²	151	71.5 Å²	71.5	66%	0.657	38%	0.375	S	S	*	.	H	α-helix	trans	-64.2	-47.5	178.7	-179.2	-175.6	174.3	-174.4	0	111.9	F407 T408 K409 V415	F407-K411 WeakPolarHBondContact O-CB 3.44Å; F407-K411 PolarHBondContact O-N 3.04Å; T408-K411 WeakPolarHBondContact O-CB 3.39Å; T408-K411 PolarHBondContact O-N 3.06Å; K409-K411 VanDerWaalsContact C-N 3.35Å; K411-V415 HydrophobicContact CG-CG2 4.43Å; K411-V415 WeakPolarHBondContact O-CB 3.43Å; K411-V415 VanDerWaalsContact O-CG2 3.29Å; K411-V415 WeakPolarHBondContact O-CG2 3.33Å; K411-V415 PolarHBondContact O-N 3.39Å
412	E	95.5	Very high	96.1	Very high	79 Å²	79	69.1 Å²	69.1	37%	0.369	36%	0.363	S	S	.	.	H	α-helix	trans	-55.7	-51.4	175.1	-72.9	172	-153.2	0	0	111.1	A349 T408 K409 G416	A349-E412 HydrophobicContact CB-CB 4.01Å; T408-E412 WeakPolarHBondContact CG2-OE1 3.23Å; T408-E412 WeakPolarHBondContact O-CG 3.42Å; T408-E412 PolarHBondContact O-N 2.77Å; K409-E412 WeakPolarHBondContact CD-OE1 3.3Å; K409-E412 WeakPolarHBondContact CD-OE2 3.37Å; K409-E412 WeakPolarHBondContact CE-OE2 3.44Å; K409-E412 IonicContact NZ-OE1 2.97Å; K409-E412 PolarHBondContact NZ-OE1 3.42Å; K409-E412 IonicContact NZ-OE2 3.14Å; K409-E412 PolarHBondContact NZ-OE2 3.49Å; E412-G416 PolarHBondContact O-N 3.14Å
413	Y	97.5	Very high	96.2	Very high	79 Å²	79	67.6 Å²	67.6	31%	0.31	36%	0.355	S	S	.	.	H	α-helix	trans	-61.1	-46.8	-179.6	175.1	-100.2	0	0	0	113.1	T346 G350 M353 K409 V410 S417	T346-Y413 HydrophobicContact CG2-CD2 3.92Å; T346-Y413 HydrophobicContact CG2-CE2 4.09Å; T346-Y413 WeakPolarHBondContact O-CD2 3.23Å; G350-Y413 VanDerWaalsContact CA-CD2 3.43Å; M353-Y413 HydrophobicContact CE-CD1 3.71Å; M353-Y413 HydrophobicContact CE-CD2 4.46Å; M353-Y413 HydrophobicContact CE-CE1 4.06Å; M353-Y413 HydrophobicContact CE-CG 3.95Å; M353-Y413 HydrophobicContact SD-CD1 3.99Å; M353-Y413 HydrophobicContact SD-CG 4.2Å; K409-Y413 VanDerWaalsContact O-CB 3.3Å; K409-Y413 WeakPolarHBondContact O-CB 3.42Å; K409-Y413 PolarHBondContact O-N 2.75Å; V410-Y413 PolarHBondContact O-N 3.29Å; Y413-S417 WeakPolarHBondContact O-CB 3.22Å; Y413-S417 PolarHBondContact O-N 2.96Å
414	L	97.4	Very high	96.3	Very high	104 Å²	104	67.6 Å²	67.6	55%	0.545	36%	0.355	S	S	.	.	H	α-helix	trans	-69	-39	-178	-70.2	176.1	0	0	0	112.6	V410 S418	V410-L414 HydrophobicContact CG1-CD1 3.71Å; V410-L414 HydrophobicContact CG1-CG 4.3Å; V410-L414 WeakPolarHBondContact O-CB 3.33Å; V410-L414 VanDerWaalsContact O-CG 3.3Å; V410-L414 WeakPolarHBondContact O-CG 3.5Å; V410-L414 PolarHBondContact O-N 3.22Å; L414-S418 WeakPolarHBondContact O-CB 3.38Å; L414-S418 PolarHBondContact O-N 3.34Å
415	V	95.4	Very high	96.3	Very high	96 Å²	96	65.1 Å²	65.1	58%	0.582	35%	0.349	S	S	*	.	H	α-helix	trans	-70.2	-42.7	176.4	174.9	0	0	0	0	110.7	K411 S418 L419	K411-V415 HydrophobicContact CG-CG2 4.43Å; K411-V415 WeakPolarHBondContact O-CB 3.43Å; K411-V415 VanDerWaalsContact O-CG2 3.29Å; K411-V415 WeakPolarHBondContact O-CG2 3.33Å; K411-V415 PolarHBondContact O-N 3.39Å; V415-S418 PolarHBondContact O-N 3.13Å; V415-L419 PolarHBondContact O-N 2.91Å
416	G	95.1	Very high	96.1	Very high	13 Å²	13	64.8 Å²	64.8	13%	0.134	34%	0.342	C	S	.	.	H	α-helix	trans	-59.4	-51	174.1	0	0	0	0	0	112.1	T346 E412 S418 L419 V420	T346-G416 VanDerWaalsContact OG1-C 3.27Å; T346-G416 VanDerWaalsContact OG1-CA 3.32Å; T346-G416 WeakPolarHBondContact OG1-CA 3.4Å; E412-G416 PolarHBondContact O-N 3.14Å; G416-S418 VanDerWaalsContact C-N 3.29Å; G416-S418 PolarHBondContact O-N 2.99Å; G416-L419 CarbonylContact O-C 3.55Å; G416-L419 WeakPolarHBondContact O-CA 3.44Å; G416-L419 WeakPolarHBondContact O-CB 3.45Å; G416-L419 PolarHBondContact O-N 3.2Å; G416-V420 WeakPolarHBondContact O-CG2 3.5Å; G416-V420 PolarHBondContact O-N 2.69Å
417	S	97.4	Very high	96	Very high	40 Å²	40	63.3 Å²	63.3	28%	0.28	34%	0.337	S	S	.	.	H	α-helix	trans	-60.8	-35.3	178.2	-178.4	0	0	0	0	113	Y413 S421	Y413-S417 WeakPolarHBondContact O-CB 3.22Å; Y413-S417 PolarHBondContact O-N 2.96Å; S417-S421 WeakPolarHBondContact O-CB 3.48Å; S417-S421 PolarHBondContact O-N 3.09Å; S417-S421 PolarHBondContact O-OG 2.73Å
418	S	96.4	Very high	95.9	Very high	65 Å²	65	61.1 Å²	61.1	46%	0.455	33%	0.33	S	S	.	.	H	α-helix	trans	-65.6	-42.1	171.1	-175.9	0	0	0	0	112.1	L414 V415 G416 S421 K422	L414-S418 WeakPolarHBondContact O-CB 3.38Å; L414-S418 PolarHBondContact O-N 3.34Å; V415-S418 PolarHBondContact O-N 3.13Å; G416-S418 VanDerWaalsContact C-N 3.29Å; G416-S418 PolarHBondContact O-N 2.99Å; S418-S421 PolarHBondContact O-N 3.04Å; S418-K422 WeakPolarHBondContact O-CG 3.44Å; S418-K422 PolarHBondContact O-N 2.73Å
419	L	94.3	Very high	95.8	Very high	28 Å²	28	62.8 Å²	62.8	15%	0.147	34%	0.336	C	S	.	.	H	α-helix	trans	-65.7	-44.2	175.5	-179.1	58.6	0	0	0	112.2	V342 V415 G416 S421 K422 L423 D610	V342-L419 HydrophobicContact CG1-CB 4.15Å; V342-L419 HydrophobicContact CG1-CD2 3.84Å; V342-L419 HydrophobicContact CG1-CG 3.95Å; V342-L419 HydrophobicContact CG2-CD2 3.89Å; V342-L419 HydrophobicContact CG2-CG 4.44Å; V415-L419 PolarHBondContact O-N 2.91Å; G416-L419 CarbonylContact O-C 3.55Å; G416-L419 WeakPolarHBondContact O-CA 3.44Å; G416-L419 WeakPolarHBondContact O-CB 3.45Å; G416-L419 PolarHBondContact O-N 3.2Å; L419-S421 VanDerWaalsContact C-N 3.29Å; L419-S421 PolarHBondContact O-N 2.94Å; L419-K422 PolarHBondContact O-N 3.31Å; L419-L423 HydrophobicContact CD1-CD1 3.94Å; L419-L423 HydrophobicContact CD1-CG 3.95Å; L419-L423 HydrophobicContact CG-CD1 3.95Å; L419-L423 HydrophobicContact CG-CG 4.37Å; L419-L423 WeakPolarHBondContact O-CG 3.36Å; L419-L423 PolarHBondContact O-N 3.03Å; L419-D610 HydrophobicContact CD1-CB 3.69Å; L419-D610 VanDerWaalsContact CD1-OD1 3.31Å; L419-D610 WeakPolarHBondContact CD1-OD1 3.41Å
420	V	96.9	Very high	95.6	Very high	26 Å²	26	60.6 Å²	60.6	16%	0.158	33%	0.327	C	S	.	.	H	α-helix	trans	-53.1	-49.1	171.5	175.2	0	0	0	0	109.9	L339 V342 G416 K422 L423 Q424	L339-V420 HydrophobicContact CD1-CG1 3.96Å; V342-V420 HydrophobicContact CB-CG2 4.4Å; V342-V420 HydrophobicContact CG1-CG2 3.74Å; G416-V420 WeakPolarHBondContact O-CG2 3.5Å; G416-V420 PolarHBondContact O-N 2.69Å; V420-K422 VanDerWaalsContact C-N 3.34Å; V420-K422 PolarHBondContact O-N 3.4Å; V420-L423 PolarHBondContact O-N 3.21Å; V420-Q424 WeakPolarHBondContact O-CB 3.46Å; V420-Q424 PolarHBondContact O-N 3.36Å
421	S	96.4	Very high	95.3	Very high	73 Å²	73	63.4 Å²	63.4	51%	0.51	34%	0.337	S	S	.	.	H	α-helix	trans	-60.2	-40.8	-179.1	-57.8	0	0	0	0	112.9	S417 S418 L419 A425	S417-S421 WeakPolarHBondContact O-CB 3.48Å; S417-S421 PolarHBondContact O-N 3.09Å; S417-S421 PolarHBondContact O-OG 2.73Å; S418-S421 PolarHBondContact O-N 3.04Å; L419-S421 VanDerWaalsContact C-N 3.29Å; L419-S421 PolarHBondContact O-N 2.94Å; S421-A425 PolarHBondContact O-N 2.99Å
422	K	95.1	Very high	95.1	Very high	85 Å²	85	60.6 Å²	60.6	37%	0.37	33%	0.332	S	S	.	.	H	α-helix	trans	-68.5	-44	176.4	-69.8	-176.2	-64	163.9	0	112.5	S418 L419 V420 K426 D610	S418-K422 WeakPolarHBondContact O-CG 3.44Å; S418-K422 PolarHBondContact O-N 2.73Å; L419-K422 PolarHBondContact O-N 3.31Å; V420-K422 VanDerWaalsContact C-N 3.34Å; V420-K422 PolarHBondContact O-N 3.4Å; K422-K426 PolarHBondContact O-N 2.92Å; K422-D610 VanDerWaalsContact CE-OD2 3.3Å; K422-D610 WeakPolarHBondContact CE-OD2 3.5Å; K422-D610 IonicContact NZ-OD1 2.76Å; K422-D610 PolarHBondContact NZ-OD1 3.21Å; K422-D610 IonicContact NZ-OD2 2.73Å; K422-D610 PolarHBondContact NZ-OD2 3.4Å
423	L	94.6	Very high	94.8	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-70.8	-37.6	-179.7	-69.2	177.2	0	0	0	111.9	I335 R338 L339 V342 L419 V420 K426 H427 D610 E611	I335-L423 HydrophobicContact CG2-CB 4.43Å; I335-L423 HydrophobicContact CG2-CD2 4.32Å; R338-L423 HydrophobicContact CG-CD1 4.01Å; L339-L423 HydrophobicContact CB-CB 4.24Å; L339-L423 HydrophobicContact CD1-CB 3.94Å; V342-L423 HydrophobicContact CG2-CD1 4.33Å; L419-L423 HydrophobicContact CD1-CD1 3.94Å; L419-L423 HydrophobicContact CD1-CG 3.95Å; L419-L423 HydrophobicContact CG-CD1 3.95Å; L419-L423 HydrophobicContact CG-CG 4.37Å; L419-L423 WeakPolarHBondContact O-CG 3.36Å; L419-L423 PolarHBondContact O-N 3.03Å; V420-L423 PolarHBondContact O-N 3.21Å; L423-K426 PolarHBondContact O-N 3.06Å; L423-H427 VanDerWaalsContact O-CB 3.25Å; L423-H427 WeakPolarHBondContact O-CB 3.21Å; L423-H427 PolarHBondContact O-N 3.26Å; L423-D610 HydrophobicContact CD2-CB 4.37Å; L423-E611 HydrophobicContact CD2-CG 4.17Å
424	Q	96.9	Very high	94.4	Very high	73 Å²	73	53.9 Å²	53.9	34%	0.341	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-48.2	174.9	-173.5	67.9	61.7	0	0	111.2	L339 V420 K426 H427 D428	L339-Q424 HydrophobicContact CD1-CB 4.27Å; L339-Q424 HydrophobicContact CD2-CB 4.5Å; V420-Q424 WeakPolarHBondContact O-CB 3.46Å; V420-Q424 PolarHBondContact O-N 3.36Å; Q424-K426 VanDerWaalsContact C-N 3.33Å; Q424-K426 PolarHBondContact O-N 3.44Å; Q424-H427 WeakPolarHBondContact O-CB 3.5Å; Q424-H427 PolarHBondContact O-N 3.1Å; Q424-D428 PolarHBondContact NE2-OD1 3.26Å; Q424-D428 PolarHBondContact NE2-OD2 3.14Å; Q424-D428 VanDerWaalsContact O-CG 3.26Å; Q424-D428 PolarHBondContact O-N 3.23Å
425	A	94.9	Very high	93.9	Very high	55 Å²	55	53.6 Å²	53.6	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-39.3	178	0	0	0	0	0	112.8	S421 L429	S421-A425 PolarHBondContact O-N 2.99Å; A425-L429 WeakPolarHBondContact O-CG 3.47Å; A425-L429 PolarHBondContact O-N 3.04Å
426	K	93.3	Very high	93.3	Very high	67 Å²	67	54.3 Å²	54.3	29%	0.291	30%	0.296	S	S	.	.	H	α-helix	trans	-67.7	-44.8	173.4	-71.6	176.5	176.4	177.3	0	112.1	I335 K422 L423 Q424 D428 L430 E611	I335-K426 HydrophobicContact CD1-CB 4.12Å; I335-K426 HydrophobicContact CD1-CD 4.44Å; K422-K426 PolarHBondContact O-N 2.92Å; L423-K426 PolarHBondContact O-N 3.06Å; Q424-K426 VanDerWaalsContact C-N 3.33Å; Q424-K426 PolarHBondContact O-N 3.44Å; K426-D428 PolarHBondContact O-N 3.32Å; K426-L430 WeakPolarHBondContact O-CB 3.22Å; K426-L430 WeakPolarHBondContact O-CG 3.11Å; K426-L430 PolarHBondContact O-N 3.25Å; K426-E611 WeakPolarHBondContact CE-OE1 3.4Å; K426-E611 IonicContact NZ-OE1 2.77Å; K426-E611 PolarHBondContact NZ-OE1 3.46Å
427	H	95.1	Very high	92.6	Very high	22 Å²	22	53.8 Å²	53.8	10%	0.102	29%	0.291	C	S	.	.	H	α-helix	trans	-56.4	-47.7	178.1	169.3	-87.7	0	0	0	111.5	F332 I335 Q336 L339 L423 Q424 L430 K431	F332-H427 AromaticContact CE2-CD2 3.47Å; F332-H427 VanDerWaalsContact CE2-CD2 3.47Å; F332-H427 WeakPolarHBondContact CE2-CD2 3.43Å; F332-H427 AromaticContact CE2-NE2 3.49Å; F332-H427 WeakPolarHBondContact CE2-NE2 3.36Å; F332-H427 AromaticContact CZ-NE2 3.82Å; I335-H427 HydrophobicContact CG2-CB 3.98Å; Q336-H427 PolarHBondContact NE2-NE2 2.97Å; L339-H427 HydrophobicContact CD2-CB 3.89Å; L423-H427 VanDerWaalsContact O-CB 3.25Å; L423-H427 WeakPolarHBondContact O-CB 3.21Å; L423-H427 PolarHBondContact O-N 3.26Å; Q424-H427 WeakPolarHBondContact O-CB 3.5Å; Q424-H427 PolarHBondContact O-N 3.1Å; H427-L430 PolarHBondContact O-N 3.18Å; H427-K431 VanDerWaalsContact O-CB 3.28Å; H427-K431 WeakPolarHBondContact O-CB 3.26Å; H427-K431 PolarHBondContact O-N 2.65Å
428	D	94.3	Very high	91.4	Very high	71 Å²	71	57.4 Å²	57.4	38%	0.38	30%	0.304	S	S	.	.	H	α-helix	trans	-72.3	-35.1	-173.5	-63.3	-24.1	0	0	0	112.4	Q424 K426 V432	Q424-D428 PolarHBondContact NE2-OD1 3.26Å; Q424-D428 PolarHBondContact NE2-OD2 3.14Å; Q424-D428 VanDerWaalsContact O-CG 3.26Å; Q424-D428 PolarHBondContact O-N 3.23Å; K426-D428 PolarHBondContact O-N 3.32Å; D428-V432 WeakPolarHBondContact O-CG2 3.38Å; D428-V432 PolarHBondContact O-N 3.35Å
429	L	94.4	Very high	90.1	Very high	110 Å²	110	58.2 Å²	58.2	58%	0.576	31%	0.314	S	S	*	.	H	α-helix	trans	-66.4	-46.8	171.3	-71.4	171.9	0	0	0	112.1	V318 A425 K431 V432 A433	V318-L429 HydrophobicContact CG2-CB 4.38Å; A425-L429 WeakPolarHBondContact O-CG 3.47Å; A425-L429 PolarHBondContact O-N 3.04Å; L429-K431 VanDerWaalsContact C-N 3.33Å; L429-K431 PolarHBondContact O-N 2.84Å; L429-V432 PolarHBondContact O-N 2.89Å; L429-A433 PolarHBondContact O-N 3Å; L429-A433 VanDerWaalsContact O-N 3.07Å
430	L	92.3	Very high	88.5	Confident	12 Å²	12	59.9 Å²	59.9	6%	0.063	33%	0.328	C	S	.	.	H	α-helix	trans	-64.9	-36.9	177.9	-76.8	169.1	0	0	0	112.1	V318 M328 R331 F332 I335 K426 H427 A433 V434	V318-L430 HydrophobicContact CG1-CD2 4.47Å; M328-L430 HydrophobicContact CB-CD2 4.37Å; M328-L430 HydrophobicContact SD-CD2 3.84Å; R331-L430 HydrophobicContact CG-CD1 4.28Å; F332-L430 HydrophobicContact CB-CB 4.21Å; F332-L430 HydrophobicContact CD2-CB 3.96Å; F332-L430 HydrophobicContact CG-CB 4.49Å; I335-L430 HydrophobicContact CD1-CD1 3.64Å; K426-L430 WeakPolarHBondContact O-CB 3.22Å; K426-L430 WeakPolarHBondContact O-CG 3.11Å; K426-L430 PolarHBondContact O-N 3.25Å; H427-L430 PolarHBondContact O-N 3.18Å; L430-A433 PolarHBondContact O-N 3.13Å; L430-V434 WeakPolarHBondContact O-CB 3.5Å; L430-V434 WeakPolarHBondContact O-CG2 3.43Å; L430-V434 PolarHBondContact O-N 2.78Å
431	K	92.4	Very high	86.3	Confident	83 Å²	83	63.2 Å²	63.2	36%	0.361	35%	0.345	S	S	.	.	H	α-helix	trans	-56.6	-52.6	174.9	-175.2	-177.5	169.2	-175	0	111	F332 H427 L429 A433 V434 E435	F332-K431 HydrophobicContact CD2-CB 4.42Å; F332-K431 HydrophobicContact CE2-CB 3.64Å; F332-K431 HydrophobicContact CE2-CG 4.22Å; F332-K431 HydrophobicContact CZ-CB 4.03Å; F332-K431 HydrophobicContact CZ-CG 4.09Å; H427-K431 VanDerWaalsContact O-CB 3.28Å; H427-K431 WeakPolarHBondContact O-CB 3.26Å; H427-K431 PolarHBondContact O-N 2.65Å; L429-K431 VanDerWaalsContact C-N 3.33Å; L429-K431 PolarHBondContact O-N 2.84Å; K431-A433 VanDerWaalsContact C-N 3.32Å; K431-A433 PolarHBondContact O-N 3.18Å; K431-V434 PolarHBondContact O-N 3.25Å; K431-E435 WeakPolarHBondContact CE-OE1 3.48Å; K431-E435 WeakPolarHBondContact CE-OE2 3.19Å; K431-E435 HydrophobicContact CG-CG 4.39Å; K431-E435 IonicContact NZ-OE1 2.65Å; K431-E435 WeakPolarHBondContact O-CB 3.33Å; K431-E435 WeakPolarHBondContact O-CG 3.47Å; K431-E435 PolarHBondContact O-N 2.98Å
432	V	91.6	Very high	83.9	Confident	91 Å²	91	62.6 Å²	62.6	55%	0.552	35%	0.351	S	S	*	.	H	α-helix	trans	-61.2	-41.6	179.1	173	0	0	0	0	111.1	D428 L429 K436	D428-V432 WeakPolarHBondContact O-CG2 3.38Å; D428-V432 PolarHBondContact O-N 3.35Å; L429-V432 PolarHBondContact O-N 2.89Å; V432-K436 WeakPolarHBondContact O-CB 3.46Å; V432-K436 PolarHBondContact O-N 3.44Å
433	A	89	Confident	81.3	Confident	4 Å²	4	66.8 Å²	66.8	3%	0.033	37%	0.371	C	S	.	.	H	α-helix	trans	-63.1	-44.4	177.7	0	0	0	0	0	112.9	V318 A320 L429 L430 K431 A437	V318-A433 HydrophobicContact CB-CB 4.02Å; V318-A433 HydrophobicContact CG1-CB 3.78Å; V318-A433 VanDerWaalsContact O-CB 3.3Å; V318-A433 WeakPolarHBondContact O-CB 3.39Å; A320-A433 HydrophobicContact CB-CB 4.25Å; L429-A433 PolarHBondContact O-N 3Å; L429-A433 VanDerWaalsContact O-N 3.07Å; L430-A433 PolarHBondContact O-N 3.13Å; K431-A433 VanDerWaalsContact C-N 3.32Å; K431-A433 PolarHBondContact O-N 3.18Å; A433-A437 WeakPolarHBondContact O-CB 3.34Å; A433-A437 PolarHBondContact O-N 3.34Å
434	V	88.1	Confident	78.6	Confident	13 Å²	13	75.3 Å²	75.3	8%	0.079	41%	0.411	C	S	.	.	H	α-helix	trans	-67.9	-48.2	178.1	172.1	0	0	0	0	110.9	E329 F332 L430 K431 K436 A437 E438	E329-V434 HydrophobicContact CG-CG1 4.02Å; E329-V434 HydrophobicContact CG-CG2 4.31Å; F332-V434 HydrophobicContact CB-CG2 4.46Å; L430-V434 WeakPolarHBondContact O-CB 3.5Å; L430-V434 WeakPolarHBondContact O-CG2 3.43Å; L430-V434 PolarHBondContact O-N 2.78Å; K431-V434 PolarHBondContact O-N 3.25Å; V434-K436 VanDerWaalsContact C-N 3.29Å; V434-K436 PolarHBondContact O-N 3.39Å; V434-A437 CarbonylContact O-C 3.32Å; V434-A437 PolarHBondContact O-N 3.05Å; V434-A437 VanDerWaalsContact O-N 3.08Å; V434-E438 PolarHBondContact O-N 3.44Å
435	E	87.1	Confident	75.8	Confident	99 Å²	99	76 Å²	76	46%	0.463	42%	0.422	S	S	.	.	H	α-helix	trans	-60	-38.5	177.7	-71.4	176.5	160.4	0	0	111.8	K431 E438 A439	K431-E435 WeakPolarHBondContact CE-OE1 3.48Å; K431-E435 WeakPolarHBondContact CE-OE2 3.19Å; K431-E435 HydrophobicContact CG-CG 4.39Å; K431-E435 IonicContact NZ-OE1 2.65Å; K431-E435 WeakPolarHBondContact O-CB 3.33Å; K431-E435 WeakPolarHBondContact O-CG 3.47Å; K431-E435 PolarHBondContact O-N 2.98Å; E435-E438 PolarHBondContact O-N 2.96Å; E435-A439 WeakPolarHBondContact O-CB 3.32Å; E435-A439 PolarHBondContact O-N 3.06Å; E435-A439 VanDerWaalsContact O-N 3.08Å
436	K	84.4	Confident	73.1	Confident	110 Å²	110	85.3 Å²	85.3	48%	0.478	45%	0.445	S	S	.	.	H	α-helix	trans	-65.5	-39.6	174	-172.7	-177.9	-178	-170.1	0	112.2	E317 V432 V434 A439 S440	E317-K436 IonicContact OE2-NZ 3.34Å; E317-K436 PolarHBondContact OE2-NZ 2.97Å; V432-K436 WeakPolarHBondContact O-CB 3.46Å; V432-K436 PolarHBondContact O-N 3.44Å; V434-K436 VanDerWaalsContact C-N 3.29Å; V434-K436 PolarHBondContact O-N 3.39Å; K436-A439 PolarHBondContact O-N 3.41Å; K436-S440 PolarHBondContact O-N 3.16Å
437	A	79.4	Confident	70	Confident	3 Å²	3	91.8 Å²	91.8	3%	0.025	47%	0.474	C	S	.	.	H	α-helix	trans	-76.8	-24.1	177.8	0	0	0	0	0	113.9	A320 R325 A433 V434 S440 N441	A320-A437 HydrophobicContact CB-CB 3.84Å; A320-A437 VanDerWaalsContact O-CB 3.26Å; A320-A437 WeakPolarHBondContact O-CB 3.44Å; R325-A437 PolarHBondContact NH2-O 3.44Å; A433-A437 WeakPolarHBondContact O-CB 3.34Å; A433-A437 PolarHBondContact O-N 3.34Å; V434-A437 CarbonylContact O-C 3.32Å; V434-A437 PolarHBondContact O-N 3.05Å; V434-A437 VanDerWaalsContact O-N 3.08Å; A437-S440 PolarHBondContact O-OG 3.26Å; A437-N441 PolarHBondContact O-ND2 3.34Å
438	E	73.4	Confident	66.8	Low	116 Å²	116	95 Å²	95	54%	0.542	50%	0.499	S	S	.	.	H	α-helix	trans	-69.2	-46.6	167	-74.8	-172.3	165.3	0	0	110.6	V434 E435 S440 N441	V434-E438 PolarHBondContact O-N 3.44Å; E435-E438 PolarHBondContact O-N 2.96Å; E438-S440 VanDerWaalsContact C-N 3.33Å; E438-S440 PolarHBondContact O-N 3.45Å; E438-N441 WeakPolarHBondContact CA-ND2 3.34Å; E438-N441 WeakPolarHBondContact O-CB 3.28Å; E438-N441 PolarHBondContact O-N 3.2Å; E438-N441 PolarHBondContact O-ND2 2.96Å
439	A	67.1	Low	64	Low	82 Å²	82	95.8 Å²	95.8	68%	0.678	52%	0.524	S	S	*	.	H	α-helix	trans	-63.6	-31.4	-179.1	0	0	0	0	0	114.2	E435 K436 N441	E435-A439 WeakPolarHBondContact O-CB 3.32Å; E435-A439 PolarHBondContact O-N 3.06Å; E435-A439 VanDerWaalsContact O-N 3.08Å; K436-A439 PolarHBondContact O-N 3.41Å; A439-N441 VanDerWaalsContact C-N 3.26Å; A439-N441 PolarHBondContact O-N 3.44Å
440	S	61.3	Low	60.8	Low	62 Å²	62	99.3 Å²	99.3	43%	0.434	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-73.2	-11.6	179.6	66.2	0	0	0	0	114.5	K436 A437 E438 G442	K436-S440 PolarHBondContact O-N 3.16Å; A437-S440 PolarHBondContact O-OG 3.26Å; E438-S440 VanDerWaalsContact C-N 3.33Å; E438-S440 PolarHBondContact O-N 3.45Å; S440-G442 PolarHBondContact O-N 2.82Å
441	N	51.3	Low	57.8	Low	96 Å²	96	104.2 Å²	104.2	51%	0.513	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-68.5	3.1	179.4	-64.7	-57.3	0	0	0	115	R325 A437 E438 A439 H443	R325-N441 PolarHBondContact NH1-ND2 3.28Å; R325-N441 PolarHBondContact NH1-OD1 2.93Å; A437-N441 PolarHBondContact O-ND2 3.34Å; E438-N441 WeakPolarHBondContact CA-ND2 3.34Å; E438-N441 WeakPolarHBondContact O-CB 3.28Å; E438-N441 PolarHBondContact O-N 3.2Å; E438-N441 PolarHBondContact O-ND2 2.96Å; A439-N441 VanDerWaalsContact C-N 3.26Å; A439-N441 PolarHBondContact O-N 3.44Å; N441-H443 VanDerWaalsContact C-N 3.29Å; N441-H443 PolarHBondContact O-N 2.88Å
442	G	46.4	Very low	54.7	Low	61 Å²	61	107.5 Å²	107.5	63%	0.629	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-64.9	-23.7	179.6	0	0	0	0	0	115.2	S440	S440-G442 PolarHBondContact O-N 2.82Å
443	H	38.9	Very low	51.9	Low	173 Å²	173	114.4 Å²	114.4	80%	0.801	61%	0.606	S	S	*	*	S	Bend	trans	-147.9	104	-175.6	-83.6	71	0	0	0	113.6	N441	N441-H443 VanDerWaalsContact C-N 3.29Å; N441-H443 PolarHBondContact O-N 2.88Å
444	Q	39	Very low	49	Very low	179 Å²	179	121.3 Å²	121.3	84%	0.836	64%	0.641	S	S	*	*			trans	153.8	155.2	142.2	-82.4	-68.2	-34.8	0	0	110.3
445	P	38.1	Very low	46.2	Very low	88 Å²	88	131.2 Å²	131.2	57%	0.571	68%	0.677	S	S	*	*			trans	-94	161.6	-160.4	36.7	-36.1	0	0	0	115	F447	P445-F447 PolarHBondContact O-N 2.91Å
446	R	37.3	Very low	43.6	Very low	249 Å²	249	133.8 Å²	133.8	94%	0.94	69%	0.687	S	S	*	*			trans	-59.3	116	169.9	-63.9	172.8	177.4	160.5	-2.3	111.3
447	F	28.9	Very low	40.8	Very low	204 Å²	204	134.7 Å²	134.7	90%	0.895	70%	0.697	S	S	*	*			trans	-77	126.3	156.6	-91.3	-89.1	0	0	0	109.9	P445 G449	P445-F447 PolarHBondContact O-N 2.91Å; F447-G449 PolarHBondContact O-N 3Å
448	S	29.1	Very low	38.6	Very low	90 Å²	90	143.1 Å²	143.1	63%	0.629	74%	0.735	S	S	*	*			trans	-73.8	124.4	178.7	60	0	0	0	0	110.4	K450	S448-K450 PolarHBondContact O-N 3.27Å
449	G	33.5	Very low	36.8	Very low	87 Å²	87	142.7 Å²	142.7	90%	0.897	75%	0.745	S	S	*	*			trans	-58.6	104.8	173.2	0	0	0	0	0	111.7	F447	F447-G449 PolarHBondContact O-N 3Å
450	K	28.6	Very low	35.3	Very low	183 Å²	183	144 Å²	144	80%	0.796	75%	0.749	S	S	*	*			trans	-90.9	109.6	166	-74	-176.3	179.3	176.9	0	108	S448 L452	S448-K450 PolarHBondContact O-N 3.27Å; K450-L452 PolarHBondContact O-N 3.04Å
451	S	29.4	Very low	34.1	Very low	115 Å²	115	144.2 Å²	144.2	80%	0.804	76%	0.755	S	S	*	*			trans	-62.1	102.2	173.7	178.3	0	0	0	0	110	R453	S451-R453 PolarHBondContact O-N 3.06Å
452	L	25.8	Very low	33.5	Very low	152 Å²	152	147 Å²	147	80%	0.796	77%	0.769	S	S	*	*			trans	-75.3	108.9	167.3	-78.5	167.4	0	0	0	108	K450 I454	K450-L452 PolarHBondContact O-N 3.04Å; L452-I454 PolarHBondContact O-N 3.14Å
453	R	33.6	Very low	33.5	Very low	236 Å²	236	151.8 Å²	151.8	89%	0.891	78%	0.78	S	S	*	*			trans	-70.3	92.2	172.1	-75.8	179.9	171	165	-4	109.7	S451 R455	S451-R453 PolarHBondContact O-N 3.06Å; R453-R455 PolarHBondContact O-N 3.24Å
454	I	27.9	Very low	34.1	Very low	149 Å²	149	147.2 Å²	147.2	76%	0.764	76%	0.761	S	S	*	*			trans	-70.6	117.8	167.5	-62.6	177.4	0	0	0	108	L452	L452-I454 PolarHBondContact O-N 3.14Å
455	R	30.3	Very low	34.4	Very low	222 Å²	222	146.6 Å²	146.6	84%	0.838	76%	0.757	S	S	*	*			trans	-96.7	80	172.4	-177.1	-177.2	178.7	170.5	0.6	108.2	R453 N457	R453-R455 PolarHBondContact O-N 3.24Å; R455-N457 PolarHBondContact O-N 3.48Å
456	K	31.5	Very low	34.8	Very low	152 Å²	152	149.7 Å²	149.7	66%	0.661	77%	0.769	S	S	*	*			trans	-65.5	131.4	173.5	-129.7	173.8	-175.1	177.9	0	108.1	D678	K456-D678 IonicContact NZ-OD2 2.71Å; K456-D678 PolarHBondContact NZ-OD2 3.17Å
457	N	25.3	Very low	35.8	Very low	129 Å²	129	142.7 Å²	142.7	69%	0.69	75%	0.747	S	S	*	*			trans	-82	123.3	-176.4	-79	-33.7	0	0	0	110.4	R455 S459	R455-N457 PolarHBondContact O-N 3.48Å; N457-S459 PolarHBondContact O-N 3.09Å; N457-S459 VanDerWaalsContact O-N 3.15Å
458	H	33.7	Very low	37.7	Very low	181 Å²	181	140 Å²	140	84%	0.838	74%	0.735	S	S	*	*			trans	-76	97.9	171.3	-68	-86.6	0	0	0	110.4
459	S	35.6	Very low	39.9	Very low	107 Å²	107	136.1 Å²	136.1	75%	0.748	71%	0.707	S	S	*	*			trans	-118.9	10.6	-179.8	-60.7	0	0	0	0	114.8	N457	N457-S459 PolarHBondContact O-N 3.09Å; N457-S459 VanDerWaalsContact O-N 3.15Å
460	S	35.9	Very low	42.1	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	67%	0.665	S	S	*	*	S	Bend	trans	-132.7	5.7	-174.9	-46.1	0	0	0	0	115.4	N462	S460-N462 PolarHBondContact O-N 3.44Å
461	A	36.8	Very low	44.6	Very low	66 Å²	66	126.4 Å²	126.4	55%	0.545	65%	0.648	S	S	.	*			trans	-78.3	-9.3	-164.8	0	0	0	0	0	116.3	L463	A461-L463 PolarHBondContact O-N 3.38Å
462	N	38.7	Very low	46.9	Very low	153 Å²	153	121.5 Å²	121.5	82%	0.818	62%	0.616	S	S	*	*	S	Bend	trans	-98	17.6	-158.1	-72	-11.9	0	0	0	116.5	S460	S460-N462 PolarHBondContact O-N 3.44Å
463	L	46	Very low	49.6	Very low	163 Å²	163	116.1 Å²	116.1	85%	0.853	59%	0.587	S	S	*	*	S	Bend	trans	-124.7	-13.1	178.1	-83.5	96.2	0	0	0	116.7	A461	A461-L463 PolarHBondContact O-N 3.38Å
464	I	50.9	Low	52.1	Low	77 Å²	77	105.4 Å²	105.4	40%	0.395	55%	0.548	S	S	.	.			trans	-92.1	-7.4	-169.6	-56.4	178.3	0	0	0	113	N466	I464-N466 PolarHBondContact O-N 3.18Å
465	H	45.1	Very low	54.8	Low	165 Å²	165	100.2 Å²	100.2	76%	0.764	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	26.6	-162.9	-149.3	80.5	0	0	0	117.2
466	N	47.4	Very low	57.2	Low	153 Å²	153	92.8 Å²	92.8	82%	0.818	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.6	2.2	-178.5	-83.1	-50.2	0	0	0	115.3	I464	I464-N466 PolarHBondContact O-N 3.18Å
467	H	57.5	Low	59.6	Low	103 Å²	103	86 Å²	86	48%	0.477	47%	0.474	S	S	.	.	S	Bend	trans	-118.7	127.7	178.6	-68.2	-74.3	0	0	0	111.7
468	K	68.4	Low	62.4	Low	147 Å²	147	80.5 Å²	80.5	64%	0.639	44%	0.444	S	S	*	.			trans	-67.9	134.8	173.5	-70.8	-172.5	174.9	-174.1	0	110.7	S471	K468-S471 WeakPolarHBondContact CD-O 3.5Å
469	L	75.7	Confident	64.6	Low	8 Å²	8	79.9 Å²	79.9	4%	0.042	44%	0.439	C	S	.	.	S	Bend	trans	-85.3	-42.7	177.6	-173.5	66.5	0	0	0	112.1	F477 Y487 V488 F523 E524 Y547	L469-F477 HydrophobicContact CD1-CD1 4.46Å; L469-F477 HydrophobicContact CD1-CD2 4.16Å; L469-F477 HydrophobicContact CD1-CE1 4.14Å; L469-F477 HydrophobicContact CD1-CE2 3.81Å; L469-F477 HydrophobicContact CD1-CG 4.49Å; L469-F477 HydrophobicContact CD1-CZ 3.82Å; L469-Y487 HydrophobicContact CD1-CE1 3.93Å; L469-Y487 HydrophobicContact CD2-CE1 4Å; L469-V488 HydrophobicContact CD1-CG1 4.08Å; L469-V488 HydrophobicContact CD2-CB 4.06Å; L469-V488 HydrophobicContact CD2-CG1 3.97Å; L469-V488 HydrophobicContact CG-CG1 4.12Å; L469-F523 HydrophobicContact CD2-CB 3.77Å; L469-E524 HydrophobicContact CB-CG 4.47Å; L469-Y547 HydrophobicContact CD1-CE2 4.24Å; L469-Y547 HydrophobicContact CG-CE2 4.3Å; L469-Y547 WeakPolarHBondContact O-CE2 3.42Å
470	F	80.9	Confident	66.5	Low	4 Å²	4	77.4 Å²	77.4	2%	0.018	43%	0.425	C	S	.	.	S	Bend	trans	-103.4	147.7	169.5	-56.9	-106.9	0	0	0	108.8	V488 R520 F523 E524 V543 L546 Y547	F470-V488 HydrophobicContact CZ-CG2 4.06Å; F470-R520 HydrophobicContact CD1-CG 4.2Å; F470-R520 HydrophobicContact CD2-CG 3.59Å; F470-R520 HydrophobicContact CE1-CG 4.12Å; F470-R520 HydrophobicContact CE2-CB 4.24Å; F470-R520 HydrophobicContact CE2-CG 3.51Å; F470-R520 HydrophobicContact CG-CG 3.96Å; F470-R520 HydrophobicContact CZ-CB 4.22Å; F470-R520 HydrophobicContact CZ-CG 3.79Å; F470-F523 HydrophobicContact CE2-CB 4.21Å; F470-E524 HydrophobicContact CD2-CG 3.72Å; F470-E524 HydrophobicContact CE2-CG 4.26Å; F470-V543 HydrophobicContact CZ-CG1 4.16Å; F470-L546 HydrophobicContact CD1-CG 4.35Å; F470-L546 HydrophobicContact CE1-CD2 4.4Å; F470-L546 HydrophobicContact CE1-CG 4.25Å; F470-Y547 HydrophobicContact CD1-CD2 4.22Å; F470-Y547 HydrophobicContact CE1-CD2 4.16Å; F470-Y547 HydrophobicContact CZ-CD2 4.5Å
471	S	79	Confident	68.4	Low	63 Å²	63	73.4 Å²	73.4	44%	0.441	40%	0.397	S	S	.	.	S	Bend	trans	55.7	55.5	-172.6	-40.9	0	0	0	0	111.8	K468 C550 D552	K468-S471 WeakPolarHBondContact CD-O 3.5Å; S471-C550 WeakPolarHBondContact CA-O 3.33Å; S471-C550 PolarHBondContact N-O 3.14Å; S471-D552 VanDerWaalsContact C-OD1 3.24Å
472	G	78.7	Confident	70.2	Confident	12 Å²	12	73.4 Å²	73.4	12%	0.124	40%	0.403	C	S	.	.	S	Bend	trans	-154	166.4	178.9	0	0	0	0	0	111.3	D552	G472-D552 VanDerWaalsContact C-CG 3.44Å; G472-D552 WeakPolarHBondContact CA-OD2 3.4Å; G472-D552 PolarHBondContact N-OD1 3.25Å; G472-D552 PolarHBondContact O-N 2.57Å
473	D	82.1	Confident	72.1	Confident	38 Å²	38	69.2 Å²	69.2	20%	0.203	38%	0.379	C	S	.	.			trans	-83.1	123.3	175.6	178	62.3	0	0	0	112.4	L475 S476 F477 D552 N553	D473-L475 VanDerWaalsContact C-N 3.33Å; D473-L475 PolarHBondContact O-N 3.41Å; D473-L475 WeakPolarHBondContact OD2-CB 3.27Å; D473-L475 PolarHBondContact OD2-N 3.01Å; D473-S476 PolarHBondContact O-N 2.91Å; D473-S476 PolarHBondContact OD2-N 2.96Å; D473-S476 PolarHBondContact OD2-OG 2.96Å; D473-F477 PolarHBondContact O-N 3.43Å; D473-D552 PolarHBondContact N-OD2 3.01Å; D473-N553 PolarHBondContact OD1-ND2 2.97Å
474	M	86.4	Confident	73.9	Confident	12 Å²	12	65.8 Å²	65.8	6%	0.059	36%	0.355	C	S	.	.	H	α-helix	trans	-62.4	-36.9	-178.5	-175.2	-170	-73.1	0	0	112.6	F477 I478 P486 Y547 F548 L551 L555 V594	M474-F477 PolarHBondContact O-N 2.95Å; M474-I478 HydrophobicContact CG-CD1 3.77Å; M474-I478 HydrophobicContact CG-CG1 4.34Å; M474-I478 WeakPolarHBondContact O-CB 3.38Å; M474-I478 WeakPolarHBondContact O-CG1 3.34Å; M474-I478 PolarHBondContact O-N 3.39Å; M474-I478 HydrophobicContact SD-CD1 4.22Å; M474-P486 HydrophobicContact CG-CG 4.27Å; M474-Y547 HydrophobicContact CE-CE1 3.9Å; M474-F548 HydrophobicContact CE-CD1 4.46Å; M474-F548 HydrophobicContact CE-CE1 4.18Å; M474-L551 HydrophobicContact CB-CD2 4.32Å; M474-L551 HydrophobicContact CE-CD1 3.55Å; M474-L551 HydrophobicContact CE-CD2 3.95Å; M474-L551 HydrophobicContact CE-CG 4.41Å; M474-L555 HydrophobicContact CE-CD1 4.05Å; M474-L555 HydrophobicContact SD-CD1 4.44Å; M474-V594 HydrophobicContact CE-CG1 4.13Å; M474-V594 HydrophobicContact SD-CB 4.29Å; M474-V594 HydrophobicContact SD-CG1 4.16Å; M474-V594 HydrophobicContact SD-CG2 4.09Å
475	L	83.8	Confident	75.6	Confident	40 Å²	40	62.3 Å²	62.3	21%	0.209	34%	0.337	C	S	.	.	H	α-helix	trans	-69.8	-39.7	-178.7	-70.5	168.9	0	0	0	111.4	D473 K479 P588 P590 V591	D473-L475 VanDerWaalsContact C-N 3.33Å; D473-L475 PolarHBondContact O-N 3.41Å; D473-L475 WeakPolarHBondContact OD2-CB 3.27Å; D473-L475 PolarHBondContact OD2-N 3.01Å; L475-K479 WeakPolarHBondContact O-CB 3.5Å; L475-K479 WeakPolarHBondContact O-CD 3.47Å; L475-K479 WeakPolarHBondContact O-CG 3.25Å; L475-K479 PolarHBondContact O-N 2.92Å; L475-K479 VanDerWaalsContact O-N 3.16Å; L475-P588 HydrophobicContact CD1-CB 4.24Å; L475-P588 HydrophobicContact CD1-CG 4.03Å; L475-P588 HydrophobicContact CD2-CB 4.05Å; L475-P590 HydrophobicContact CD2-CB 4.01Å; L475-P590 HydrophobicContact CD2-CG 3.97Å; L475-V591 HydrophobicContact CD1-CG2 4.48Å; L475-V591 HydrophobicContact CD2-CG2 3.99Å; L475-V591 HydrophobicContact CG-CG2 4.29Å
476	S	82.6	Confident	77.7	Confident	65 Å²	65	54.4 Å²	54.4	46%	0.455	30%	0.3	S	S	.	.	H	α-helix	trans	-62.7	-43.3	169.9	-71.5	0	0	0	0	112	D473 A480	D473-S476 PolarHBondContact O-N 2.91Å; D473-S476 PolarHBondContact OD2-N 2.96Å; D473-S476 PolarHBondContact OD2-OG 2.96Å; S476-A480 WeakPolarHBondContact O-CB 3.45Å; S476-A480 PolarHBondContact O-N 2.86Å; S476-A480 VanDerWaalsContact O-N 3.09Å
477	F	80.8	Confident	79.5	Confident	9 Å²	9	48.9 Å²	48.9	4%	0.039	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-52.1	176.9	178.6	-93.1	0	0	0	112.3	L469 D473 M474 K479 A480 S481 P486 Y487	L469-F477 HydrophobicContact CD1-CD1 4.46Å; L469-F477 HydrophobicContact CD1-CD2 4.16Å; L469-F477 HydrophobicContact CD1-CE1 4.14Å; L469-F477 HydrophobicContact CD1-CE2 3.81Å; L469-F477 HydrophobicContact CD1-CG 4.49Å; L469-F477 HydrophobicContact CD1-CZ 3.82Å; D473-F477 PolarHBondContact O-N 3.43Å; M474-F477 PolarHBondContact O-N 2.95Å; F477-K479 VanDerWaalsContact C-N 3.29Å; F477-K479 PolarHBondContact O-N 3.49Å; F477-A480 PolarHBondContact O-N 3.34Å; F477-S481 PolarHBondContact O-N 2.92Å; F477-S481 PolarHBondContact O-OG 3.45Å; F477-P486 HydrophobicContact CD1-CB 4.32Å; F477-P486 HydrophobicContact CD1-CG 4.49Å; F477-P486 HydrophobicContact CE1-CB 4.12Å; F477-Y487 HydrophobicContact CE1-CD1 4.48Å; F477-Y487 HydrophobicContact CE2-CE1 4.48Å; F477-Y487 HydrophobicContact CZ-CD1 4.04Å; F477-Y487 AromaticContact CZ-CE1 3.77Å; F477-Y487 HydrophobicContact CZ-CE1 3.77Å
478	I	83.7	Confident	81.1	Confident	14 Å²	14	44 Å²	44	7%	0.072	25%	0.245	C	C	.	.	H	α-helix	trans	-58.1	-41.4	-179.6	-74	172.1	0	0	0	111.4	M474 A480 G482 Q483 P486 P590 V594	M474-I478 HydrophobicContact CG-CD1 3.77Å; M474-I478 HydrophobicContact CG-CG1 4.34Å; M474-I478 WeakPolarHBondContact O-CB 3.38Å; M474-I478 WeakPolarHBondContact O-CG1 3.34Å; M474-I478 PolarHBondContact O-N 3.39Å; M474-I478 HydrophobicContact SD-CD1 4.22Å; I478-A480 VanDerWaalsContact C-N 3.33Å; I478-A480 PolarHBondContact O-N 2.98Å; I478-G482 PolarHBondContact O-N 2.97Å; I478-Q483 WeakPolarHBondContact CG2-O 3.24Å; I478-P486 HydrophobicContact CD1-CG 4.43Å; I478-P486 HydrophobicContact CG1-CG 4.36Å; I478-P590 HydrophobicContact CD1-CB 3.96Å; I478-P590 HydrophobicContact CG2-CB 4.16Å; I478-V594 HydrophobicContact CD1-CG2 4.22Å
479	K	80.5	Confident	82.1	Confident	169 Å²	169	37 Å²	37	74%	0.735	22%	0.215	S	C	*	.	H	α-helix	trans	-68.1	-29.3	176.7	-72.2	171	-175.9	176.3	0	113.5	L475 F477	L475-K479 WeakPolarHBondContact O-CB 3.5Å; L475-K479 WeakPolarHBondContact O-CD 3.47Å; L475-K479 WeakPolarHBondContact O-CG 3.25Å; L475-K479 PolarHBondContact O-N 2.92Å; L475-K479 VanDerWaalsContact O-N 3.16Å; F477-K479 VanDerWaalsContact C-N 3.29Å; F477-K479 PolarHBondContact O-N 3.49Å
480	A	75.9	Confident	82.8	Confident	55 Å²	55	40.3 Å²	40.3	46%	0.455	23%	0.23	S	C	.	.	H	α-helix	trans	-86.9	-32.7	-179.4	0	0	0	0	0	113.3	S476 F477 I478	S476-A480 WeakPolarHBondContact O-CB 3.45Å; S476-A480 PolarHBondContact O-N 2.86Å; S476-A480 VanDerWaalsContact O-N 3.09Å; F477-A480 PolarHBondContact O-N 3.34Å; I478-A480 VanDerWaalsContact C-N 3.33Å; I478-A480 PolarHBondContact O-N 2.98Å
481	S	76.2	Confident	83.2	Confident	26 Å²	26	40.4 Å²	40.4	18%	0.182	23%	0.231	C	C	.	.	H	α-helix	trans	-89.1	-21.9	179.4	68.5	0	0	0	0	113.9	F477 Q483	F477-S481 PolarHBondContact O-N 2.92Å; F477-S481 PolarHBondContact O-OG 3.45Å; S481-Q483 PolarHBondContact O-N 2.86Å; S481-Q483 PolarHBondContact OG-N 3.2Å
482	G	73.6	Confident	83.8	Confident	65 Å²	65	37.4 Å²	37.4	67%	0.67	21%	0.21	S	C	*	.			trans	74.5	-4.1	-172.1	0	0	0	0	0	114.3	I478 R484	I478-G482 PolarHBondContact O-N 2.97Å; G482-R484 PolarHBondContact O-N 3.14Å
483	Q	79.1	Confident	84.5	Confident	65 Å²	65	36.8 Å²	36.8	30%	0.304	20%	0.204	S	C	.	.			trans	-79.1	119.7	-179.6	-60.9	179.4	-34.6	0	0	110.5	I478 S481 I485	I478-Q483 WeakPolarHBondContact CG2-O 3.24Å; S481-Q483 PolarHBondContact O-N 2.86Å; S481-Q483 PolarHBondContact OG-N 3.2Å; Q483-I485 WeakPolarHBondContact CB-O 3.49Å; Q483-I485 PolarHBondContact O-N 2.74Å
484	R	82.6	Confident	84.9	Confident	92 Å²	92	37.4 Å²	37.4	35%	0.347	20%	0.204	S	C	.	.	S	Bend	trans	-61.2	-24.1	177.2	-71	-77	-154.9	159.6	5.6	113.1	G482 E589 E665 P667	G482-R484 PolarHBondContact O-N 3.14Å; R484-E589 IonicContact CZ-OE1 3.8Å; R484-E589 IonicContact NH1-OE1 3.66Å; R484-E589 PolarHBondContact NH1-OE1 2.85Å; R484-E589 IonicContact NH2-OE1 2.98Å; R484-E665 IonicContact CZ-OE2 3.77Å; R484-E665 PolarHBondContact NH1-O 3.43Å; R484-E665 IonicContact NH2-OE2 3.94Å; R484-E665 PolarHBondContact NH2-OE2 3.09Å; R484-P667 VanDerWaalsContact CB-CD 3.49Å; R484-P667 HydrophobicContact CB-CG 3.96Å
485	I	87.6	Confident	85	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.015	20%	0.203	C	C	.	.	S	Bend	trans	-129.5	138.9	171.3	-64.6	-178	0	0	0	108.2	Q483 Y487 V489 E490 V593 V594 Y597 P667	Q483-I485 WeakPolarHBondContact CB-O 3.49Å; Q483-I485 PolarHBondContact O-N 2.74Å; I485-Y487 PolarHBondContact O-N 3.49Å; I485-V489 HydrophobicContact CG2-CB 4.15Å; I485-V489 HydrophobicContact CG2-CG1 4.25Å; I485-E490 HydrophobicContact CG2-CB 4.24Å; I485-V593 HydrophobicContact CG1-CG1 4.17Å; I485-V594 HydrophobicContact CG1-CG2 4.44Å; I485-Y597 HydrophobicContact CD1-CD1 3.98Å; I485-Y597 HydrophobicContact CD1-CD2 3.37Å; I485-Y597 HydrophobicContact CD1-CE1 4.41Å; I485-Y597 HydrophobicContact CD1-CE2 3.88Å; I485-Y597 HydrophobicContact CD1-CG 3.42Å; I485-Y597 VanDerWaalsContact CD1-CG 3.42Å; I485-P667 HydrophobicContact CD1-CB 3.74Å; I485-P667 HydrophobicContact CD1-CG 3.96Å; I485-P667 HydrophobicContact CG1-CB 4.39Å; I485-P667 HydrophobicContact CG1-CG 4.05Å
486	P	89.4	Confident	85.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.			trans	-64.4	125.3	174.7	-20.2	32.4	0	0	0	111.7	M474 F477 I478 V488 V489 E490 Y547	M474-P486 HydrophobicContact CG-CG 4.27Å; F477-P486 HydrophobicContact CD1-CB 4.32Å; F477-P486 HydrophobicContact CD1-CG 4.49Å; F477-P486 HydrophobicContact CE1-CB 4.12Å; I478-P486 HydrophobicContact CD1-CG 4.43Å; I478-P486 HydrophobicContact CG1-CG 4.36Å; P486-V488 HydrophobicContact CB-CG1 4.31Å; P486-V488 PolarHBondContact O-N 2.96Å; P486-V489 HydrophobicContact CB-CG2 4.35Å; P486-V489 WeakPolarHBondContact O-CA 3.41Å; P486-V489 WeakPolarHBondContact O-CB 3.41Å; P486-V489 PolarHBondContact O-N 2.97Å; P486-E490 PolarHBondContact O-N 3.35Å; P486-Y547 HydrophobicContact CB-CE1 4.48Å; P486-Y547 HydrophobicContact CG-CE1 4.39Å; P486-Y547 VanDerWaalsContact CG-OH 3.3Å; P486-Y547 WeakPolarHBondContact CG-OH 3.48Å
487	Y	85.8	Confident	85.7	Confident	37 Å²	37	32.8 Å²	32.8	15%	0.145	17%	0.174	C	C	.	.	H	α-helix	trans	-53	-26.3	-177.3	70	-70.9	0	0	0	116	L469 F477 I485 E490 S491 F523 G526	L469-Y487 HydrophobicContact CD1-CE1 3.93Å; L469-Y487 HydrophobicContact CD2-CE1 4Å; F477-Y487 HydrophobicContact CE1-CD1 4.48Å; F477-Y487 HydrophobicContact CE2-CE1 4.48Å; F477-Y487 HydrophobicContact CZ-CD1 4.04Å; F477-Y487 AromaticContact CZ-CE1 3.77Å; F477-Y487 HydrophobicContact CZ-CE1 3.77Å; I485-Y487 PolarHBondContact O-N 3.49Å; Y487-E490 PolarHBondContact O-N 3.27Å; Y487-S491 VanDerWaalsContact O-CB 3.25Å; Y487-S491 WeakPolarHBondContact O-CB 3.27Å; Y487-S491 PolarHBondContact O-N 2.97Å; Y487-F523 HydrophobicContact CD2-CD1 4.15Å; Y487-F523 HydrophobicContact CD2-CE1 4.42Å; Y487-F523 AromaticContact CE2-CD1 3.81Å; Y487-F523 HydrophobicContact CE2-CD1 3.81Å; Y487-F523 HydrophobicContact CE2-CE1 4.5Å; Y487-F523 PolarHBondContact OH-O 3.19Å; Y487-G526 WeakPolarHBondContact OH-CA 3.31Å
488	V	89.6	Confident	85.8	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67.6	-35.2	172.3	60.1	0	0	0	0	112.7	L469 F470 P486 C492 F523 V543 Y547	L469-V488 HydrophobicContact CD1-CG1 4.08Å; L469-V488 HydrophobicContact CD2-CB 4.06Å; L469-V488 HydrophobicContact CD2-CG1 3.97Å; L469-V488 HydrophobicContact CG-CG1 4.12Å; F470-V488 HydrophobicContact CZ-CG2 4.06Å; P486-V488 HydrophobicContact CB-CG1 4.31Å; P486-V488 PolarHBondContact O-N 2.96Å; V488-C492 VanDerWaalsContact O-CB 3.25Å; V488-C492 WeakPolarHBondContact O-CB 3.25Å; V488-C492 PolarHBondContact O-N 3.49Å; V488-C492 PolarHBondContact O-SG 3.49Å; V488-F523 HydrophobicContact CB-CD1 4.11Å; V488-F523 HydrophobicContact CB-CE1 4.37Å; V488-F523 HydrophobicContact CB-CG 4.2Å; V488-F523 HydrophobicContact CG2-CB 4.41Å; V488-F523 HydrophobicContact CG2-CD1 4.21Å; V488-F523 HydrophobicContact CG2-CD2 3.76Å; V488-F523 HydrophobicContact CG2-CE1 4.39Å; V488-F523 HydrophobicContact CG2-CE2 3.98Å; V488-F523 HydrophobicContact CG2-CG 3.89Å; V488-F523 HydrophobicContact CG2-CZ 4.29Å; V488-V543 HydrophobicContact CG2-CG1 4.16Å; V488-Y547 HydrophobicContact CG1-CD1 4.37Å; V488-Y547 HydrophobicContact CG1-CD2 3.52Å; V488-Y547 HydrophobicContact CG1-CE1 4.46Å; V488-Y547 HydrophobicContact CG1-CE2 3.64Å; V488-Y547 HydrophobicContact CG1-CG 3.92Å
489	V	91.1	Very high	85.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-70	-49.7	172.6	178.1	0	0	0	0	109.2	I485 P486 V493 L544 Y547 F548	I485-V489 HydrophobicContact CG2-CB 4.15Å; I485-V489 HydrophobicContact CG2-CG1 4.25Å; P486-V489 HydrophobicContact CB-CG2 4.35Å; P486-V489 WeakPolarHBondContact O-CA 3.41Å; P486-V489 WeakPolarHBondContact O-CB 3.41Å; P486-V489 PolarHBondContact O-N 2.97Å; V489-V493 HydrophobicContact CG1-CG2 4.33Å; V489-V493 VanDerWaalsContact O-CB 3.26Å; V489-V493 WeakPolarHBondContact O-CB 3.37Å; V489-V493 VanDerWaalsContact O-CG2 3.22Å; V489-V493 WeakPolarHBondContact O-CG2 3.44Å; V489-V493 PolarHBondContact O-N 3.41Å; V489-L544 HydrophobicContact CB-CD1 4.34Å; V489-L544 HydrophobicContact CG1-CD1 4.16Å; V489-L544 HydrophobicContact CG2-CD1 4.37Å; V489-Y547 HydrophobicContact CG2-CD1 3.48Å; V489-Y547 VanDerWaalsContact CG2-CD1 3.48Å; V489-Y547 HydrophobicContact CG2-CE1 3.41Å; V489-Y547 VanDerWaalsContact CG2-CE1 3.41Å; V489-Y547 HydrophobicContact CG2-CG 4.45Å; V489-F548 HydrophobicContact CG1-CE2 4.44Å; V489-F548 HydrophobicContact CG1-CZ 3.99Å; V489-F548 HydrophobicContact CG2-CE1 4.36Å; V489-F548 HydrophobicContact CG2-CE2 4.16Å; V489-F548 HydrophobicContact CG2-CZ 3.69Å
490	E	89.2	Confident	86.1	Confident	77 Å²	77	28.6 Å²	28.6	36%	0.36	16%	0.155	S	C	.	.	H	α-helix	trans	-60.7	-51.7	-178	-174	166.9	-125.9	0	0	112.5	I485 P486 Y487 V493 R494	I485-E490 HydrophobicContact CG2-CB 4.24Å; P486-E490 PolarHBondContact O-N 3.35Å; Y487-E490 PolarHBondContact O-N 3.27Å; E490-V493 PolarHBondContact O-N 3.01Å; E490-R494 VanDerWaalsContact O-CB 3.25Å; E490-R494 WeakPolarHBondContact O-CB 3.35Å; E490-R494 PolarHBondContact O-N 3.12Å
491	S	89.4	Confident	86.8	Confident	6 Å²	6	26.5 Å²	26.5	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-67.3	-39.9	-179.1	-165.2	0	0	0	0	112.4	Y487 R494 F495 D528	Y487-S491 VanDerWaalsContact O-CB 3.25Å; Y487-S491 WeakPolarHBondContact O-CB 3.27Å; Y487-S491 PolarHBondContact O-N 2.97Å; S491-R494 PolarHBondContact O-N 3Å; S491-F495 WeakPolarHBondContact O-CB 3.39Å; S491-F495 PolarHBondContact O-N 3.07Å; S491-D528 WeakPolarHBondContact CB-OD1 3.4Å; S491-D528 VanDerWaalsContact OG-CG 3.25Å; S491-D528 PolarHBondContact OG-OD1 3.38Å; S491-D528 PolarHBondContact OG-OD2 3.46Å
492	C	92.2	Very high	87.3	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-66.2	-42.1	174.2	-67.6	0	0	0	0	112	V488 F495 I496 L530 V540 L544	V488-C492 VanDerWaalsContact O-CB 3.25Å; V488-C492 WeakPolarHBondContact O-CB 3.25Å; V488-C492 PolarHBondContact O-N 3.49Å; V488-C492 PolarHBondContact O-SG 3.49Å; C492-F495 PolarHBondContact O-N 3.07Å; C492-I496 WeakPolarHBondContact O-CB 3.42Å; C492-I496 WeakPolarHBondContact O-CD1 3.46Å; C492-I496 WeakPolarHBondContact O-CG1 3.47Å; C492-I496 PolarHBondContact O-N 3.31Å; C492-L530 HydrophobicContact CB-CD1 4.47Å; C492-V540 HydrophobicContact CB-CG1 4.05Å; C492-L544 HydrophobicContact CB-CB 3.97Å; C492-L544 HydrophobicContact CB-CD1 4.14Å; C492-L544 HydrophobicContact CB-CD2 4.37Å; C492-L544 HydrophobicContact CB-CG 4.39Å
493	V	93.1	Very high	88	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.1	-45.8	175.6	165	0	0	0	0	110.6	V489 E490 F495 I496 N497 L544 Y597 F601 Y669	V489-V493 HydrophobicContact CG1-CG2 4.33Å; V489-V493 VanDerWaalsContact O-CB 3.26Å; V489-V493 WeakPolarHBondContact O-CB 3.37Å; V489-V493 VanDerWaalsContact O-CG2 3.22Å; V489-V493 WeakPolarHBondContact O-CG2 3.44Å; V489-V493 PolarHBondContact O-N 3.41Å; E490-V493 PolarHBondContact O-N 3.01Å; V493-F495 PolarHBondContact O-N 3.09Å; V493-I496 PolarHBondContact O-N 3.46Å; V493-N497 VanDerWaalsContact O-CB 3.24Å; V493-N497 WeakPolarHBondContact O-CB 3.22Å; V493-N497 PolarHBondContact O-N 2.94Å; V493-L544 HydrophobicContact CG2-CD2 3.88Å; V493-Y597 HydrophobicContact CB-CE1 3.89Å; V493-Y597 HydrophobicContact CG1-CE1 3.62Å; V493-Y597 HydrophobicContact CG2-CE1 4.04Å; V493-F601 HydrophobicContact CB-CD2 4.49Å; V493-F601 HydrophobicContact CB-CG 4.5Å; V493-F601 HydrophobicContact CG1-CB 4.13Å; V493-F601 HydrophobicContact CG1-CD1 4.39Å; V493-F601 HydrophobicContact CG1-CD2 3.63Å; V493-F601 HydrophobicContact CG1-CE2 4.07Å; V493-F601 HydrophobicContact CG1-CG 3.79Å; V493-F601 HydrophobicContact CG2-CD1 3.77Å; V493-F601 HydrophobicContact CG2-CD2 4.42Å; V493-F601 HydrophobicContact CG2-CE1 3.94Å; V493-F601 HydrophobicContact CG2-CG 4Å; V493-F601 HydrophobicContact CG2-CZ 4.32Å; V493-Y669 HydrophobicContact CG1-CD2 3.83Å; V493-Y669 HydrophobicContact CG1-CE2 3.61Å
494	R	89.4	Confident	88.5	Confident	50 Å²	50	28.1 Å²	28.1	19%	0.189	12%	0.124	C	C	.	.	H	α-helix	trans	-57.4	-47.1	176	-176.3	-178.5	64.5	135.7	2.5	112	E490 S491 N497 L498 D528 M673 E676	E490-R494 VanDerWaalsContact O-CB 3.25Å; E490-R494 WeakPolarHBondContact O-CB 3.35Å; E490-R494 PolarHBondContact O-N 3.12Å; S491-R494 PolarHBondContact O-N 3Å; R494-N497 PolarHBondContact O-N 3.32Å; R494-L498 HydrophobicContact CG-CD1 3.94Å; R494-L498 WeakPolarHBondContact O-CB 3.45Å; R494-L498 VanDerWaalsContact O-CG 3.28Å; R494-L498 WeakPolarHBondContact O-CG 3.44Å; R494-L498 PolarHBondContact O-N 3Å; R494-D528 IonicContact NH2-OD2 2.61Å; R494-D528 PolarHBondContact NH2-OD2 3.03Å; R494-M673 HydrophobicContact CB-SD 3.99Å; R494-M673 HydrophobicContact CG-SD 3.89Å; R494-E676 IonicContact NH1-OE2 3.22Å; R494-E676 PolarHBondContact NH1-OE2 3.18Å
495	F	89.1	Confident	88.9	Confident	12 Å²	12	23.8 Å²	23.8	5%	0.053	11%	0.107	C	C	.	.	H	α-helix	trans	-64.6	-42.4	178.9	-168.5	-88.7	0	0	0	112.7	S491 C492 V493 Y499 L530 M537 V540	S491-F495 WeakPolarHBondContact O-CB 3.39Å; S491-F495 PolarHBondContact O-N 3.07Å; C492-F495 PolarHBondContact O-N 3.07Å; V493-F495 PolarHBondContact O-N 3.09Å; F495-Y499 HydrophobicContact CD1-CD2 4.44Å; F495-Y499 HydrophobicContact CD2-CD2 4.02Å; F495-Y499 HydrophobicContact CD2-CE2 4.13Å; F495-Y499 HydrophobicContact CE1-CD2 4.39Å; F495-Y499 AromaticContact CE2-CD2 3.96Å; F495-Y499 HydrophobicContact CE2-CD2 3.96Å; F495-Y499 HydrophobicContact CE2-CE2 4.15Å; F495-Y499 HydrophobicContact CG-CD2 4.27Å; F495-Y499 HydrophobicContact CZ-CD2 4.15Å; F495-Y499 PolarHBondContact O-N 3.02Å; F495-Y499 VanDerWaalsContact O-N 3.07Å; F495-L530 HydrophobicContact CB-CD1 4.04Å; F495-L530 HydrophobicContact CD2-CB 4.01Å; F495-L530 HydrophobicContact CG-CB 4.47Å; F495-L530 HydrophobicContact CG-CD1 4.34Å; F495-M537 HydrophobicContact CD1-CE 3.8Å; F495-M537 HydrophobicContact CD1-SD 4.39Å; F495-M537 HydrophobicContact CE1-CE 3.61Å; F495-V540 HydrophobicContact CB-CG1 4.4Å; F495-V540 HydrophobicContact CD1-CB 4.21Å; F495-V540 HydrophobicContact CD1-CG1 3.98Å; F495-V540 HydrophobicContact CD1-CG2 3.96Å; F495-V540 HydrophobicContact CE1-CG2 3.96Å; F495-V540 HydrophobicContact CG-CG1 4.48Å
496	I	91.3	Very high	89.2	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-72.4	-30	177.4	-60.5	166.5	0	0	0	111.2	C492 V493 G500 L501 I506 F507 M537 V540 A541 L544 F601	C492-I496 WeakPolarHBondContact O-CB 3.42Å; C492-I496 WeakPolarHBondContact O-CD1 3.46Å; C492-I496 WeakPolarHBondContact O-CG1 3.47Å; C492-I496 PolarHBondContact O-N 3.31Å; V493-I496 PolarHBondContact O-N 3.46Å; I496-G500 CarbonylContact O-C 3.59Å; I496-G500 VanDerWaalsContact O-C 3.3Å; I496-G500 WeakPolarHBondContact O-CA 3.4Å; I496-G500 PolarHBondContact O-N 2.85Å; I496-L501 PolarHBondContact O-N 3.45Å; I496-L501 VanDerWaalsContact O-N 3.09Å; I496-I506 HydrophobicContact CG2-CD1 4.14Å; I496-I506 HydrophobicContact CG2-CG1 4.08Å; I496-F507 HydrophobicContact CD1-CE1 3.82Å; I496-F507 HydrophobicContact CD1-CZ 3.6Å; I496-F507 HydrophobicContact CG2-CZ 4.35Å; I496-M537 HydrophobicContact CB-SD 4.32Å; I496-M537 HydrophobicContact CG1-SD 3.8Å; I496-M537 HydrophobicContact CG2-SD 4.37Å; I496-V540 HydrophobicContact CD1-CG1 4.17Å; I496-V540 HydrophobicContact CG1-CG1 4.04Å; I496-A541 HydrophobicContact CD1-CB 4.25Å; I496-L544 HydrophobicContact CD1-CD2 4.21Å; I496-F601 HydrophobicContact CB-CE2 4.29Å; I496-F601 HydrophobicContact CB-CZ 3.97Å; I496-F601 HydrophobicContact CD1-CZ 4.4Å; I496-F601 HydrophobicContact CG2-CE2 4.11Å; I496-F601 HydrophobicContact CG2-CZ 3.73Å
497	N	89.4	Confident	89.4	Confident	9 Å²	9	23.7 Å²	23.7	5%	0.048	11%	0.107	C	C	.	.	H	α-helix	trans	-66.2	-49.4	173	-160.8	20.5	0	0	0	111.2	V493 R494 L501 Y669 E670 K671 M673	V493-N497 VanDerWaalsContact O-CB 3.24Å; V493-N497 WeakPolarHBondContact O-CB 3.22Å; V493-N497 PolarHBondContact O-N 2.94Å; R494-N497 PolarHBondContact O-N 3.32Å; N497-L501 WeakPolarHBondContact O-CD1 3.29Å; N497-L501 WeakPolarHBondContact O-CG 3.1Å; N497-Y669 PolarHBondContact ND2-OH 3.39Å; N497-Y669 PolarHBondContact OD1-OH 2.8Å; N497-E670 PolarHBondContact ND2-O 2.97Å; N497-K671 PolarHBondContact OD1-O 3.29Å; N497-M673 HydrophobicContact CB-SD 4Å; N497-M673 VanDerWaalsContact ND2-CG 3.35Å; N497-M673 WeakPolarHBondContact ND2-CG 3.46Å; N497-M673 PolarHBondContact ND2-SD 3.47Å
498	L	84.5	Confident	89.8	Confident	34 Å²	34	27.7 Å²	27.7	18%	0.178	12%	0.121	C	C	.	.	H	α-helix	trans	-67.7	-36.4	-177.7	-71.2	167.8	0	0	0	113.4	R494 M673 L675	R494-L498 HydrophobicContact CG-CD1 3.94Å; R494-L498 WeakPolarHBondContact O-CB 3.45Å; R494-L498 VanDerWaalsContact O-CG 3.28Å; R494-L498 WeakPolarHBondContact O-CG 3.44Å; R494-L498 PolarHBondContact O-N 3Å; L498-M673 HydrophobicContact CD2-CB 4.04Å; L498-M673 WeakPolarHBondContact CD2-O 3.38Å; L498-M673 HydrophobicContact CG-CB 4.37Å; L498-L675 HydrophobicContact CD1-CD2 4.23Å
499	Y	84.4	Confident	89.8	Confident	69 Å²	69	30.2 Å²	30.2	27%	0.271	14%	0.137	S	C	.	.	H	α-helix	trans	-131.4	-8.4	-169.3	-46.6	-51.3	0	0	0	115.2	F495 R533	F495-Y499 HydrophobicContact CD1-CD2 4.44Å; F495-Y499 HydrophobicContact CD2-CD2 4.02Å; F495-Y499 HydrophobicContact CD2-CE2 4.13Å; F495-Y499 HydrophobicContact CE1-CD2 4.39Å; F495-Y499 AromaticContact CE2-CD2 3.96Å; F495-Y499 HydrophobicContact CE2-CD2 3.96Å; F495-Y499 HydrophobicContact CE2-CE2 4.15Å; F495-Y499 HydrophobicContact CG-CD2 4.27Å; F495-Y499 HydrophobicContact CZ-CD2 4.15Å; F495-Y499 PolarHBondContact O-N 3.02Å; F495-Y499 VanDerWaalsContact O-N 3.07Å; Y499-R533 HydrophobicContact CE2-CG 4.03Å; Y499-R533 PolarHBondContact OH-NE 3.3Å; Y499-R533 PolarHBondContact OH-NH2 2.96Å
500	G	86.4	Confident	89.7	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-11.9	-166.8	0	0	0	0	0	116.4	I496 H502 H503	I496-G500 CarbonylContact O-C 3.59Å; I496-G500 VanDerWaalsContact O-C 3.3Å; I496-G500 WeakPolarHBondContact O-CA 3.4Å; I496-G500 PolarHBondContact O-N 2.85Å; G500-H502 PolarHBondContact O-N 2.86Å; G500-H502 VanDerWaalsContact O-N 3.12Å; G500-H503 VanDerWaalsContact O-CB 3.3Å; G500-H503 WeakPolarHBondContact O-CB 3.33Å; G500-H503 PolarHBondContact O-N 2.91Å
501	L	89.9	Confident	89.6	Confident	11 Å²	11	31.9 Å²	31.9	6%	0.058	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-32.7	-176.7	-67.6	175.4	0	0	0	113.7	I496 N497 V605 Y608 N612	I496-L501 PolarHBondContact O-N 3.45Å; I496-L501 VanDerWaalsContact O-N 3.09Å; N497-L501 WeakPolarHBondContact O-CD1 3.29Å; N497-L501 WeakPolarHBondContact O-CG 3.1Å; L501-V605 HydrophobicContact CD2-CG2 4.04Å; L501-Y608 HydrophobicContact CB-CD2 4.12Å; L501-Y608 HydrophobicContact CB-CE2 4.27Å; L501-Y608 HydrophobicContact CB-CG 4.29Å; L501-Y608 HydrophobicContact CD1-CD2 4.43Å; L501-Y608 HydrophobicContact CD1-CE2 3.81Å; L501-Y608 HydrophobicContact CD2-CD2 4.31Å; L501-Y608 HydrophobicContact CD2-CE2 4.31Å; L501-Y608 HydrophobicContact CG-CE2 4.36Å; L501-Y608 WeakPolarHBondContact O-CB 3.31Å; L501-N612 WeakPolarHBondContact O-CB 3.43Å; L501-N612 PolarHBondContact O-ND2 3.46Å
502	H	87.3	Confident	89.7	Confident	29 Å²	29	34 Å²	34	13%	0.134	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-10.2	179.1	-52.4	104.6	0	0	0	113.5	R331 Q334 G500 E504 Y608 E611	R331-H502 PolarHBondContact NE-CD2 3.21Å; R331-H502 PolarHBondContact NE-NE2 3.26Å; R331-H502 PolarHBondContact NH1-NE2 2.75Å; R331-H502 PolarHBondContact NH2-NE2 2.89Å; Q334-H502 PolarHBondContact NE2-O 3.11Å; Q334-H502 PolarHBondContact OE1-O 3.32Å; G500-H502 PolarHBondContact O-N 2.86Å; G500-H502 VanDerWaalsContact O-N 3.12Å; H502-E504 PolarHBondContact O-N 3.29Å; H502-Y608 AromaticContact CD2-CD1 3.66Å; H502-Y608 AromaticContact NE2-CD1 3.43Å; H502-Y608 WeakPolarHBondContact NE2-CD1 3.33Å; H502-Y608 AromaticContact NE2-CE1 3.4Å; H502-Y608 WeakPolarHBondContact NE2-CE1 3.45Å; H502-E611 IonicContact CD2-OE2 3.39Å; H502-E611 PolarHBondContact CD2-OE2 3.49Å; H502-E611 VanDerWaalsContact CD2-OE2 3.31Å; H502-E611 IonicContact NE2-OE2 3.76Å
503	H	88.3	Confident	89.6	Confident	63 Å²	63	39.9 Å²	39.9	29%	0.292	20%	0.198	S	C	.	.			trans	-65.2	121.3	-170.8	-169.1	-87.5	0	0	0	112.1	G500 G505 I506 M537 D538 N612	G500-H503 VanDerWaalsContact O-CB 3.3Å; G500-H503 WeakPolarHBondContact O-CB 3.33Å; G500-H503 PolarHBondContact O-N 2.91Å; H503-G505 PolarHBondContact O-N 3.49Å; H503-I506 HydrophobicContact CB-CB 4.38Å; H503-I506 HydrophobicContact CB-CD1 4.47Å; H503-I506 WeakPolarHBondContact O-CB 3.41Å; H503-I506 PolarHBondContact O-N 3.06Å; H503-M537 HydrophobicContact CB-CG 4.02Å; H503-D538 IonicContact CE1-OD1 3Å; H503-D538 IonicContact CE1-OD2 3.44Å; H503-D538 PolarHBondContact CE1-OD2 3.04Å; H503-D538 IonicContact ND1-OD1 3.71Å; H503-N612 WeakPolarHBondContact O-CB 3.5Å
504	E	89.3	Confident	89.5	Confident	99 Å²	99	46.6 Å²	46.6	46%	0.463	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	126.3	-173.7	-159.4	-153.9	126.1	0	0	111.6	H502 I506 R508 M613	H502-E504 PolarHBondContact O-N 3.29Å; E504-I506 VanDerWaalsContact C-N 3.27Å; E504-I506 PolarHBondContact O-N 3.02Å; E504-R508 IonicContact OE1-NH2 2.65Å; E504-R508 PolarHBondContact OE1-NH2 3.02Å; E504-M613 HydrophobicContact CG-CB 4.15Å; E504-M613 HydrophobicContact CG-CG 3.77Å
505	G	90.4	Very high	89.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	23.5	178.2	0	0	0	0	0	114	H503 F507 R508 V509 N612	H503-G505 PolarHBondContact O-N 3.49Å; G505-F507 PolarHBondContact O-N 2.92Å; G505-R508 WeakPolarHBondContact O-CA 3.31Å; G505-R508 VanDerWaalsContact O-CB 3.28Å; G505-R508 WeakPolarHBondContact O-CB 3.47Å; G505-R508 PolarHBondContact O-N 3.37Å; G505-V509 PolarHBondContact O-N 3.5Å; G505-N612 PolarHBondContact N-O 2.92Å
506	I	92.9	Very high	89.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.5	132.9	172.1	-173.3	66.9	0	0	0	111.1	I496 H503 E504 R508 M537 A541 V605 M614	I496-I506 HydrophobicContact CG2-CD1 4.14Å; I496-I506 HydrophobicContact CG2-CG1 4.08Å; H503-I506 HydrophobicContact CB-CB 4.38Å; H503-I506 HydrophobicContact CB-CD1 4.47Å; H503-I506 WeakPolarHBondContact O-CB 3.41Å; H503-I506 PolarHBondContact O-N 3.06Å; E504-I506 VanDerWaalsContact C-N 3.27Å; E504-I506 PolarHBondContact O-N 3.02Å; I506-R508 PolarHBondContact O-N 3.28Å; I506-M537 HydrophobicContact CD1-CG 3.56Å; I506-M537 HydrophobicContact CD1-SD 3.92Å; I506-A541 HydrophobicContact CD1-CB 3.77Å; I506-V605 HydrophobicContact CG2-CG1 3.79Å; I506-M614 HydrophobicContact CG2-CB 4.24Å; I506-M614 HydrophobicContact CG2-CG 3.78Å; I506-M614 WeakPolarHBondContact O-CE 3.29Å; I506-M614 VanDerWaalsContact O-CG 3.3Å; I506-M614 WeakPolarHBondContact O-CG 3.34Å
507	F	94.8	Very high	89.4	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.009	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	-19.3	-169.9	-51.7	-74	0	0	0	117.5	I496 G505 A541 L544 K545 F601 L602 V605 L619 C622 F623	I496-F507 HydrophobicContact CD1-CE1 3.82Å; I496-F507 HydrophobicContact CD1-CZ 3.6Å; I496-F507 HydrophobicContact CG2-CZ 4.35Å; G505-F507 PolarHBondContact O-N 2.92Å; F507-A541 HydrophobicContact CD1-CB 3.6Å; F507-A541 HydrophobicContact CE1-CB 3.73Å; F507-A541 HydrophobicContact CG-CB 4.28Å; F507-L544 HydrophobicContact CE1-CB 4.46Å; F507-L544 HydrophobicContact CE1-CD2 3.98Å; F507-L544 HydrophobicContact CZ-CD2 4.1Å; F507-K545 HydrophobicContact CB-CD 4.22Å; F507-K545 HydrophobicContact CD1-CD 4.16Å; F507-K545 HydrophobicContact CD1-CG 4.09Å; F507-K545 PolarHBondContact O-NZ 3.39Å; F507-F601 HydrophobicContact CE2-CE1 4.06Å; F507-F601 HydrophobicContact CE2-CZ 4.1Å; F507-F601 AromaticContact CZ-CE1 3.65Å; F507-F601 HydrophobicContact CZ-CE1 3.65Å; F507-F601 AromaticContact CZ-CZ 3.78Å; F507-F601 HydrophobicContact CZ-CZ 3.78Å; F507-L602 HydrophobicContact CE2-CD2 4.39Å; F507-V605 HydrophobicContact CE2-CG2 4.49Å; F507-L619 HydrophobicContact CD2-CD2 3.85Å; F507-C622 HydrophobicContact CB-CB 4.19Å; F507-F623 HydrophobicContact CB-CE2 4.08Å; F507-F623 AromaticContact CD1-CE2 3.55Å; F507-F623 HydrophobicContact CD1-CE2 3.55Å; F507-F623 AromaticContact CD1-CZ 3.66Å; F507-F623 HydrophobicContact CD1-CZ 3.66Å; F507-F623 AromaticContact CD2-CE2 3.89Å; F507-F623 HydrophobicContact CD2-CE2 3.89Å; F507-F623 AromaticContact CE1-CE2 3.91Å; F507-F623 HydrophobicContact CE1-CE2 3.91Å; F507-F623 AromaticContact CE1-CZ 3.65Å; F507-F623 HydrophobicContact CE1-CZ 3.65Å; F507-F623 HydrophobicContact CE2-CE2 4.2Å; F507-F623 AromaticContact CG-CE2 3.57Å; F507-F623 HydrophobicContact CG-CE2 3.57Å; F507-F623 HydrophobicContact CG-CZ 4.16Å; F507-F623 HydrophobicContact CZ-CE2 4.21Å; F507-F623 HydrophobicContact CZ-CZ 4.11Å
508	R	93.2	Very high	89.4	Confident	120 Å²	120	53.4 Å²	53.4	45%	0.453	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-41.5	173.8	177	-171.9	67.8	172.2	-1.9	111.6	E504 G505 I506 M614	E504-R508 IonicContact OE1-NH2 2.65Å; E504-R508 PolarHBondContact OE1-NH2 3.02Å; G505-R508 WeakPolarHBondContact O-CA 3.31Å; G505-R508 VanDerWaalsContact O-CB 3.28Å; G505-R508 WeakPolarHBondContact O-CB 3.47Å; G505-R508 PolarHBondContact O-N 3.37Å; I506-R508 PolarHBondContact O-N 3.28Å; R508-M614 HydrophobicContact CB-CE 3.93Å; R508-M614 HydrophobicContact CB-SD 3.69Å
509	V	90.8	Very high	89.6	Confident	53 Å²	53	51.9 Å²	51.9	32%	0.321	26%	0.264	S	S	.	.	S	Bend	trans	-75.6	141.2	177.4	-176.8	0	0	0	0	109.7	G505 D538	G505-V509 PolarHBondContact O-N 3.5Å; V509-D538 VanDerWaalsContact CB-OD2 3.28Å; V509-D538 WeakPolarHBondContact CB-OD2 3.14Å; V509-D538 HydrophobicContact CG1-CB 4.45Å; V509-D538 WeakPolarHBondContact CG1-OD2 3.44Å
510	P	87.5	Confident	89.8	Confident	104 Å²	104	51.7 Å²	51.7	68%	0.675	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-91.6	117	178	33	-31.3	0	0	0	112
511	G	88.3	Confident	89.9	Confident	8 Å²	8	54.4 Å²	54.4	8%	0.082	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-65.3	169.1	173.8	0	0	0	0	0	115.1	Q513 D538	G511-Q513 PolarHBondContact O-N 3.41Å; G511-Q513 VanDerWaalsContact O-N 3.15Å; G511-Q513 PolarHBondContact O-NE2 3.49Å; G511-D538 VanDerWaalsContact CA-C 3.44Å; G511-D538 WeakPolarHBondContact CA-O 3.47Å; G511-D538 PolarHBondContact N-O 3.37Å
512	S	91.3	Very high	89.7	Confident	51 Å²	51	54.1 Å²	54.1	36%	0.357	28%	0.277	S	S	.	.			trans	-58.3	115.4	-178.3	175	0	0	0	0	111.1	M514 E515 V516 S539	S512-M514 PolarHBondContact O-N 3.07Å; S512-M514 VanDerWaalsContact O-N 3.14Å; S512-E515 PolarHBondContact O-N 2.93Å; S512-V516 WeakPolarHBondContact O-CG2 3.32Å; S512-V516 PolarHBondContact O-N 3.06Å; S512-S539 PolarHBondContact N-OG 3.42Å; S512-S539 VanDerWaalsContact N-OG 3.12Å
513	Q	90.8	Very high	89.7	Confident	123 Å²	123	52.7 Å²	52.7	58%	0.575	27%	0.27	S	S	*	.	H	α-helix	trans	-62.4	-24.9	-178.4	-62.9	-57.6	-76	0	0	112.5	G511 N517	G511-Q513 PolarHBondContact O-N 3.41Å; G511-Q513 VanDerWaalsContact O-N 3.15Å; G511-Q513 PolarHBondContact O-NE2 3.49Å; Q513-N517 PolarHBondContact O-N 3.31Å; Q513-N517 PolarHBondContact O-ND2 3.37Å
514	M	90.2	Very high	89.6	Confident	141 Å²	141	54.1 Å²	54.1	70%	0.695	28%	0.277	S	S	*	.	H	α-helix	trans	-66.7	-49.2	171.9	-172.6	63.1	71.4	0	0	110.9	S512 N517 V518	S512-M514 PolarHBondContact O-N 3.07Å; S512-M514 VanDerWaalsContact O-N 3.14Å; M514-N517 PolarHBondContact O-N 3.44Å; M514-V518 WeakPolarHBondContact O-CG2 3.35Å; M514-V518 PolarHBondContact O-N 3.22Å
515	E	89.3	Confident	89.3	Confident	72 Å²	72	55.8 Å²	55.8	34%	0.336	28%	0.279	S	S	.	.	H	α-helix	trans	-68.1	-40.2	-178.7	-67.4	165.8	-161.6	0	0	112.4	S512 N517 V518 L519 S539	S512-E515 PolarHBondContact O-N 2.93Å; E515-N517 VanDerWaalsContact C-N 3.26Å; E515-N517 PolarHBondContact O-N 2.66Å; E515-V518 PolarHBondContact O-N 3.49Å; E515-L519 WeakPolarHBondContact O-CB 3.22Å; E515-L519 WeakPolarHBondContact O-CG 3.26Å; E515-L519 PolarHBondContact O-N 3.31Å; E515-S539 WeakPolarHBondContact OE2-CB 3.47Å; E515-S539 PolarHBondContact OE2-OG 2.97Å
516	V	89.4	Confident	88.6	Confident	7 Å²	7	58.4 Å²	58.4	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-58.2	-39.6	174.8	173.3	0	0	0	0	111.2	S512 R520 V543 L546	S512-V516 WeakPolarHBondContact O-CG2 3.32Å; S512-V516 PolarHBondContact O-N 3.06Å; V516-R520 WeakPolarHBondContact O-CB 3.23Å; V516-R520 PolarHBondContact O-N 3.43Å; V516-V543 HydrophobicContact CB-CG2 4.4Å; V516-V543 HydrophobicContact CG1-CG2 4.08Å; V516-L546 HydrophobicContact CG1-CD2 3.86Å
517	N	88.6	Confident	88	Confident	61 Å²	61	62.7 Å²	62.7	33%	0.326	33%	0.326	S	S	.	.	H	α-helix	trans	-70.8	-43.6	174.2	-76.6	-65.1	0	0	0	111.9	Q513 M514 E515 L519 R520 D521	Q513-N517 PolarHBondContact O-N 3.31Å; Q513-N517 PolarHBondContact O-ND2 3.37Å; M514-N517 PolarHBondContact O-N 3.44Å; E515-N517 VanDerWaalsContact C-N 3.26Å; E515-N517 PolarHBondContact O-N 2.66Å; N517-L519 PolarHBondContact O-N 3.04Å; N517-R520 WeakPolarHBondContact O-CB 3.43Å; N517-R520 PolarHBondContact O-N 3.3Å; N517-R520 VanDerWaalsContact OD1-CZ 3.26Å; N517-R520 PolarHBondContact OD1-NH1 3.22Å; N517-R520 PolarHBondContact OD1-NH2 2.9Å; N517-D521 WeakPolarHBondContact O-CB 3.4Å; N517-D521 PolarHBondContact O-N 3.47Å
518	V	89.3	Confident	87.4	Confident	75 Å²	75	65 Å²	65	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-61	-42.6	177.4	168.4	0	0	0	0	111.9	M514 E515 D521 A522	M514-V518 WeakPolarHBondContact O-CG2 3.35Å; M514-V518 PolarHBondContact O-N 3.22Å; E515-V518 PolarHBondContact O-N 3.49Å; V518-D521 PolarHBondContact O-N 3.41Å; V518-A522 WeakPolarHBondContact O-CB 3.22Å; V518-A522 PolarHBondContact O-N 3.2Å
519	L	89	Confident	86.8	Confident	2 Å²	2	60 Å²	60	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-65.7	-45.8	175.3	-72.7	172	0	0	0	111.3	E515 N517 D521 A522 F523 P529 L530 Y535 V540 V543	E515-L519 WeakPolarHBondContact O-CB 3.22Å; E515-L519 WeakPolarHBondContact O-CG 3.26Å; E515-L519 PolarHBondContact O-N 3.31Å; N517-L519 PolarHBondContact O-N 3.04Å; L519-D521 VanDerWaalsContact C-N 3.31Å; L519-D521 PolarHBondContact O-N 3.4Å; L519-A522 PolarHBondContact O-N 3.05Å; L519-F523 WeakPolarHBondContact O-CD2 3.5Å; L519-F523 PolarHBondContact O-N 3.01Å; L519-P529 HydrophobicContact CD2-CB 3.68Å; L519-P529 HydrophobicContact CD2-CG 3.47Å; L519-P529 VanDerWaalsContact CD2-CG 3.47Å; L519-L530 HydrophobicContact CD2-CD2 3.87Å; L519-Y535 HydrophobicContact CD1-CD1 4.34Å; L519-Y535 HydrophobicContact CD2-CD1 3.73Å; L519-Y535 HydrophobicContact CD2-CD2 4.39Å; L519-Y535 HydrophobicContact CD2-CE1 3.74Å; L519-Y535 HydrophobicContact CD2-CE2 4.42Å; L519-Y535 HydrophobicContact CD2-CG 4.06Å; L519-Y535 HydrophobicContact CG-CD1 4.22Å; L519-Y535 HydrophobicContact CG-CE1 4.38Å; L519-V540 HydrophobicContact CD1-CG2 4.18Å; L519-V543 HydrophobicContact CB-CG2 3.61Å; L519-V543 HydrophobicContact CD1-CG2 3.86Å; L519-V543 HydrophobicContact CG-CG2 4.4Å
520	R	88.5	Confident	86.4	Confident	65 Å²	65	57.9 Å²	57.9	25%	0.245	31%	0.308	C	S	.	.	H	α-helix	trans	-52.6	-50.9	172.2	-179.5	-157.9	62.6	-139.2	-10.5	110.6	F470 V516 N517 A522 F523 E524	F470-R520 HydrophobicContact CD1-CG 4.2Å; F470-R520 HydrophobicContact CD2-CG 3.59Å; F470-R520 HydrophobicContact CE1-CG 4.12Å; F470-R520 HydrophobicContact CE2-CB 4.24Å; F470-R520 HydrophobicContact CE2-CG 3.51Å; F470-R520 HydrophobicContact CG-CG 3.96Å; F470-R520 HydrophobicContact CZ-CB 4.22Å; F470-R520 HydrophobicContact CZ-CG 3.79Å; V516-R520 WeakPolarHBondContact O-CB 3.23Å; V516-R520 PolarHBondContact O-N 3.43Å; N517-R520 WeakPolarHBondContact O-CB 3.43Å; N517-R520 PolarHBondContact O-N 3.3Å; N517-R520 VanDerWaalsContact OD1-CZ 3.26Å; N517-R520 PolarHBondContact OD1-NH1 3.22Å; N517-R520 PolarHBondContact OD1-NH2 2.9Å; R520-A522 VanDerWaalsContact C-N 3.31Å; R520-A522 PolarHBondContact O-N 2.94Å; R520-F523 CarbonylContact O-C 3.55Å; R520-F523 PolarHBondContact O-N 3.29Å; R520-E524 HydrophobicContact CG-CG 4.46Å; R520-E524 PolarHBondContact O-N 3.47Å
521	D	88.3	Confident	85.6	Confident	56 Å²	56	56.9 Å²	56.9	30%	0.299	30%	0.304	S	S	.	.	H	α-helix	trans	-69.8	-29.4	-173.9	-65.2	-15.2	0	0	0	112.3	N517 V518 L519 R525	N517-D521 WeakPolarHBondContact O-CB 3.4Å; N517-D521 PolarHBondContact O-N 3.47Å; V518-D521 PolarHBondContact O-N 3.41Å; L519-D521 VanDerWaalsContact C-N 3.31Å; L519-D521 PolarHBondContact O-N 3.4Å; D521-R525 WeakPolarHBondContact O-CG 3.49Å; D521-R525 PolarHBondContact O-N 2.95Å; D521-R525 PolarHBondContact O-NH1 2.9Å
522	A	86.3	Confident	84.4	Confident	5 Å²	5	61.5 Å²	61.5	4%	0.041	32%	0.323	C	S	.	.	H	α-helix	trans	-67	-48.9	169.9	0	0	0	0	0	111.5	V518 L519 R520 E524 R525 G526 E527 P529	V518-A522 WeakPolarHBondContact O-CB 3.22Å; V518-A522 PolarHBondContact O-N 3.2Å; L519-A522 PolarHBondContact O-N 3.05Å; R520-A522 VanDerWaalsContact C-N 3.31Å; R520-A522 PolarHBondContact O-N 2.94Å; A522-E524 VanDerWaalsContact C-N 3.33Å; A522-E524 PolarHBondContact O-N 2.68Å; A522-R525 PolarHBondContact O-N 2.67Å; A522-G526 PolarHBondContact O-N 3.42Å; A522-E527 HydrophobicContact CB-CB 4.35Å; A522-E527 WeakPolarHBondContact O-CB 3.42Å; A522-E527 PolarHBondContact O-N 3.24Å; A522-E527 VanDerWaalsContact O-N 3.1Å; A522-P529 HydrophobicContact CB-CB 4.17Å; A522-P529 HydrophobicContact CB-CG 3.97Å
523	F	87.5	Confident	83	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-59.6	-40.4	173.3	-74	-61.2	0	0	0	111.7	L469 F470 Y487 V488 L519 R520 R525 G526 E527 P529 L530 V543	L469-F523 HydrophobicContact CD2-CB 3.77Å; F470-F523 HydrophobicContact CE2-CB 4.21Å; Y487-F523 HydrophobicContact CD2-CD1 4.15Å; Y487-F523 HydrophobicContact CD2-CE1 4.42Å; Y487-F523 AromaticContact CE2-CD1 3.81Å; Y487-F523 HydrophobicContact CE2-CD1 3.81Å; Y487-F523 HydrophobicContact CE2-CE1 4.5Å; Y487-F523 PolarHBondContact OH-O 3.19Å; V488-F523 HydrophobicContact CB-CD1 4.11Å; V488-F523 HydrophobicContact CB-CE1 4.37Å; V488-F523 HydrophobicContact CB-CG 4.2Å; V488-F523 HydrophobicContact CG2-CB 4.41Å; V488-F523 HydrophobicContact CG2-CD1 4.21Å; V488-F523 HydrophobicContact CG2-CD2 3.76Å; V488-F523 HydrophobicContact CG2-CE1 4.39Å; V488-F523 HydrophobicContact CG2-CE2 3.98Å; V488-F523 HydrophobicContact CG2-CG 3.89Å; V488-F523 HydrophobicContact CG2-CZ 4.29Å; L519-F523 WeakPolarHBondContact O-CD2 3.5Å; L519-F523 PolarHBondContact O-N 3.01Å; R520-F523 CarbonylContact O-C 3.55Å; R520-F523 PolarHBondContact O-N 3.29Å; F523-R525 PolarHBondContact O-N 3.25Å; F523-G526 PolarHBondContact O-N 3.33Å; F523-E527 WeakPolarHBondContact CD1-O 2.96Å; F523-P529 HydrophobicContact CD2-CG 4.29Å; F523-P529 HydrophobicContact CE1-CG 4.35Å; F523-P529 HydrophobicContact CE2-CG 3.95Å; F523-P529 HydrophobicContact CZ-CG 3.99Å; F523-L530 HydrophobicContact CZ-CD1 4.02Å; F523-L530 HydrophobicContact CZ-CG 4.07Å; F523-V543 HydrophobicContact CD2-CG1 4.07Å; F523-V543 HydrophobicContact CE2-CG1 4.05Å
524	E	85.4	Confident	81.8	Confident	92 Å²	92	69.9 Å²	69.9	43%	0.43	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-22.4	175.5	-73.8	-163.1	164	0	0	114.3	L469 F470 R520 A522	L469-E524 HydrophobicContact CB-CG 4.47Å; F470-E524 HydrophobicContact CD2-CG 3.72Å; F470-E524 HydrophobicContact CE2-CG 4.26Å; R520-E524 HydrophobicContact CG-CG 4.46Å; R520-E524 PolarHBondContact O-N 3.47Å; A522-E524 VanDerWaalsContact C-N 3.33Å; A522-E524 PolarHBondContact O-N 2.68Å
525	R	83.2	Confident	81.3	Confident	135 Å²	135	67 Å²	67	51%	0.509	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-8.4	173.3	-70.6	-172.9	-53.8	-85.7	3.9	114.2	D521 A522 F523 E527	D521-R525 WeakPolarHBondContact O-CG 3.49Å; D521-R525 PolarHBondContact O-N 2.95Å; D521-R525 PolarHBondContact O-NH1 2.9Å; A522-R525 PolarHBondContact O-N 2.67Å; F523-R525 PolarHBondContact O-N 3.25Å; R525-E527 HydrophobicContact CB-CG 4.27Å; R525-E527 IonicContact CZ-OE1 3.59Å; R525-E527 IonicContact CZ-OE2 3.42Å; R525-E527 VanDerWaalsContact NE-CD 3.33Å; R525-E527 IonicContact NE-OE1 2.77Å; R525-E527 PolarHBondContact NE-OE1 3.39Å; R525-E527 IonicContact NE-OE2 3.39Å; R525-E527 PolarHBondContact NE-OE2 3.08Å; R525-E527 IonicContact NH2-OE1 3.55Å; R525-E527 IonicContact NH2-OE2 2.7Å; R525-E527 PolarHBondContact NH2-OE2 3.38Å
526	G	75	Confident	81.2	Confident	54 Å²	54	66.8 Å²	66.8	56%	0.557	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	17.4	-171.8	0	0	0	0	0	114.3	Y487 A522 F523	Y487-G526 WeakPolarHBondContact OH-CA 3.31Å; A522-G526 PolarHBondContact O-N 3.42Å; F523-G526 PolarHBondContact O-N 3.33Å
527	E	82	Confident	81.2	Confident	91 Å²	91	67.2 Å²	67.2	43%	0.425	33%	0.326	S	S	.	.			trans	-93.3	141.7	175.4	-60.5	161.5	-163.1	0	0	109.8	A522 F523 R525 P529	A522-E527 HydrophobicContact CB-CB 4.35Å; A522-E527 WeakPolarHBondContact O-CB 3.42Å; A522-E527 PolarHBondContact O-N 3.24Å; A522-E527 VanDerWaalsContact O-N 3.1Å; F523-E527 WeakPolarHBondContact CD1-O 2.96Å; R525-E527 HydrophobicContact CB-CG 4.27Å; R525-E527 IonicContact CZ-OE1 3.59Å; R525-E527 IonicContact CZ-OE2 3.42Å; R525-E527 VanDerWaalsContact NE-CD 3.33Å; R525-E527 IonicContact NE-OE1 2.77Å; R525-E527 PolarHBondContact NE-OE1 3.39Å; R525-E527 IonicContact NE-OE2 3.39Å; R525-E527 PolarHBondContact NE-OE2 3.08Å; R525-E527 IonicContact NH2-OE1 3.55Å; R525-E527 IonicContact NH2-OE2 2.7Å; R525-E527 PolarHBondContact NH2-OE2 3.38Å; E527-P529 WeakPolarHBondContact O-CD 3.22Å
528	D	81.4	Confident	81.3	Confident	49 Å²	49	65 Å²	65	26%	0.262	32%	0.315	S	S	.	.			trans	-97.9	94.4	164.8	176.9	31.9	0	0	0	109.8	S491 R494 L530 S531	S491-D528 WeakPolarHBondContact CB-OD1 3.4Å; S491-D528 VanDerWaalsContact OG-CG 3.25Å; S491-D528 PolarHBondContact OG-OD1 3.38Å; S491-D528 PolarHBondContact OG-OD2 3.46Å; R494-D528 IonicContact NH2-OD2 2.61Å; R494-D528 PolarHBondContact NH2-OD2 3.03Å; D528-L530 PolarHBondContact O-N 2.95Å; D528-L530 PolarHBondContact OD1-N 3.24Å; D528-S531 PolarHBondContact O-N 2.94Å; D528-S531 PolarHBondContact O-OG 3.21Å; D528-S531 PolarHBondContact OD2-N 3.13Å
529	P	80.6	Confident	81.4	Confident	17 Å²	17	61.4 Å²	61.4	11%	0.11	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-65.8	-21.8	179.7	27.9	-36.3	0	0	0	113	L519 A522 F523 E527 S531 Y535	L519-P529 HydrophobicContact CD2-CB 3.68Å; L519-P529 HydrophobicContact CD2-CG 3.47Å; L519-P529 VanDerWaalsContact CD2-CG 3.47Å; A522-P529 HydrophobicContact CB-CB 4.17Å; A522-P529 HydrophobicContact CB-CG 3.97Å; F523-P529 HydrophobicContact CD2-CG 4.29Å; F523-P529 HydrophobicContact CE1-CG 4.35Å; F523-P529 HydrophobicContact CE2-CG 3.95Å; F523-P529 HydrophobicContact CZ-CG 3.99Å; E527-P529 WeakPolarHBondContact O-CD 3.22Å; P529-S531 VanDerWaalsContact C-N 3.27Å; P529-S531 PolarHBondContact O-N 3.49Å; P529-Y535 HydrophobicContact CB-CE2 4.15Å; P529-Y535 WeakPolarHBondContact O-CE2 3.44Å
530	L	82.4	Confident	81.6	Confident	8 Å²	8	61.3 Å²	61.3	4%	0.042	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-84.8	-1.3	-173.9	-51.6	-176.8	0	0	0	113.5	C492 F495 L519 F523 D528 E532 Y535 V540	C492-L530 HydrophobicContact CB-CD1 4.47Å; F495-L530 HydrophobicContact CB-CD1 4.04Å; F495-L530 HydrophobicContact CD2-CB 4.01Å; F495-L530 HydrophobicContact CG-CB 4.47Å; F495-L530 HydrophobicContact CG-CD1 4.34Å; L519-L530 HydrophobicContact CD2-CD2 3.87Å; F523-L530 HydrophobicContact CZ-CD1 4.02Å; F523-L530 HydrophobicContact CZ-CG 4.07Å; D528-L530 PolarHBondContact O-N 2.95Å; D528-L530 PolarHBondContact OD1-N 3.24Å; L530-E532 PolarHBondContact O-N 3.08Å; L530-Y535 HydrophobicContact CD2-CD2 3.98Å; L530-Y535 HydrophobicContact CD2-CG 4.25Å; L530-V540 HydrophobicContact CD1-CG1 3.75Å; L530-V540 HydrophobicContact CD1-CG2 4.18Å; L530-V540 HydrophobicContact CD2-CG2 3.63Å
531	S	70.5	Confident	81.8	Confident	82 Å²	82	58.2 Å²	58.2	57%	0.573	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-61.8	-20.1	173.4	56.6	0	0	0	0	114.2	D528 P529	D528-S531 PolarHBondContact O-N 2.94Å; D528-S531 PolarHBondContact O-OG 3.21Å; D528-S531 PolarHBondContact OD2-N 3.13Å; P529-S531 VanDerWaalsContact C-N 3.27Å; P529-S531 PolarHBondContact O-N 3.49Å
532	E	63.2	Low	82	Confident	105 Å²	105	56.1 Å²	56.1	49%	0.491	27%	0.272	S	S	.	.	S	Bend	trans	-121.2	129.5	171.6	-64.2	-171.1	172.3	0	0	111.5	L530 R534	L530-E532 PolarHBondContact O-N 3.08Å; E532-R534 HydrophobicContact CB-CG 4.38Å; E532-R534 PolarHBondContact O-N 3.45Å; E532-R534 IonicContact OE2-CZ 2.64Å; E532-R534 IonicContact OE2-NE 2.71Å; E532-R534 PolarHBondContact OE2-NE 3.18Å; E532-R534 IonicContact OE2-NH2 4Å; E532-R534 PolarHBondContact OE2-NH2 2.72Å
533	R	61.5	Low	82.4	Confident	165 Å²	165	55.9 Å²	55.9	62%	0.623	27%	0.27	S	S	*	.	S	Bend	trans	-62.7	91.2	-180	-65.4	-167.9	-166.8	-175.1	7.7	112.3	Y499	Y499-R533 HydrophobicContact CE2-CG 4.03Å; Y499-R533 PolarHBondContact OH-NE 3.3Å; Y499-R533 PolarHBondContact OH-NH2 2.96Å
534	R	66	Low	82.7	Confident	186 Å²	186	55.9 Å²	55.9	70%	0.702	27%	0.27	S	S	*	.			trans	-143.1	-3.8	-179.3	-58.2	-175.3	-170.4	-121.5	10.8	116.5	E532	E532-R534 HydrophobicContact CB-CG 4.38Å; E532-R534 PolarHBondContact O-N 3.45Å; E532-R534 IonicContact OE2-CZ 2.64Å; E532-R534 IonicContact OE2-NE 2.71Å; E532-R534 PolarHBondContact OE2-NE 3.18Å; E532-R534 IonicContact OE2-NH2 4Å; E532-R534 PolarHBondContact OE2-NH2 2.72Å
535	Y	80.5	Confident	83.1	Confident	80 Å²	80	53.2 Å²	53.2	31%	0.314	26%	0.257	S	S	.	.	S	Bend	trans	-114.9	151.5	-165.9	-64.5	-83.5	0	0	0	114.1	L519 P529 L530	L519-Y535 HydrophobicContact CD1-CD1 4.34Å; L519-Y535 HydrophobicContact CD2-CD1 3.73Å; L519-Y535 HydrophobicContact CD2-CD2 4.39Å; L519-Y535 HydrophobicContact CD2-CE1 3.74Å; L519-Y535 HydrophobicContact CD2-CE2 4.42Å; L519-Y535 HydrophobicContact CD2-CG 4.06Å; L519-Y535 HydrophobicContact CG-CD1 4.22Å; L519-Y535 HydrophobicContact CG-CE1 4.38Å; P529-Y535 HydrophobicContact CB-CE2 4.15Å; P529-Y535 WeakPolarHBondContact O-CE2 3.44Å; L530-Y535 HydrophobicContact CD2-CD2 3.98Å; L530-Y535 HydrophobicContact CD2-CG 4.25Å
536	D	85.5	Confident	83.5	Confident	67 Å²	67	47.9 Å²	47.9	36%	0.358	24%	0.239	S	C	.	.			trans	-67.9	145	175.2	173.7	62.7	0	0	0	112.8	D538 S539 V540	D536-D538 PolarHBondContact OD2-N 2.67Å; D536-S539 PolarHBondContact OD2-N 3.45Å; D536-S539 PolarHBondContact OD2-OG 3.01Å; D536-V540 WeakPolarHBondContact O-CG2 3.43Å; D536-V540 PolarHBondContact O-N 3.13Å; D536-V540 VanDerWaalsContact O-N 3.1Å
537	M	89.7	Confident	84.3	Confident	16 Å²	16	45.4 Å²	45.4	8%	0.079	21%	0.212	C	C	.	.	H	α-helix	trans	-73	-40.3	-174	-173.4	54.5	59.3	0	0	112.7	F495 I496 H503 I506 S539 V540 A541	F495-M537 HydrophobicContact CD1-CE 3.8Å; F495-M537 HydrophobicContact CD1-SD 4.39Å; F495-M537 HydrophobicContact CE1-CE 3.61Å; I496-M537 HydrophobicContact CB-SD 4.32Å; I496-M537 HydrophobicContact CG1-SD 3.8Å; I496-M537 HydrophobicContact CG2-SD 4.37Å; H503-M537 HydrophobicContact CB-CG 4.02Å; I506-M537 HydrophobicContact CD1-CG 3.56Å; I506-M537 HydrophobicContact CD1-SD 3.92Å; M537-S539 VanDerWaalsContact C-N 3.34Å; M537-V540 PolarHBondContact O-N 2.97Å; M537-A541 VanDerWaalsContact O-CB 3.32Å; M537-A541 WeakPolarHBondContact O-CB 3.17Å; M537-A541 PolarHBondContact O-N 2.95Å
538	D	91.4	Very high	84.8	Confident	15 Å²	15	41.1 Å²	41.1	8%	0.08	19%	0.192	C	C	.	.	H	α-helix	trans	-74.8	-27.3	178.1	-71.8	-41	0	0	0	111.9	H503 V509 G511 D536 G542	H503-D538 IonicContact CE1-OD1 3Å; H503-D538 IonicContact CE1-OD2 3.44Å; H503-D538 PolarHBondContact CE1-OD2 3.04Å; H503-D538 IonicContact ND1-OD1 3.71Å; V509-D538 VanDerWaalsContact CB-OD2 3.28Å; V509-D538 WeakPolarHBondContact CB-OD2 3.14Å; V509-D538 HydrophobicContact CG1-CB 4.45Å; V509-D538 WeakPolarHBondContact CG1-OD2 3.44Å; G511-D538 VanDerWaalsContact CA-C 3.44Å; G511-D538 WeakPolarHBondContact CA-O 3.47Å; G511-D538 PolarHBondContact N-O 3.37Å; D536-D538 PolarHBondContact OD2-N 2.67Å; D538-G542 PolarHBondContact O-N 2.94Å
539	S	92.3	Very high	85.2	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-49	167.2	-72	0	0	0	0	111.4	S512 E515 D536 M537 G542 V543	S512-S539 PolarHBondContact N-OG 3.42Å; S512-S539 VanDerWaalsContact N-OG 3.12Å; E515-S539 WeakPolarHBondContact OE2-CB 3.47Å; E515-S539 PolarHBondContact OE2-OG 2.97Å; D536-S539 PolarHBondContact OD2-N 3.45Å; D536-S539 PolarHBondContact OD2-OG 3.01Å; M537-S539 VanDerWaalsContact C-N 3.34Å; S539-G542 WeakPolarHBondContact O-CA 3.49Å; S539-G542 PolarHBondContact O-N 3.22Å; S539-G542 VanDerWaalsContact O-N 3.13Å; S539-V543 WeakPolarHBondContact O-CG2 3.14Å; S539-V543 PolarHBondContact O-N 3.34Å
540	V	92.8	Very high	85.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-43.9	176.5	175.8	0	0	0	0	111.7	C492 F495 I496 L519 L530 D536 M537 G542 V543 L544	C492-V540 HydrophobicContact CB-CG1 4.05Å; F495-V540 HydrophobicContact CB-CG1 4.4Å; F495-V540 HydrophobicContact CD1-CB 4.21Å; F495-V540 HydrophobicContact CD1-CG1 3.98Å; F495-V540 HydrophobicContact CD1-CG2 3.96Å; F495-V540 HydrophobicContact CE1-CG2 3.96Å; F495-V540 HydrophobicContact CG-CG1 4.48Å; I496-V540 HydrophobicContact CD1-CG1 4.17Å; I496-V540 HydrophobicContact CG1-CG1 4.04Å; L519-V540 HydrophobicContact CD1-CG2 4.18Å; L530-V540 HydrophobicContact CD1-CG1 3.75Å; L530-V540 HydrophobicContact CD1-CG2 4.18Å; L530-V540 HydrophobicContact CD2-CG2 3.63Å; D536-V540 WeakPolarHBondContact O-CG2 3.43Å; D536-V540 PolarHBondContact O-N 3.13Å; D536-V540 VanDerWaalsContact O-N 3.1Å; M537-V540 PolarHBondContact O-N 2.97Å; V540-G542 PolarHBondContact O-N 3.26Å; V540-V543 PolarHBondContact O-N 3.25Å; V540-V543 VanDerWaalsContact O-N 3.15Å; V540-L544 PolarHBondContact O-N 3.16Å; V540-L544 VanDerWaalsContact O-N 3.14Å
541	A	92.9	Very high	85.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61	-31.2	173.1	0	0	0	0	0	112.6	I496 I506 F507 M537 K545	I496-A541 HydrophobicContact CD1-CB 4.25Å; I506-A541 HydrophobicContact CD1-CB 3.77Å; F507-A541 HydrophobicContact CD1-CB 3.6Å; F507-A541 HydrophobicContact CE1-CB 3.73Å; F507-A541 HydrophobicContact CG-CB 4.28Å; M537-A541 VanDerWaalsContact O-CB 3.32Å; M537-A541 WeakPolarHBondContact O-CB 3.17Å; M537-A541 PolarHBondContact O-N 2.95Å; A541-K545 WeakPolarHBondContact O-CE 3.47Å; A541-K545 PolarHBondContact O-N 3.47Å
542	G	92.4	Very high	86.5	Confident	12 Å²	12	46.5 Å²	46.5	12%	0.124	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-47	171.4	0	0	0	0	0	112.9	D538 S539 V540 K545 L546	D538-G542 PolarHBondContact O-N 2.94Å; S539-G542 WeakPolarHBondContact O-CA 3.49Å; S539-G542 PolarHBondContact O-N 3.22Å; S539-G542 VanDerWaalsContact O-N 3.13Å; V540-G542 PolarHBondContact O-N 3.26Å; G542-K545 PolarHBondContact O-N 3.1Å; G542-L546 WeakPolarHBondContact O-CB 3.31Å; G542-L546 PolarHBondContact O-N 2.96Å
543	V	93.5	Very high	87.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-44	179.1	176.6	0	0	0	0	111.7	F470 V488 V516 L519 F523 S539 V540 K545 L546 Y547	F470-V543 HydrophobicContact CZ-CG1 4.16Å; V488-V543 HydrophobicContact CG2-CG1 4.16Å; V516-V543 HydrophobicContact CB-CG2 4.4Å; V516-V543 HydrophobicContact CG1-CG2 4.08Å; L519-V543 HydrophobicContact CB-CG2 3.61Å; L519-V543 HydrophobicContact CD1-CG2 3.86Å; L519-V543 HydrophobicContact CG-CG2 4.4Å; F523-V543 HydrophobicContact CD2-CG1 4.07Å; F523-V543 HydrophobicContact CE2-CG1 4.05Å; S539-V543 WeakPolarHBondContact O-CG2 3.14Å; S539-V543 PolarHBondContact O-N 3.34Å; V540-V543 PolarHBondContact O-N 3.25Å; V540-V543 VanDerWaalsContact O-N 3.15Å; V543-K545 PolarHBondContact O-N 3.02Å; V543-L546 WeakPolarHBondContact O-CB 3.27Å; V543-L546 PolarHBondContact O-N 3.47Å; V543-L546 VanDerWaalsContact O-N 3.14Å; V543-Y547 PolarHBondContact O-N 3.05Å
544	L	94.1	Very high	88.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.9	-42.8	179.1	-175.6	57.6	0	0	0	112.3	V489 C492 V493 I496 F507 V540 F548 F601	V489-L544 HydrophobicContact CB-CD1 4.34Å; V489-L544 HydrophobicContact CG1-CD1 4.16Å; V489-L544 HydrophobicContact CG2-CD1 4.37Å; C492-L544 HydrophobicContact CB-CB 3.97Å; C492-L544 HydrophobicContact CB-CD1 4.14Å; C492-L544 HydrophobicContact CB-CD2 4.37Å; C492-L544 HydrophobicContact CB-CG 4.39Å; V493-L544 HydrophobicContact CG2-CD2 3.88Å; I496-L544 HydrophobicContact CD1-CD2 4.21Å; F507-L544 HydrophobicContact CE1-CB 4.46Å; F507-L544 HydrophobicContact CE1-CD2 3.98Å; F507-L544 HydrophobicContact CZ-CD2 4.1Å; V540-L544 PolarHBondContact O-N 3.16Å; V540-L544 VanDerWaalsContact O-N 3.14Å; L544-F548 HydrophobicContact CD1-CD2 4.48Å; L544-F548 HydrophobicContact CD1-CE2 3.79Å; L544-F548 HydrophobicContact CG-CE2 4.37Å; L544-F548 VanDerWaalsContact O-CD2 3.28Å; L544-F548 WeakPolarHBondContact O-CD2 3.44Å; L544-F601 HydrophobicContact CD2-CE1 3.95Å
545	K	93.4	Very high	89.8	Confident	36 Å²	36	30.6 Å²	30.6	16%	0.157	15%	0.151	C	C	.	.	H	α-helix	trans	-65.9	-41.4	173.1	-70.8	176.7	-70.4	173.7	0	112.1	F507 A541 G542 V543 Y547 F548 R549 F623	F507-K545 HydrophobicContact CB-CD 4.22Å; F507-K545 HydrophobicContact CD1-CD 4.16Å; F507-K545 HydrophobicContact CD1-CG 4.09Å; F507-K545 PolarHBondContact O-NZ 3.39Å; A541-K545 WeakPolarHBondContact O-CE 3.47Å; A541-K545 PolarHBondContact O-N 3.47Å; G542-K545 PolarHBondContact O-N 3.1Å; V543-K545 PolarHBondContact O-N 3.02Å; K545-Y547 VanDerWaalsContact C-N 3.29Å; K545-Y547 PolarHBondContact O-N 3.04Å; K545-F548 PolarHBondContact O-N 3.36Å; K545-R549 WeakPolarHBondContact O-CB 3.46Å; K545-R549 PolarHBondContact O-N 2.6Å; K545-R549 VanDerWaalsContact O-N 3.1Å; K545-F623 HydrophobicContact CG-CE1 4.05Å; K545-F623 HydrophobicContact CG-CE2 4.26Å; K545-F623 HydrophobicContact CG-CZ 3.89Å
546	L	91.6	Very high	90.2	Very high	22 Å²	22	26.8 Å²	26.8	12%	0.115	14%	0.136	C	C	.	.	H	α-helix	trans	-59.9	-40.6	-179.9	-179.1	65	0	0	0	111.5	F470 V516 G542 V543 R549 C550	F470-L546 HydrophobicContact CD1-CG 4.35Å; F470-L546 HydrophobicContact CE1-CD2 4.4Å; F470-L546 HydrophobicContact CE1-CG 4.25Å; V516-L546 HydrophobicContact CG1-CD2 3.86Å; G542-L546 WeakPolarHBondContact O-CB 3.31Å; G542-L546 PolarHBondContact O-N 2.96Å; V543-L546 WeakPolarHBondContact O-CB 3.27Å; V543-L546 PolarHBondContact O-N 3.47Å; V543-L546 VanDerWaalsContact O-N 3.14Å; L546-R549 PolarHBondContact O-N 3.38Å; L546-C550 VanDerWaalsContact O-CB 3.29Å; L546-C550 WeakPolarHBondContact O-CB 3.44Å; L546-C550 PolarHBondContact O-N 3.48Å
547	Y	92.4	Very high	90.4	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.008	13%	0.131	C	C	.	.	H	α-helix	trans	-54.9	-60.7	177	177.5	-105.2	0	0	0	111.7	L469 F470 M474 P486 V488 V489 V543 K545 R549 C550 L551	L469-Y547 HydrophobicContact CD1-CE2 4.24Å; L469-Y547 HydrophobicContact CG-CE2 4.3Å; L469-Y547 WeakPolarHBondContact O-CE2 3.42Å; F470-Y547 HydrophobicContact CD1-CD2 4.22Å; F470-Y547 HydrophobicContact CE1-CD2 4.16Å; F470-Y547 HydrophobicContact CZ-CD2 4.5Å; M474-Y547 HydrophobicContact CE-CE1 3.9Å; P486-Y547 HydrophobicContact CB-CE1 4.48Å; P486-Y547 HydrophobicContact CG-CE1 4.39Å; P486-Y547 VanDerWaalsContact CG-OH 3.3Å; P486-Y547 WeakPolarHBondContact CG-OH 3.48Å; V488-Y547 HydrophobicContact CG1-CD1 4.37Å; V488-Y547 HydrophobicContact CG1-CD2 3.52Å; V488-Y547 HydrophobicContact CG1-CE1 4.46Å; V488-Y547 HydrophobicContact CG1-CE2 3.64Å; V488-Y547 HydrophobicContact CG1-CG 3.92Å; V489-Y547 HydrophobicContact CG2-CD1 3.48Å; V489-Y547 VanDerWaalsContact CG2-CD1 3.48Å; V489-Y547 HydrophobicContact CG2-CE1 3.41Å; V489-Y547 VanDerWaalsContact CG2-CE1 3.41Å; V489-Y547 HydrophobicContact CG2-CG 4.45Å; V543-Y547 PolarHBondContact O-N 3.05Å; K545-Y547 VanDerWaalsContact C-N 3.29Å; K545-Y547 PolarHBondContact O-N 3.04Å; Y547-R549 VanDerWaalsContact C-N 3.34Å; Y547-R549 PolarHBondContact O-N 3.5Å; Y547-C550 CarbonylContact O-C 3.58Å; Y547-C550 PolarHBondContact O-N 3.4Å; Y547-C550 VanDerWaalsContact O-N 3.17Å; Y547-L551 HydrophobicContact CE1-CD2 3.98Å; Y547-L551 HydrophobicContact CE2-CD2 4.09Å; Y547-L551 PolarHBondContact O-N 3.37Å
548	F	92.5	Very high	90.1	Very high	1 Å²	1	27.3 Å²	27.3	0%	0.004	14%	0.144	C	C	.	.	H	α-helix	trans	-61.4	-39.5	-178.7	-67.9	-71.2	0	0	0	113.1	M474 V489 L544 K545 C550 L551 L555 V594 L598 S626 L627	M474-F548 HydrophobicContact CE-CD1 4.46Å; M474-F548 HydrophobicContact CE-CE1 4.18Å; V489-F548 HydrophobicContact CG1-CE2 4.44Å; V489-F548 HydrophobicContact CG1-CZ 3.99Å; V489-F548 HydrophobicContact CG2-CE1 4.36Å; V489-F548 HydrophobicContact CG2-CE2 4.16Å; V489-F548 HydrophobicContact CG2-CZ 3.69Å; L544-F548 HydrophobicContact CD1-CD2 4.48Å; L544-F548 HydrophobicContact CD1-CE2 3.79Å; L544-F548 HydrophobicContact CG-CE2 4.37Å; L544-F548 VanDerWaalsContact O-CD2 3.28Å; L544-F548 WeakPolarHBondContact O-CD2 3.44Å; K545-F548 PolarHBondContact O-N 3.36Å; F548-C550 VanDerWaalsContact C-N 3.28Å; F548-C550 PolarHBondContact O-N 3.4Å; F548-L551 HydrophobicContact CD1-CD1 4.05Å; F548-L551 WeakPolarHBondContact O-CG 3.36Å; F548-L551 PolarHBondContact O-N 3.49Å; F548-L555 HydrophobicContact CD1-CB 4.47Å; F548-L555 HydrophobicContact CD1-CD1 4.38Å; F548-L555 HydrophobicContact CD1-CD2 4.14Å; F548-L555 HydrophobicContact CE1-CD1 4.19Å; F548-L555 HydrophobicContact CE1-CD2 4.04Å; F548-V594 HydrophobicContact CE1-CG1 3.93Å; F548-V594 HydrophobicContact CZ-CG1 4.26Å; F548-L598 HydrophobicContact CD2-CD2 4.34Å; F548-L598 HydrophobicContact CE1-CD2 4.17Å; F548-L598 HydrophobicContact CE2-CD1 3.88Å; F548-L598 HydrophobicContact CE2-CD2 3.87Å; F548-L598 HydrophobicContact CE2-CG 4.45Å; F548-L598 HydrophobicContact CZ-CD1 4.19Å; F548-L598 HydrophobicContact CZ-CD2 3.78Å; F548-L598 HydrophobicContact CZ-CG 4.4Å; F548-S626 CarbonylContact C-O 3.58Å; F548-L627 HydrophobicContact CB-CD2 3.88Å; F548-L627 HydrophobicContact CD1-CD2 4.15Å; F548-L627 HydrophobicContact CD2-CD2 4.44Å; F548-L627 HydrophobicContact CG-CD2 3.91Å
549	R	90.3	Very high	89.7	Confident	141 Å²	141	32 Å²	32	53%	0.532	18%	0.177	S	C	.	.	H	α-helix	trans	-60.9	-37.3	177.8	-171.9	178	68.7	170.2	1.1	112.5	K545 L546 Y547 R629	K545-R549 WeakPolarHBondContact O-CB 3.46Å; K545-R549 PolarHBondContact O-N 2.6Å; K545-R549 VanDerWaalsContact O-N 3.1Å; L546-R549 PolarHBondContact O-N 3.38Å; Y547-R549 VanDerWaalsContact C-N 3.34Å; Y547-R549 PolarHBondContact O-N 3.5Å; R549-R629 PolarHBondContact O-NH2 3.29Å
550	C	88.1	Confident	89.5	Confident	37 Å²	37	32.2 Å²	32.2	25%	0.25	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	15.6	-174.4	-67.7	0	0	0	0	114.4	S471 L546 Y547 F548	S471-C550 WeakPolarHBondContact CA-O 3.33Å; S471-C550 PolarHBondContact N-O 3.14Å; L546-C550 VanDerWaalsContact O-CB 3.29Å; L546-C550 WeakPolarHBondContact O-CB 3.44Å; L546-C550 PolarHBondContact O-N 3.48Å; Y547-C550 CarbonylContact O-C 3.58Å; Y547-C550 PolarHBondContact O-N 3.4Å; Y547-C550 VanDerWaalsContact O-N 3.17Å; F548-C550 VanDerWaalsContact C-N 3.28Å; F548-C550 PolarHBondContact O-N 3.4Å
551	L	87.1	Confident	89.1	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.021	18%	0.18	C	C	.	.			trans	-66.6	149.1	167.2	-61.8	171.6	0	0	0	110.8	M474 Y547 F548 N553 R629	M474-L551 HydrophobicContact CB-CD2 4.32Å; M474-L551 HydrophobicContact CE-CD1 3.55Å; M474-L551 HydrophobicContact CE-CD2 3.95Å; M474-L551 HydrophobicContact CE-CG 4.41Å; Y547-L551 HydrophobicContact CE1-CD2 3.98Å; Y547-L551 HydrophobicContact CE2-CD2 4.09Å; Y547-L551 PolarHBondContact O-N 3.37Å; F548-L551 HydrophobicContact CD1-CD1 4.05Å; F548-L551 WeakPolarHBondContact O-CG 3.36Å; F548-L551 PolarHBondContact O-N 3.49Å; L551-N553 WeakPolarHBondContact CB-O 3.41Å; L551-R629 PolarHBondContact O-NH1 3.35Å; L551-R629 PolarHBondContact O-NH2 3.07Å
552	D	84.4	Confident	88.7	Confident	88 Å²	88	35.1 Å²	35.1	47%	0.471	20%	0.199	S	C	.	.	S	Bend	trans	-63.1	-51.9	172.7	-71.1	-15.1	0	0	0	109.9	S471 G472 D473 R629	S471-D552 VanDerWaalsContact C-OD1 3.24Å; G472-D552 VanDerWaalsContact C-CG 3.44Å; G472-D552 WeakPolarHBondContact CA-OD2 3.4Å; G472-D552 PolarHBondContact N-OD1 3.25Å; G472-D552 PolarHBondContact O-N 2.57Å; D473-D552 PolarHBondContact N-OD2 3.01Å; D552-R629 PolarHBondContact O-NH1 2.88Å
553	N	83.7	Confident	88.5	Confident	103 Å²	103	39.7 Å²	39.7	55%	0.551	22%	0.217	S	C	*	.	S	Bend	trans	-95.2	125.9	171.5	-66.3	-57.5	0	0	0	110.5	D473 L551	D473-N553 PolarHBondContact OD1-ND2 2.97Å; L551-N553 WeakPolarHBondContact CB-O 3.41Å
554	P	87.3	Confident	88.2	Confident	14 Å²	14	39.7 Å²	39.7	9%	0.091	22%	0.217	C	C	.	.			trans	-67.2	153.7	176.7	29.2	-33.9	0	0	0	111.7	F556 V558 R629	P554-F556 VanDerWaalsContact C-N 3.25Å; P554-F556 WeakPolarHBondContact CG-O 3.27Å; P554-F556 CarbonylContact O-C 3.51Å; P554-F556 PolarHBondContact O-N 2.97Å; P554-V558 HydrophobicContact CG-CG2 3.77Å; P554-R629 HydrophobicContact CB-CG 4.05Å; P554-R629 HydrophobicContact CG-CG 4.25Å
555	L	89.1	Confident	87.9	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	22%	0.223	C	C	.	.	S	Bend	trans	-60.9	-33	-174.6	-166.8	71.9	0	0	0	112.9	M474 F548 V591 V594 M595 L598 L627	M474-L555 HydrophobicContact CE-CD1 4.05Å; M474-L555 HydrophobicContact SD-CD1 4.44Å; F548-L555 HydrophobicContact CD1-CB 4.47Å; F548-L555 HydrophobicContact CD1-CD1 4.38Å; F548-L555 HydrophobicContact CD1-CD2 4.14Å; F548-L555 HydrophobicContact CE1-CD1 4.19Å; F548-L555 HydrophobicContact CE1-CD2 4.04Å; L555-V591 HydrophobicContact CD1-CG1 4.05Å; L555-V594 HydrophobicContact CD1-CG1 4.12Å; L555-M595 HydrophobicContact CD1-CG 3.98Å; L555-M595 HydrophobicContact CD2-CG 3.73Å; L555-M595 HydrophobicContact CG-CG 3.67Å; L555-L598 HydrophobicContact CD2-CD2 3.83Å; L555-L627 HydrophobicContact CB-CD2 4.15Å; L555-L627 HydrophobicContact CD2-CD2 3.76Å
556	F	90.4	Very high	87.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-97.6	117.5	163.6	-69	-94.6	0	0	0	109.5	P554 V558 L564 Y587 M595 F599 L627 V628 I650	P554-F556 VanDerWaalsContact C-N 3.25Å; P554-F556 WeakPolarHBondContact CG-O 3.27Å; P554-F556 CarbonylContact O-C 3.51Å; P554-F556 PolarHBondContact O-N 2.97Å; F556-V558 PolarHBondContact O-N 3.44Å; F556-L564 HydrophobicContact CB-CD1 4.3Å; F556-L564 HydrophobicContact CD1-CD1 3.58Å; F556-L564 HydrophobicContact CE1-CD1 4.35Å; F556-L564 HydrophobicContact CG-CD1 4.32Å; F556-Y587 HydrophobicContact CD1-CE2 4.41Å; F556-M595 HydrophobicContact CD1-CE 3.61Å; F556-M595 HydrophobicContact CD2-CE 4.05Å; F556-M595 HydrophobicContact CE1-CE 3.24Å; F556-M595 HydrophobicContact CE2-CE 3.71Å; F556-M595 HydrophobicContact CG-CE 4.02Å; F556-M595 HydrophobicContact CZ-CE 3.29Å; F556-F599 AromaticContact CE2-CE2 3.82Å; F556-F599 HydrophobicContact CE2-CE2 3.82Å; F556-F599 AromaticContact CE2-CZ 3.78Å; F556-F599 HydrophobicContact CE2-CZ 3.78Å; F556-F599 AromaticContact CZ-CE2 3.7Å; F556-F599 HydrophobicContact CZ-CE2 3.7Å; F556-F599 AromaticContact CZ-CZ 3.69Å; F556-F599 HydrophobicContact CZ-CZ 3.69Å; F556-L627 HydrophobicContact CD2-CB 3.97Å; F556-L627 HydrophobicContact CE2-CB 4.09Å; F556-L627 HydrophobicContact CE2-CD1 4.36Å; F556-L627 PolarHBondContact N-O 3.05Å; F556-L627 VanDerWaalsContact N-O 3.16Å; F556-V628 HydrophobicContact CB-CG2 4.07Å; F556-V628 HydrophobicContact CD2-CG2 3.78Å; F556-V628 HydrophobicContact CE2-CG2 4.44Å; F556-V628 HydrophobicContact CG-CG2 4Å; F556-I650 HydrophobicContact CE1-CD1 3.63Å; F556-I650 HydrophobicContact CZ-CD1 3.56Å
557	P	88.2	Confident	87.4	Confident	37 Å²	37	44 Å²	44	24%	0.24	24%	0.239	C	C	.	.			trans	-59.8	132.6	-179.9	-25.8	35.3	0	0	0	112.9	S559 S560 Y587	P557-S559 PolarHBondContact O-N 3.27Å; P557-S559 VanDerWaalsContact O-N 3.09Å; P557-S560 PolarHBondContact O-N 2.97Å; P557-S560 PolarHBondContact O-OG 3.36Å; P557-Y587 HydrophobicContact CG-CD1 4.04Å; P557-Y587 HydrophobicContact CG-CE1 3.99Å; P557-Y587 HydrophobicContact CG-CG 4.47Å
558	V	83.8	Confident	87.1	Confident	58 Å²	58	46.4 Å²	46.4	35%	0.352	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-56.2	-31.7	-177.1	-174.3	0	0	0	0	112.7	P554 F556 S560 T561 R629 L631	P554-V558 HydrophobicContact CG-CG2 3.77Å; F556-V558 PolarHBondContact O-N 3.44Å; V558-S560 PolarHBondContact O-N 3.49Å; V558-T561 PolarHBondContact O-N 3.48Å; V558-T561 PolarHBondContact O-OG1 2.93Å; V558-R629 HydrophobicContact CG2-CB 4.48Å; V558-L631 HydrophobicContact CG1-CD2 3.64Å
559	S	84.1	Confident	86.8	Confident	112 Å²	112	53.9 Å²	53.9	78%	0.783	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-62.7	-21.3	175.1	49.4	0	0	0	0	114.6	P557	P557-S559 PolarHBondContact O-N 3.27Å; P557-S559 VanDerWaalsContact O-N 3.09Å
560	S	87.3	Confident	86.7	Confident	5 Å²	5	48.8 Å²	48.8	4%	0.035	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-100.8	-12.7	-179.9	67.6	0	0	0	0	113.8	P557 V558 S562 Q563 L564 Y587	P557-S560 PolarHBondContact O-N 2.97Å; P557-S560 PolarHBondContact O-OG 3.36Å; V558-S560 PolarHBondContact O-N 3.49Å; S560-S562 VanDerWaalsContact C-N 3.32Å; S560-S562 PolarHBondContact O-N 3.18Å; S560-Q563 PolarHBondContact O-N 3.02Å; S560-L564 WeakPolarHBondContact O-CG 3.37Å; S560-L564 PolarHBondContact O-N 3.14Å; S560-Y587 PolarHBondContact OG-OH 3.5Å
561	T	85.2	Confident	86.5	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.018	30%	0.3	C	S	.	.	H	α-helix	trans	-52	-45.5	-172.6	-61.4	0	0	0	0	112.9	V558 Q563 L564 L565 V628	V558-T561 PolarHBondContact O-N 3.48Å; V558-T561 PolarHBondContact O-OG1 2.93Å; T561-Q563 PolarHBondContact O-N 3.18Å; T561-L564 PolarHBondContact O-N 3Å; T561-L565 HydrophobicContact CG2-CD1 3.9Å; T561-L565 HydrophobicContact CG2-CG 4.44Å; T561-L565 VanDerWaalsContact O-CG 3.28Å; T561-L565 WeakPolarHBondContact O-CG 3.44Å; T561-L565 PolarHBondContact O-N 3.01Å; T561-V628 HydrophobicContact CG2-CG1 3.9Å
562	S	84.3	Confident	86.7	Confident	59 Å²	59	60.7 Å²	60.7	41%	0.413	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-44.3	179.2	-48.8	0	0	0	0	112.7	S560 L564 L565 E566	S560-S562 VanDerWaalsContact C-N 3.32Å; S560-S562 PolarHBondContact O-N 3.18Å; S562-L564 VanDerWaalsContact C-N 3.33Å; S562-L564 PolarHBondContact O-N 3.41Å; S562-L565 PolarHBondContact O-N 2.91Å; S562-E566 WeakPolarHBondContact O-CG 3.14Å; S562-E566 PolarHBondContact O-N 3.03Å
563	Q	87.8	Confident	86.8	Confident	107 Å²	107	60.9 Å²	60.9	50%	0.5	32%	0.322	S	S	.	.	H	α-helix	trans	-65.2	-37.9	-179.9	-61.9	178.7	-4.4	0	0	111.6	S560 T561 E566 C567 I583	S560-Q563 PolarHBondContact O-N 3.02Å; T561-Q563 PolarHBondContact O-N 3.18Å; Q563-E566 PolarHBondContact O-N 3.37Å; Q563-C567 PolarHBondContact O-N 2.93Å; Q563-C567 PolarHBondContact O-SG 3.47Å; Q563-I583 HydrophobicContact CB-CD1 3.95Å
564	L	87.7	Confident	87	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-66.6	-38.6	174.9	-64	166.6	0	0	0	111.9	F556 S560 T561 S562 C567 L580 I583 L646	F556-L564 HydrophobicContact CB-CD1 4.3Å; F556-L564 HydrophobicContact CD1-CD1 3.58Å; F556-L564 HydrophobicContact CE1-CD1 4.35Å; F556-L564 HydrophobicContact CG-CD1 4.32Å; S560-L564 WeakPolarHBondContact O-CG 3.37Å; S560-L564 PolarHBondContact O-N 3.14Å; T561-L564 PolarHBondContact O-N 3Å; S562-L564 VanDerWaalsContact C-N 3.33Å; S562-L564 PolarHBondContact O-N 3.41Å; L564-C567 WeakPolarHBondContact O-CB 3.47Å; L564-C567 PolarHBondContact O-N 3.48Å; L564-L580 HydrophobicContact CD2-CD2 3.8Å; L564-I583 HydrophobicContact CD2-CB 4.23Å; L564-I583 HydrophobicContact CD2-CD1 4.13Å; L564-I583 HydrophobicContact CD2-CG2 3.74Å; L564-I583 HydrophobicContact CG-CG2 4.23Å; L564-L646 HydrophobicContact CB-CD1 4.23Å; L564-L646 HydrophobicContact CB-CD2 3.66Å
565	L	87.6	Confident	87.2	Confident	23 Å²	23	63 Å²	63	12%	0.12	34%	0.339	C	S	.	.	H	α-helix	trans	-71.8	-32.6	178.3	-68.1	172.9	0	0	0	112.3	T561 S562 C567 N568 V639 Q642 I643 L646	T561-L565 HydrophobicContact CG2-CD1 3.9Å; T561-L565 HydrophobicContact CG2-CG 4.44Å; T561-L565 VanDerWaalsContact O-CG 3.28Å; T561-L565 WeakPolarHBondContact O-CG 3.44Å; T561-L565 PolarHBondContact O-N 3.01Å; S562-L565 PolarHBondContact O-N 2.91Å; L565-C567 VanDerWaalsContact C-N 3.25Å; L565-C567 PolarHBondContact O-N 3.04Å; L565-N568 WeakPolarHBondContact O-CB 3.3Å; L565-N568 PolarHBondContact O-N 3.04Å; L565-N568 VanDerWaalsContact O-N 3.15Å; L565-N568 PolarHBondContact O-ND2 3.12Å; L565-V639 HydrophobicContact CD1-CG1 3.62Å; L565-Q642 HydrophobicContact CD2-CB 3.75Å; L565-I643 HydrophobicContact CD2-CG1 4.07Å; L565-L646 HydrophobicContact CD2-CD2 4.3Å
566	E	87.6	Confident	87.3	Confident	118 Å²	118	64.6 Å²	64.6	55%	0.551	35%	0.345	S	S	*	.	H	α-helix	trans	-59.3	-34.1	171	-76	170.7	-160.1	0	0	112.4	S562 Q563 N568 Q569	S562-E566 WeakPolarHBondContact O-CG 3.14Å; S562-E566 PolarHBondContact O-N 3.03Å; Q563-E566 PolarHBondContact O-N 3.37Å; E566-N568 PolarHBondContact O-N 3.36Å; E566-N568 VanDerWaalsContact O-N 3.11Å; E566-Q569 WeakPolarHBondContact O-CB 3.29Å; E566-Q569 PolarHBondContact O-N 3.1Å
567	C	87.6	Confident	87.3	Confident	7 Å²	7	64.8 Å²	64.8	5%	0.047	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-58.8	-23.6	175.8	-65	0	0	0	0	113.6	Q563 L564 L565 Q569 I570 R576 L580	Q563-C567 PolarHBondContact O-N 2.93Å; Q563-C567 PolarHBondContact O-SG 3.47Å; L564-C567 WeakPolarHBondContact O-CB 3.47Å; L564-C567 PolarHBondContact O-N 3.48Å; L565-C567 VanDerWaalsContact C-N 3.25Å; L565-C567 PolarHBondContact O-N 3.04Å; C567-Q569 PolarHBondContact O-N 3.29Å; C567-I570 WeakPolarHBondContact O-CB 3.41Å; C567-I570 PolarHBondContact O-N 3.33Å; C567-R576 HydrophobicContact CB-CG 4.13Å; C567-R576 WeakPolarHBondContact O-CD 3.45Å; C567-R576 WeakPolarHBondContact O-CG 3.38Å; C567-L580 HydrophobicContact CB-CD2 3.93Å; C567-L580 HydrophobicContact CB-CG 4.17Å
568	N	84.7	Confident	87.5	Confident	53 Å²	53	66 Å²	66	28%	0.283	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-65.8	-16.2	174.8	-70.7	-45.9	0	0	0	113.7	L565 E566 I570 Q642 L646	L565-N568 WeakPolarHBondContact O-CB 3.3Å; L565-N568 PolarHBondContact O-N 3.04Å; L565-N568 VanDerWaalsContact O-N 3.15Å; L565-N568 PolarHBondContact O-ND2 3.12Å; E566-N568 PolarHBondContact O-N 3.36Å; E566-N568 VanDerWaalsContact O-N 3.11Å; N568-I570 VanDerWaalsContact C-N 3.32Å; N568-Q642 PolarHBondContact ND2-O 2.76Å; N568-L646 PolarHBondContact OD1-N 3.18Å
569	Q	85.6	Confident	87.8	Confident	159 Å²	159	70 Å²	70	74%	0.743	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-80.8	-15.6	177.4	-55.9	-174.4	36	0	0	112.6	E566 C567 K571	E566-Q569 WeakPolarHBondContact O-CB 3.29Å; E566-Q569 PolarHBondContact O-N 3.1Å; C567-Q569 PolarHBondContact O-N 3.29Å; Q569-K571 PolarHBondContact O-N 2.88Å
570	I	88.3	Confident	88.2	Confident	33 Å²	33	64.7 Å²	64.7	17%	0.169	33%	0.331	C	S	.	.			trans	-78.1	117.5	-179	-54.8	175.3	0	0	0	109.2	C567 N568 E575 R576 R579	C567-I570 WeakPolarHBondContact O-CB 3.41Å; C567-I570 PolarHBondContact O-N 3.33Å; N568-I570 VanDerWaalsContact C-N 3.32Å; I570-E575 HydrophobicContact CG2-CB 3.93Å; I570-E575 HydrophobicContact CG2-CG 4.05Å; I570-R576 HydrophobicContact CB-CB 4.08Å; I570-R576 HydrophobicContact CB-CG 4.4Å; I570-R576 HydrophobicContact CG2-CB 4.06Å; I570-R579 HydrophobicContact CD1-CB 4.17Å; I570-R579 HydrophobicContact CD1-CG 3.72Å
571	K	85.3	Confident	88.5	Confident	205 Å²	205	67 Å²	67	89%	0.891	34%	0.341	S	S	*	.			trans	-78.5	-26.2	-177.8	-70.8	-174.2	178.2	179.7	0	114.2	Q569	Q569-K571 PolarHBondContact O-N 2.88Å
572	D	90.2	Very high	88.8	Confident	87 Å²	87	70 Å²	70	47%	0.465	37%	0.365	S	S	.	.			trans	-84	128.7	175.1	-179.1	58.7	0	0	0	110.4	A574 E575 R576	D572-A574 VanDerWaalsContact C-N 3.35Å; D572-A574 WeakPolarHBondContact OD2-CB 3.3Å; D572-A574 PolarHBondContact OD2-N 2.92Å; D572-A574 VanDerWaalsContact OD2-N 3.15Å; D572-E575 HydrophobicContact CB-CB 4.18Å; D572-E575 PolarHBondContact OD2-N 2.84Å; D572-R576 VanDerWaalsContact O-CB 3.32Å; D572-R576 WeakPolarHBondContact O-CB 3.43Å; D572-R576 PolarHBondContact O-N 3.37Å; D572-R576 VanDerWaalsContact O-N 3.09Å
573	D	86.5	Confident	89.2	Confident	91 Å²	91	68.1 Å²	68.1	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-70.8	-31.8	-176.6	-77.4	-15.7	0	0	0	111.7	R576 A577 Q653	D573-R576 IonicContact OD1-CZ 2.93Å; D573-R576 IonicContact OD1-NH1 3.13Å; D573-R576 PolarHBondContact OD1-NH1 3.46Å; D573-R576 IonicContact OD1-NH2 3.84Å; D573-R576 PolarHBondContact OD1-NH2 3.49Å; D573-A577 PolarHBondContact O-N 2.84Å; D573-Q653 PolarHBondContact O-NE2 2.88Å
574	A	88.8	Confident	89.4	Confident	68 Å²	68	63.1 Å²	63.1	56%	0.562	33%	0.327	S	S	*	.	H	α-helix	trans	-76.4	-45.1	-179.9	0	0	0	0	0	112.1	D572 R576 A577 A578	D572-A574 VanDerWaalsContact C-N 3.35Å; D572-A574 WeakPolarHBondContact OD2-CB 3.3Å; D572-A574 PolarHBondContact OD2-N 2.92Å; D572-A574 VanDerWaalsContact OD2-N 3.15Å; A574-R576 VanDerWaalsContact C-N 3.3Å; A574-R576 PolarHBondContact O-N 3.4Å; A574-A577 PolarHBondContact O-N 3.41Å; A574-A578 PolarHBondContact O-N 3.36Å
575	E	90.9	Very high	89.5	Confident	94 Å²	94	66.3 Å²	66.3	44%	0.439	35%	0.35	S	S	.	.	H	α-helix	trans	-58.5	-43.6	172.1	-173.4	-176.3	-175.3	0	0	110.6	I570 D572 A577 A578 R579	I570-E575 HydrophobicContact CG2-CB 3.93Å; I570-E575 HydrophobicContact CG2-CG 4.05Å; D572-E575 HydrophobicContact CB-CB 4.18Å; D572-E575 PolarHBondContact OD2-N 2.84Å; E575-A577 PolarHBondContact O-N 2.85Å; E575-A578 PolarHBondContact O-N 3.12Å; E575-R579 HydrophobicContact CG-CG 4.45Å; E575-R579 WeakPolarHBondContact O-CG 3.19Å; E575-R579 PolarHBondContact O-N 3.1Å; E575-R579 IonicContact OE1-NH2 3.99Å
576	R	91.6	Very high	89.7	Confident	37 Å²	37	70.3 Å²	70.3	14%	0.14	38%	0.375	C	S	.	.	H	α-helix	trans	-61.1	-44.3	177.5	-169.7	178.5	64.7	-112.6	-7	112	C567 I570 D572 D573 A574 R579 L580	C567-R576 HydrophobicContact CB-CG 4.13Å; C567-R576 WeakPolarHBondContact O-CD 3.45Å; C567-R576 WeakPolarHBondContact O-CG 3.38Å; I570-R576 HydrophobicContact CB-CB 4.08Å; I570-R576 HydrophobicContact CB-CG 4.4Å; I570-R576 HydrophobicContact CG2-CB 4.06Å; D572-R576 VanDerWaalsContact O-CB 3.32Å; D572-R576 WeakPolarHBondContact O-CB 3.43Å; D572-R576 PolarHBondContact O-N 3.37Å; D572-R576 VanDerWaalsContact O-N 3.09Å; D573-R576 IonicContact OD1-CZ 2.93Å; D573-R576 IonicContact OD1-NH1 3.13Å; D573-R576 PolarHBondContact OD1-NH1 3.46Å; D573-R576 IonicContact OD1-NH2 3.84Å; D573-R576 PolarHBondContact OD1-NH2 3.49Å; A574-R576 VanDerWaalsContact C-N 3.3Å; A574-R576 PolarHBondContact O-N 3.4Å; R576-R579 PolarHBondContact O-N 3.47Å; R576-L580 HydrophobicContact CG-CD1 4.11Å; R576-L580 WeakPolarHBondContact O-CB 3.28Å; R576-L580 VanDerWaalsContact O-CG 3.31Å; R576-L580 WeakPolarHBondContact O-CG 3.45Å; R576-L580 PolarHBondContact O-N 3.21Å
577	A	91	Very high	89.9	Confident	4 Å²	4	65.5 Å²	65.5	3%	0.033	35%	0.352	C	S	.	.	H	α-helix	trans	-62.6	-42.9	175.9	0	0	0	0	0	112.3	D573 A574 E575 R579 L580 K581 Q653 I657	D573-A577 PolarHBondContact O-N 2.84Å; A574-A577 PolarHBondContact O-N 3.41Å; E575-A577 PolarHBondContact O-N 2.85Å; A577-R579 PolarHBondContact O-N 2.87Å; A577-L580 PolarHBondContact O-N 3.44Å; A577-K581 PolarHBondContact O-N 3.43Å; A577-Q653 HydrophobicContact CB-CB 4.43Å; A577-I657 HydrophobicContact CB-CG1 4.08Å
578	A	91	Very high	90	Very high	63 Å²	63	68.1 Å²	68.1	52%	0.521	37%	0.369	S	S	.	.	H	α-helix	trans	-62.7	-39.8	177.4	0	0	0	0	0	112.5	A574 E575 K581 A582	A574-A578 PolarHBondContact O-N 3.36Å; E575-A578 PolarHBondContact O-N 3.12Å; A578-K581 PolarHBondContact O-N 3.26Å; A578-A582 PolarHBondContact O-N 3.31Å
579	R	91.4	Very high	90.2	Very high	141 Å²	141	69.9 Å²	69.9	53%	0.532	38%	0.376	S	S	.	.	H	α-helix	trans	-65	-42.1	173.4	-69.1	-66.9	-169.1	151.8	5.3	112.3	I570 E575 R576 A577 A582 I583	I570-R579 HydrophobicContact CD1-CB 4.17Å; I570-R579 HydrophobicContact CD1-CG 3.72Å; E575-R579 HydrophobicContact CG-CG 4.45Å; E575-R579 WeakPolarHBondContact O-CG 3.19Å; E575-R579 PolarHBondContact O-N 3.1Å; E575-R579 IonicContact OE1-NH2 3.99Å; R576-R579 PolarHBondContact O-N 3.47Å; A577-R579 PolarHBondContact O-N 2.87Å; R579-A582 PolarHBondContact O-N 2.81Å; R579-I583 WeakPolarHBondContact O-CG1 3.5Å; R579-I583 PolarHBondContact O-N 2.9Å; R579-I583 VanDerWaalsContact O-N 3.13Å
580	L	92.8	Very high	90.4	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-65.7	-41	176.4	-71.2	169.7	0	0	0	111.9	L564 C567 R576 A577 A582 I583 V584 L646 I650 I657	L564-L580 HydrophobicContact CD2-CD2 3.8Å; C567-L580 HydrophobicContact CB-CD2 3.93Å; C567-L580 HydrophobicContact CB-CG 4.17Å; R576-L580 HydrophobicContact CG-CD1 4.11Å; R576-L580 WeakPolarHBondContact O-CB 3.28Å; R576-L580 VanDerWaalsContact O-CG 3.31Å; R576-L580 WeakPolarHBondContact O-CG 3.45Å; R576-L580 PolarHBondContact O-N 3.21Å; A577-L580 PolarHBondContact O-N 3.44Å; L580-A582 PolarHBondContact O-N 2.79Å; L580-I583 PolarHBondContact O-N 3Å; L580-V584 WeakPolarHBondContact O-CB 3.24Å; L580-V584 VanDerWaalsContact O-CG2 3.31Å; L580-V584 WeakPolarHBondContact O-CG2 3.28Å; L580-V584 PolarHBondContact O-N 2.68Å; L580-L646 HydrophobicContact CD1-CD1 4.43Å; L580-L646 HydrophobicContact CD2-CD1 3.72Å; L580-I650 HydrophobicContact CD1-CG1 4.17Å; L580-I657 HydrophobicContact CB-CD1 4Å; L580-I657 HydrophobicContact CB-CG1 4.01Å; L580-I657 HydrophobicContact CB-CG2 4.14Å; L580-I657 HydrophobicContact CD1-CD1 3.78Å
581	K	92.9	Very high	90.5	Very high	54 Å²	54	63 Å²	63	24%	0.235	35%	0.346	C	S	.	.	H	α-helix	trans	-57.1	-48.3	171.8	-176.5	161.5	-175.9	175.1	0	110.9	A577 A578 I583 V584 S585 I657 E663	A577-K581 PolarHBondContact O-N 3.43Å; A578-K581 PolarHBondContact O-N 3.26Å; K581-I583 VanDerWaalsContact C-N 3.3Å; K581-I583 PolarHBondContact O-N 3.07Å; K581-V584 PolarHBondContact O-N 3.42Å; K581-S585 WeakPolarHBondContact O-CB 3.35Å; K581-S585 PolarHBondContact O-N 2.75Å; K581-S585 PolarHBondContact O-OG 3.06Å; K581-S585 VanDerWaalsContact O-OG 3.13Å; K581-I657 WeakPolarHBondContact CA-O 3.45Å; K581-I657 WeakPolarHBondContact CB-O 3.43Å; K581-I657 WeakPolarHBondContact CG-O 3.47Å; K581-E663 WeakPolarHBondContact CE-OE2 3.37Å; K581-E663 VanDerWaalsContact NZ-CD 3.25Å; K581-E663 IonicContact NZ-OE1 3.35Å; K581-E663 PolarHBondContact NZ-OE1 3.36Å; K581-E663 IonicContact NZ-OE2 2.83Å; K581-E663 PolarHBondContact NZ-OE2 3.04Å
582	A	92.1	Very high	90.8	Very high	64 Å²	64	53.7 Å²	53.7	53%	0.529	31%	0.306	S	S	.	.	H	α-helix	trans	-59.8	-35.6	180	0	0	0	0	0	113.7	A578 R579 L580	A578-A582 PolarHBondContact O-N 3.31Å; R579-A582 PolarHBondContact O-N 2.81Å; L580-A582 PolarHBondContact O-N 2.79Å
583	I	92.1	Very high	90.8	Very high	21 Å²	21	49.6 Å²	49.6	11%	0.108	28%	0.284	C	S	.	.	H	α-helix	trans	-73.1	-48.6	174.5	-62	165.6	0	0	0	110.5	Q563 L564 R579 L580 K581 S585 T586 Y587	Q563-I583 HydrophobicContact CB-CD1 3.95Å; L564-I583 HydrophobicContact CD2-CB 4.23Å; L564-I583 HydrophobicContact CD2-CD1 4.13Å; L564-I583 HydrophobicContact CD2-CG2 3.74Å; L564-I583 HydrophobicContact CG-CG2 4.23Å; R579-I583 WeakPolarHBondContact O-CG1 3.5Å; R579-I583 PolarHBondContact O-N 2.9Å; R579-I583 VanDerWaalsContact O-N 3.13Å; L580-I583 PolarHBondContact O-N 3Å; K581-I583 VanDerWaalsContact C-N 3.3Å; K581-I583 PolarHBondContact O-N 3.07Å; I583-S585 VanDerWaalsContact C-N 3.29Å; I583-S585 PolarHBondContact O-N 3.1Å; I583-T586 WeakPolarHBondContact O-CB 3.24Å; I583-T586 PolarHBondContact O-N 3.29Å; I583-T586 PolarHBondContact O-OG1 3.31Å; I583-Y587 HydrophobicContact CG2-CE1 4.34Å
584	V	91.9	Very high	91.1	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-35.6	-178.3	170.1	0	0	0	0	112	L580 K581 T586 Y587 I592 I657 F658	L580-V584 WeakPolarHBondContact O-CB 3.24Å; L580-V584 VanDerWaalsContact O-CG2 3.31Å; L580-V584 WeakPolarHBondContact O-CG2 3.28Å; L580-V584 PolarHBondContact O-N 2.68Å; K581-V584 PolarHBondContact O-N 3.42Å; V584-T586 PolarHBondContact O-N 2.89Å; V584-T586 VanDerWaalsContact O-N 3.07Å; V584-Y587 HydrophobicContact CB-CE2 4.41Å; V584-Y587 HydrophobicContact CG1-CD2 4.36Å; V584-Y587 HydrophobicContact CG2-CE2 4.09Å; V584-Y587 WeakPolarHBondContact O-CB 3.28Å; V584-Y587 PolarHBondContact O-N 2.99Å; V584-I592 HydrophobicContact CG1-CG1 4.36Å; V584-I592 HydrophobicContact CG1-CG2 4.49Å; V584-I592 WeakPolarHBondContact O-CD1 3.39Å; V584-I657 HydrophobicContact CG2-CG2 4.19Å; V584-F658 HydrophobicContact CG1-CD1 3.83Å; V584-F658 HydrophobicContact CG1-CE1 3.76Å; V584-F658 HydrophobicContact CG2-CE1 4.44Å
585	S	90.3	Very high	91.4	Very high	68 Å²	68	42 Å²	42	48%	0.476	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-7.2	174	-68.4	0	0	0	0	114.8	K581 I583	K581-S585 WeakPolarHBondContact O-CB 3.35Å; K581-S585 PolarHBondContact O-N 2.75Å; K581-S585 PolarHBondContact O-OG 3.06Å; K581-S585 VanDerWaalsContact O-OG 3.13Å; I583-S585 VanDerWaalsContact C-N 3.29Å; I583-S585 PolarHBondContact O-N 3.1Å
586	T	91.8	Very high	91.5	Very high	106 Å²	106	38.1 Å²	38.1	65%	0.65	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-9.8	171.4	70.1	0	0	0	0	113.7	I583 V584	I583-T586 WeakPolarHBondContact O-CB 3.24Å; I583-T586 PolarHBondContact O-N 3.29Å; I583-T586 PolarHBondContact O-OG1 3.31Å; V584-T586 PolarHBondContact O-N 2.89Å; V584-T586 VanDerWaalsContact O-N 3.07Å
587	Y	91.4	Very high	91.6	Very high	18 Å²	18	36.7 Å²	36.7	7%	0.071	21%	0.21	C	C	.	.	S	Bend	trans	-83.3	159.7	-176.6	-56.4	-16.1	0	0	0	112.2	F556 P557 S560 I583 V584 E589 I592 M595	F556-Y587 HydrophobicContact CD1-CE2 4.41Å; P557-Y587 HydrophobicContact CG-CD1 4.04Å; P557-Y587 HydrophobicContact CG-CE1 3.99Å; P557-Y587 HydrophobicContact CG-CG 4.47Å; S560-Y587 PolarHBondContact OG-OH 3.5Å; I583-Y587 HydrophobicContact CG2-CE1 4.34Å; V584-Y587 HydrophobicContact CB-CE2 4.41Å; V584-Y587 HydrophobicContact CG1-CD2 4.36Å; V584-Y587 HydrophobicContact CG2-CE2 4.09Å; V584-Y587 WeakPolarHBondContact O-CB 3.28Å; V584-Y587 PolarHBondContact O-N 2.99Å; Y587-E589 PolarHBondContact O-N 3.49Å; Y587-I592 WeakPolarHBondContact O-CD1 3.37Å; Y587-M595 HydrophobicContact CD2-CE 4.39Å; Y587-M595 HydrophobicContact CD2-SD 3.82Å; Y587-M595 HydrophobicContact CE2-CE 4.04Å; Y587-M595 HydrophobicContact CE2-SD 4.08Å
588	P	90.5	Very high	91.8	Very high	61 Å²	61	36.5 Å²	36.5	40%	0.396	21%	0.209	S	C	.	.			trans	-61.6	136	174.4	-23.6	35.7	0	0	0	112.1	L475 P590 V591 I592	L475-P588 HydrophobicContact CD1-CB 4.24Å; L475-P588 HydrophobicContact CD1-CG 4.03Å; L475-P588 HydrophobicContact CD2-CB 4.05Å; P588-P590 VanDerWaalsContact C-CD 3.4Å; P588-P590 VanDerWaalsContact C-N 3.34Å; P588-P590 VanDerWaalsContact O-N 3.12Å; P588-V591 HydrophobicContact CB-CG2 4.3Å; P588-V591 HydrophobicContact CG-CG2 4.49Å; P588-V591 WeakPolarHBondContact O-CA 3.4Å; P588-V591 WeakPolarHBondContact O-CB 3.3Å; P588-V591 PolarHBondContact O-N 3.45Å; P588-I592 PolarHBondContact O-N 3.3Å
589	E	88.3	Confident	92	Very high	91 Å²	91	33.5 Å²	33.5	43%	0.425	18%	0.184	S	C	.	.	H	α-helix	trans	-44.1	-45.2	-178.4	-173.1	-162.9	131	0	0	114.6	R484 Y587 V591 I592 V593 V664	R484-E589 IonicContact CZ-OE1 3.8Å; R484-E589 IonicContact NH1-OE1 3.66Å; R484-E589 PolarHBondContact NH1-OE1 2.85Å; R484-E589 IonicContact NH2-OE1 2.98Å; Y587-E589 PolarHBondContact O-N 3.49Å; E589-V591 VanDerWaalsContact C-N 3.31Å; E589-V591 PolarHBondContact O-N 2.87Å; E589-I592 WeakPolarHBondContact O-CB 3.49Å; E589-I592 PolarHBondContact O-N 2.87Å; E589-I592 VanDerWaalsContact O-N 3.14Å; E589-V593 WeakPolarHBondContact O-CG2 3.34Å; E589-V593 PolarHBondContact O-N 3.22Å; E589-V664 HydrophobicContact CG-CG1 3.64Å
590	P	89	Confident	92.1	Very high	30 Å²	30	27.5 Å²	27.5	20%	0.195	17%	0.165	C	C	.	.	H	α-helix	trans	-66.4	-30.4	179.7	-19.2	33.4	0	0	0	113.7	L475 I478 P588 V594	L475-P590 HydrophobicContact CD2-CB 4.01Å; L475-P590 HydrophobicContact CD2-CG 3.97Å; I478-P590 HydrophobicContact CD1-CB 3.96Å; I478-P590 HydrophobicContact CG2-CB 4.16Å; P588-P590 VanDerWaalsContact C-CD 3.4Å; P588-P590 VanDerWaalsContact C-N 3.34Å; P588-P590 VanDerWaalsContact O-N 3.12Å; P590-V594 WeakPolarHBondContact O-CG2 3.21Å; P590-V594 PolarHBondContact O-N 3.11Å; P590-V594 VanDerWaalsContact O-N 3.13Å
591	V	90.2	Very high	92.2	Very high	17 Å²	17	27.4 Å²	27.4	10%	0.103	16%	0.164	C	C	.	.	H	α-helix	trans	-68	-44	173.8	-176.6	0	0	0	0	109.3	L475 L555 P588 E589 V593 V594 M595	L475-V591 HydrophobicContact CD1-CG2 4.48Å; L475-V591 HydrophobicContact CD2-CG2 3.99Å; L475-V591 HydrophobicContact CG-CG2 4.29Å; L555-V591 HydrophobicContact CD1-CG1 4.05Å; P588-V591 HydrophobicContact CB-CG2 4.3Å; P588-V591 HydrophobicContact CG-CG2 4.49Å; P588-V591 WeakPolarHBondContact O-CA 3.4Å; P588-V591 WeakPolarHBondContact O-CB 3.3Å; P588-V591 PolarHBondContact O-N 3.45Å; E589-V591 VanDerWaalsContact C-N 3.31Å; E589-V591 PolarHBondContact O-N 2.87Å; V591-V593 VanDerWaalsContact C-N 3.32Å; V591-V593 PolarHBondContact O-N 3.31Å; V591-V594 PolarHBondContact O-N 3.34Å; V591-M595 HydrophobicContact CG1-CG 4.19Å; V591-M595 HydrophobicContact CG1-SD 3.89Å; V591-M595 WeakPolarHBondContact O-CB 3.17Å; V591-M595 WeakPolarHBondContact O-CG 3.41Å; V591-M595 PolarHBondContact O-N 3.45Å
592	I	91.6	Very high	92.4	Very high	9 Å²	9	24.9 Å²	24.9	5%	0.046	15%	0.153	C	C	.	.	H	α-helix	trans	-60.4	-41.5	177.7	-59.3	177.8	0	0	0	111.1	V584 Y587 P588 E589 M595 R596 P659	V584-I592 HydrophobicContact CG1-CG1 4.36Å; V584-I592 HydrophobicContact CG1-CG2 4.49Å; V584-I592 WeakPolarHBondContact O-CD1 3.39Å; Y587-I592 WeakPolarHBondContact O-CD1 3.37Å; P588-I592 PolarHBondContact O-N 3.3Å; E589-I592 WeakPolarHBondContact O-CB 3.49Å; E589-I592 PolarHBondContact O-N 2.87Å; E589-I592 VanDerWaalsContact O-N 3.14Å; I592-M595 PolarHBondContact O-N 2.66Å; I592-R596 VanDerWaalsContact O-CB 3.24Å; I592-R596 WeakPolarHBondContact O-CB 3.46Å; I592-R596 PolarHBondContact O-N 3.48Å; I592-P659 VanDerWaalsContact CG2-CD 3.46Å; I592-P659 HydrophobicContact CG2-CG 3.46Å; I592-P659 VanDerWaalsContact CG2-CG 3.46Å
593	V	91.3	Very high	92.5	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-61.9	-47.8	175.6	172	0	0	0	0	111.7	I485 E589 V591 M595 R596 Y597 V664	I485-V593 HydrophobicContact CG1-CG1 4.17Å; E589-V593 WeakPolarHBondContact O-CG2 3.34Å; E589-V593 PolarHBondContact O-N 3.22Å; V591-V593 VanDerWaalsContact C-N 3.32Å; V591-V593 PolarHBondContact O-N 3.31Å; V593-M595 PolarHBondContact O-N 3.08Å; V593-R596 PolarHBondContact O-N 3.45Å; V593-Y597 PolarHBondContact O-N 3.27Å; V593-V664 HydrophobicContact CG2-CG1 3.67Å
594	V	92.5	Very high	92.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.6	-39.4	177.7	172.4	0	0	0	0	111.8	M474 I478 I485 F548 L555 P590 V591 L598	M474-V594 HydrophobicContact CE-CG1 4.13Å; M474-V594 HydrophobicContact SD-CB 4.29Å; M474-V594 HydrophobicContact SD-CG1 4.16Å; M474-V594 HydrophobicContact SD-CG2 4.09Å; I478-V594 HydrophobicContact CD1-CG2 4.22Å; I485-V594 HydrophobicContact CG1-CG2 4.44Å; F548-V594 HydrophobicContact CE1-CG1 3.93Å; F548-V594 HydrophobicContact CZ-CG1 4.26Å; L555-V594 HydrophobicContact CD1-CG1 4.12Å; P590-V594 WeakPolarHBondContact O-CG2 3.21Å; P590-V594 PolarHBondContact O-N 3.11Å; P590-V594 VanDerWaalsContact O-N 3.13Å; V591-V594 PolarHBondContact O-N 3.34Å; V594-L598 WeakPolarHBondContact O-CB 3.49Å; V594-L598 PolarHBondContact O-N 3.24Å
595	M	94	Very high	92.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.7	-47.4	174.1	-68.7	175.2	94.8	0	0	111.7	L555 F556 Y587 V591 I592 V593 Y597 L598 F599 F658	L555-M595 HydrophobicContact CD1-CG 3.98Å; L555-M595 HydrophobicContact CD2-CG 3.73Å; L555-M595 HydrophobicContact CG-CG 3.67Å; F556-M595 HydrophobicContact CD1-CE 3.61Å; F556-M595 HydrophobicContact CD2-CE 4.05Å; F556-M595 HydrophobicContact CE1-CE 3.24Å; F556-M595 HydrophobicContact CE2-CE 3.71Å; F556-M595 HydrophobicContact CG-CE 4.02Å; F556-M595 HydrophobicContact CZ-CE 3.29Å; Y587-M595 HydrophobicContact CD2-CE 4.39Å; Y587-M595 HydrophobicContact CD2-SD 3.82Å; Y587-M595 HydrophobicContact CE2-CE 4.04Å; Y587-M595 HydrophobicContact CE2-SD 4.08Å; V591-M595 HydrophobicContact CG1-CG 4.19Å; V591-M595 HydrophobicContact CG1-SD 3.89Å; V591-M595 WeakPolarHBondContact O-CB 3.17Å; V591-M595 WeakPolarHBondContact O-CG 3.41Å; V591-M595 PolarHBondContact O-N 3.45Å; I592-M595 PolarHBondContact O-N 2.66Å; V593-M595 PolarHBondContact O-N 3.08Å; M595-Y597 VanDerWaalsContact C-N 3.32Å; M595-Y597 PolarHBondContact O-N 2.93Å; M595-L598 PolarHBondContact O-N 3.28Å; M595-F599 HydrophobicContact CB-CD2 4.42Å; M595-F599 WeakPolarHBondContact O-CB 3.15Å; M595-F599 WeakPolarHBondContact O-CD2 3.49Å; M595-F599 PolarHBondContact O-N 2.9Å; M595-F658 HydrophobicContact CB-CD1 4.17Å; M595-F658 HydrophobicContact CB-CE1 3.47Å; M595-F658 VanDerWaalsContact CB-CE1 3.47Å; M595-F658 HydrophobicContact CB-CZ 3.93Å; M595-F658 HydrophobicContact CE-CE1 4.27Å; M595-F658 HydrophobicContact CE-CZ 4.48Å; M595-F658 HydrophobicContact CG-CE1 4.42Å; M595-F658 HydrophobicContact SD-CE1 4.26Å
596	R	93.8	Very high	92.9	Very high	12 Å²	12	19.8 Å²	19.8	5%	0.045	11%	0.111	C	C	.	.	H	α-helix	trans	-55.9	-46.6	178.3	-178.2	174.6	73.3	178.8	9.2	111.4	I592 V593 A600 F658 P659 S660 V664 P667 M668	I592-R596 VanDerWaalsContact O-CB 3.24Å; I592-R596 WeakPolarHBondContact O-CB 3.46Å; I592-R596 PolarHBondContact O-N 3.48Å; V593-R596 PolarHBondContact O-N 3.45Å; R596-A600 VanDerWaalsContact O-CB 3.24Å; R596-A600 WeakPolarHBondContact O-CB 3.44Å; R596-A600 PolarHBondContact O-N 3.03Å; R596-A600 VanDerWaalsContact O-N 3.1Å; R596-F658 HydrophobicContact CB-CB 4.01Å; R596-F658 HydrophobicContact CB-CD1 4.48Å; R596-F658 HydrophobicContact CB-CG 4.22Å; R596-F658 HydrophobicContact CG-CB 3.98Å; R596-P659 WeakPolarHBondContact CD-O 3.45Å; R596-P659 PolarHBondContact NH1-O 3.18Å; R596-S660 PolarHBondContact NH1-O 2.95Å; R596-S660 VanDerWaalsContact NH1-O 3.15Å; R596-V664 PolarHBondContact NH1-O 3.24Å; R596-V664 PolarHBondContact NH2-O 3.32Å; R596-P667 PolarHBondContact NH2-O 2.93Å; R596-M668 HydrophobicContact CG-SD 4.42Å; R596-M668 PolarHBondContact NE-SD 3.02Å
597	Y	93.6	Very high	92.9	Very high	7 Å²	7	19.3 Å²	19.3	3%	0.027	10%	0.102	C	C	.	.	H	α-helix	trans	-64.7	-50.1	177.1	-171.5	-90.5	0	0	0	112	I485 V493 V593 M595 F599 A600 F601 Y669	I485-Y597 HydrophobicContact CD1-CD1 3.98Å; I485-Y597 HydrophobicContact CD1-CD2 3.37Å; I485-Y597 HydrophobicContact CD1-CE1 4.41Å; I485-Y597 HydrophobicContact CD1-CE2 3.88Å; I485-Y597 HydrophobicContact CD1-CG 3.42Å; I485-Y597 VanDerWaalsContact CD1-CG 3.42Å; V493-Y597 HydrophobicContact CB-CE1 3.89Å; V493-Y597 HydrophobicContact CG1-CE1 3.62Å; V493-Y597 HydrophobicContact CG2-CE1 4.04Å; V593-Y597 PolarHBondContact O-N 3.27Å; M595-Y597 VanDerWaalsContact C-N 3.32Å; M595-Y597 PolarHBondContact O-N 2.93Å; Y597-F599 PolarHBondContact O-N 3.49Å; Y597-A600 PolarHBondContact O-N 3.12Å; Y597-F601 WeakPolarHBondContact O-CB 3.45Å; Y597-F601 PolarHBondContact O-N 2.78Å; Y597-Y669 HydrophobicContact CE1-CD2 4.44Å; Y597-Y669 HydrophobicContact CE2-CD2 4.26Å
598	L	95.1	Very high	92.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.8	-47.4	179.8	178.4	66.3	0	0	0	112.3	F548 L555 V594 M595 F601 L602 F623 L627	F548-L598 HydrophobicContact CD2-CD2 4.34Å; F548-L598 HydrophobicContact CE1-CD2 4.17Å; F548-L598 HydrophobicContact CE2-CD1 3.88Å; F548-L598 HydrophobicContact CE2-CD2 3.87Å; F548-L598 HydrophobicContact CE2-CG 4.45Å; F548-L598 HydrophobicContact CZ-CD1 4.19Å; F548-L598 HydrophobicContact CZ-CD2 3.78Å; F548-L598 HydrophobicContact CZ-CG 4.4Å; L555-L598 HydrophobicContact CD2-CD2 3.83Å; V594-L598 WeakPolarHBondContact O-CB 3.49Å; V594-L598 PolarHBondContact O-N 3.24Å; M595-L598 PolarHBondContact O-N 3.28Å; L598-F601 HydrophobicContact CD1-CD1 4.43Å; L598-F601 PolarHBondContact O-N 3.39Å; L598-L602 HydrophobicContact CD1-CD1 4.15Å; L598-L602 HydrophobicContact CD1-CG 4.18Å; L598-L602 HydrophobicContact CG-CD1 4.01Å; L598-L602 HydrophobicContact CG-CG 4.37Å; L598-L602 WeakPolarHBondContact O-CG 3.5Å; L598-L602 PolarHBondContact O-N 3.31Å; L598-F623 HydrophobicContact CD1-CE1 4.3Å; L598-L627 HydrophobicContact CD2-CD1 4.12Å; L598-L627 HydrophobicContact CD2-CD2 3.86Å
599	F	95.6	Very high	93	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-73.1	-31.2	-176.7	-82.5	-79.8	0	0	0	112.9	F556 M595 Y597 H603 L627 V647 I650 I651 H654 F658	F556-F599 AromaticContact CE2-CE2 3.82Å; F556-F599 HydrophobicContact CE2-CE2 3.82Å; F556-F599 AromaticContact CE2-CZ 3.78Å; F556-F599 HydrophobicContact CE2-CZ 3.78Å; F556-F599 AromaticContact CZ-CE2 3.7Å; F556-F599 HydrophobicContact CZ-CE2 3.7Å; F556-F599 AromaticContact CZ-CZ 3.69Å; F556-F599 HydrophobicContact CZ-CZ 3.69Å; M595-F599 HydrophobicContact CB-CD2 4.42Å; M595-F599 WeakPolarHBondContact O-CB 3.15Å; M595-F599 WeakPolarHBondContact O-CD2 3.49Å; M595-F599 PolarHBondContact O-N 2.9Å; Y597-F599 PolarHBondContact O-N 3.49Å; F599-H603 VanDerWaalsContact O-CB 3.3Å; F599-H603 WeakPolarHBondContact O-CB 3.44Å; F599-H603 PolarHBondContact O-N 3.21Å; F599-L627 HydrophobicContact CE2-CD1 4.26Å; F599-L627 HydrophobicContact CZ-CD1 3.84Å; F599-V647 HydrophobicContact CE1-CG1 4.05Å; F599-V647 HydrophobicContact CZ-CG1 4.37Å; F599-I650 HydrophobicContact CD1-CB 4.14Å; F599-I650 HydrophobicContact CD1-CG2 3.53Å; F599-I650 HydrophobicContact CD2-CG2 4.06Å; F599-I650 HydrophobicContact CE1-CB 3.81Å; F599-I650 HydrophobicContact CE1-CG2 3.51Å; F599-I650 HydrophobicContact CE2-CG2 4.06Å; F599-I650 HydrophobicContact CG-CG2 3.81Å; F599-I650 HydrophobicContact CZ-CB 4.27Å; F599-I650 HydrophobicContact CZ-CG2 3.79Å; F599-I651 HydrophobicContact CD1-CG1 3.69Å; F599-I651 HydrophobicContact CE1-CG1 3.82Å; F599-H654 HydrophobicContact CB-CB 4.08Å; F599-F658 HydrophobicContact CB-CD2 4.3Å; F599-F658 HydrophobicContact CB-CE2 3.57Å; F599-F658 HydrophobicContact CB-CZ 4.25Å; F599-F658 AromaticContact CD2-CE2 3.78Å; F599-F658 HydrophobicContact CD2-CE2 3.78Å; F599-F658 AromaticContact CD2-CZ 3.55Å; F599-F658 HydrophobicContact CD2-CZ 3.55Å; F599-F658 HydrophobicContact CE2-CZ 4.16Å; F599-F658 AromaticContact CG-CE2 3.77Å; F599-F658 HydrophobicContact CG-CE2 3.77Å; F599-F658 HydrophobicContact CG-CZ 4.03Å
600	A	94.4	Very high	92.9	Very high	16 Å²	16	15.9 Å²	15.9	13%	0.132	8%	0.082	C	C	.	.	H	α-helix	trans	-65.2	-41.1	169.3	0	0	0	0	0	112	R596 Y597 H603 H604 Y669	R596-A600 VanDerWaalsContact O-CB 3.24Å; R596-A600 WeakPolarHBondContact O-CB 3.44Å; R596-A600 PolarHBondContact O-N 3.03Å; R596-A600 VanDerWaalsContact O-N 3.1Å; Y597-A600 PolarHBondContact O-N 3.12Å; A600-H603 PolarHBondContact O-N 3.06Å; A600-H604 PolarHBondContact O-N 2.83Å; A600-Y669 HydrophobicContact CB-CD1 4.09Å; A600-Y669 HydrophobicContact CB-CG 4.38Å
601	F	95	Very high	92.9	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-63.3	-48.6	172.7	163.9	-109.1	0	0	0	112.5	V493 I496 F507 L544 Y597 L598 H603 H604 V605 Y669	V493-F601 HydrophobicContact CB-CD2 4.49Å; V493-F601 HydrophobicContact CB-CG 4.5Å; V493-F601 HydrophobicContact CG1-CB 4.13Å; V493-F601 HydrophobicContact CG1-CD1 4.39Å; V493-F601 HydrophobicContact CG1-CD2 3.63Å; V493-F601 HydrophobicContact CG1-CE2 4.07Å; V493-F601 HydrophobicContact CG1-CG 3.79Å; V493-F601 HydrophobicContact CG2-CD1 3.77Å; V493-F601 HydrophobicContact CG2-CD2 4.42Å; V493-F601 HydrophobicContact CG2-CE1 3.94Å; V493-F601 HydrophobicContact CG2-CG 4Å; V493-F601 HydrophobicContact CG2-CZ 4.32Å; I496-F601 HydrophobicContact CB-CE2 4.29Å; I496-F601 HydrophobicContact CB-CZ 3.97Å; I496-F601 HydrophobicContact CD1-CZ 4.4Å; I496-F601 HydrophobicContact CG2-CE2 4.11Å; I496-F601 HydrophobicContact CG2-CZ 3.73Å; F507-F601 HydrophobicContact CE2-CE1 4.06Å; F507-F601 HydrophobicContact CE2-CZ 4.1Å; F507-F601 AromaticContact CZ-CE1 3.65Å; F507-F601 HydrophobicContact CZ-CE1 3.65Å; F507-F601 AromaticContact CZ-CZ 3.78Å; F507-F601 HydrophobicContact CZ-CZ 3.78Å; L544-F601 HydrophobicContact CD2-CE1 3.95Å; Y597-F601 WeakPolarHBondContact O-CB 3.45Å; Y597-F601 PolarHBondContact O-N 2.78Å; L598-F601 HydrophobicContact CD1-CD1 4.43Å; L598-F601 PolarHBondContact O-N 3.39Å; F601-H603 VanDerWaalsContact C-N 3.28Å; F601-H603 PolarHBondContact O-N 3.49Å; F601-H604 WeakPolarHBondContact O-CB 3.45Å; F601-H604 PolarHBondContact O-N 3.21Å; F601-V605 HydrophobicContact CD2-CG2 4.06Å; F601-V605 HydrophobicContact CE1-CG2 4.29Å; F601-V605 HydrophobicContact CE2-CG2 3.6Å; F601-V605 HydrophobicContact CZ-CG2 3.73Å; F601-V605 WeakPolarHBondContact O-CG2 3.47Å; F601-V605 PolarHBondContact O-N 3.31Å; F601-Y669 HydrophobicContact CB-CD1 4.29Å; F601-Y669 HydrophobicContact CB-CD2 3.88Å; F601-Y669 HydrophobicContact CB-CE1 4.28Å; F601-Y669 HydrophobicContact CB-CE2 3.89Å; F601-Y669 HydrophobicContact CB-CG 4.08Å; F601-Y669 AromaticContact CD2-CE2 3.77Å; F601-Y669 HydrophobicContact CD2-CE2 3.77Å; F601-Y669 AromaticContact CD2-CZ 3.82Å; F601-Y669 HydrophobicContact CG-CE2 4.27Å
602	L	95.6	Very high	92.9	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-63.4	-34.7	177.6	-68.3	177.7	0	0	0	112.1	F507 L598 S606 L619 F623 I651	F507-L602 HydrophobicContact CE2-CD2 4.39Å; L598-L602 HydrophobicContact CD1-CD1 4.15Å; L598-L602 HydrophobicContact CD1-CG 4.18Å; L598-L602 HydrophobicContact CG-CD1 4.01Å; L598-L602 HydrophobicContact CG-CG 4.37Å; L598-L602 WeakPolarHBondContact O-CG 3.5Å; L598-L602 PolarHBondContact O-N 3.31Å; L602-S606 PolarHBondContact O-N 3.44Å; L602-S606 VanDerWaalsContact O-N 3.14Å; L602-L619 HydrophobicContact CD2-CD2 4.49Å; L602-L619 VanDerWaalsContact O-CD1 3.29Å; L602-L619 WeakPolarHBondContact O-CD1 3.32Å; L602-F623 HydrophobicContact CD1-CB 4.5Å; L602-F623 HydrophobicContact CD1-CD1 4.28Å; L602-F623 HydrophobicContact CD1-CD2 4.1Å; L602-F623 HydrophobicContact CD1-CE2 4.41Å; L602-F623 HydrophobicContact CD1-CG 4.03Å; L602-F623 HydrophobicContact CD2-CD2 3.79Å; L602-F623 HydrophobicContact CD2-CE2 3.42Å; L602-F623 VanDerWaalsContact CD2-CE2 3.42Å; L602-F623 HydrophobicContact CD2-CG 4.48Å; L602-F623 HydrophobicContact CD2-CZ 3.84Å; L602-I651 HydrophobicContact CB-CD1 4.36Å; L602-I651 HydrophobicContact CB-CG1 4.18Å; L602-I651 HydrophobicContact CD1-CD1 4.47Å
603	H	95.3	Very high	92.8	Very high	32 Å²	32	16 Å²	16	15%	0.148	8%	0.079	C	C	.	.	H	α-helix	trans	-62.1	-49.1	169.6	-174.4	94.7	0	0	0	110.9	F599 A600 F601 V605 S606 Q607 I651 H654	F599-H603 VanDerWaalsContact O-CB 3.3Å; F599-H603 WeakPolarHBondContact O-CB 3.44Å; F599-H603 PolarHBondContact O-N 3.21Å; A600-H603 PolarHBondContact O-N 3.06Å; F601-H603 VanDerWaalsContact C-N 3.28Å; F601-H603 PolarHBondContact O-N 3.49Å; H603-V605 PolarHBondContact O-N 3.49Å; H603-S606 CarbonylContact O-C 3.59Å; H603-S606 WeakPolarHBondContact O-CA 3.43Å; H603-S606 WeakPolarHBondContact O-CB 3.45Å; H603-S606 PolarHBondContact O-N 2.93Å; H603-S606 PolarHBondContact O-OG 2.98Å; H603-Q607 PolarHBondContact CD2-NE2 3.43Å; H603-Q607 VanDerWaalsContact CD2-NE2 3.25Å; H603-Q607 PolarHBondContact NE2-NE2 3.15Å; H603-Q607 WeakPolarHBondContact O-CG 3.49Å; H603-Q607 PolarHBondContact O-N 2.9Å; H603-Q607 VanDerWaalsContact O-N 3.1Å; H603-I651 HydrophobicContact CB-CG2 4.39Å; H603-I651 PolarHBondContact ND1-O 2.98Å; H603-H654 WeakPolarHBondContact CB-CD2 3.45Å; H603-H654 WeakPolarHBondContact CB-NE2 3.46Å; H603-H654 AromaticContact CD2-NE2 3.58Å; H603-H654 AromaticContact CG-CD2 3.37Å; H603-H654 AromaticContact CG-NE2 3.26Å; H603-H654 VanDerWaalsContact CG-NE2 3.26Å; H603-H654 AromaticContact ND1-CD2 3.51Å; H603-H654 AromaticContact ND1-NE2 3.74Å
604	H	94.6	Very high	92.9	Very high	6 Å²	6	15.9 Å²	15.9	3%	0.028	8%	0.078	C	C	.	.	H	α-helix	trans	-58.4	-46.2	178.9	-169.6	-139.8	0	0	0	112.5	A600 F601 S606 Q607 Y608 Y669 K671	A600-H604 PolarHBondContact O-N 2.83Å; F601-H604 WeakPolarHBondContact O-CB 3.45Å; F601-H604 PolarHBondContact O-N 3.21Å; H604-S606 PolarHBondContact O-N 3.41Å; H604-Q607 WeakPolarHBondContact O-CB 3.4Å; H604-Q607 PolarHBondContact O-N 3Å; H604-Y608 AromaticContact CD2-CE2 3.87Å; H604-Y608 AromaticContact CE1-CE2 3.95Å; H604-Y608 AromaticContact NE2-CE2 3.55Å; H604-Y608 WeakPolarHBondContact O-CD2 3.32Å; H604-Y669 HydrophobicContact CB-CE1 3.61Å; H604-Y669 AromaticContact CG-CE1 3.89Å; H604-Y669 AromaticContact ND1-CE1 3.7Å; H604-Y669 AromaticContact ND1-CZ 3.72Å; H604-Y669 PolarHBondContact ND1-OH 3.35Å; H604-K671 PolarHBondContact CE1-O 2.96Å
605	V	94.1	Very high	92.9	Very high	1 Å²	1	20 Å²	20	1%	0.006	10%	0.098	C	C	.	.	H	α-helix	trans	-54.8	-39	172.5	174.6	0	0	0	0	111.3	L501 I506 F507 F601 H603 Q607 Y608 N612 L619	L501-V605 HydrophobicContact CD2-CG2 4.04Å; I506-V605 HydrophobicContact CG2-CG1 3.79Å; F507-V605 HydrophobicContact CE2-CG2 4.49Å; F601-V605 HydrophobicContact CD2-CG2 4.06Å; F601-V605 HydrophobicContact CE1-CG2 4.29Å; F601-V605 HydrophobicContact CE2-CG2 3.6Å; F601-V605 HydrophobicContact CZ-CG2 3.73Å; F601-V605 WeakPolarHBondContact O-CG2 3.47Å; F601-V605 PolarHBondContact O-N 3.31Å; H603-V605 PolarHBondContact O-N 3.49Å; V605-Q607 VanDerWaalsContact C-N 3.31Å; V605-Q607 PolarHBondContact O-N 3.08Å; V605-Y608 PolarHBondContact O-N 3.01Å; V605-N612 PolarHBondContact O-ND2 3.06Å; V605-L619 HydrophobicContact CB-CD1 4.35Å; V605-L619 HydrophobicContact CG1-CD1 4.17Å; V605-L619 HydrophobicContact CG1-CD2 4.09Å
606	S	94.1	Very high	92.9	Very high	8 Å²	8	20.7 Å²	20.7	6%	0.056	10%	0.102	C	C	.	.	H	α-helix	trans	-70.9	-20.6	177.2	86.2	0	0	0	0	114.4	L602 H603 H604 Y608 S609	L602-S606 PolarHBondContact O-N 3.44Å; L602-S606 VanDerWaalsContact O-N 3.14Å; H603-S606 CarbonylContact O-C 3.59Å; H603-S606 WeakPolarHBondContact O-CA 3.43Å; H603-S606 WeakPolarHBondContact O-CB 3.45Å; H603-S606 PolarHBondContact O-N 2.93Å; H603-S606 PolarHBondContact O-OG 2.98Å; H604-S606 PolarHBondContact O-N 3.41Å; S606-Y608 PolarHBondContact O-N 3.3Å; S606-S609 WeakPolarHBondContact O-CB 3.48Å; S606-S609 PolarHBondContact O-N 2.98Å; S606-S609 VanDerWaalsContact O-N 3.14Å; S606-S609 PolarHBondContact O-OG 2.98Å
607	Q	91.7	Very high	92.9	Very high	96 Å²	96	24.9 Å²	24.9	45%	0.449	12%	0.118	S	C	.	.	H	α-helix	trans	-68.1	-20.9	174.1	-60.6	-170.8	-31.7	0	0	112	H603 H604 V605	H603-Q607 PolarHBondContact CD2-NE2 3.43Å; H603-Q607 VanDerWaalsContact CD2-NE2 3.25Å; H603-Q607 PolarHBondContact NE2-NE2 3.15Å; H603-Q607 WeakPolarHBondContact O-CG 3.49Å; H603-Q607 PolarHBondContact O-N 2.9Å; H603-Q607 VanDerWaalsContact O-N 3.1Å; H604-Q607 WeakPolarHBondContact O-CB 3.4Å; H604-Q607 PolarHBondContact O-N 3Å; V605-Q607 VanDerWaalsContact C-N 3.31Å; V605-Q607 PolarHBondContact O-N 3.08Å
608	Y	91.4	Very high	92.9	Very high	56 Å²	56	27.2 Å²	27.2	22%	0.22	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	12.1	173.5	-62.7	-95.4	0	0	0	113.6	L501 H502 H604 V605 S606 D610 E611 N612	L501-Y608 HydrophobicContact CB-CD2 4.12Å; L501-Y608 HydrophobicContact CB-CE2 4.27Å; L501-Y608 HydrophobicContact CB-CG 4.29Å; L501-Y608 HydrophobicContact CD1-CD2 4.43Å; L501-Y608 HydrophobicContact CD1-CE2 3.81Å; L501-Y608 HydrophobicContact CD2-CD2 4.31Å; L501-Y608 HydrophobicContact CD2-CE2 4.31Å; L501-Y608 HydrophobicContact CG-CE2 4.36Å; L501-Y608 WeakPolarHBondContact O-CB 3.31Å; H502-Y608 AromaticContact CD2-CD1 3.66Å; H502-Y608 AromaticContact NE2-CD1 3.43Å; H502-Y608 WeakPolarHBondContact NE2-CD1 3.33Å; H502-Y608 AromaticContact NE2-CE1 3.4Å; H502-Y608 WeakPolarHBondContact NE2-CE1 3.45Å; H604-Y608 AromaticContact CD2-CE2 3.87Å; H604-Y608 AromaticContact CE1-CE2 3.95Å; H604-Y608 AromaticContact NE2-CE2 3.55Å; H604-Y608 WeakPolarHBondContact O-CD2 3.32Å; V605-Y608 PolarHBondContact O-N 3.01Å; S606-Y608 PolarHBondContact O-N 3.3Å; Y608-D610 PolarHBondContact O-N 2.7Å; Y608-E611 PolarHBondContact O-N 3.04Å; Y608-N612 PolarHBondContact O-N 3.02Å; Y608-N612 PolarHBondContact O-OD1 2.76Å
609	S	91	Very high	92.9	Very high	14 Å²	14	27.2 Å²	27.2	10%	0.098	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-8.1	-173.7	61.3	0	0	0	0	116.5	S606 E611 N612 Q615	S606-S609 WeakPolarHBondContact O-CB 3.48Å; S606-S609 PolarHBondContact O-N 2.98Å; S606-S609 VanDerWaalsContact O-N 3.14Å; S606-S609 PolarHBondContact O-OG 2.98Å; S609-E611 VanDerWaalsContact C-N 3.32Å; S609-N612 VanDerWaalsContact CA-OD1 3.3Å; S609-N612 WeakPolarHBondContact CA-OD1 2.89Å; S609-Q615 VanDerWaalsContact CB-NE2 3.31Å; S609-Q615 PolarHBondContact O-NE2 3.36Å; S609-Q615 PolarHBondContact OG-NE2 3.3Å
610	D	87.9	Confident	92.8	Very high	29 Å²	29	27.2 Å²	27.2	16%	0.155	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-29.1	164.6	-72.2	-19.1	0	0	0	112.8	L419 K422 L423 Y608	L419-D610 HydrophobicContact CD1-CB 3.69Å; L419-D610 VanDerWaalsContact CD1-OD1 3.31Å; L419-D610 WeakPolarHBondContact CD1-OD1 3.41Å; K422-D610 VanDerWaalsContact CE-OD2 3.3Å; K422-D610 WeakPolarHBondContact CE-OD2 3.5Å; K422-D610 IonicContact NZ-OD1 2.76Å; K422-D610 PolarHBondContact NZ-OD1 3.21Å; K422-D610 IonicContact NZ-OD2 2.73Å; K422-D610 PolarHBondContact NZ-OD2 3.4Å; L423-D610 HydrophobicContact CD2-CB 4.37Å; Y608-D610 PolarHBondContact O-N 2.7Å
611	E	87.9	Confident	92.8	Very high	5 Å²	5	29.5 Å²	29.5	2%	0.023	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-46.7	-173.7	-63.8	172	-126.9	0	0	111.1	R331 I335 L423 K426 H502 Y608 S609	R331-E611 IonicContact CZ-OE1 3.49Å; R331-E611 IonicContact CZ-OE2 3.14Å; R331-E611 IonicContact NE-OE1 3.9Å; R331-E611 IonicContact NE-OE2 3.88Å; R331-E611 PolarHBondContact NE-OE2 3Å; R331-E611 IonicContact NH2-OE1 2.75Å; R331-E611 PolarHBondContact NH2-OE1 3.48Å; R331-E611 IonicContact NH2-OE2 2.69Å; R331-E611 PolarHBondContact NH2-OE2 3.04Å; I335-E611 HydrophobicContact CD1-CG 4.36Å; I335-E611 HydrophobicContact CG1-CG 4.12Å; L423-E611 HydrophobicContact CD2-CG 4.17Å; K426-E611 WeakPolarHBondContact CE-OE1 3.4Å; K426-E611 IonicContact NZ-OE1 2.77Å; K426-E611 PolarHBondContact NZ-OE1 3.46Å; H502-E611 IonicContact CD2-OE2 3.39Å; H502-E611 PolarHBondContact CD2-OE2 3.49Å; H502-E611 VanDerWaalsContact CD2-OE2 3.31Å; H502-E611 IonicContact NE2-OE2 3.76Å; Y608-E611 PolarHBondContact O-N 3.04Å; S609-E611 VanDerWaalsContact C-N 3.32Å
612	N	90.3	Very high	92.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.152	C	C	.	.	S	Bend	trans	-89.6	-2.4	-175.3	76.7	18.9	0	0	0	114.7	L501 H503 G505 V605 Y608 S609 M614	L501-N612 WeakPolarHBondContact O-CB 3.43Å; L501-N612 PolarHBondContact O-ND2 3.46Å; H503-N612 WeakPolarHBondContact O-CB 3.5Å; G505-N612 PolarHBondContact N-O 2.92Å; V605-N612 PolarHBondContact O-ND2 3.06Å; Y608-N612 PolarHBondContact O-N 3.02Å; Y608-N612 PolarHBondContact O-OD1 2.76Å; S609-N612 VanDerWaalsContact CA-OD1 3.3Å; S609-N612 WeakPolarHBondContact CA-OD1 2.89Å; N612-M614 PolarHBondContact O-N 3.27Å; N612-M614 VanDerWaalsContact O-N 3.1Å; N612-M614 WeakPolarHBondContact OD1-CA 3.35Å; N612-M614 WeakPolarHBondContact OD1-CB 3.39Å; N612-M614 PolarHBondContact OD1-N 2.73Å
613	M	89.2	Confident	92.7	Very high	52 Å²	52	30.7 Å²	30.7	26%	0.256	15%	0.152	S	C	.	.			trans	63.4	4.5	-179.2	-61.5	-69.6	-82.9	0	0	116.6	R338 E504 Q615 N618	R338-M613 VanDerWaalsContact CZ-SD 3.53Å; R338-M613 PolarHBondContact NE-SD 2.95Å; E504-M613 HydrophobicContact CG-CB 4.15Å; E504-M613 HydrophobicContact CG-CG 3.77Å; M613-Q615 PolarHBondContact O-N 3.08Å; M613-N618 PolarHBondContact O-ND2 3.14Å
614	M	93.4	Very high	92.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.145	C	C	.	.			trans	-98.1	71.5	-175	-67	-56.4	-64.9	0	0	112.7	I506 R508 N612 N618 L619	I506-M614 HydrophobicContact CG2-CB 4.24Å; I506-M614 HydrophobicContact CG2-CG 3.78Å; I506-M614 WeakPolarHBondContact O-CE 3.29Å; I506-M614 VanDerWaalsContact O-CG 3.3Å; I506-M614 WeakPolarHBondContact O-CG 3.34Å; R508-M614 HydrophobicContact CB-CE 3.93Å; R508-M614 HydrophobicContact CB-SD 3.69Å; N612-M614 PolarHBondContact O-N 3.27Å; N612-M614 VanDerWaalsContact O-N 3.1Å; N612-M614 WeakPolarHBondContact OD1-CA 3.35Å; N612-M614 WeakPolarHBondContact OD1-CB 3.39Å; N612-M614 PolarHBondContact OD1-N 2.73Å; M614-N618 HydrophobicContact CE-CB 3.67Å; M614-N618 HydrophobicContact SD-CB 3.97Å; M614-L619 HydrophobicContact CB-CD2 3.97Å; M614-L619 HydrophobicContact CB-CG 4.08Å; M614-L619 HydrophobicContact CE-CD2 3.79Å; M614-L619 HydrophobicContact CE-CG 4.17Å
615	Q	92.6	Very high	92.1	Very high	87 Å²	87	32 Å²	32	41%	0.407	16%	0.163	S	C	.	.			trans	-52.9	153.1	168.6	-64.7	-64.8	-35.1	0	0	111.6	S609 M613 Y617 N618 L619	S609-Q615 VanDerWaalsContact CB-NE2 3.31Å; S609-Q615 PolarHBondContact O-NE2 3.36Å; S609-Q615 PolarHBondContact OG-NE2 3.3Å; M613-Q615 PolarHBondContact O-N 3.08Å; Q615-Y617 PolarHBondContact O-N 2.92Å; Q615-N618 WeakPolarHBondContact O-CA 3.27Å; Q615-N618 WeakPolarHBondContact O-CB 3.36Å; Q615-N618 PolarHBondContact O-N 3.47Å; Q615-L619 PolarHBondContact O-N 3.07Å; Q615-L619 VanDerWaalsContact O-N 3.1Å
616	P	93.9	Very high	91.9	Very high	14 Å²	14	32.6 Å²	32.6	9%	0.091	17%	0.167	C	C	.	.	H	α-helix	trans	-52.4	-32.9	-178.3	-28.9	34	0	0	0	115	A620 K648 I651 L652	P616-A620 WeakPolarHBondContact O-CB 3.27Å; P616-A620 PolarHBondContact O-N 3.41Å; P616-K648 HydrophobicContact CB-CG 4.14Å; P616-I651 HydrophobicContact CB-CG2 4.06Å; P616-L652 HydrophobicContact CB-CD2 4.27Å; P616-L652 HydrophobicContact CB-CG 4.16Å; P616-L652 HydrophobicContact CG-CD2 3.87Å; P616-L652 HydrophobicContact CG-CG 4.32Å
617	Y	93.4	Very high	91.7	Very high	100 Å²	100	32.2 Å²	32.2	39%	0.392	17%	0.165	S	C	.	.	H	α-helix	trans	-73.7	-34.3	174.9	-173.3	-104.1	0	0	0	112.9	Q615 A620 V621 N644 K648	Q615-Y617 PolarHBondContact O-N 2.92Å; Y617-A620 PolarHBondContact O-N 3.11Å; Y617-V621 HydrophobicContact CD1-CG2 4.15Å; Y617-V621 HydrophobicContact CE1-CG2 3.79Å; Y617-V621 VanDerWaalsContact O-CG2 3.3Å; Y617-V621 WeakPolarHBondContact O-CG2 3.28Å; Y617-V621 PolarHBondContact O-N 3.29Å; Y617-N644 HydrophobicContact CD2-CB 4.37Å; Y617-N644 HydrophobicContact CE2-CB 3.59Å; Y617-K648 HydrophobicContact CD2-CB 4.27Å; Y617-K648 HydrophobicContact CD2-CD 4.16Å; Y617-K648 HydrophobicContact CD2-CG 4.48Å
618	N	95.1	Very high	91.5	Very high	56 Å²	56	27.9 Å²	27.9	30%	0.299	15%	0.145	S	C	.	.	H	α-helix	trans	-66.3	-41.3	176	-61	-4.7	0	0	0	110.1	M613 M614 Q615 V621 C622	M613-N618 PolarHBondContact O-ND2 3.14Å; M614-N618 HydrophobicContact CE-CB 3.67Å; M614-N618 HydrophobicContact SD-CB 3.97Å; Q615-N618 WeakPolarHBondContact O-CA 3.27Å; Q615-N618 WeakPolarHBondContact O-CB 3.36Å; Q615-N618 PolarHBondContact O-N 3.47Å; N618-V621 PolarHBondContact O-N 3.4Å; N618-C622 PolarHBondContact O-N 3.29Å; N618-C622 VanDerWaalsContact O-N 3.16Å; N618-C622 PolarHBondContact O-SG 2.94Å
619	L	95.2	Very high	90.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.8	-42.6	172	-67.3	170	0	0	0	111.5	F507 L602 V605 M614 Q615 V621 C622 F623 I651	F507-L619 HydrophobicContact CD2-CD2 3.85Å; L602-L619 HydrophobicContact CD2-CD2 4.49Å; L602-L619 VanDerWaalsContact O-CD1 3.29Å; L602-L619 WeakPolarHBondContact O-CD1 3.32Å; V605-L619 HydrophobicContact CB-CD1 4.35Å; V605-L619 HydrophobicContact CG1-CD1 4.17Å; V605-L619 HydrophobicContact CG1-CD2 4.09Å; M614-L619 HydrophobicContact CB-CD2 3.97Å; M614-L619 HydrophobicContact CB-CG 4.08Å; M614-L619 HydrophobicContact CE-CD2 3.79Å; M614-L619 HydrophobicContact CE-CG 4.17Å; Q615-L619 PolarHBondContact O-N 3.07Å; Q615-L619 VanDerWaalsContact O-N 3.1Å; L619-V621 VanDerWaalsContact C-N 3.34Å; L619-V621 PolarHBondContact O-N 3.11Å; L619-C622 PolarHBondContact O-N 2.78Å; L619-C622 VanDerWaalsContact O-N 3.08Å; L619-F623 PolarHBondContact O-N 2.99Å; L619-I651 HydrophobicContact CB-CD1 3.96Å
620	A	93.8	Very high	89.6	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-36.2	176.3	0	0	0	0	0	113.4	P616 Y617 C622 G624 N644 V647 K648 I651	P616-A620 WeakPolarHBondContact O-CB 3.27Å; P616-A620 PolarHBondContact O-N 3.41Å; Y617-A620 PolarHBondContact O-N 3.11Å; A620-C622 VanDerWaalsContact C-N 3.34Å; A620-G624 VanDerWaalsContact O-CA 3.31Å; A620-G624 WeakPolarHBondContact O-CA 3.27Å; A620-G624 PolarHBondContact O-N 3.44Å; A620-N644 VanDerWaalsContact CB-O 3.27Å; A620-N644 WeakPolarHBondContact CB-O 3.46Å; A620-V647 HydrophobicContact CB-CB 3.93Å; A620-V647 HydrophobicContact CB-CG1 3.82Å; A620-K648 HydrophobicContact CB-CB 3.95Å; A620-I651 HydrophobicContact CB-CD1 4.38Å
621	V	92.9	Very high	88.3	Confident	64 Å²	64	33.7 Å²	33.7	39%	0.388	18%	0.18	S	C	.	.	H	α-helix	trans	-63.7	-38.7	171	169.8	0	0	0	0	111.4	Y617 N618 L619 P625 N644	Y617-V621 HydrophobicContact CD1-CG2 4.15Å; Y617-V621 HydrophobicContact CE1-CG2 3.79Å; Y617-V621 VanDerWaalsContact O-CG2 3.3Å; Y617-V621 WeakPolarHBondContact O-CG2 3.28Å; Y617-V621 PolarHBondContact O-N 3.29Å; N618-V621 PolarHBondContact O-N 3.4Å; L619-V621 VanDerWaalsContact C-N 3.34Å; L619-V621 PolarHBondContact O-N 3.11Å; V621-P625 WeakPolarHBondContact O-CD 3.48Å; V621-N644 HydrophobicContact CG2-CB 4.36Å
622	C	94.1	Very high	86.9	Confident	25 Å²	25	40.1 Å²	40.1	17%	0.169	21%	0.21	C	C	.	.	H	α-helix	trans	-76.6	-36.3	-178.4	-62.1	0	0	0	0	113.3	F507 N618 L619 A620	F507-C622 HydrophobicContact CB-CB 4.19Å; N618-C622 PolarHBondContact O-N 3.29Å; N618-C622 VanDerWaalsContact O-N 3.16Å; N618-C622 PolarHBondContact O-SG 2.94Å; L619-C622 PolarHBondContact O-N 2.78Å; L619-C622 VanDerWaalsContact O-N 3.08Å; A620-C622 VanDerWaalsContact C-N 3.34Å
623	F	94.1	Very high	85.3	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-96.2	-28.9	-177.5	-85.7	-89.5	0	0	0	114.2	F507 K545 L598 L602 L619 S626 L627	F507-F623 HydrophobicContact CB-CE2 4.08Å; F507-F623 AromaticContact CD1-CE2 3.55Å; F507-F623 HydrophobicContact CD1-CE2 3.55Å; F507-F623 AromaticContact CD1-CZ 3.66Å; F507-F623 HydrophobicContact CD1-CZ 3.66Å; F507-F623 AromaticContact CD2-CE2 3.89Å; F507-F623 HydrophobicContact CD2-CE2 3.89Å; F507-F623 AromaticContact CE1-CE2 3.91Å; F507-F623 HydrophobicContact CE1-CE2 3.91Å; F507-F623 AromaticContact CE1-CZ 3.65Å; F507-F623 HydrophobicContact CE1-CZ 3.65Å; F507-F623 HydrophobicContact CE2-CE2 4.2Å; F507-F623 AromaticContact CG-CE2 3.57Å; F507-F623 HydrophobicContact CG-CE2 3.57Å; F507-F623 HydrophobicContact CG-CZ 4.16Å; F507-F623 HydrophobicContact CZ-CE2 4.21Å; F507-F623 HydrophobicContact CZ-CZ 4.11Å; K545-F623 HydrophobicContact CG-CE1 4.05Å; K545-F623 HydrophobicContact CG-CE2 4.26Å; K545-F623 HydrophobicContact CG-CZ 3.89Å; L598-F623 HydrophobicContact CD1-CE1 4.3Å; L602-F623 HydrophobicContact CD1-CB 4.5Å; L602-F623 HydrophobicContact CD1-CD1 4.28Å; L602-F623 HydrophobicContact CD1-CD2 4.1Å; L602-F623 HydrophobicContact CD1-CE2 4.41Å; L602-F623 HydrophobicContact CD1-CG 4.03Å; L602-F623 HydrophobicContact CD2-CD2 3.79Å; L602-F623 HydrophobicContact CD2-CE2 3.42Å; L602-F623 VanDerWaalsContact CD2-CE2 3.42Å; L602-F623 HydrophobicContact CD2-CG 4.48Å; L602-F623 HydrophobicContact CD2-CZ 3.84Å; L619-F623 PolarHBondContact O-N 2.99Å; F623-S626 CarbonylContact O-C 3.59Å; F623-S626 WeakPolarHBondContact O-CA 3.25Å; F623-S626 WeakPolarHBondContact O-CB 3.32Å; F623-S626 PolarHBondContact O-N 3.35Å; F623-L627 HydrophobicContact CB-CD1 3.97Å; F623-L627 HydrophobicContact CB-CG 4.23Å; F623-L627 HydrophobicContact CD1-CD1 4.33Å; F623-L627 HydrophobicContact CD1-CD2 4.47Å; F623-L627 HydrophobicContact CD1-CG 4.34Å; F623-L627 WeakPolarHBondContact O-CG 3.28Å; F623-L627 PolarHBondContact O-N 2.88Å
624	G	90.3	Very high	83.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-46.6	-55.2	-177.4	0	0	0	0	0	114.2	A620 S626 L627 V628	A620-G624 VanDerWaalsContact O-CA 3.31Å; A620-G624 WeakPolarHBondContact O-CA 3.27Å; A620-G624 PolarHBondContact O-N 3.44Å; G624-S626 PolarHBondContact O-N 3.37Å; G624-S626 VanDerWaalsContact O-N 3.15Å; G624-L627 PolarHBondContact O-N 3.47Å; G624-V628 PolarHBondContact O-N 3.25Å
625	P	88.2	Confident	81.8	Confident	64 Å²	64	57.6 Å²	57.6	42%	0.416	30%	0.301	S	S	.	.	H	α-helix	trans	-64.3	-14.2	176.7	-19.5	30.7	0	0	0	115.4	V621	V621-P625 WeakPolarHBondContact O-CD 3.48Å
626	S	89.1	Confident	80.4	Confident	14 Å²	14	56.2 Å²	56.2	10%	0.098	30%	0.298	C	S	.	.	H	α-helix	trans	-100.1	-13.4	178.8	-53.1	0	0	0	0	112.9	F548 F623 G624	F548-S626 CarbonylContact C-O 3.58Å; F623-S626 CarbonylContact O-C 3.59Å; F623-S626 WeakPolarHBondContact O-CA 3.25Å; F623-S626 WeakPolarHBondContact O-CB 3.32Å; F623-S626 PolarHBondContact O-N 3.35Å; G624-S626 PolarHBondContact O-N 3.37Å; G624-S626 VanDerWaalsContact O-N 3.15Å
627	L	90.6	Very high	79	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-110.1	-33.5	-177.3	-62.9	-174.1	0	0	0	113.1	F548 L555 F556 L598 F599 F623 G624	F548-L627 HydrophobicContact CB-CD2 3.88Å; F548-L627 HydrophobicContact CD1-CD2 4.15Å; F548-L627 HydrophobicContact CD2-CD2 4.44Å; F548-L627 HydrophobicContact CG-CD2 3.91Å; L555-L627 HydrophobicContact CB-CD2 4.15Å; L555-L627 HydrophobicContact CD2-CD2 3.76Å; F556-L627 HydrophobicContact CD2-CB 3.97Å; F556-L627 HydrophobicContact CE2-CB 4.09Å; F556-L627 HydrophobicContact CE2-CD1 4.36Å; F556-L627 PolarHBondContact N-O 3.05Å; F556-L627 VanDerWaalsContact N-O 3.16Å; L598-L627 HydrophobicContact CD2-CD1 4.12Å; L598-L627 HydrophobicContact CD2-CD2 3.86Å; F599-L627 HydrophobicContact CE2-CD1 4.26Å; F599-L627 HydrophobicContact CZ-CD1 3.84Å; F623-L627 HydrophobicContact CB-CD1 3.97Å; F623-L627 HydrophobicContact CB-CG 4.23Å; F623-L627 HydrophobicContact CD1-CD1 4.33Å; F623-L627 HydrophobicContact CD1-CD2 4.47Å; F623-L627 HydrophobicContact CD1-CG 4.34Å; F623-L627 WeakPolarHBondContact O-CG 3.28Å; F623-L627 PolarHBondContact O-N 2.88Å; G624-L627 PolarHBondContact O-N 3.47Å
628	V	86.8	Confident	78.1	Confident	5 Å²	5	61.5 Å²	61.5	3%	0.03	34%	0.34	C	S	.	.			trans	-122.5	129.5	-179	-172.4	0	0	0	0	109	F556 T561 G624 I643 V647	F556-V628 HydrophobicContact CB-CG2 4.07Å; F556-V628 HydrophobicContact CD2-CG2 3.78Å; F556-V628 HydrophobicContact CE2-CG2 4.44Å; F556-V628 HydrophobicContact CG-CG2 4Å; T561-V628 HydrophobicContact CG2-CG1 3.9Å; G624-V628 PolarHBondContact O-N 3.25Å; V628-I643 HydrophobicContact CB-CD1 4.39Å; V628-I643 HydrophobicContact CB-CG2 3.96Å; V628-I643 HydrophobicContact CG1-CD1 4.1Å; V628-I643 HydrophobicContact CG1-CG1 4.26Å; V628-I643 HydrophobicContact CG2-CG2 4.09Å; V628-V647 HydrophobicContact CG2-CG2 4.45Å
629	R	79.4	Confident	77.4	Confident	91 Å²	91	60.2 Å²	60.2	34%	0.343	34%	0.335	S	S	.	.			trans	-96.8	138.9	172.7	-69.1	-179.6	179.5	151	4.4	110.3	R549 L551 D552 P554 V558	R549-R629 PolarHBondContact O-NH2 3.29Å; L551-R629 PolarHBondContact O-NH1 3.35Å; L551-R629 PolarHBondContact O-NH2 3.07Å; D552-R629 PolarHBondContact O-NH1 2.88Å; P554-R629 HydrophobicContact CB-CG 4.05Å; P554-R629 HydrophobicContact CG-CG 4.25Å; V558-R629 HydrophobicContact CG2-CB 4.48Å
630	G	64.2	Low	76.9	Confident	35 Å²	35	62.1 Å²	62.1	36%	0.361	34%	0.344	S	S	.	.			trans	-66.7	160.4	171.7	0	0	0	0	0	111.8
631	L	60.5	Low	76.6	Confident	96 Å²	96	65.5 Å²	65.5	50%	0.503	37%	0.366	S	S	.	.	S	Bend	trans	-80.4	-29.1	-176.1	-68.1	169.9	0	0	0	113.2	V558	V558-L631 HydrophobicContact CG1-CD2 3.64Å
632	Q	58	Low	76.4	Confident	139 Å²	139	67 Å²	67	65%	0.65	37%	0.369	S	S	*	.	S	Bend	trans	-149.4	152.7	173.5	-59.2	-173.5	33.5	0	0	109.5	D634 E635	Q632-D634 VanDerWaalsContact C-N 3.34Å; Q632-D634 PolarHBondContact O-N 3.4Å; Q632-E635 PolarHBondContact O-N 2.94Å
633	D	55.8	Low	76.1	Confident	153 Å²	153	66 Å²	66	82%	0.818	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-63.4	-33.9	-175	-77.7	-39.7	0	0	0	113.8	E635 V636	D633-E635 VanDerWaalsContact C-N 3.33Å; D633-E635 PolarHBondContact O-N 3.36Å; D633-V636 WeakPolarHBondContact O-CG2 3.47Å; D633-V636 PolarHBondContact O-N 2.87Å
634	D	51.5	Low	76	Confident	162 Å²	162	66.6 Å²	66.6	87%	0.866	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-72.5	-19.6	-177.5	-72	-44.3	0	0	0	114.1	Q632	Q632-D634 VanDerWaalsContact C-N 3.34Å; Q632-D634 PolarHBondContact O-N 3.4Å
635	E	59	Low	76	Confident	104 Å²	104	68.6 Å²	68.6	49%	0.486	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-96.6	-2.6	179.9	-67.4	-164.6	139.1	0	0	114	Q632 D633 V637 T638 V639	Q632-E635 PolarHBondContact O-N 2.94Å; D633-E635 VanDerWaalsContact C-N 3.33Å; D633-E635 PolarHBondContact O-N 3.36Å; E635-V637 VanDerWaalsContact C-N 3.26Å; E635-V637 PolarHBondContact O-N 3.5Å; E635-V637 VanDerWaalsContact O-N 3.15Å; E635-T638 PolarHBondContact O-N 2.85Å; E635-T638 PolarHBondContact O-OG1 3.29Å; E635-V639 HydrophobicContact CB-CG2 4.38Å; E635-V639 PolarHBondContact O-N 2.94Å
636	V	62.2	Low	76.2	Confident	58 Å²	58	65.7 Å²	65.7	35%	0.352	36%	0.362	S	S	.	.	H	α-helix	trans	-55.4	-40.5	-172.8	174.3	0	0	0	0	112.2	D633 Q640	D633-V636 WeakPolarHBondContact O-CG2 3.47Å; D633-V636 PolarHBondContact O-N 2.87Å; V636-Q640 WeakPolarHBondContact O-CB 3.36Å; V636-Q640 PolarHBondContact O-N 3.35Å; V636-Q640 VanDerWaalsContact O-N 3.09Å
637	V	65.6	Low	76.4	Confident	126 Å²	126	65 Å²	65	76%	0.764	36%	0.357	S	S	*	.	H	α-helix	trans	-70.3	-34.9	-175.8	-175.9	0	0	0	0	113	E635	E635-V637 VanDerWaalsContact C-N 3.26Å; E635-V637 PolarHBondContact O-N 3.5Å; E635-V637 VanDerWaalsContact O-N 3.15Å
638	T	73	Confident	76.5	Confident	99 Å²	99	69.2 Å²	69.2	61%	0.607	38%	0.375	S	S	*	.	H	α-helix	trans	-81.5	-30.4	-177.8	52.9	0	0	0	0	112.4	E635 P641	E635-T638 PolarHBondContact O-N 2.85Å; E635-T638 PolarHBondContact O-OG1 3.29Å; T638-P641 WeakPolarHBondContact O-CD 3.2Å
639	V	80.8	Confident	76.8	Confident	30 Å²	30	69.2 Å²	69.2	18%	0.182	38%	0.377	C	S	.	.	H	α-helix	trans	-86.7	-27.3	-178.9	-177.3	0	0	0	0	112.4	L565 E635 P641 Q642 I643	L565-V639 HydrophobicContact CD1-CG1 3.62Å; E635-V639 HydrophobicContact CB-CG2 4.38Å; E635-V639 PolarHBondContact O-N 2.94Å; V639-P641 VanDerWaalsContact C-CD 3.46Å; V639-Q642 WeakPolarHBondContact O-CA 3.4Å; V639-Q642 WeakPolarHBondContact O-CB 3.38Å; V639-Q642 PolarHBondContact O-N 3.39Å; V639-I643 HydrophobicContact CG1-CD1 3.99Å; V639-I643 HydrophobicContact CG1-CG1 4.09Å; V639-I643 PolarHBondContact O-N 3.48Å; V639-I643 VanDerWaalsContact O-N 3.1Å
640	Q	85.1	Confident	77.5	Confident	39 Å²	39	64.9 Å²	64.9	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-52.5	-41.1	-177.9	-166.9	64	63.4	0	0	115.2	V636 Q642 I643 N644	V636-Q640 WeakPolarHBondContact O-CB 3.36Å; V636-Q640 PolarHBondContact O-N 3.35Å; V636-Q640 VanDerWaalsContact O-N 3.09Å; Q640-Q642 VanDerWaalsContact C-N 3.25Å; Q640-Q642 PolarHBondContact O-N 3.07Å; Q640-I643 PolarHBondContact O-N 3.04Å; Q640-N644 PolarHBondContact NE2-OD1 3.47Å; Q640-N644 PolarHBondContact O-N 3.01Å; Q640-N644 PolarHBondContact O-ND2 3.4Å; Q640-N644 PolarHBondContact O-OD1 3.29Å
641	P	87.6	Confident	79	Confident	72 Å²	72	63.2 Å²	63.2	47%	0.468	34%	0.343	S	S	.	.	H	α-helix	trans	-61.5	-33	176.1	-23.3	35.1	0	0	0	113.3	T638 V639 A645	T638-P641 WeakPolarHBondContact O-CD 3.2Å; V639-P641 VanDerWaalsContact C-CD 3.46Å; P641-A645 WeakPolarHBondContact O-CB 3.24Å; P641-A645 PolarHBondContact O-N 3.04Å
642	Q	87.7	Confident	80.5	Confident	96 Å²	96	62.7 Å²	62.7	45%	0.449	34%	0.341	S	S	.	.	H	α-helix	trans	-75.4	-36.9	177.9	-53.7	-179	-0.9	0	0	111.5	L565 N568 V639 Q640 N644 A645 L646	L565-Q642 HydrophobicContact CD2-CB 3.75Å; N568-Q642 PolarHBondContact ND2-O 2.76Å; V639-Q642 WeakPolarHBondContact O-CA 3.4Å; V639-Q642 WeakPolarHBondContact O-CB 3.38Å; V639-Q642 PolarHBondContact O-N 3.39Å; Q640-Q642 VanDerWaalsContact C-N 3.25Å; Q640-Q642 PolarHBondContact O-N 3.07Å; Q642-N644 VanDerWaalsContact C-N 3.35Å; Q642-A645 PolarHBondContact O-N 2.89Å; Q642-L646 WeakPolarHBondContact O-CB 3.32Å; Q642-L646 PolarHBondContact O-N 3.46Å
643	I	89.4	Confident	82.1	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-61.9	-44	170.4	-66.4	169.9	0	0	0	110.2	L565 V628 V639 Q640 A645 L646 V647	L565-I643 HydrophobicContact CD2-CG1 4.07Å; V628-I643 HydrophobicContact CB-CD1 4.39Å; V628-I643 HydrophobicContact CB-CG2 3.96Å; V628-I643 HydrophobicContact CG1-CD1 4.1Å; V628-I643 HydrophobicContact CG1-CG1 4.26Å; V628-I643 HydrophobicContact CG2-CG2 4.09Å; V639-I643 HydrophobicContact CG1-CD1 3.99Å; V639-I643 HydrophobicContact CG1-CG1 4.09Å; V639-I643 PolarHBondContact O-N 3.48Å; V639-I643 VanDerWaalsContact O-N 3.1Å; Q640-I643 PolarHBondContact O-N 3.04Å; I643-A645 VanDerWaalsContact C-N 3.34Å; I643-A645 PolarHBondContact O-N 2.64Å; I643-L646 PolarHBondContact O-N 3.44Å; I643-V647 HydrophobicContact CG2-CG2 4.35Å; I643-V647 WeakPolarHBondContact O-CB 3.38Å; I643-V647 WeakPolarHBondContact O-CG2 3.43Å; I643-V647 PolarHBondContact O-N 3.21Å
644	N	92.3	Very high	83.9	Confident	12 Å²	12	51.1 Å²	51.1	6%	0.064	28%	0.282	C	S	.	.	H	α-helix	trans	-65.6	-36.9	178.3	-60.6	-12.5	0	0	0	111.7	Y617 A620 V621 Q640 Q642 K648	Y617-N644 HydrophobicContact CD2-CB 4.37Å; Y617-N644 HydrophobicContact CE2-CB 3.59Å; A620-N644 VanDerWaalsContact CB-O 3.27Å; A620-N644 WeakPolarHBondContact CB-O 3.46Å; V621-N644 HydrophobicContact CG2-CB 4.36Å; Q640-N644 PolarHBondContact NE2-OD1 3.47Å; Q640-N644 PolarHBondContact O-N 3.01Å; Q640-N644 PolarHBondContact O-ND2 3.4Å; Q640-N644 PolarHBondContact O-OD1 3.29Å; Q642-N644 VanDerWaalsContact C-N 3.35Å; N644-K648 WeakPolarHBondContact O-CB 3.37Å; N644-K648 PolarHBondContact O-N 3.09Å
645	A	89.8	Confident	85.8	Confident	41 Å²	41	50.9 Å²	50.9	34%	0.339	28%	0.275	S	S	.	.	H	α-helix	trans	-65.9	-45.1	173.8	0	0	0	0	0	112.3	P641 Q642 I643 K648 G649	P641-A645 WeakPolarHBondContact O-CB 3.24Å; P641-A645 PolarHBondContact O-N 3.04Å; Q642-A645 PolarHBondContact O-N 2.89Å; I643-A645 VanDerWaalsContact C-N 3.34Å; I643-A645 PolarHBondContact O-N 2.64Å; A645-K648 PolarHBondContact O-N 2.89Å; A645-G649 PolarHBondContact O-N 2.94Å
646	L	91.4	Very high	87.3	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-55.1	175.8	168.9	65.3	0	0	0	111.4	L564 L565 N568 L580 Q642 I643 K648 G649 I650	L564-L646 HydrophobicContact CB-CD1 4.23Å; L564-L646 HydrophobicContact CB-CD2 3.66Å; L565-L646 HydrophobicContact CD2-CD2 4.3Å; N568-L646 PolarHBondContact OD1-N 3.18Å; L580-L646 HydrophobicContact CD1-CD1 4.43Å; L580-L646 HydrophobicContact CD2-CD1 3.72Å; Q642-L646 WeakPolarHBondContact O-CB 3.32Å; Q642-L646 PolarHBondContact O-N 3.46Å; I643-L646 PolarHBondContact O-N 3.44Å; L646-K648 VanDerWaalsContact C-N 3.3Å; L646-K648 PolarHBondContact O-N 3.15Å; L646-G649 WeakPolarHBondContact O-CA 3.46Å; L646-G649 PolarHBondContact O-N 3.41Å; L646-I650 HydrophobicContact CD1-CD1 3.85Å; L646-I650 HydrophobicContact CD1-CG1 4.28Å; L646-I650 HydrophobicContact CG-CD1 4.06Å; L646-I650 WeakPolarHBondContact O-CG1 3.31Å; L646-I650 PolarHBondContact O-N 2.97Å
647	V	93.3	Very high	88.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.6	-35.2	-177.7	173.8	0	0	0	0	111.2	F599 A620 V628 I643 G649 I650 I651	F599-V647 HydrophobicContact CE1-CG1 4.05Å; F599-V647 HydrophobicContact CZ-CG1 4.37Å; A620-V647 HydrophobicContact CB-CB 3.93Å; A620-V647 HydrophobicContact CB-CG1 3.82Å; V628-V647 HydrophobicContact CG2-CG2 4.45Å; I643-V647 HydrophobicContact CG2-CG2 4.35Å; I643-V647 WeakPolarHBondContact O-CB 3.38Å; I643-V647 WeakPolarHBondContact O-CG2 3.43Å; I643-V647 PolarHBondContact O-N 3.21Å; V647-G649 PolarHBondContact O-N 2.96Å; V647-I650 PolarHBondContact O-N 2.9Å; V647-I651 HydrophobicContact CG1-CD1 4.08Å; V647-I651 VanDerWaalsContact O-CG1 3.29Å; V647-I651 WeakPolarHBondContact O-CG1 3.48Å; V647-I651 PolarHBondContact O-N 3.14Å
648	K	94.1	Very high	90.1	Very high	88 Å²	88	41 Å²	41	38%	0.383	23%	0.225	S	C	.	.	H	α-helix	trans	-59.6	-44.4	169.6	178.7	-148.8	170.8	-167.8	0	111.4	P616 Y617 A620 N644 A645 L646 I651 L652	P616-K648 HydrophobicContact CB-CG 4.14Å; Y617-K648 HydrophobicContact CD2-CB 4.27Å; Y617-K648 HydrophobicContact CD2-CD 4.16Å; Y617-K648 HydrophobicContact CD2-CG 4.48Å; A620-K648 HydrophobicContact CB-CB 3.95Å; N644-K648 WeakPolarHBondContact O-CB 3.37Å; N644-K648 PolarHBondContact O-N 3.09Å; A645-K648 PolarHBondContact O-N 2.89Å; L646-K648 VanDerWaalsContact C-N 3.3Å; L646-K648 PolarHBondContact O-N 3.15Å; K648-I651 PolarHBondContact O-N 3.42Å; K648-L652 HydrophobicContact CD-CD1 4.45Å; K648-L652 HydrophobicContact CG-CD1 4.15Å; K648-L652 WeakPolarHBondContact O-CB 3.27Å; K648-L652 WeakPolarHBondContact O-CG 3.21Å; K648-L652 PolarHBondContact O-N 3.37Å
649	G	91.6	Very high	90.7	Very high	6 Å²	6	36.6 Å²	36.6	6%	0.062	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-44.9	176	0	0	0	0	0	112.4	A645 L646 V647 L652 Q653	A645-G649 PolarHBondContact O-N 2.94Å; L646-G649 WeakPolarHBondContact O-CA 3.46Å; L646-G649 PolarHBondContact O-N 3.41Å; V647-G649 PolarHBondContact O-N 2.96Å; G649-L652 PolarHBondContact O-N 3.46Å; G649-Q653 WeakPolarHBondContact O-CB 3.28Å; G649-Q653 WeakPolarHBondContact O-CG 3.42Å; G649-Q653 PolarHBondContact O-N 3.3Å
650	I	94.4	Very high	90.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66.6	-39.8	178.6	-58.7	171	0	0	0	111.5	F556 L580 F599 L646 V647 L652 Q653 H654 I657 F658	F556-I650 HydrophobicContact CE1-CD1 3.63Å; F556-I650 HydrophobicContact CZ-CD1 3.56Å; L580-I650 HydrophobicContact CD1-CG1 4.17Å; F599-I650 HydrophobicContact CD1-CB 4.14Å; F599-I650 HydrophobicContact CD1-CG2 3.53Å; F599-I650 HydrophobicContact CD2-CG2 4.06Å; F599-I650 HydrophobicContact CE1-CB 3.81Å; F599-I650 HydrophobicContact CE1-CG2 3.51Å; F599-I650 HydrophobicContact CE2-CG2 4.06Å; F599-I650 HydrophobicContact CG-CG2 3.81Å; F599-I650 HydrophobicContact CZ-CB 4.27Å; F599-I650 HydrophobicContact CZ-CG2 3.79Å; L646-I650 HydrophobicContact CD1-CD1 3.85Å; L646-I650 HydrophobicContact CD1-CG1 4.28Å; L646-I650 HydrophobicContact CG-CD1 4.06Å; L646-I650 WeakPolarHBondContact O-CG1 3.31Å; L646-I650 PolarHBondContact O-N 2.97Å; V647-I650 PolarHBondContact O-N 2.9Å; I650-L652 VanDerWaalsContact C-N 3.34Å; I650-L652 PolarHBondContact O-N 2.9Å; I650-Q653 PolarHBondContact O-N 2.98Å; I650-H654 WeakPolarHBondContact O-CA 3.45Å; I650-H654 WeakPolarHBondContact O-CB 3.37Å; I650-H654 PolarHBondContact O-N 3.17Å; I650-H654 VanDerWaalsContact O-N 3.09Å; I650-I657 HydrophobicContact CB-CD1 4.41Å; I650-I657 HydrophobicContact CG1-CD1 4.21Å; I650-I657 HydrophobicContact CG2-CD1 4.48Å; I650-F658 HydrophobicContact CG2-CE2 3.58Å; I650-F658 HydrophobicContact CG2-CZ 3.69Å
651	I	95.1	Very high	90.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-41.6	172.4	-67.8	166.3	0	0	0	111.2	F599 L602 H603 P616 L619 A620 V647 K648	F599-I651 HydrophobicContact CD1-CG1 3.69Å; F599-I651 HydrophobicContact CE1-CG1 3.82Å; L602-I651 HydrophobicContact CB-CD1 4.36Å; L602-I651 HydrophobicContact CB-CG1 4.18Å; L602-I651 HydrophobicContact CD1-CD1 4.47Å; H603-I651 HydrophobicContact CB-CG2 4.39Å; H603-I651 PolarHBondContact ND1-O 2.98Å; P616-I651 HydrophobicContact CB-CG2 4.06Å; L619-I651 HydrophobicContact CB-CD1 3.96Å; A620-I651 HydrophobicContact CB-CD1 4.38Å; V647-I651 HydrophobicContact CG1-CD1 4.08Å; V647-I651 VanDerWaalsContact O-CG1 3.29Å; V647-I651 WeakPolarHBondContact O-CG1 3.48Å; V647-I651 PolarHBondContact O-N 3.14Å; K648-I651 PolarHBondContact O-N 3.42Å
652	L	92.7	Very high	90.4	Very high	85 Å²	85	41.8 Å²	41.8	45%	0.445	23%	0.232	S	C	.	.	H	α-helix	trans	-72.4	-28.8	-179	-78.1	171.8	0	0	0	113.9	P616 K648 G649 I650	P616-L652 HydrophobicContact CB-CD2 4.27Å; P616-L652 HydrophobicContact CB-CG 4.16Å; P616-L652 HydrophobicContact CG-CD2 3.87Å; P616-L652 HydrophobicContact CG-CG 4.32Å; K648-L652 HydrophobicContact CD-CD1 4.45Å; K648-L652 HydrophobicContact CG-CD1 4.15Å; K648-L652 WeakPolarHBondContact O-CB 3.27Å; K648-L652 WeakPolarHBondContact O-CG 3.21Å; K648-L652 PolarHBondContact O-N 3.37Å; G649-L652 PolarHBondContact O-N 3.46Å; I650-L652 VanDerWaalsContact C-N 3.34Å; I650-L652 PolarHBondContact O-N 2.9Å
653	Q	92.2	Very high	90.2	Very high	28 Å²	28	42.5 Å²	42.5	13%	0.131	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	23.2	-168.8	-54.7	-174.8	-90.3	0	0	113	D573 A577 G649 I650 E655 S656 I657	D573-Q653 PolarHBondContact O-NE2 2.88Å; A577-Q653 HydrophobicContact CB-CB 4.43Å; G649-Q653 WeakPolarHBondContact O-CB 3.28Å; G649-Q653 WeakPolarHBondContact O-CG 3.42Å; G649-Q653 PolarHBondContact O-N 3.3Å; I650-Q653 PolarHBondContact O-N 2.98Å; Q653-E655 VanDerWaalsContact C-N 3.28Å; Q653-E655 PolarHBondContact O-N 3.3Å; Q653-S656 PolarHBondContact O-N 3.37Å; Q653-I657 HydrophobicContact CB-CD1 3.79Å; Q653-I657 HydrophobicContact CB-CG1 4.33Å; Q653-I657 WeakPolarHBondContact O-CG1 3.28Å; Q653-I657 PolarHBondContact O-N 2.91Å; Q653-I657 VanDerWaalsContact O-N 3.11Å
654	H	93.1	Very high	89.9	Confident	21 Å²	21	43.5 Å²	43.5	10%	0.097	24%	0.241	C	C	.	.	H	α-helix	trans	-56.4	-38	-171.5	72.9	90.1	0	0	0	113.3	F599 H603 I650 S656 I657 F658	F599-H654 HydrophobicContact CB-CB 4.08Å; H603-H654 WeakPolarHBondContact CB-CD2 3.45Å; H603-H654 WeakPolarHBondContact CB-NE2 3.46Å; H603-H654 AromaticContact CD2-NE2 3.58Å; H603-H654 AromaticContact CG-CD2 3.37Å; H603-H654 AromaticContact CG-NE2 3.26Å; H603-H654 VanDerWaalsContact CG-NE2 3.26Å; H603-H654 AromaticContact ND1-CD2 3.51Å; H603-H654 AromaticContact ND1-NE2 3.74Å; I650-H654 WeakPolarHBondContact O-CA 3.45Å; I650-H654 WeakPolarHBondContact O-CB 3.37Å; I650-H654 PolarHBondContact O-N 3.17Å; I650-H654 VanDerWaalsContact O-N 3.09Å; H654-S656 VanDerWaalsContact C-N 3.26Å; H654-S656 PolarHBondContact O-N 3.18Å; H654-I657 PolarHBondContact O-N 2.93Å; H654-F658 HydrophobicContact CB-CD2 3.94Å; H654-F658 HydrophobicContact CB-CE2 4.18Å; H654-F658 WeakPolarHBondContact O-CD2 3.45Å; H654-F658 PolarHBondContact O-N 3.35Å
655	E	91.4	Very high	89.5	Confident	157 Å²	157	49 Å²	49	73%	0.734	27%	0.267	S	S	*	.	H	α-helix	trans	-66.4	-25.2	178	-55.6	-173.2	155.9	0	0	113.4	Q653	Q653-E655 VanDerWaalsContact C-N 3.28Å; Q653-E655 PolarHBondContact O-N 3.3Å
656	S	91.1	Very high	89.1	Confident	73 Å²	73	47.7 Å²	47.7	51%	0.51	26%	0.257	S	S	.	.	H	α-helix	trans	-91.5	-18.8	176.3	-49.8	0	0	0	0	113.1	Q653 H654	Q653-S656 PolarHBondContact O-N 3.37Å; H654-S656 VanDerWaalsContact C-N 3.26Å; H654-S656 PolarHBondContact O-N 3.18Å
657	I	92.6	Very high	88.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-98.7	-42.1	-173.8	-68.7	168.8	0	0	0	111.9	A577 L580 K581 V584 I650 Q653 H654	A577-I657 HydrophobicContact CB-CG1 4.08Å; L580-I657 HydrophobicContact CB-CD1 4Å; L580-I657 HydrophobicContact CB-CG1 4.01Å; L580-I657 HydrophobicContact CB-CG2 4.14Å; L580-I657 HydrophobicContact CD1-CD1 3.78Å; K581-I657 WeakPolarHBondContact CA-O 3.45Å; K581-I657 WeakPolarHBondContact CB-O 3.43Å; K581-I657 WeakPolarHBondContact CG-O 3.47Å; V584-I657 HydrophobicContact CG2-CG2 4.19Å; I650-I657 HydrophobicContact CB-CD1 4.41Å; I650-I657 HydrophobicContact CG1-CD1 4.21Å; I650-I657 HydrophobicContact CG2-CD1 4.48Å; Q653-I657 HydrophobicContact CB-CD1 3.79Å; Q653-I657 HydrophobicContact CB-CG1 4.33Å; Q653-I657 WeakPolarHBondContact O-CG1 3.28Å; Q653-I657 PolarHBondContact O-N 2.91Å; Q653-I657 VanDerWaalsContact O-N 3.11Å; H654-I657 PolarHBondContact O-N 2.93Å
658	F	92.9	Very high	88.4	Confident	8 Å²	8	54.2 Å²	54.2	4%	0.035	29%	0.292	C	S	.	.	S	Bend	trans	-94.5	147.3	-177.9	-62.6	-71.7	0	0	0	111.9	V584 M595 R596 F599 I650 H654	V584-F658 HydrophobicContact CG1-CD1 3.83Å; V584-F658 HydrophobicContact CG1-CE1 3.76Å; V584-F658 HydrophobicContact CG2-CE1 4.44Å; M595-F658 HydrophobicContact CB-CD1 4.17Å; M595-F658 HydrophobicContact CB-CE1 3.47Å; M595-F658 VanDerWaalsContact CB-CE1 3.47Å; M595-F658 HydrophobicContact CB-CZ 3.93Å; M595-F658 HydrophobicContact CE-CE1 4.27Å; M595-F658 HydrophobicContact CE-CZ 4.48Å; M595-F658 HydrophobicContact CG-CE1 4.42Å; M595-F658 HydrophobicContact SD-CE1 4.26Å; R596-F658 HydrophobicContact CB-CB 4.01Å; R596-F658 HydrophobicContact CB-CD1 4.48Å; R596-F658 HydrophobicContact CB-CG 4.22Å; R596-F658 HydrophobicContact CG-CB 3.98Å; F599-F658 HydrophobicContact CB-CD2 4.3Å; F599-F658 HydrophobicContact CB-CE2 3.57Å; F599-F658 HydrophobicContact CB-CZ 4.25Å; F599-F658 AromaticContact CD2-CE2 3.78Å; F599-F658 HydrophobicContact CD2-CE2 3.78Å; F599-F658 AromaticContact CD2-CZ 3.55Å; F599-F658 HydrophobicContact CD2-CZ 3.55Å; F599-F658 HydrophobicContact CE2-CZ 4.16Å; F599-F658 AromaticContact CG-CE2 3.77Å; F599-F658 HydrophobicContact CG-CE2 3.77Å; F599-F658 HydrophobicContact CG-CZ 4.03Å; I650-F658 HydrophobicContact CG2-CE2 3.58Å; I650-F658 HydrophobicContact CG2-CZ 3.69Å; H654-F658 HydrophobicContact CB-CD2 3.94Å; H654-F658 HydrophobicContact CB-CE2 4.18Å; H654-F658 WeakPolarHBondContact O-CD2 3.45Å; H654-F658 PolarHBondContact O-N 3.35Å
659	P	87.1	Confident	88.1	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.032	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-67.7	141.6	179.6	25.4	-33	0	0	0	112.8	I592 R596 E663 V664	I592-P659 VanDerWaalsContact CG2-CD 3.46Å; I592-P659 HydrophobicContact CG2-CG 3.46Å; I592-P659 VanDerWaalsContact CG2-CG 3.46Å; R596-P659 WeakPolarHBondContact CD-O 3.45Å; R596-P659 PolarHBondContact NH1-O 3.18Å; P659-E663 WeakPolarHBondContact CA-OE2 3.45Å; P659-E663 HydrophobicContact CB-CB 3.57Å; P659-E663 HydrophobicContact CB-CG 4.49Å; P659-E663 WeakPolarHBondContact CB-OE2 3.49Å; P659-V664 HydrophobicContact CB-CB 4.21Å; P659-V664 HydrophobicContact CB-CG2 3.83Å; P659-V664 HydrophobicContact CG-CB 3.95Å; P659-V664 HydrophobicContact CG-CG2 3.55Å
660	S	84.9	Confident	87.9	Confident	50 Å²	50	56.3 Å²	56.3	35%	0.35	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-64.3	169.6	174.6	61.3	0	0	0	0	112.1	R596 S662 E663 V664	R596-S660 PolarHBondContact NH1-O 2.95Å; R596-S660 VanDerWaalsContact NH1-O 3.15Å; S660-S662 PolarHBondContact O-N 2.84Å; S660-S662 PolarHBondContact OG-OG 3.46Å; S660-E663 PolarHBondContact O-N 3.37Å; S660-E663 PolarHBondContact OG-N 3.46Å; S660-V664 PolarHBondContact O-N 3.46Å
661	Q	81.2	Confident	87.4	Confident	86 Å²	86	60.5 Å²	60.5	40%	0.402	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.3	174.7	-171.4	64.5	0	0	0	113.4	V664 G666 M668	Q661-V664 PolarHBondContact OE1-O 3.06Å; Q661-G666 VanDerWaalsContact CD-O 3.3Å; Q661-G666 PolarHBondContact NE2-O 3.01Å; Q661-G666 PolarHBondContact OE1-O 2.95Å; Q661-M668 HydrophobicContact CB-CG 4.39Å
662	S	79.3	Confident	86.5	Confident	115 Å²	115	65.6 Å²	65.6	80%	0.804	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-17.3	174.2	51.3	0	0	0	0	114.3	S660	S660-S662 PolarHBondContact O-N 2.84Å; S660-S662 PolarHBondContact OG-OG 3.46Å
663	E	83.6	Confident	85.8	Confident	111 Å²	111	63.4 Å²	63.4	52%	0.519	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-35.5	174.5	-74.8	-179.9	-178.7	0	0	111.9	K581 P659 S660	K581-E663 WeakPolarHBondContact CE-OE2 3.37Å; K581-E663 VanDerWaalsContact NZ-CD 3.25Å; K581-E663 IonicContact NZ-OE1 3.35Å; K581-E663 PolarHBondContact NZ-OE1 3.36Å; K581-E663 IonicContact NZ-OE2 2.83Å; K581-E663 PolarHBondContact NZ-OE2 3.04Å; P659-E663 WeakPolarHBondContact CA-OE2 3.45Å; P659-E663 HydrophobicContact CB-CB 3.57Å; P659-E663 HydrophobicContact CB-CG 4.49Å; P659-E663 WeakPolarHBondContact CB-OE2 3.49Å; S660-E663 PolarHBondContact O-N 3.37Å; S660-E663 PolarHBondContact OG-N 3.46Å
664	V	85	Confident	84.4	Confident	24 Å²	24	67.1 Å²	67.1	15%	0.145	37%	0.366	C	S	.	.	S	Bend	trans	-141.8	124.9	176.6	171.3	0	0	0	0	110.5	E589 V593 R596 P659 S660 Q661	E589-V664 HydrophobicContact CG-CG1 3.64Å; V593-V664 HydrophobicContact CG2-CG1 3.67Å; R596-V664 PolarHBondContact NH1-O 3.24Å; R596-V664 PolarHBondContact NH2-O 3.32Å; P659-V664 HydrophobicContact CB-CB 4.21Å; P659-V664 HydrophobicContact CB-CG2 3.83Å; P659-V664 HydrophobicContact CG-CB 3.95Å; P659-V664 HydrophobicContact CG-CG2 3.55Å; S660-V664 PolarHBondContact O-N 3.46Å; Q661-V664 PolarHBondContact OE1-O 3.06Å
665	E	81.8	Confident	82.6	Confident	129 Å²	129	70.7 Å²	70.7	60%	0.603	39%	0.385	S	S	*	.			trans	-79.2	130.8	178.4	-171.5	-167.4	-125.4	0	0	112.1	R484	R484-E665 IonicContact CZ-OE2 3.77Å; R484-E665 PolarHBondContact NH1-O 3.43Å; R484-E665 IonicContact NH2-OE2 3.94Å; R484-E665 PolarHBondContact NH2-OE2 3.09Å
666	G	82.6	Confident	80.2	Confident	12 Å²	12	69.7 Å²	69.7	12%	0.124	38%	0.381	C	S	.	.	S	Bend	trans	174.4	-173.2	171.7	0	0	0	0	0	111.6	Q661	Q661-G666 VanDerWaalsContact CD-O 3.3Å; Q661-G666 PolarHBondContact NE2-O 3.01Å; Q661-G666 PolarHBondContact OE1-O 2.95Å
667	P	83.8	Confident	77.5	Confident	41 Å²	41	75.5 Å²	75.5	27%	0.266	40%	0.4	S	S	.	.			trans	-63.1	152.8	170.6	-20.3	33	0	0	0	111.4	R484 I485 R596	R484-P667 VanDerWaalsContact CB-CD 3.49Å; R484-P667 HydrophobicContact CB-CG 3.96Å; I485-P667 HydrophobicContact CD1-CB 3.74Å; I485-P667 HydrophobicContact CD1-CG 3.96Å; I485-P667 HydrophobicContact CG1-CB 4.39Å; I485-P667 HydrophobicContact CG1-CG 4.05Å; R596-P667 PolarHBondContact NH2-O 2.93Å
668	M	85.9	Confident	74.6	Confident	99 Å²	99	80 Å²	80	49%	0.488	42%	0.424	S	S	.	.			trans	-116.4	152.4	171.3	-73.1	-66.1	-72	0	0	108.9	R596 Q661 E670	R596-M668 HydrophobicContact CG-SD 4.42Å; R596-M668 PolarHBondContact NE-SD 3.02Å; Q661-M668 HydrophobicContact CB-CG 4.39Å; M668-E670 PolarHBondContact O-N 3.15Å
669	Y	88.7	Confident	71.8	Confident	23 Å²	23	87 Å²	87	9%	0.09	46%	0.461	C	S	.	.			trans	-80.9	119.7	177.1	171.4	-103.4	0	0	0	110.6	V493 N497 Y597 A600 F601 H604 K671 M673	V493-Y669 HydrophobicContact CG1-CD2 3.83Å; V493-Y669 HydrophobicContact CG1-CE2 3.61Å; N497-Y669 PolarHBondContact ND2-OH 3.39Å; N497-Y669 PolarHBondContact OD1-OH 2.8Å; Y597-Y669 HydrophobicContact CE1-CD2 4.44Å; Y597-Y669 HydrophobicContact CE2-CD2 4.26Å; A600-Y669 HydrophobicContact CB-CD1 4.09Å; A600-Y669 HydrophobicContact CB-CG 4.38Å; F601-Y669 HydrophobicContact CB-CD1 4.29Å; F601-Y669 HydrophobicContact CB-CD2 3.88Å; F601-Y669 HydrophobicContact CB-CE1 4.28Å; F601-Y669 HydrophobicContact CB-CE2 3.89Å; F601-Y669 HydrophobicContact CB-CG 4.08Å; F601-Y669 AromaticContact CD2-CE2 3.77Å; F601-Y669 HydrophobicContact CD2-CE2 3.77Å; F601-Y669 AromaticContact CD2-CZ 3.82Å; F601-Y669 HydrophobicContact CG-CE2 4.27Å; H604-Y669 HydrophobicContact CB-CE1 3.61Å; H604-Y669 AromaticContact CG-CE1 3.89Å; H604-Y669 AromaticContact ND1-CE1 3.7Å; H604-Y669 AromaticContact ND1-CZ 3.72Å; H604-Y669 PolarHBondContact ND1-OH 3.35Å; Y669-K671 HydrophobicContact CE1-CG 4.24Å; Y669-M673 HydrophobicContact CD2-CE 4.14Å; Y669-M673 HydrophobicContact CE2-CE 3.99Å
670	E	86	Confident	68.8	Low	116 Å²	116	92.8 Å²	92.8	54%	0.542	50%	0.501	S	S	.	.			trans	-91.2	135.4	177	-179.4	167.1	-131.1	0	0	111.9	N497 M668 M673	N497-E670 PolarHBondContact ND2-O 2.97Å; M668-E670 PolarHBondContact O-N 3.15Å; E670-M673 HydrophobicContact CB-CE 4.38Å; E670-M673 HydrophobicContact CB-CG 4.38Å
671	K	84.6	Confident	66.1	Low	88 Å²	88	99.3 Å²	99.3	38%	0.383	53%	0.526	S	S	.	.	S	Bend	trans	-79.2	-33	-179.1	-67.9	-170.6	177.1	-171.2	0	113.7	N497 H604 Y669	N497-K671 PolarHBondContact OD1-O 3.29Å; H604-K671 PolarHBondContact CE1-O 2.96Å; Y669-K671 HydrophobicContact CE1-CG 4.24Å
672	C	77	Confident	63.5	Low	106 Å²	106	101.6 Å²	101.6	72%	0.716	55%	0.545	S	S	*	.	S	Bend	trans	-115.8	70.5	-174.4	-61.8	0	0	0	0	110.9
673	M	77.8	Confident	61.1	Low	39 Å²	39	103.6 Å²	103.6	19%	0.192	55%	0.545	C	S	.	.			trans	-71.4	143.6	177.5	-70.5	173.8	-179.9	0	0	111.4	R494 N497 L498 Y669 E670	R494-M673 HydrophobicContact CB-SD 3.99Å; R494-M673 HydrophobicContact CG-SD 3.89Å; N497-M673 HydrophobicContact CB-SD 4Å; N497-M673 VanDerWaalsContact ND2-CG 3.35Å; N497-M673 WeakPolarHBondContact ND2-CG 3.46Å; N497-M673 PolarHBondContact ND2-SD 3.47Å; L498-M673 HydrophobicContact CD2-CB 4.04Å; L498-M673 WeakPolarHBondContact CD2-O 3.38Å; L498-M673 HydrophobicContact CG-CB 4.37Å; Y669-M673 HydrophobicContact CD2-CE 4.14Å; Y669-M673 HydrophobicContact CE2-CE 3.99Å; E670-M673 HydrophobicContact CB-CE 4.38Å; E670-M673 HydrophobicContact CB-CG 4.38Å
674	T	61.3	Low	58.6	Low	106 Å²	106	105.9 Å²	105.9	65%	0.65	56%	0.56	S	S	*	*			trans	-101.9	174.3	170.8	56.1	0	0	0	0	111
675	L	56	Low	55.8	Low	96 Å²	96	113.9 Å²	113.9	50%	0.503	60%	0.595	S	S	.	*			trans	-83.2	119.1	159.9	-77	174.8	0	0	0	108.1	L498 Q677	L498-L675 HydrophobicContact CD1-CD2 4.23Å; L675-Q677 PolarHBondContact O-N 3.44Å
676	E	41.4	Very low	53.2	Low	137 Å²	137	111 Å²	111	64%	0.64	60%	0.6	S	S	*	*			trans	-56.4	124.1	-173.8	-66.3	156.6	134	0	0	112.2	R494	R494-E676 IonicContact NH1-OE2 3.22Å; R494-E676 PolarHBondContact NH1-OE2 3.18Å
677	Q	34.3	Very low	50.6	Low	195 Å²	195	119.7 Å²	119.7	91%	0.911	64%	0.637	S	S	*	*			trans	-103.3	115.7	155.5	-71.4	-174	-12	0	0	106.9	L675	L675-Q677 PolarHBondContact O-N 3.44Å
678	D	31.7	Very low	48	Very low	95 Å²	95	123.1 Å²	123.1	51%	0.508	66%	0.658	S	S	.	*			trans	-66.6	162.9	175	-69.8	-48.5	0	0	0	111.5	K456	K456-D678 IonicContact NZ-OD2 2.71Å; K456-D678 PolarHBondContact NZ-OD2 3.17Å
679	D	33.3	Very low	45.2	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	68%	0.676	S	S	*	*			trans	72.5	88.1	162.9	-54.8	-25.8	0	0	0	118.5
680	C	25.7	Very low	42.2	Very low	128 Å²	128	130 Å²	130	87%	0.865	70%	0.703	S	S	*	*			trans	-135.2	80.6	148.5	-127.9	0	0	0	0	110
681	E	26.5	Very low	39.3	Very low	186 Å²	186	130.1 Å²	130.1	87%	0.869	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-63.5	131.8	173	-66.7	-173.4	132.7	0	0	110.9
682	V	27.3	Very low	36.7	Very low	134 Å²	134	134.8 Å²	134.8	81%	0.812	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-100.3	119.5	170.8	-179.3	0	0	0	0	109.1
683	I	28.2	Very low	34.3	Very low	157 Å²	157	134 Å²	134	81%	0.805	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-69.7	140.9	-177.9	-62.9	169	0	0	0	110.4
684	I	31.1	Very low	31.9	Very low	160 Å²	160	140.3 Å²	140.3	82%	0.821	75%	0.748	S	S	*	*			trans	-99.5	106.8	-178.8	-57.3	174.1	0	0	0	111.3
685	E	27.4	Very low	30.2	Very low	192 Å²	192	140.3 Å²	140.3	90%	0.897	75%	0.753	S	S	*	*			trans	-147.9	142.3	154	-63.7	-171.9	161.3	0	0	107.1
686	G	27.1	Very low	28.9	Very low	68 Å²	68	146.8 Å²	146.8	70%	0.701	77%	0.771	S	S	*	*			cis	161	82.1	-8	0	0	0	0	0	113.7
687	E	27	Very low	28.1	Very low	194 Å²	194	146.9 Å²	146.9	91%	0.907	78%	0.775	S	S	*	*			trans	65.5	155.6	164.3	-62.6	-163.7	149.2	0	0	117.5
688	V	29.7	Very low	27.7	Very low	114 Å²	114	144.4 Å²	144.4	69%	0.691	77%	0.769	S	S	*	*			cis	-165.4	167.6	-12.4	125.7	0	0	0	0	109.8
689	E	26.1	Very low	27.6	Very low	186 Å²	186	147 Å²	147	87%	0.869	78%	0.781	S	S	*	*			trans	70.9	155.9	172	-72.7	-152.1	165.7	0	0	119.9
690	A	26.8	Very low	27.3	Very low	79 Å²	79	146.7 Å²	146.7	65%	0.653	78%	0.775	S	S	*	*			cis	-170	144	-30.6	0	0	0	0	0	114
691	D	25.7	Very low	27.3	Very low	120 Å²	120	148.4 Å²	148.4	64%	0.642	77%	0.772	S	S	*	*			trans	72.8	154	142.4	-132.5	-14.2	0	0	0	124.3
692	Y	28.9	Very low	27.3	Very low	185 Å²	185	143.3 Å²	143.3	73%	0.725	77%	0.77	S	S	*	*			trans	66.3	137.7	167.5	-63.2	-60.6	0	0	0	120.6
693	S	27.1	Very low	27.2	Very low	89 Å²	89	146.9 Å²	146.9	62%	0.622	78%	0.775	S	S	*	*			cis	-165.9	141.4	-2.9	52.3	0	0	0	0	114.1
694	Q	26.5	Very low	27.7	Very low	172 Å²	172	145.6 Å²	145.6	80%	0.804	78%	0.777	S	S	*	*			trans	54.3	152.3	132.2	-65.6	178.3	3.4	0	0	120.1
695	S	26.2	Very low	27.5	Very low	107 Å²	107	143.1 Å²	143.1	75%	0.748	78%	0.781	S	S	*	*			cis	-177.6	174.7	0.8	40.6	0	0	0	0	107.7
696	R	27.9	Very low	27.4	Very low	232 Å²	232	137.6 Å²	137.6	88%	0.875	78%	0.775	S	S	*	*			cis	-176.3	161.4	-30.2	-177.4	173.9	-175.9	-164.3	2	106.3
697	D	25.9	Very low	27.6	Very low	138 Å²	138	142.8 Å²	142.8	74%	0.738	79%	0.785	S	S	*	*			trans	-81.4	159.9	-166.5	-37.4	-90.1	0	0	0	117.2
698	D	26.4	Very low	27.4	Very low	144 Å²	144	136.6 Å²	136.6	77%	0.77	77%	0.773	S	S	*	*			trans	71.7	135.1	137	-87.1	-20.4	0	0	0	125.8
699	L	29.2	Very low	28.2	Very low	148 Å²	148	137.4 Å²	137.4	78%	0.775	78%	0.78	S	S	*	*			trans	65.9	155.3	147.9	-63.8	162.4	0	0	0	118
700	E	25.9	Very low	28.1	Very low	147 Å²	147	135.5 Å²	135.5	69%	0.687	78%	0.776	S	S	*	*			cis	-152.4	166.6	13	-143.4	-171.5	178.9	0	0	113.1
701	M	25.7	Very low	28.3	Very low	164 Å²	164	137.3 Å²	137.3	81%	0.808	78%	0.779	S	S	*	*			trans	37	136.6	160.6	-65.3	-163.1	-149.9	0	0	123.8
702	G	26.2	Very low	28.3	Very low	80 Å²	80	136.8 Å²	136.8	83%	0.825	79%	0.785	S	S	*	*			trans	159.7	99.1	149.5	0	0	0	0	0	118.4
703	F	26	Very low	28.2	Very low	208 Å²	208	133.1 Å²	133.1	91%	0.912	79%	0.793	S	S	*	*			trans	-113.4	146.1	163.3	-89.9	-69.7	0	0	0	109.1
704	P	39.3	Very low	28.1	Very low	131 Å²	131	133.4 Å²	133.4	85%	0.851	80%	0.801	S	S	*	*				-147.7	-174.4	84.6	38.7	-19.1	0	0	0	115.8
705	A	26.9	Very low	28.8	Very low	108 Å²	108	131 Å²	131	89%	0.893	80%	0.799	S	S	*	*			trans	-84.6	160.8	-165.6	0	0	0	0	0	116.7
706	G	25.8	Very low	28.7	Very low	76 Å²	76	129.7 Å²	129.7	78%	0.784	80%	0.796	S	S	*	*			trans	-149.9	143.8	170.6	0	0	0	0	0	112.2
707	I	29.8	Very low	28.5	Very low	177 Å²	177	125.8 Å²	125.8	91%	0.908	79%	0.791	S	S	*	*			trans	-85.8	151.7	-169.6	-64	162.9	0	0	0	111.6
708	G	24	Very low	28.4	Very low	63 Å²	63	124.9 Å²	124.9	65%	0.649	79%	0.791	S	S	*	*			trans	-79.4	-147.7	175.9	0	0	0	0	0	114.5
709	P	45	Very low	28.3	Very low	131 Å²	131	127.5 Å²	127.5	85%	0.851	80%	0.795	S	S	*	*			cis	-141.4	-159.9	10	41.5	-19.9	0	0	0	115.5
710	D	24.9	Very low	28	Very low	146 Å²	146	125 Å²	125	78%	0.781	80%	0.797	S	S	*	*			trans	107.1	160.4	144	-148	13.7	0	0	0	121.1
711	V	30.4	Very low	27.9	Very low	118 Å²	118	127.5 Å²	127.5	72%	0.715	81%	0.808	S	S	*	*			trans	84.9	81.7	167.6	-161.4	0	0	0	0	119.8
712	S	25.8	Very low	28	Very low	109 Å²	109	130.9 Å²	130.9	76%	0.762	81%	0.812	S	S	*	*				38.2	121.7	118.9	-53.8	0	0	0	0	122.9
713	A	27.1	Very low	28.5	Very low	108 Å²	108	132.1 Å²	132.1	89%	0.893	81%	0.805	S	S	*	*				-177.9	160	121.3	0	0	0	0	0	113.6
714	A	24.3	Very low	28.5	Very low	95 Å²	95	133.5 Å²	133.5	79%	0.785	80%	0.804	S	S	*	*			trans	-152.3	-172.2	171.7	0	0	0	0	0	108.3
715	P	41.9	Very low	27.9	Very low	120 Å²	120	131 Å²	131	78%	0.779	80%	0.795	S	S	*	*			cis	-134.9	-168	-14.4	38.5	-18.7	0	0	0	114.3
716	A	24.3	Very low	27.9	Very low	81 Å²	81	133.2 Å²	133.2	67%	0.669	79%	0.792	S	S	*	*			trans	89.8	121.8	138.7	0	0	0	0	0	124.4
717	L	24	Very low	28	Very low	150 Å²	150	134.5 Å²	134.5	79%	0.785	79%	0.789	S	S	*	*				72.8	103.9	128.8	-63.7	171.5	0	0	0	124.3
718	T	24.3	Very low	28	Very low	119 Å²	119	131.9 Å²	131.9	73%	0.73	79%	0.786	S	S	*	*				82.6	150.9	125.2	64.9	0	0	0	0	123.6
719	K	23.6	Very low	28.2	Very low	198 Å²	198	132.4 Å²	132.4	86%	0.861	79%	0.792	S	S	*	*			trans	70.8	117.3	171.8	-61.8	174.1	-178.6	175	0	114.6
720	A	23.3	Very low	27.2	Very low	97 Å²	97	131.9 Å²	131.9	80%	0.802	79%	0.79	S	S	*	*			cis	90.6	118.7	28.7	0	0	0	0	0	115.3
721	E	24	Very low	27.5	Very low	199 Å²	199	132.1 Å²	132.1	93%	0.93	79%	0.79	S	S	*	*			trans	-159.8	158.2	142.1	-117.3	169.4	-168.4	0	0	112.2
722	R	26.7	Very low	27.3	Very low	235 Å²	235	132.4 Å²	132.4	89%	0.887	79%	0.788	S	S	*	*			trans	-122.9	159.3	166.7	-69.6	176.1	167.2	178.5	-5.3	106.5
723	P	37.4	Very low	27.4	Very low	105 Å²	105	137.4 Å²	137.4	68%	0.682	79%	0.791	S	S	*	*				-157.6	140.1	104.1	34.6	-14.7	0	0	0	118.7
724	R	26.6	Very low	27.4	Very low	237 Å²	237	136.7 Å²	136.7	89%	0.894	78%	0.78	S	S	*	*			trans	66.3	160.8	141.4	-62.9	171.6	175.3	133.1	-1.6	117.9
725	A	26.2	Very low	27.6	Very low	80 Å²	80	141 Å²	141	66%	0.661	78%	0.781	S	S	*	*			cis	-139	146.9	2	0	0	0	0	0	110.3
726	N	27.2	Very low	26.9	Very low	154 Å²	154	141.4 Å²	141.4	82%	0.824	78%	0.781	S	S	*	*				58.8	141.2	94.6	-63.4	13.8	0	0	0	115.4
727	S	28.1	Very low	27.7	Very low	103 Å²	103	143.3 Å²	143.3	72%	0.72	79%	0.787	S	S	*	*			cis	-166.8	152.8	-1.3	43.2	0	0	0	0	109.9
728	S	28.3	Very low	27.9	Very low	121 Å²	121	140.6 Å²	140.6	85%	0.846	79%	0.786	S	S	*	*				158.1	166	90.7	50.7	0	0	0	0	109.3
729	G	28.1	Very low	28	Very low	75 Å²	75	138.9 Å²	138.9	77%	0.773	79%	0.792	S	S	*	*			cis	148.2	111.4	-13.8	0	0	0	0	0	115.1
730	C	25.2	Very low	28.2	Very low	120 Å²	120	132.7 Å²	132.7	81%	0.811	78%	0.784	S	S	*	*			trans	-164.4	105.2	163.8	-137.9	0	0	0	0	108.9
731	L	30.8	Very low	28.3	Very low	150 Å²	150	134.6 Å²	134.6	79%	0.785	79%	0.786	S	S	*	*				79.8	131.9	79.7	-71.7	177.3	0	0	0	114.9
732	D	27.4	Very low	28.4	Very low	124 Å²	124	132.6 Å²	132.6	66%	0.663	78%	0.781	S	S	*	*			cis	-137.6	-118.3	-15.5	-160.5	36.8	0	0	0	110.7
733	Y	27.7	Very low	28.4	Very low	214 Å²	214	126.7 Å²	126.7	84%	0.839	78%	0.775	S	S	*	*			cis	-152.8	145	-2.2	-140	-7.8	0	0	0	111.5
734	S	26.8	Very low	27.8	Very low	93 Å²	93	125.5 Å²	125.5	65%	0.65	77%	0.774	S	S	*	*			trans	53.8	87.1	162.9	-167.3	0	0	0	0	118.2
735	K	28.1	Very low	27.8	Very low	185 Å²	185	120.1 Å²	120.1	80%	0.804	77%	0.773	S	S	*	*				70.9	120.6	90.2	-69.7	176.1	178.7	175.1	0	115.6
736	V	28.1	Very low	27.7	Very low	130 Å²	130	119.9 Å²	119.9	79%	0.788	78%	0.778	S	S	*	*			cis	73.5	139.3	43.7	-179.4	0	0	0	0	111.2
737	P	40.2	Very low	27.8	Very low	121 Å²	121	122.2 Å²	122.2	79%	0.786	78%	0.781	S	S	*	*			cis	-127.8	-168.4	18.1	17.2	10.2	0	0	0	114.9
738	A	28.3	Very low	27.6	Very low	92 Å²	92	124.7 Å²	124.7	76%	0.76	79%	0.785	S	S	*	*			cis	-176.1	158.7	-39.1	0	0	0	0	0	110.2
739	G	27.2	Very low	27.5	Very low	83 Å²	83	124.3 Å²	124.3	86%	0.856	78%	0.778	S	S	*	*			trans	80.4	149.5	169.9	0	0	0	0	0	116
740	G	26.9	Very low	27.3	Very low	69 Å²	69	128 Å²	128	71%	0.711	78%	0.779	S	S	*	*			cis	175.6	136.9	-11	0	0	0	0	0	114.8
741	V	25.7	Very low	27.4	Very low	136 Å²	136	130.6 Å²	130.6	82%	0.824	78%	0.779	S	S	*	*			trans	68.3	119.9	141.3	-175.8	0	0	0	0	120
742	L	26.3	Very low	27.3	Very low	158 Å²	158	130.7 Å²	130.7	83%	0.827	78%	0.779	S	S	*	*			trans	74.7	111.4	154.9	-73	168.7	0	0	0	122.7
743	S	25.1	Very low	27.3	Very low	111 Å²	111	130.3 Å²	130.3	78%	0.776	78%	0.783	S	S	*	*				84.8	135.8	121.6	-149.5	0	0	0	0	123.1
744	A	26	Very low	27.4	Very low	79 Å²	79	126.5 Å²	126.5	65%	0.653	78%	0.782	S	S	*	*			trans	60.8	114.2	147.4	0	0	0	0	0	122.6
745	S	25.6	Very low	27.3	Very low	125 Å²	125	125 Å²	125	87%	0.874	78%	0.781	S	S	*	*				55.1	98.2	125.2	-55.8	0	0	0	0	121.9
746	G	24.8	Very low	27.8	Very low	74 Å²	74	121.6 Å²	121.6	76%	0.763	78%	0.778	S	S	*	*				100.9	108.2	117.4	0	0	0	0	0	120.8
747	K	28.9	Very low	27.8	Very low	204 Å²	204	121.7 Å²	121.7	89%	0.887	77%	0.77	S	S	*	*			trans	49.6	124.5	146.6	-64.7	-179.9	177.1	176.8	0	120.3
748	L	25.1	Very low	27.1	Very low	154 Å²	154	126.3 Å²	126.3	81%	0.806	77%	0.773	S	S	*	*				163.8	101.8	128.9	-88.3	162.6	0	0	0	109.1
749	T	25.2	Very low	27	Very low	113 Å²	113	130 Å²	130	69%	0.693	77%	0.767	S	S	*	*				91.6	158.9	90.8	48.7	0	0	0	0	116.5
750	L	25	Very low	26.8	Very low	153 Å²	153	135.5 Å²	135.5	80%	0.801	77%	0.771	S	S	*	*			trans	84.2	138.9	-177.2	-53.6	168.3	0	0	0	113.9
751	Q	26.1	Very low	26.7	Very low	175 Å²	175	140.8 Å²	140.8	82%	0.818	77%	0.774	S	S	*	*			cis	-147.2	173.9	-2.6	-140	165.7	15.3	0	0	112.3
752	I	27.9	Very low	26.7	Very low	151 Å²	151	143.6 Å²	143.6	77%	0.774	78%	0.775	S	S	*	*			trans	-121.8	147.3	-170.3	-52.8	162.1	0	0	0	110.3
753	P	29.1	Very low	26.7	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	77%	0.768	S	S	*	*				-136.3	158.2	125.2	38.3	-28.9	0	0	0	112.7
754	V	28.4	Very low	26.7	Very low	134 Å²	134	142.7 Å²	142.7	81%	0.812	77%	0.766	S	S	*	*			cis	-154.8	161.4	-21.2	136.8	0	0	0	0	106.1
755	G	26.3	Very low	26.6	Very low	61 Å²	61	143.8 Å²	143.8	63%	0.629	77%	0.769	S	S	*	*			trans	-75.1	-160.1	-179.1	0	0	0	0	0	115.7
756	P	36.5	Very low	27.3	Very low	114 Å²	114	143.3 Å²	143.3	74%	0.74	76%	0.763	S	S	*	*			cis	-126.2	136.8	25.6	38.1	-21.7	0	0	0	116
757	Q	28.1	Very low	27.3	Very low	132 Å²	132	145.1 Å²	145.1	62%	0.617	76%	0.763	S	S	*	*				62	120.1	100.3	-62.2	-163.6	75.8	0	0	118.4
758	Y	25.6	Very low	27.1	Very low	217 Å²	217	145.8 Å²	145.8	85%	0.851	76%	0.762	S	S	*	*				-144	-176	102.8	-122	-85.3	0	0	0	112.2
759	R	26.6	Very low	27.1	Very low	169 Å²	169	144.7 Å²	144.7	64%	0.638	76%	0.762	S	S	*	*				-165.1	122.8	-126.6	-170.9	-171	-154.6	-161.8	12.9	114.6
760	Q	23.4	Very low	27	Very low	200 Å²	200	149.6 Å²	149.6	94%	0.935	77%	0.768	S	S	*	*			trans	-136.7	155.6	162.3	-88.9	-168.6	-9.6	0	0	112.8
761	K	25.1	Very low	27.1	Very low	179 Å²	179	149.1 Å²	149.1	78%	0.778	76%	0.759	S	S	*	*			trans	-119.2	158.7	177	-57.7	177.7	174.3	179.7	0	108.2
762	K	26.5	Very low	27	Very low	195 Å²	195	148.1 Å²	148.1	85%	0.848	75%	0.754	S	S	*	*			cis	59.4	134.7	49.9	-85	-170.1	176.2	-174.8	0	112.5
763	V	26.1	Very low	26.8	Very low	110 Å²	110	151.8 Å²	151.8	67%	0.667	76%	0.76	S	S	*	*			cis	-166.2	159.1	16.4	87.1	0	0	0	0	113.9
764	L	24.4	Very low	26.6	Very low	141 Å²	141	154.9 Å²	154.9	74%	0.738	76%	0.764	S	S	*	*			trans	57.4	119.6	153.3	-61.5	168.5	0	0	0	125.1
765	S	24.7	Very low	26.4	Very low	102 Å²	102	157.1 Å²	157.1	71%	0.713	77%	0.766	S	S	*	*				58.5	169.8	115.8	-46	0	0	0	0	122.3
766	P	39.8	Very low	26.3	Very low	115 Å²	115	160.3 Å²	160.3	75%	0.747	78%	0.778	S	S	*	*			cis	-137.3	-169.9	0.4	44.5	-27	0	0	0	117.7
767	S	23.9	Very low	26	Very low	111 Å²	111	160 Å²	160	78%	0.776	78%	0.779	S	S	*	*			trans	87.1	127.6	150.6	73	0	0	0	0	123.3
768	Y	25.1	Very low	26.1	Very low	219 Å²	219	159 Å²	159	86%	0.859	79%	0.786	S	S	*	*			trans	-79.5	168.9	156.3	-70.6	-110.4	0	0	0	110
769	T	25.4	Very low	26.2	Very low	131 Å²	131	157.7 Å²	157.7	80%	0.804	79%	0.788	S	S	*	*			cis	-160.1	156.1	21.2	-11.9	0	0	0	0	109.3
770	R	23.6	Very low	26.5	Very low	216 Å²	216	156.7 Å²	156.7	82%	0.815	80%	0.795	S	S	*	*				153.1	121.7	113.8	-167.8	173	-148.1	-154.5	7.3	115.2
771	K	26.1	Very low	26.7	Very low	143 Å²	143	154.9 Å²	154.9	62%	0.622	79%	0.791	S	S	*	*			trans	73.8	133.2	152.7	-84.5	179.6	158.6	-118.9	0	122.6
772	E	23.6	Very low	27	Very low	153 Å²	153	155.7 Å²	155.7	72%	0.715	80%	0.795	S	S	*	*			trans	80.9	135.5	142.6	-86.7	126.4	-131.5	0	0	121.5
773	Y	23.6	Very low	27.5	Very low	228 Å²	228	152.4 Å²	152.4	89%	0.894	79%	0.791	S	S	*	*			trans	-104.4	145.2	-175.5	-91.4	-112.7	0	0	0	109.6
774	Q	25.2	Very low	27.8	Very low	182 Å²	182	157 Å²	157	85%	0.85	80%	0.802	S	S	*	*				-164.9	165.4	120.7	-109.1	172.5	1.5	0	0	113
775	H	25.8	Very low	28.7	Very low	182 Å²	182	155 Å²	155	84%	0.843	80%	0.795	S	S	*	*			trans	-46.3	150.4	-167.4	-63.9	-87.1	0	0	0	118.7
776	S	23.7	Very low	30.1	Very low	127 Å²	127	155.2 Å²	155.2	89%	0.888	79%	0.788	S	S	*	*			trans	-137.8	163.4	144	61.6	0	0	0	0	110.3
777	S	28.9	Very low	31	Very low	108 Å²	108	158 Å²	158	76%	0.755	79%	0.788	S	S	*	*			trans	-115.3	141.6	-170.7	54.1	0	0	0	0	113.2
778	S	31.3	Very low	32.3	Very low	110 Å²	110	159.4 Å²	159.4	77%	0.769	78%	0.783	S	S	*	*			trans	33.9	113.6	136.6	-158.4	0	0	0	0	119.6
779	E	28.2	Very low	33.9	Very low	191 Å²	191	152.7 Å²	152.7	89%	0.893	76%	0.764	S	S	*	*			trans	-131.3	158.7	148.2	-75.5	-164.9	141.8	0	0	109.5
780	D	31.3	Very low	35.2	Very low	147 Å²	147	149.8 Å²	149.8	79%	0.786	75%	0.749	S	S	*	*			trans	-80.4	158.2	-160.8	-66	-66.3	0	0	0	116.3
781	L	29.6	Very low	36.8	Very low	163 Å²	163	144.7 Å²	144.7	85%	0.853	74%	0.738	S	S	*	*			trans	-131.8	98.1	175	-133.7	166.2	0	0	0	110.7	V783	L781-V783 PolarHBondContact O-N 2.94Å
782	F	30.3	Very low	38.5	Very low	196 Å²	196	142.7 Å²	142.7	86%	0.86	73%	0.734	S	S	*	*			trans	-68.1	116.8	-178.8	-92.2	-94	0	0	0	112.3
783	V	36.2	Very low	40.1	Very low	125 Å²	125	141.9 Å²	141.9	76%	0.758	73%	0.732	S	S	*	*			trans	-88.4	126.7	166.3	-179.6	0	0	0	0	109.4	L781	L781-V783 PolarHBondContact O-N 2.94Å
784	K	33	Very low	41.8	Very low	207 Å²	207	136.5 Å²	136.5	90%	0.9	72%	0.715	S	S	*	*			trans	-95	101.2	-175.7	-156.7	178.2	-171.3	-179	0	110.2
785	V	44.5	Very low	43.8	Very low	98 Å²	98	131.5 Å²	131.5	59%	0.594	70%	0.7	S	S	*	*			trans	-83.8	147.9	175.7	-176.4	0	0	0	0	110.1
786	D	53.6	Low	46	Very low	107 Å²	107	126.9 Å²	126.9	57%	0.572	68%	0.684	S	S	*	*			trans	-69.2	141.5	-179	-152.4	-46.7	0	0	0	112.4	E788 V789 C790	D786-E788 VanDerWaalsContact C-N 3.3Å; D786-E788 PolarHBondContact O-N 2.97Å; D786-E788 PolarHBondContact OD1-N 2.67Å; D786-V789 HydrophobicContact CB-CG2 4.22Å; D786-V789 PolarHBondContact O-N 2.69Å; D786-C790 PolarHBondContact O-N 3.34Å
787	K	58	Low	47.8	Very low	173 Å²	173	127.5 Å²	127.5	75%	0.752	67%	0.671	S	S	*	*	H	α-helix	trans	-64.8	-33.8	179.4	-85.1	-173.1	169.6	-175	0	112.5	V789 C790 N791	K787-V789 VanDerWaalsContact C-N 3.31Å; K787-V789 PolarHBondContact O-N 2.88Å; K787-C790 PolarHBondContact O-N 3.17Å; K787-N791 PolarHBondContact O-N 2.95Å
788	E	52.1	Low	49.8	Very low	141 Å²	141	127.9 Å²	127.9	66%	0.659	66%	0.659	S	S	*	*	H	α-helix	trans	-68.8	-33.7	-177.8	-162.9	154.4	-128.2	0	0	111.5	D786 N791 N792	D786-E788 VanDerWaalsContact C-N 3.3Å; D786-E788 PolarHBondContact O-N 2.97Å; D786-E788 PolarHBondContact OD1-N 2.67Å; E788-N791 PolarHBondContact O-N 3.39Å; E788-N792 WeakPolarHBondContact O-CB 3.35Å; E788-N792 VanDerWaalsContact O-CG 3.29Å; E788-N792 PolarHBondContact O-N 3.2Å; E788-N792 PolarHBondContact O-ND2 3.47Å
789	V	57.4	Low	51.9	Low	78 Å²	78	127.2 Å²	127.2	47%	0.473	64%	0.644	S	S	.	*	H	α-helix	trans	-66.4	-44.8	173.6	179.5	0	0	0	0	111.4	D786 K787 N791 N792 M793	D786-V789 HydrophobicContact CB-CG2 4.22Å; D786-V789 PolarHBondContact O-N 2.69Å; K787-V789 VanDerWaalsContact C-N 3.31Å; K787-V789 PolarHBondContact O-N 2.88Å; V789-N791 PolarHBondContact O-N 2.91Å; V789-N792 PolarHBondContact O-N 3.3Å; V789-M793 PolarHBondContact O-N 2.81Å
790	C	54.3	Low	53.5	Low	71 Å²	71	123 Å²	123	48%	0.48	63%	0.627	S	S	.	*	H	α-helix	trans	-61	-44.2	175.4	-77.8	0	0	0	0	112.6	D786 K787 N792 M793 E794	D786-C790 PolarHBondContact O-N 3.34Å; K787-C790 PolarHBondContact O-N 3.17Å; C790-N792 VanDerWaalsContact C-N 3.35Å; C790-N792 PolarHBondContact O-N 3.25Å; C790-M793 PolarHBondContact O-N 3.28Å; C790-E794 PolarHBondContact O-N 3.11Å
791	N	56.3	Low	55	Low	108 Å²	108	120.2 Å²	120.2	58%	0.578	61%	0.612	S	S	*	*	H	α-helix	trans	-63	-41.3	178.7	-71.9	-8	0	0	0	111.9	K787 E788 V789 E794 S795	K787-N791 PolarHBondContact O-N 2.95Å; E788-N791 PolarHBondContact O-N 3.39Å; V789-N791 PolarHBondContact O-N 2.91Å; N791-E794 PolarHBondContact O-N 3.28Å; N791-S795 PolarHBondContact O-N 2.82Å
792	N	62.1	Low	56.8	Low	101 Å²	101	116 Å²	116	54%	0.54	59%	0.593	S	S	.	*	H	α-helix	trans	-66.3	-39.3	176.4	-73.4	-26.3	0	0	0	112	E788 V789 C790 S795 V796	E788-N792 WeakPolarHBondContact O-CB 3.35Å; E788-N792 VanDerWaalsContact O-CG 3.29Å; E788-N792 PolarHBondContact O-N 3.2Å; E788-N792 PolarHBondContact O-ND2 3.47Å; V789-N792 PolarHBondContact O-N 3.3Å; C790-N792 VanDerWaalsContact C-N 3.35Å; C790-N792 PolarHBondContact O-N 3.25Å; N792-S795 PolarHBondContact O-N 3.36Å; N792-V796 WeakPolarHBondContact O-CG2 3.16Å; N792-V796 PolarHBondContact O-N 3.27Å; N792-V796 VanDerWaalsContact O-N 3.07Å
793	M	56.8	Low	58.5	Low	136 Å²	136	113.8 Å²	113.8	67%	0.67	58%	0.579	S	S	*	*	H	α-helix	trans	-63.7	-41.9	173	-75.6	-168.7	71	0	0	112.8	V789 C790 S795 V796 F797	V789-M793 PolarHBondContact O-N 2.81Å; C790-M793 PolarHBondContact O-N 3.28Å; M793-S795 VanDerWaalsContact C-N 3.3Å; M793-S795 PolarHBondContact O-N 3.32Å; M793-V796 PolarHBondContact O-N 2.9Å; M793-F797 WeakPolarHBondContact O-CB 3.23Å; M793-F797 PolarHBondContact O-N 3.14Å
794	E	58.6	Low	59.3	Low	115 Å²	115	113.5 Å²	113.5	54%	0.537	57%	0.569	S	S	.	*	H	α-helix	trans	-61.5	-38.3	174.3	-91.7	-152.4	-177.2	0	0	112.6	C790 N791 F797 K798	C790-E794 PolarHBondContact O-N 3.11Å; N791-E794 PolarHBondContact O-N 3.28Å; E794-F797 PolarHBondContact O-N 3.46Å; E794-K798 WeakPolarHBondContact O-CB 3.48Å; E794-K798 WeakPolarHBondContact O-CD 3.45Å; E794-K798 VanDerWaalsContact O-CG 3.29Å; E794-K798 WeakPolarHBondContact O-CG 3.47Å; E794-K798 PolarHBondContact O-N 3.18Å; E794-K798 IonicContact OE2-NZ 3.52Å; E794-K798 PolarHBondContact OE2-NZ 2.97Å
795	S	67.9	Low	60.3	Low	77 Å²	77	108.1 Å²	108.1	54%	0.538	55%	0.554	S	S	.	*	H	α-helix	trans	-63.1	-50.7	177.8	-165.4	0	0	0	0	111.2	N791 N792 M793 F797 K798 E799	N791-S795 PolarHBondContact O-N 2.82Å; N792-S795 PolarHBondContact O-N 3.36Å; M793-S795 VanDerWaalsContact C-N 3.3Å; M793-S795 PolarHBondContact O-N 3.32Å; S795-F797 VanDerWaalsContact C-N 3.34Å; S795-F797 PolarHBondContact O-N 2.99Å; S795-K798 PolarHBondContact O-N 2.93Å; S795-E799 PolarHBondContact O-N 3.11Å
796	V	71.5	Confident	60.7	Low	85 Å²	85	109.7 Å²	109.7	52%	0.515	55%	0.554	S	S	.	*	H	α-helix	trans	-60.9	-41.2	176.9	172.7	0	0	0	0	111.5	N792 M793 K798 E799 L800	N792-V796 WeakPolarHBondContact O-CG2 3.16Å; N792-V796 PolarHBondContact O-N 3.27Å; N792-V796 VanDerWaalsContact O-N 3.07Å; M793-V796 PolarHBondContact O-N 2.9Å; V796-K798 PolarHBondContact O-N 2.92Å; V796-E799 PolarHBondContact O-N 3.48Å; V796-L800 HydrophobicContact CG1-CD1 4Å; V796-L800 HydrophobicContact CG1-CG 4.45Å; V796-L800 WeakPolarHBondContact O-CG 3.22Å; V796-L800 PolarHBondContact O-N 3.3Å
797	F	62.8	Low	60.5	Low	141 Å²	141	111.4 Å²	111.4	62%	0.618	56%	0.559	S	S	*	*	H	α-helix	trans	-66	-39	179.4	-159.3	-100.3	0	0	0	112.4	M793 E794 S795 L800 L801	M793-F797 WeakPolarHBondContact O-CB 3.23Å; M793-F797 PolarHBondContact O-N 3.14Å; E794-F797 PolarHBondContact O-N 3.46Å; S795-F797 VanDerWaalsContact C-N 3.34Å; S795-F797 PolarHBondContact O-N 2.99Å; F797-L800 PolarHBondContact O-N 3.26Å; F797-L801 HydrophobicContact CD1-CD1 3.79Å; F797-L801 HydrophobicContact CD1-CG 4.48Å; F797-L801 HydrophobicContact CE1-CD1 3.82Å; F797-L801 HydrophobicContact CE1-CG 4.42Å; F797-L801 WeakPolarHBondContact O-CG 3.46Å; F797-L801 PolarHBondContact O-N 3.05Å; F797-L801 VanDerWaalsContact O-N 3.12Å
798	K	70.4	Confident	60.1	Low	116 Å²	116	107.7 Å²	107.7	50%	0.504	55%	0.548	S	S	.	.	H	α-helix	trans	-67	-37.7	173.4	-72.8	165.2	-170.6	161.7	0	111.9	E794 S795 V796 T802	E794-K798 WeakPolarHBondContact O-CB 3.48Å; E794-K798 WeakPolarHBondContact O-CD 3.45Å; E794-K798 VanDerWaalsContact O-CG 3.29Å; E794-K798 WeakPolarHBondContact O-CG 3.47Å; E794-K798 PolarHBondContact O-N 3.18Å; E794-K798 IonicContact OE2-NZ 3.52Å; E794-K798 PolarHBondContact OE2-NZ 2.97Å; S795-K798 PolarHBondContact O-N 2.93Å; V796-K798 PolarHBondContact O-N 2.92Å; K798-T802 WeakPolarHBondContact O-CB 3.38Å; K798-T802 PolarHBondContact O-N 3.41Å; K798-T802 VanDerWaalsContact O-N 3.09Å; K798-T802 PolarHBondContact O-OG1 2.73Å
799	E	74.9	Confident	59.9	Low	95 Å²	95	104 Å²	104	44%	0.444	54%	0.541	S	S	.	.	H	α-helix	trans	-65.6	-43.9	175.7	-158.3	-167.3	155.5	0	0	111.8	S795 V796 L801 T802 R803	S795-E799 PolarHBondContact O-N 3.11Å; V796-E799 PolarHBondContact O-N 3.48Å; E799-L801 PolarHBondContact O-N 2.87Å; E799-T802 WeakPolarHBondContact O-CB 3.33Å; E799-T802 PolarHBondContact O-N 3.04Å; E799-T802 VanDerWaalsContact O-N 3.14Å; E799-R803 WeakPolarHBondContact O-CG 3.37Å; E799-R803 PolarHBondContact O-N 3.44Å; E799-R803 IonicContact OE1-CZ 2.72Å; E799-R803 IonicContact OE1-NE 3.64Å; E799-R803 PolarHBondContact OE1-NE 3.32Å; E799-R803 IonicContact OE1-NH2 2.71Å; E799-R803 PolarHBondContact OE1-NH2 3.24Å
800	L	61.6	Low	59.5	Low	102 Å²	102	103.3 Å²	103.3	53%	0.534	54%	0.54	S	S	.	.	H	α-helix	trans	-60.4	-45.8	177.1	-71.9	169.4	0	0	0	112.2	V796 F797 T802 R803 Q804	V796-L800 HydrophobicContact CG1-CD1 4Å; V796-L800 HydrophobicContact CG1-CG 4.45Å; V796-L800 WeakPolarHBondContact O-CG 3.22Å; V796-L800 PolarHBondContact O-N 3.3Å; F797-L800 PolarHBondContact O-N 3.26Å; L800-T802 VanDerWaalsContact C-N 3.26Å; L800-T802 PolarHBondContact O-N 2.96Å; L800-R803 PolarHBondContact O-N 2.99Å; L800-Q804 PolarHBondContact O-N 2.81Å
801	L	63.7	Low	59.4	Low	89 Å²	89	102.2 Å²	102.2	47%	0.466	54%	0.536	S	S	.	.	H	α-helix	trans	-59.6	-36.1	174	-74.6	166.9	0	0	0	112.7	F797 E799 T805	F797-L801 HydrophobicContact CD1-CD1 3.79Å; F797-L801 HydrophobicContact CD1-CG 4.48Å; F797-L801 HydrophobicContact CE1-CD1 3.82Å; F797-L801 HydrophobicContact CE1-CG 4.42Å; F797-L801 WeakPolarHBondContact O-CG 3.46Å; F797-L801 PolarHBondContact O-N 3.05Å; F797-L801 VanDerWaalsContact O-N 3.12Å; E799-L801 PolarHBondContact O-N 2.87Å; L801-T805 PolarHBondContact O-N 3.05Å; L801-T805 PolarHBondContact O-OG1 3.34Å
802	T	66.9	Low	58.9	Low	74 Å²	74	103 Å²	103	45%	0.454	54%	0.536	S	S	.	.	H	α-helix	trans	-71.9	-39.3	178	-53.5	0	0	0	0	111.7	K798 E799 L800 T805 Q806	K798-T802 WeakPolarHBondContact O-CB 3.38Å; K798-T802 PolarHBondContact O-N 3.41Å; K798-T802 VanDerWaalsContact O-N 3.09Å; K798-T802 PolarHBondContact O-OG1 2.73Å; E799-T802 WeakPolarHBondContact O-CB 3.33Å; E799-T802 PolarHBondContact O-N 3.04Å; E799-T802 VanDerWaalsContact O-N 3.14Å; L800-T802 VanDerWaalsContact C-N 3.26Å; L800-T802 PolarHBondContact O-N 2.96Å; T802-T805 PolarHBondContact O-OG1 3.22Å; T802-T805 VanDerWaalsContact O-OG1 3.13Å; T802-Q806 WeakPolarHBondContact O-CG 3.33Å; T802-Q806 PolarHBondContact O-N 2.93Å
803	R	65.1	Low	58.3	Low	151 Å²	151	101 Å²	101	57%	0.57	53%	0.534	S	S	*	.	H	α-helix	trans	-66.7	-39.9	175.2	-70.9	176.7	178.5	-138.5	5.6	111.8	E799 L800 Q806 Q807	E799-R803 WeakPolarHBondContact O-CG 3.37Å; E799-R803 PolarHBondContact O-N 3.44Å; E799-R803 IonicContact OE1-CZ 2.72Å; E799-R803 IonicContact OE1-NE 3.64Å; E799-R803 PolarHBondContact OE1-NE 3.32Å; E799-R803 IonicContact OE1-NH2 2.71Å; E799-R803 PolarHBondContact OE1-NH2 3.24Å; L800-R803 PolarHBondContact O-N 2.99Å; R803-Q806 PolarHBondContact O-N 3.21Å; R803-Q807 PolarHBondContact O-N 3.46Å
804	Q	54.4	Low	57.9	Low	119 Å²	119	101 Å²	101	56%	0.556	53%	0.532	S	S	*	.	H	α-helix	trans	-65.3	-45.4	179.1	-168.8	167.4	6.3	0	0	112	L800 Q806 Q807 D808	L800-Q804 PolarHBondContact O-N 2.81Å; Q804-Q806 VanDerWaalsContact C-N 3.28Å; Q804-Q806 PolarHBondContact O-N 2.77Å; Q804-Q807 PolarHBondContact O-N 3.28Å; Q804-Q807 VanDerWaalsContact O-N 3.1Å; Q804-D808 PolarHBondContact O-N 3.28Å
805	T	52.4	Low	57.4	Low	93 Å²	93	102.7 Å²	102.7	57%	0.571	54%	0.54	S	S	*	.	H	α-helix	trans	-64.8	-28.1	176.7	41.7	0	0	0	0	113.6	L801 T802 A809	L801-T805 PolarHBondContact O-N 3.05Å; L801-T805 PolarHBondContact O-OG1 3.34Å; T802-T805 PolarHBondContact O-OG1 3.22Å; T802-T805 VanDerWaalsContact O-OG1 3.13Å; T805-A809 WeakPolarHBondContact O-CB 3.41Å; T805-A809 PolarHBondContact O-N 3.49Å
806	Q	53.6	Low	56.4	Low	131 Å²	131	106.6 Å²	106.6	61%	0.612	55%	0.547	S	S	*	.	H	α-helix	trans	-71.4	-34.8	171.3	-73.3	-179.5	-0.3	0	0	113.1	T802 R803 Q804 S810	T802-Q806 WeakPolarHBondContact O-CG 3.33Å; T802-Q806 PolarHBondContact O-N 2.93Å; R803-Q806 PolarHBondContact O-N 3.21Å; Q804-Q806 VanDerWaalsContact C-N 3.28Å; Q804-Q806 PolarHBondContact O-N 2.77Å; Q806-S810 PolarHBondContact O-N 2.85Å; Q806-S810 VanDerWaalsContact O-N 3.13Å
807	Q	49.6	Very low	55	Low	143 Å²	143	109.7 Å²	109.7	67%	0.668	55%	0.554	S	S	*	*	H	α-helix	trans	-67	-44.4	176	-73.4	-177.9	-32	0	0	111.9	R803 Q804 A809 S810 A811	R803-Q807 PolarHBondContact O-N 3.46Å; Q804-Q807 PolarHBondContact O-N 3.28Å; Q804-Q807 VanDerWaalsContact O-N 3.1Å; Q807-A809 PolarHBondContact O-N 2.7Å; Q807-S810 WeakPolarHBondContact O-CB 3.38Å; Q807-S810 PolarHBondContact O-N 3.13Å; Q807-A811 PolarHBondContact O-N 3.09Å
808	D	49.2	Very low	54.2	Low	96 Å²	96	106.5 Å²	106.5	51%	0.513	55%	0.553	S	S	.	*	H	α-helix	trans	-62.4	-40.3	176.6	-74.6	-35.3	0	0	0	112.6	Q804 S810 A811 Q812	Q804-D808 PolarHBondContact O-N 3.28Å; D808-S810 VanDerWaalsContact C-N 3.33Å; D808-S810 PolarHBondContact O-N 2.94Å; D808-A811 PolarHBondContact O-N 3.37Å; D808-Q812 WeakPolarHBondContact O-CG 3.33Å; D808-Q812 PolarHBondContact O-N 2.97Å; D808-Q812 VanDerWaalsContact O-N 3.1Å
809	A	49.3	Very low	52.9	Low	63 Å²	63	110.3 Å²	110.3	52%	0.521	57%	0.57	S	S	.	*	H	α-helix	trans	-62.3	-39.4	175.1	0	0	0	0	0	112.3	T805 Q807 A813	T805-A809 WeakPolarHBondContact O-CB 3.41Å; T805-A809 PolarHBondContact O-N 3.49Å; Q807-A809 PolarHBondContact O-N 2.7Å; A809-A813 PolarHBondContact O-N 3.42Å; A809-A813 VanDerWaalsContact O-N 3.14Å
810	S	49	Very low	51.3	Low	63 Å²	63	115.9 Å²	115.9	44%	0.441	59%	0.587	S	S	.	*	H	α-helix	trans	-64.1	-46.6	175.6	-172.9	0	0	0	0	111.9	Q806 Q807 D808 Q812 A813 Q814	Q806-S810 PolarHBondContact O-N 2.85Å; Q806-S810 VanDerWaalsContact O-N 3.13Å; Q807-S810 WeakPolarHBondContact O-CB 3.38Å; Q807-S810 PolarHBondContact O-N 3.13Å; D808-S810 VanDerWaalsContact C-N 3.33Å; D808-S810 PolarHBondContact O-N 2.94Å; S810-Q812 PolarHBondContact O-N 3.48Å; S810-A813 WeakPolarHBondContact O-CB 3.48Å; S810-A813 PolarHBondContact O-N 2.71Å; S810-A813 VanDerWaalsContact O-N 3.16Å; S810-Q814 PolarHBondContact O-N 3.07Å
811	A	50.6	Low	50.5	Low	48 Å²	48	116.3 Å²	116.3	40%	0.397	59%	0.59	S	S	.	*	H	α-helix	trans	-60.2	-43.6	178.8	0	0	0	0	0	112.4	Q807 D808 A813 Q814 Q815	Q807-A811 PolarHBondContact O-N 3.09Å; D808-A811 PolarHBondContact O-N 3.37Å; A811-A813 VanDerWaalsContact C-N 3.34Å; A811-A813 PolarHBondContact O-N 2.86Å; A811-Q814 PolarHBondContact O-N 2.83Å; A811-Q815 PolarHBondContact O-N 3.29Å; A811-Q815 VanDerWaalsContact O-N 3.14Å
812	Q	46.6	Very low	49.3	Very low	124 Å²	124	115.8 Å²	115.8	58%	0.579	61%	0.606	S	S	*	*	H	α-helix	trans	-66.6	-33	176.3	-68.8	-170.4	19.5	0	0	113.2	D808 S810 K816	D808-Q812 WeakPolarHBondContact O-CG 3.33Å; D808-Q812 PolarHBondContact O-N 2.97Å; D808-Q812 VanDerWaalsContact O-N 3.1Å; S810-Q812 PolarHBondContact O-N 3.48Å; Q812-K816 PolarHBondContact O-N 2.66Å
813	A	48.9	Very low	48	Very low	61 Å²	61	123.5 Å²	123.5	50%	0.504	63%	0.627	S	S	.	*	H	α-helix	trans	-67.2	-42	175.2	0	0	0	0	0	111.9	A809 S810 A811 K816 K817	A809-A813 PolarHBondContact O-N 3.42Å; A809-A813 VanDerWaalsContact O-N 3.14Å; S810-A813 WeakPolarHBondContact O-CB 3.48Å; S810-A813 PolarHBondContact O-N 2.71Å; S810-A813 VanDerWaalsContact O-N 3.16Å; A811-A813 VanDerWaalsContact C-N 3.34Å; A811-A813 PolarHBondContact O-N 2.86Å; A813-K816 PolarHBondContact O-N 2.97Å; A813-K817 PolarHBondContact O-N 2.81Å
814	Q	48.2	Very low	46.8	Very low	135 Å²	135	126.1 Å²	126.1	63%	0.631	64%	0.642	S	S	*	*	H	α-helix	trans	-64.9	-44.4	177.7	-69	-177	-1.7	0	0	112.2	S810 A811 K816 K817 A818	S810-Q814 PolarHBondContact O-N 3.07Å; A811-Q814 PolarHBondContact O-N 2.83Å; Q814-K816 VanDerWaalsContact C-N 3.32Å; Q814-K816 PolarHBondContact O-N 3.17Å; Q814-K817 WeakPolarHBondContact O-CB 3.41Å; Q814-K817 PolarHBondContact O-N 3.4Å; Q814-K817 VanDerWaalsContact O-N 3.09Å; Q814-A818 PolarHBondContact O-N 2.92Å; Q814-A818 VanDerWaalsContact O-N 3.11Å
815	Q	48.5	Very low	45.7	Very low	150 Å²	150	124.5 Å²	124.5	70%	0.701	66%	0.657	S	S	*	*	H	α-helix	trans	-61.3	-37.6	176.1	-72.5	-169.5	-0.2	0	0	113	A811 K817 K819	A811-Q815 PolarHBondContact O-N 3.29Å; A811-Q815 VanDerWaalsContact O-N 3.14Å; Q815-K817 VanDerWaalsContact C-N 3.29Å; Q815-K817 PolarHBondContact O-N 3.3Å; Q815-K819 PolarHBondContact O-N 3.46Å
816	K	46.6	Very low	44.9	Very low	159 Å²	159	129.9 Å²	129.9	69%	0.691	67%	0.673	S	S	*	*	H	α-helix	trans	-66.5	-28.4	174.8	-81.1	176.6	177.9	167.7	0	113.2	Q812 A813 Q814	Q812-K816 PolarHBondContact O-N 2.66Å; A813-K816 PolarHBondContact O-N 2.97Å; Q814-K816 VanDerWaalsContact C-N 3.32Å; Q814-K816 PolarHBondContact O-N 3.17Å
817	K	43	Very low	43.9	Very low	151 Å²	151	129.6 Å²	129.6	66%	0.657	68%	0.68	S	S	*	*	H	α-helix	trans	-73.6	-51.2	176.1	-159.5	175.4	-177.9	-176.2	0	111.2	A813 Q814 Q815 K819 R820	A813-K817 PolarHBondContact O-N 2.81Å; Q814-K817 WeakPolarHBondContact O-CB 3.41Å; Q814-K817 PolarHBondContact O-N 3.4Å; Q814-K817 VanDerWaalsContact O-N 3.09Å; Q815-K817 VanDerWaalsContact C-N 3.29Å; Q815-K817 PolarHBondContact O-N 3.3Å; K817-K819 PolarHBondContact O-N 2.86Å; K817-K819 VanDerWaalsContact O-N 3.15Å; K817-R820 WeakPolarHBondContact O-CB 3.42Å; K817-R820 PolarHBondContact O-N 3.14Å
818	A	45	Very low	43.1	Very low	73 Å²	73	128.7 Å²	128.7	60%	0.603	68%	0.684	S	S	*	*	H	α-helix	trans	-54.6	-36.8	177.9	0	0	0	0	0	113.2	Q814 R820	Q814-A818 PolarHBondContact O-N 2.92Å; Q814-A818 VanDerWaalsContact O-N 3.11Å; A818-R820 PolarHBondContact O-N 3.3Å
819	K	44.4	Very low	42.2	Very low	196 Å²	196	128.7 Å²	128.7	85%	0.852	69%	0.691	S	S	*	*	H	α-helix	trans	-74.1	-5.5	178.5	-136.1	170.4	-169.8	171.4	0	114.8	Q815 K817	Q815-K819 PolarHBondContact O-N 3.46Å; K817-K819 PolarHBondContact O-N 2.86Å; K817-K819 VanDerWaalsContact O-N 3.15Å
820	R	41.3	Very low	41.3	Very low	212 Å²	212	132.9 Å²	132.9	80%	0.8	71%	0.705	S	S	*	*	H	α-helix	trans	-99.5	-33.8	179.1	-162.1	175.1	-171.6	176.9	1.6	113	K817 A818	K817-R820 WeakPolarHBondContact O-CB 3.42Å; K817-R820 PolarHBondContact O-N 3.14Å; A818-R820 PolarHBondContact O-N 3.3Å
821	D	44.1	Very low	40.5	Very low	112 Å²	112	138.4 Å²	138.4	60%	0.599	72%	0.721	S	S	*	*	H	α-helix	trans	-83.9	-25.2	-174.6	-61.9	-39.4	0	0	0	113.1	R823	D821-R823 PolarHBondContact O-N 3Å
822	G	38.7	Very low	39.6	Very low	78 Å²	78	146.8 Å²	146.8	80%	0.804	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	27.6	179.1	0	0	0	0	0	117.1
823	R	39.4	Very low	38.9	Very low	236 Å²	236	145.5 Å²	145.5	89%	0.891	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	18	179.4	-147.1	179	-177.5	178.1	1.1	114.8	D821	D821-R823 PolarHBondContact O-N 3Å
824	K	39.5	Very low	38.2	Very low	206 Å²	206	148.4 Å²	148.4	90%	0.896	76%	0.759	S	S	*	*	S	Bend	trans	-137.8	142.6	166.9	-70.7	-173.6	176.3	-176.2	0	109.9
825	G	32.9	Very low	37.6	Very low	85 Å²	85	148.3 Å²	148.3	88%	0.876	76%	0.763	S	S	*	*			trans	114.5	89.7	175.6	0	0	0	0	0	114.4
826	K	34.8	Very low	37.2	Very low	206 Å²	206	148.8 Å²	148.8	90%	0.896	77%	0.765	S	S	*	*			trans	-149.2	154.6	162.8	-164.1	177.3	-175.1	-178.5	0	107.3
827	V	33	Very low	37.1	Very low	125 Å²	125	148 Å²	148	76%	0.758	77%	0.767	S	S	*	*			trans	103.1	136.7	178.1	-178.3	0	0	0	0	114.8
828	T	32.2	Very low	37.1	Very low	123 Å²	123	151.6 Å²	151.6	76%	0.755	79%	0.794	S	S	*	*			trans	55.7	121.6	171.6	47.6	0	0	0	0	118.1
829	S	30	Very low	36.7	Very low	96 Å²	96	155.6 Å²	155.6	67%	0.671	80%	0.803	S	S	*	*			cis	87.5	119.8	27.2	82.7	0	0	0	0	116.3
830	L	30.7	Very low	36.3	Very low	152 Å²	152	153.4 Å²	153.4	80%	0.796	80%	0.801	S	S	*	*				166.7	120.5	126.4	-88.1	168.1	0	0	0	113.6
831	F	31.5	Very low	36	Very low	178 Å²	178	150.2 Å²	150.2	78%	0.781	80%	0.801	S	S	*	*			trans	45.3	140.2	138.3	-83	-109.8	0	0	0	125.5
832	R	33	Very low	35.5	Very low	225 Å²	225	152.4 Å²	152.4	85%	0.849	81%	0.813	S	S	*	*			trans	72.3	152.1	146.5	-81.1	175.6	168.1	-170.2	-4.4	119
833	S	31	Very low	35.3	Very low	97 Å²	97	157.1 Å²	157.1	68%	0.678	81%	0.813	S	S	*	*			cis	-172.4	-173.1	-25.2	-110.9	0	0	0	0	110
834	T	33.6	Very low	35	Very low	122 Å²	122	151.8 Å²	151.8	75%	0.748	81%	0.808	S	S	*	*			trans	73.4	130.6	178.1	69.3	0	0	0	0	114.2
835	D	36.7	Very low	34.7	Very low	133 Å²	133	147.9 Å²	147.9	71%	0.711	80%	0.802	S	S	*	*			cis	64.5	133.8	47.4	-58.5	-59.1	0	0	0	111.4
836	Q	38.9	Very low	34.8	Very low	159 Å²	159	152.8 Å²	152.8	74%	0.743	80%	0.796	S	S	*	*			cis	-151.7	174.8	5.3	-124.8	168	22.7	0	0	110.4
837	L	45.6	Very low	34.8	Very low	143 Å²	143	148.3 Å²	148.3	75%	0.749	79%	0.788	S	S	*	*			trans	5.8	140.9	152	-59.4	161.6	0	0	0	118.6
838	D	41.8	Very low	35	Very low	227 Å²	227	150.5 Å²	150.5	100%	1.214	79%	0.79	S	S	*	*			cis	-125.9	0	25	-73.8	-50.5	0	0	0	114.7

Retrieved 838 of 838 residues in 950.5 ms (Link to these results)

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