A0A3Q0KR27_SCHMA Loading...

Serine/threonine-protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KR27, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,139 aa.

						>A0A3Q0KR27_SCHMA|A0A3Q0KR27
MISLGAYEYNPADVLGNGAFAIVYKGRVRNNPDEPVAIKIMLKDQNVLKSKTLLSKEICVLKDLNHENIVRLYDHSISSSGVYLVMEYCNGGDLSEYLQAKRTLPEDTIRHFLIQIGSAMDAMNRKGFMHRDLKPGNILLSHCRDCGHHVTSIPGYLLSFKLADFGFARFLQDGMMAVTMCGSPMYMAPEVLMCRKYDAVADIWSMGIIVYQCLTGKAPFYANTPEALKNIYEKTACLRPKIPVTTSKALQDLLLKMLIRKPSDRIDFQNFLNHRFLHQRHFEPRAGSGPESSATRSSIAPALPSRNRPTVRGPGITVLGQGTGEGPYYLAPQDGNRARDKTPQGKASNNPPGSSNGPREWTNPTHWSNNTNNKQQPLSGATSSSPSSQQPTGDFNPFYPQHTGAGIIPFNNYDDPGYSLDDIDDEMTKTTVDEYIEDELDASGSSPSSDQNNLPKLPSVKPRDCMHIDSNKYPTDNHQIDVNTNFYSSNHQQQYISNNYRPSVPTRQDGFNVDEQRSTAYRFDQRGVYMNAEMEYGEPPLEDYVIVNSDGSVQRIDRGRFRQQNQSTDPLSHMSNVGRIVRNPGAYLTNNNNNLQRRGMTDIGPLPDVTIGTNTTDTRYYQLINDNHCNNSPTLLNTNEISHGVNNKLADQYFHQLPVDSRNSPTSHKYNTQPISEPTKGSTDYTKDISHGTQVNEGNLSSLPHHNTEPKISYMEPVMSNLNVSKTGTTLQQINFQANNRQFVHPSGLQTIAVQGVDGVYPVIATGRNFENDLTSGGLWEAAEFSDEILMESEHNEEIKKITMVLELCELLAELAERRASALADCTPTRVVNTDNDDSTTTTTDPSAVNDGVSLVKLNNQQTKCSSNTNSLDNNHCGVGSYGNSDEHDTSKNCQQASSTALKFVSEAQRIVEQIVLYRRVLYYLEYVFDQVKKAFQNGRLKSTPTARRRLIDCNTLYHRCYIRLRQLARQSRREDLIEPVGRLLANITANRLIFQYALDQCYAAEMDEYIGEIALSLQRYKAGITLIHGLCQHAKSQRDKTLLSDCMRLLRERYACLWSTATKPNLQTMHYQPDTTMPTTTTATTTQCSNNNPTNILPSDSLPNPSLNDPSSEVNNKFAVTVGALPMTNCAPTTSPLR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	87.6	Confident	91.4	Very high	105 Å²	105	51.5 Å²	51.5	52%	0.517	32%	0.321	S	S	.	.				0	140.9	0	-60	-52.7	-78.7	0	0	109.3	E8 Y9 N10	M1-E8 HydrophobicContact CB-CB 4.3Å; M1-E8 VanDerWaalsContact CB-OE2 3.26Å; M1-E8 WeakPolarHBondContact CB-OE2 3.31Å; M1-E8 HydrophobicContact CE-CB 4.08Å; M1-E8 HydrophobicContact CE-CG 3.73Å; M1-Y9 CarbonylContact C-O 3.59Å; M1-Y9 WeakPolarHBondContact CA-O 3.34Å; M1-Y9 VanDerWaalsContact CE-C 3.49Å; M1-N10 HydrophobicContact SD-CB 3.88Å
2	I	90.3	Very high	91.4	Very high	76 Å²	76	53.8 Å²	53.8	39%	0.39	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126.7	166.5	-62.8	-179.9	0	0	0	106.7	E8 Y9 P11	I2-E8 CarbonylContact O-C 3.42Å; I2-E8 WeakPolarHBondContact O-CA 3.21Å; I2-E8 WeakPolarHBondContact O-CB 3.24Å; I2-Y9 HydrophobicContact CB-CD1 4.13Å; I2-Y9 HydrophobicContact CB-CE1 3.67Å; I2-Y9 HydrophobicContact CD1-CE2 4.29Å; I2-Y9 HydrophobicContact CG2-CD1 4.45Å; I2-Y9 HydrophobicContact CG2-CE1 3.64Å; I2-Y9 PolarHBondContact N-O 2.9Å; I2-Y9 PolarHBondContact O-N 2.75Å; I2-P11 HydrophobicContact CD1-CG 3.57Å; I2-P11 HydrophobicContact CG1-CG 4.14Å
3	S	91	Very high	91.5	Very high	69 Å²	69	55.2 Å²	55.2	48%	0.483	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	141.2	176.2	-91.3	0	0	0	0	111.7	R29	S3-R29 PolarHBondContact OG-NH1 2.98Å
4	L	88.6	Confident	91.5	Very high	22 Å²	22	56.4 Å²	56.4	12%	0.115	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	92.8	176.7	-171.2	80.9	0	0	0	109	A6 Y7 I38 Y83 V85	L4-A6 PolarHBondContact O-N 3.4Å; L4-A6 VanDerWaalsContact O-N 3.09Å; L4-Y7 CarbonylContact C-O 3.58Å; L4-Y7 PolarHBondContact N-O 2.7Å; L4-Y7 PolarHBondContact O-N 3.41Å; L4-I38 HydrophobicContact CD2-CD1 4.2Å; L4-I38 HydrophobicContact CD2-CG2 4.04Å; L4-Y83 HydrophobicContact CD1-CD1 3.55Å; L4-Y83 HydrophobicContact CD1-CD2 4.09Å; L4-Y83 HydrophobicContact CD1-CE1 3.87Å; L4-Y83 HydrophobicContact CD1-CE2 4.42Å; L4-Y83 HydrophobicContact CD1-CG 3.69Å; L4-Y83 HydrophobicContact CD2-CD1 3.83Å; L4-Y83 HydrophobicContact CD2-CG 3.99Å; L4-Y83 HydrophobicContact CG-CD1 4.33Å; L4-V85 HydrophobicContact CD2-CG2 3.78Å
5	G	88	Confident	91.4	Very high	63 Å²	63	57.9 Å²	57.9	65%	0.649	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	-111.8	-178.4	0	0	0	0	0	112.3	R29	G5-R29 VanDerWaalsContact O-CZ 3.24Å; G5-R29 PolarHBondContact O-NH1 3.41Å; G5-R29 PolarHBondContact O-NH2 2.76Å
6	A	93.1	Very high	90.9	Very high	48 Å²	48	56.3 Å²	56.3	40%	0.397	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.4	174.7	0	0	0	0	0	114.3	L4 R29	L4-A6 PolarHBondContact O-N 3.4Å; L4-A6 VanDerWaalsContact O-N 3.09Å; A6-R29 VanDerWaalsContact O-CB 3.3Å; A6-R29 WeakPolarHBondContact O-CB 3.48Å; A6-R29 PolarHBondContact O-N 2.66Å
7	Y	95.1	Very high	90.2	Very high	31 Å²	31	60.1 Å²	60.1	12%	0.122	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	168.1	-172.8	-49.2	-84.7	0	0	0	111.5	L4 R27 V28 V36 D74 V85	L4-Y7 CarbonylContact C-O 3.58Å; L4-Y7 PolarHBondContact N-O 2.7Å; L4-Y7 PolarHBondContact O-N 3.41Å; Y7-R27 CarbonylContact C-O 3.19Å; Y7-R27 WeakPolarHBondContact CA-O 3.49Å; Y7-V28 HydrophobicContact CD1-CG2 3.99Å; Y7-V28 HydrophobicContact CE1-CG2 3.89Å; Y7-V36 HydrophobicContact CD1-CG1 4.05Å; Y7-V36 HydrophobicContact CD1-CG2 4.03Å; Y7-V36 HydrophobicContact CE1-CG1 4.07Å; Y7-D74 HydrophobicContact CE2-CB 3.71Å; Y7-V85 HydrophobicContact CD1-CG1 3.77Å; Y7-V85 HydrophobicContact CD2-CB 4.37Å; Y7-V85 HydrophobicContact CD2-CG1 3.94Å; Y7-V85 HydrophobicContact CD2-CG2 3.91Å; Y7-V85 HydrophobicContact CE1-CG1 3.74Å; Y7-V85 HydrophobicContact CE2-CB 4.27Å; Y7-V85 HydrophobicContact CE2-CG1 3.93Å; Y7-V85 HydrophobicContact CE2-CG2 4.17Å; Y7-V85 HydrophobicContact CG-CG1 3.86Å; Y7-V85 HydrophobicContact CG-CG2 4.39Å
8	E	94.5	Very high	89	Confident	26 Å²	26	58.9 Å²	58.9	12%	0.121	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	153.7	167.2	54.7	163.1	-152.6	0	0	112.3	M1 I2 G26 R27 R29	M1-E8 HydrophobicContact CB-CB 4.3Å; M1-E8 VanDerWaalsContact CB-OE2 3.26Å; M1-E8 WeakPolarHBondContact CB-OE2 3.31Å; M1-E8 HydrophobicContact CE-CB 4.08Å; M1-E8 HydrophobicContact CE-CG 3.73Å; I2-E8 CarbonylContact O-C 3.42Å; I2-E8 WeakPolarHBondContact O-CA 3.21Å; I2-E8 WeakPolarHBondContact O-CB 3.24Å; E8-G26 CarbonylContact O-C 3.55Å; E8-G26 WeakPolarHBondContact O-CA 3.36Å; E8-R27 HydrophobicContact CG-CG 4.05Å; E8-R27 PolarHBondContact N-O 2.99Å; E8-R27 PolarHBondContact O-N 3.49Å; E8-R27 IonicContact OE1-CZ 3.85Å; E8-R27 IonicContact OE1-NE 3.09Å; E8-R27 PolarHBondContact OE1-NE 3.14Å; E8-R27 IonicContact OE1-NH2 3.38Å; E8-R27 PolarHBondContact OE1-NH2 3.4Å; E8-R29 HydrophobicContact CG-CB 4.2Å; E8-R29 HydrophobicContact CG-CG 4.37Å
9	Y	94.6	Very high	87.8	Confident	13 Å²	13	59.8 Å²	59.8	5%	0.051	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	167.6	178.3	71	-77.6	0	0	0	112.8	M1 I2 P11 Y24 K25 I38 I40	M1-Y9 CarbonylContact C-O 3.59Å; M1-Y9 WeakPolarHBondContact CA-O 3.34Å; M1-Y9 VanDerWaalsContact CE-C 3.49Å; I2-Y9 HydrophobicContact CB-CD1 4.13Å; I2-Y9 HydrophobicContact CB-CE1 3.67Å; I2-Y9 HydrophobicContact CD1-CE2 4.29Å; I2-Y9 HydrophobicContact CG2-CD1 4.45Å; I2-Y9 HydrophobicContact CG2-CE1 3.64Å; I2-Y9 PolarHBondContact N-O 2.9Å; I2-Y9 PolarHBondContact O-N 2.75Å; Y9-P11 HydrophobicContact CE2-CG 4.35Å; Y9-Y24 HydrophobicContact CD2-CD1 4.05Å; Y9-Y24 HydrophobicContact CD2-CD2 4.11Å; Y9-Y24 AromaticContact CD2-CG 3.68Å; Y9-Y24 HydrophobicContact CD2-CG 3.68Å; Y9-Y24 HydrophobicContact CE2-CD1 4.26Å; Y9-Y24 AromaticContact CE2-CD2 3.97Å; Y9-Y24 HydrophobicContact CE2-CD2 3.97Å; Y9-Y24 HydrophobicContact CE2-CE2 4.29Å; Y9-Y24 AromaticContact CE2-CG 3.95Å; Y9-Y24 HydrophobicContact CE2-CG 3.95Å; Y9-K25 WeakPolarHBondContact CB-O 3.38Å; Y9-I38 HydrophobicContact CD1-CD1 4.04Å; Y9-I38 HydrophobicContact CG-CD1 4.37Å; Y9-I40 HydrophobicContact CE1-CD1 4.22Å; Y9-I40 HydrophobicContact CE2-CD1 3.83Å; Y9-I40 VanDerWaalsContact OH-CD1 3.29Å; Y9-I40 WeakPolarHBondContact OH-CD1 3.43Å
10	N	92.3	Very high	86.9	Confident	50 Å²	50	61.5 Å²	61.5	27%	0.267	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126	174.3	-173.3	18.5	0	0	0	109.8	M1 A12 D13	M1-N10 HydrophobicContact SD-CB 3.88Å; N10-A12 PolarHBondContact O-N 3.42Å; N10-A12 VanDerWaalsContact O-N 3.11Å; N10-D13 HydrophobicContact CB-CB 4.13Å; N10-D13 WeakPolarHBondContact CB-OD2 3.35Å; N10-D13 PolarHBondContact ND2-OD1 3.43Å; N10-D13 PolarHBondContact O-N 3.08Å
11	P	90.7	Very high	86.5	Confident	64 Å²	64	59 Å²	59	42%	0.416	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	-17.5	174.9	-27.9	37	0	0	0	115.3	I2 Y9 Y24	I2-P11 HydrophobicContact CD1-CG 3.57Å; I2-P11 HydrophobicContact CG1-CG 4.14Å; Y9-P11 HydrophobicContact CE2-CG 4.35Å; P11-Y24 HydrophobicContact CB-CE1 4.45Å; P11-Y24 WeakPolarHBondContact O-CE1 3.17Å
12	A	90.7	Very high	86.5	Confident	79 Å²	79	55.2 Å²	55.2	65%	0.653	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	-23.3	172.5	0	0	0	0	0	113.3	N10 V14	N10-A12 PolarHBondContact O-N 3.42Å; N10-A12 VanDerWaalsContact O-N 3.11Å; A12-V14 PolarHBondContact O-N 3.16Å
13	D	92.5	Very high	86.5	Confident	71 Å²	71	53.2 Å²	53.2	38%	0.38	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	55.5	-173.3	-56.4	-2.4	0	0	0	110.4	N10 L15 Y24 K25	N10-D13 HydrophobicContact CB-CB 4.13Å; N10-D13 WeakPolarHBondContact CB-OD2 3.35Å; N10-D13 PolarHBondContact ND2-OD1 3.43Å; N10-D13 PolarHBondContact O-N 3.08Å; D13-L15 PolarHBondContact O-N 3.22Å; D13-Y24 CarbonylContact O-C 3.55Å; D13-Y24 WeakPolarHBondContact O-CA 3.43Å; D13-K25 HydrophobicContact CB-CB 3.9Å; D13-K25 PolarHBondContact O-N 3.32Å
14	V	92.4	Very high	86.7	Confident	72 Å²	72	51.6 Å²	51.6	44%	0.436	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	127.4	177.5	179.5	0	0	0	0	109.8	A12 I22 Y24	A12-V14 PolarHBondContact O-N 3.16Å; V14-I22 HydrophobicContact CG1-CG2 4.07Å; V14-Y24 HydrophobicContact CG2-CD1 3.97Å; V14-Y24 HydrophobicContact CG2-CE1 3.63Å
15	L	89	Confident	87	Confident	80 Å²	80	54.1 Å²	54.1	42%	0.419	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-28.1	173.7	-63.9	176.2	0	0	0	112.4	D13 V23 K25 A37 Y88	D13-L15 PolarHBondContact O-N 3.22Å; L15-V23 HydrophobicContact CB-CB 4.43Å; L15-V23 HydrophobicContact CB-CG1 4.25Å; L15-V23 HydrophobicContact CD1-CG1 4.38Å; L15-V23 PolarHBondContact N-O 3.48Å; L15-K25 HydrophobicContact CD1-CB 3.95Å; L15-K25 HydrophobicContact CD1-CG 4.49Å; L15-K25 HydrophobicContact CD2-CB 4.1Å; L15-K25 HydrophobicContact CG-CB 3.98Å; L15-A37 HydrophobicContact CD1-CB 4.33Å; L15-Y88 HydrophobicContact CD1-CD2 3.77Å; L15-Y88 HydrophobicContact CD1-CE2 3.66Å; L15-Y88 HydrophobicContact CD2-CE2 3.88Å; L15-Y88 HydrophobicContact CG-CE2 4.45Å
16	G	83.4	Confident	87.3	Confident	31 Å²	31	51.4 Å²	51.4	32%	0.32	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	152.9	178.8	0	0	0	0	0	112	I22 V23	G16-I22 WeakPolarHBondContact O-CG2 3.4Å; G16-V23 PolarHBondContact N-O 3.43Å; G16-V23 PolarHBondContact O-N 3.02Å
17	N	79.9	Confident	87.4	Confident	121 Å²	121	53.4 Å²	53.4	65%	0.647	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.5	113.5	-178.7	-169.7	-11.1	0	0	0	109.1	I22	N17-I22 HydrophobicContact CB-CG2 4.49Å
18	G	68.6	Low	87.4	Confident	40 Å²	40	53 Å²	53	41%	0.412	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	168	-176.4	0	0	0	0	0	112.1	F20 A21	G18-F20 PolarHBondContact O-N 3.08Å; G18-A21 PolarHBondContact N-O 3.11Å; G18-A21 PolarHBondContact O-N 3.34Å; G18-A21 VanDerWaalsContact O-N 3.16Å; G18-A21 VanDerWaalsContact O-O 3.13Å
19	A	66.4	Low	87.4	Confident	76 Å²	76	56.8 Å²	56.8	63%	0.628	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-20.5	-170.3	0	0	0	0	0	115.8
20	F	69.4	Low	87.3	Confident	92 Å²	92	62.9 Å²	62.9	40%	0.404	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-10.4	-178.5	-49.4	-66.6	0	0	0	114	G18 M41 L42 F167	G18-F20 PolarHBondContact O-N 3.08Å; F20-M41 HydrophobicContact CB-CE 3.82Å; F20-M41 WeakPolarHBondContact O-CA 3.49Å; F20-M41 WeakPolarHBondContact O-CE 3.47Å; F20-L42 PolarHBondContact O-N 2.66Å; F20-F167 HydrophobicContact CE2-CZ 4.19Å
21	A	79.1	Confident	87.3	Confident	10 Å²	10	63.7 Å²	63.7	8%	0.083	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	148.2	-168.5	0	0	0	0	0	113.5	G18 K39 I40 M41	G18-A21 PolarHBondContact N-O 3.11Å; G18-A21 PolarHBondContact O-N 3.34Å; G18-A21 VanDerWaalsContact O-N 3.16Å; G18-A21 VanDerWaalsContact O-O 3.13Å; A21-K39 HydrophobicContact CB-CG 3.88Å; A21-I40 CarbonylContact C-O 3.58Å; A21-I40 WeakPolarHBondContact CA-O 3.38Å; A21-M41 HydrophobicContact CB-CE 4.4Å; A21-M41 HydrophobicContact CB-SD 3.68Å
22	I	86.2	Confident	87.2	Confident	26 Å²	26	64.3 Å²	64.3	13%	0.133	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.3	169	-48.1	-175.3	0	0	0	108.7	V14 G16 N17 Y24 K39 I40 L42	V14-I22 HydrophobicContact CG1-CG2 4.07Å; G16-I22 WeakPolarHBondContact O-CG2 3.4Å; N17-I22 HydrophobicContact CB-CG2 4.49Å; I22-Y24 HydrophobicContact CB-CE2 3.73Å; I22-Y24 HydrophobicContact CG2-CD2 4.21Å; I22-Y24 HydrophobicContact CG2-CE1 4.16Å; I22-Y24 HydrophobicContact CG2-CE2 3.54Å; I22-K39 WeakPolarHBondContact O-CA 3.34Å; I22-I40 PolarHBondContact N-O 3.3Å; I22-I40 PolarHBondContact O-N 2.76Å; I22-L42 HydrophobicContact CD1-CD2 4Å; I22-L42 HydrophobicContact CG1-CD2 4.07Å; I22-L42 HydrophobicContact CG1-CG 4.39Å
23	V	91.3	Very high	87.1	Confident	34 Å²	34	66.8 Å²	66.8	21%	0.206	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	126.1	176.2	-169.8	0	0	0	0	109.1	L15 G16 A37 I38 K39	L15-V23 HydrophobicContact CB-CB 4.43Å; L15-V23 HydrophobicContact CB-CG1 4.25Å; L15-V23 HydrophobicContact CD1-CG1 4.38Å; L15-V23 PolarHBondContact N-O 3.48Å; G16-V23 PolarHBondContact N-O 3.43Å; G16-V23 PolarHBondContact O-N 3.02Å; V23-A37 HydrophobicContact CG1-CB 4.08Å; V23-I38 WeakPolarHBondContact CA-O 3.22Å; V23-K39 HydrophobicContact CG2-CB 4.07Å; V23-K39 HydrophobicContact CG2-CG 4.07Å
24	Y	94.2	Very high	87.1	Confident	35 Å²	35	67.4 Å²	67.4	14%	0.137	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	153.6	177.1	-61.7	-89.9	0	0	0	111.1	Y9 P11 D13 V14 I22 A37 I38 I40	Y9-Y24 HydrophobicContact CD2-CD1 4.05Å; Y9-Y24 HydrophobicContact CD2-CD2 4.11Å; Y9-Y24 AromaticContact CD2-CG 3.68Å; Y9-Y24 HydrophobicContact CD2-CG 3.68Å; Y9-Y24 HydrophobicContact CE2-CD1 4.26Å; Y9-Y24 AromaticContact CE2-CD2 3.97Å; Y9-Y24 HydrophobicContact CE2-CD2 3.97Å; Y9-Y24 HydrophobicContact CE2-CE2 4.29Å; Y9-Y24 AromaticContact CE2-CG 3.95Å; Y9-Y24 HydrophobicContact CE2-CG 3.95Å; P11-Y24 HydrophobicContact CB-CE1 4.45Å; P11-Y24 WeakPolarHBondContact O-CE1 3.17Å; D13-Y24 CarbonylContact O-C 3.55Å; D13-Y24 WeakPolarHBondContact O-CA 3.43Å; V14-Y24 HydrophobicContact CG2-CD1 3.97Å; V14-Y24 HydrophobicContact CG2-CE1 3.63Å; I22-Y24 HydrophobicContact CB-CE2 3.73Å; I22-Y24 HydrophobicContact CG2-CD2 4.21Å; I22-Y24 HydrophobicContact CG2-CE1 4.16Å; I22-Y24 HydrophobicContact CG2-CE2 3.54Å; Y24-A37 WeakPolarHBondContact O-CA 3.2Å; Y24-I38 PolarHBondContact N-O 3.42Å; Y24-I38 PolarHBondContact O-N 3.36Å; Y24-I40 HydrophobicContact CD2-CD1 3.65Å; Y24-I40 HydrophobicContact CD2-CG1 4.04Å; Y24-I40 HydrophobicContact CE2-CD1 3.61Å; Y24-I40 HydrophobicContact CE2-CG1 4.14Å
25	K	95.1	Very high	87.2	Confident	74 Å²	74	64.9 Å²	64.9	32%	0.322	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	126.1	163.8	-164.3	172	178	168.2	0	109	Y9 D13 L15 Y88	Y9-K25 WeakPolarHBondContact CB-O 3.38Å; D13-K25 HydrophobicContact CB-CB 3.9Å; D13-K25 PolarHBondContact O-N 3.32Å; L15-K25 HydrophobicContact CD1-CB 3.95Å; L15-K25 HydrophobicContact CD1-CG 4.49Å; L15-K25 HydrophobicContact CD2-CB 4.1Å; L15-K25 HydrophobicContact CG-CB 3.98Å; K25-Y88 HydrophobicContact CD-CE2 3.99Å; K25-Y88 HydrophobicContact CG-CD2 4.34Å; K25-Y88 HydrophobicContact CG-CE2 4.08Å; K25-Y88 PolarHBondContact NZ-OH 3.49Å
26	G	95.3	Very high	87.5	Confident	6 Å²	6	61.1 Å²	61.1	6%	0.062	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	-172	170.2	0	0	0	0	0	111.5	E8 P35 V36	E8-G26 CarbonylContact O-C 3.55Å; E8-G26 WeakPolarHBondContact O-CA 3.36Å; G26-P35 CarbonylContact O-C 3.38Å; G26-P35 WeakPolarHBondContact O-CA 3.21Å; G26-P35 WeakPolarHBondContact O-CB 3.44Å; G26-V36 PolarHBondContact N-O 3.08Å; G26-V36 PolarHBondContact O-N 3.39Å
27	R	95.4	Very high	88.1	Confident	90 Å²	90	60 Å²	60	34%	0.34	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	161	173.2	63.3	-165.5	178.7	-167.1	-2.3	111.3	Y7 E8 R29 E34	Y7-R27 CarbonylContact C-O 3.19Å; Y7-R27 WeakPolarHBondContact CA-O 3.49Å; E8-R27 HydrophobicContact CG-CG 4.05Å; E8-R27 PolarHBondContact N-O 2.99Å; E8-R27 PolarHBondContact O-N 3.49Å; E8-R27 IonicContact OE1-CZ 3.85Å; E8-R27 IonicContact OE1-NE 3.09Å; E8-R27 PolarHBondContact OE1-NE 3.14Å; E8-R27 IonicContact OE1-NH2 3.38Å; E8-R27 PolarHBondContact OE1-NH2 3.4Å; R27-R29 PolarHBondContact O-N 3.39Å; R27-E34 CarbonylContact C-O 3.53Å; R27-E34 VanDerWaalsContact CA-O 3.25Å; R27-E34 WeakPolarHBondContact CA-O 3.47Å
28	V	95.4	Very high	88.7	Confident	24 Å²	24	54.3 Å²	54.3	15%	0.145	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	124.4	165.8	179.2	0	0	0	0	108.1	Y7 N30 N31 E34	Y7-V28 HydrophobicContact CD1-CG2 3.99Å; Y7-V28 HydrophobicContact CE1-CG2 3.89Å; V28-N30 HydrophobicContact CG1-CB 4.47Å; V28-N30 PolarHBondContact O-N 2.76Å; V28-N31 HydrophobicContact CB-CB 4.13Å; V28-N31 HydrophobicContact CG1-CB 4.09Å; V28-N31 CarbonylContact O-C 3.54Å; V28-N31 PolarHBondContact O-N 3.12Å; V28-E34 HydrophobicContact CB-CB 4.24Å; V28-E34 HydrophobicContact CG2-CB 4.04Å; V28-E34 HydrophobicContact CG2-CG 3.8Å; V28-E34 PolarHBondContact N-O 3.1Å
29	R	93.2	Very high	89.7	Confident	105 Å²	105	53 Å²	53	40%	0.396	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-29	-174.7	-174.5	178.1	58.1	-123.8	-14.5	112.5	S3 G5 A6 E8 R27	S3-R29 PolarHBondContact OG-NH1 2.98Å; G5-R29 VanDerWaalsContact O-CZ 3.24Å; G5-R29 PolarHBondContact O-NH1 3.41Å; G5-R29 PolarHBondContact O-NH2 2.76Å; A6-R29 VanDerWaalsContact O-CB 3.3Å; A6-R29 WeakPolarHBondContact O-CB 3.48Å; A6-R29 PolarHBondContact O-N 2.66Å; E8-R29 HydrophobicContact CG-CB 4.2Å; E8-R29 HydrophobicContact CG-CG 4.37Å; R27-R29 PolarHBondContact O-N 3.39Å
30	N	92.4	Very high	90.6	Very high	140 Å²	140	50.4 Å²	50.4	75%	0.749	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-7	178.1	-62.3	12.4	0	0	0	113.2	V28	V28-N30 HydrophobicContact CG1-CB 4.47Å; V28-N30 PolarHBondContact O-N 2.76Å
31	N	92.6	Very high	90.9	Very high	68 Å²	68	47 Å²	47	36%	0.364	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	85.8	-179.4	-173.2	9.4	0	0	0	109.8	V28 D33 E34	V28-N31 HydrophobicContact CB-CB 4.13Å; V28-N31 HydrophobicContact CG1-CB 4.09Å; V28-N31 CarbonylContact O-C 3.54Å; V28-N31 PolarHBondContact O-N 3.12Å; N31-D33 PolarHBondContact O-N 2.67Å; N31-D33 VanDerWaalsContact O-N 3.11Å; N31-E34 HydrophobicContact CB-CB 4.08Å; N31-E34 WeakPolarHBondContact ND2-CB 3.28Å; N31-E34 PolarHBondContact ND2-OE2 2.96Å; N31-E34 WeakPolarHBondContact O-CB 3.14Å; N31-E34 PolarHBondContact O-N 3.47Å
32	P	87.8	Confident	90.3	Very high	77 Å²	77	50.2 Å²	50.2	50%	0.5	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	-24.9	-170.5	-25.8	35.7	0	0	0	114.9	E34	P32-E34 PolarHBondContact O-N 2.78Å
33	D	89	Confident	88.8	Confident	130 Å²	130	53.8 Å²	53.8	70%	0.695	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	1.7	178.4	-61.1	-55.1	0	0	0	113.2	N31 P35 R144	N31-D33 PolarHBondContact O-N 2.67Å; N31-D33 VanDerWaalsContact O-N 3.11Å; D33-P35 WeakPolarHBondContact O-CD 3.48Å; D33-R144 PolarHBondContact O-NH1 2.98Å
34	E	92.5	Very high	86.9	Confident	84 Å²	84	58.8 Å²	58.8	39%	0.393	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	80.6	177	-167.8	174.3	176.3	0	0	111.2	R27 V28 N31 P32	R27-E34 CarbonylContact C-O 3.53Å; R27-E34 VanDerWaalsContact CA-O 3.25Å; R27-E34 WeakPolarHBondContact CA-O 3.47Å; V28-E34 HydrophobicContact CB-CB 4.24Å; V28-E34 HydrophobicContact CG2-CB 4.04Å; V28-E34 HydrophobicContact CG2-CG 3.8Å; V28-E34 PolarHBondContact N-O 3.1Å; N31-E34 HydrophobicContact CB-CB 4.08Å; N31-E34 WeakPolarHBondContact ND2-CB 3.28Å; N31-E34 PolarHBondContact ND2-OE2 2.96Å; N31-E34 WeakPolarHBondContact O-CB 3.14Å; N31-E34 PolarHBondContact O-N 3.47Å; P32-E34 PolarHBondContact O-N 2.78Å
35	P	94.2	Very high	84.7	Confident	20 Å²	20	61.6 Å²	61.6	13%	0.13	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	148.3	176.9	29.9	-37.5	0	0	0	112.8	G26 D33 Y88 R144	G26-P35 CarbonylContact O-C 3.38Å; G26-P35 WeakPolarHBondContact O-CA 3.21Å; G26-P35 WeakPolarHBondContact O-CB 3.44Å; D33-P35 WeakPolarHBondContact O-CD 3.48Å; P35-Y88 HydrophobicContact CB-CD1 3.78Å; P35-Y88 HydrophobicContact CB-CE1 4.43Å; P35-Y88 HydrophobicContact CB-CG 4.07Å; P35-Y88 HydrophobicContact CG-CD1 3.61Å; P35-Y88 HydrophobicContact CG-CE1 4.29Å; P35-Y88 HydrophobicContact CG-CG 4.29Å; P35-Y88 WeakPolarHBondContact O-CB 3.32Å; P35-R144 VanDerWaalsContact CD-NH2 3.33Å
36	V	95.7	Very high	82.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	158.5	175.6	-63.5	0	0	0	0	109.7	Y7 G26 I38 Y73 V85 M86	Y7-V36 HydrophobicContact CD1-CG1 4.05Å; Y7-V36 HydrophobicContact CD1-CG2 4.03Å; Y7-V36 HydrophobicContact CE1-CG1 4.07Å; G26-V36 PolarHBondContact N-O 3.08Å; G26-V36 PolarHBondContact O-N 3.39Å; V36-I38 HydrophobicContact CG2-CD1 4.19Å; V36-I38 HydrophobicContact CG2-CG1 3.94Å; V36-Y73 HydrophobicContact CG1-CD2 3.89Å; V36-Y73 HydrophobicContact CG1-CE2 4.03Å; V36-V85 HydrophobicContact CB-CG1 3.82Å; V36-V85 HydrophobicContact CG1-CG1 4.05Å; V36-V85 HydrophobicContact CG2-CG1 3.81Å; V36-M86 CarbonylContact C-O 3.5Å; V36-M86 WeakPolarHBondContact CA-O 3.46Å; V36-M86 WeakPolarHBondContact CB-O 3.17Å
37	A	95.5	Very high	80.3	Confident	9 Å²	9	65 Å²	65	7%	0.074	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	127.9	166.9	0	0	0	0	0	109	L15 V23 Y24 M86	L15-A37 HydrophobicContact CD1-CB 4.33Å; V23-A37 HydrophobicContact CG1-CB 4.08Å; Y24-A37 WeakPolarHBondContact O-CA 3.2Å; A37-M86 HydrophobicContact CB-CB 4.4Å; A37-M86 HydrophobicContact CB-CE 4.24Å; A37-M86 PolarHBondContact N-O 3.04Å; A37-M86 PolarHBondContact O-N 3.48Å
38	I	92.9	Very high	78.2	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	105.4	178.9	-53.6	-166.3	0	0	0	109.1	L4 Y9 V23 Y24 V36 I40 Y83 L84 V85	L4-I38 HydrophobicContact CD2-CD1 4.2Å; L4-I38 HydrophobicContact CD2-CG2 4.04Å; Y9-I38 HydrophobicContact CD1-CD1 4.04Å; Y9-I38 HydrophobicContact CG-CD1 4.37Å; V23-I38 WeakPolarHBondContact CA-O 3.22Å; Y24-I38 PolarHBondContact N-O 3.42Å; Y24-I38 PolarHBondContact O-N 3.36Å; V36-I38 HydrophobicContact CG2-CD1 4.19Å; V36-I38 HydrophobicContact CG2-CG1 3.94Å; I38-I40 HydrophobicContact CG2-CG1 4.07Å; I38-Y83 HydrophobicContact CG2-CD1 4.21Å; I38-L84 CarbonylContact C-O 3.58Å; I38-L84 WeakPolarHBondContact CA-O 3.38Å; I38-V85 HydrophobicContact CD1-CG2 4.43Å; I38-V85 HydrophobicContact CG1-CG2 4.43Å
39	K	89.2	Confident	76.1	Confident	14 Å²	14	70.7 Å²	70.7	6%	0.061	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	118.6	176.2	179.8	-177.6	-168.8	-169.5	0	108.9	A21 I22 V23 E57 Y83 L84 M86 D164	A21-K39 HydrophobicContact CB-CG 3.88Å; I22-K39 WeakPolarHBondContact O-CA 3.34Å; V23-K39 HydrophobicContact CG2-CB 4.07Å; V23-K39 HydrophobicContact CG2-CG 4.07Å; K39-E57 IonicContact NZ-OE1 3.21Å; K39-E57 PolarHBondContact NZ-OE1 3.38Å; K39-E57 IonicContact NZ-OE2 3.45Å; K39-E57 PolarHBondContact NZ-OE2 3.41Å; K39-Y83 CarbonylContact O-C 3.42Å; K39-Y83 WeakPolarHBondContact O-CA 3.3Å; K39-L84 HydrophobicContact CB-CB 4.25Å; K39-L84 HydrophobicContact CB-CD1 4.49Å; K39-L84 HydrophobicContact CD-CD1 3.94Å; K39-L84 HydrophobicContact CG-CD1 4.36Å; K39-L84 PolarHBondContact N-O 2.76Å; K39-L84 PolarHBondContact O-N 3.4Å; K39-M86 HydrophobicContact CB-CE 3.6Å; K39-M86 HydrophobicContact CB-SD 4.43Å; K39-M86 HydrophobicContact CD-CE 4.29Å; K39-D164 IonicContact NZ-OD1 2.91Å; K39-D164 PolarHBondContact NZ-OD1 3.23Å
40	I	85.6	Confident	74.3	Confident	21 Å²	21	66.2 Å²	66.2	11%	0.108	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.2	-177.7	-49.4	-177.1	0	0	0	108.5	Y9 A21 I22 Y24 I38 V82 Y83	Y9-I40 HydrophobicContact CE1-CD1 4.22Å; Y9-I40 HydrophobicContact CE2-CD1 3.83Å; Y9-I40 VanDerWaalsContact OH-CD1 3.29Å; Y9-I40 WeakPolarHBondContact OH-CD1 3.43Å; A21-I40 CarbonylContact C-O 3.58Å; A21-I40 WeakPolarHBondContact CA-O 3.38Å; I22-I40 PolarHBondContact N-O 3.3Å; I22-I40 PolarHBondContact O-N 2.76Å; Y24-I40 HydrophobicContact CD2-CD1 3.65Å; Y24-I40 HydrophobicContact CD2-CG1 4.04Å; Y24-I40 HydrophobicContact CE2-CD1 3.61Å; Y24-I40 HydrophobicContact CE2-CG1 4.14Å; I38-I40 HydrophobicContact CG2-CG1 4.07Å; I40-V82 WeakPolarHBondContact CA-O 3.27Å; I40-Y83 HydrophobicContact CB-CD1 4.46Å; I40-Y83 HydrophobicContact CD1-CD1 3.8Å; I40-Y83 HydrophobicContact CD1-CE1 3.57Å; I40-Y83 HydrophobicContact CG1-CD1 3.67Å; I40-Y83 HydrophobicContact CG1-CE1 3.91Å; I40-Y83 HydrophobicContact CG2-CD1 4.2Å; I40-Y83 HydrophobicContact CG2-CE1 3.98Å
41	M	75.5	Confident	72.6	Confident	19 Å²	19	65.2 Å²	65.2	9%	0.094	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	135.2	176.9	-58.2	-54.9	-71.1	0	0	111.6	F20 A21 L54 V82	F20-M41 HydrophobicContact CB-CE 3.82Å; F20-M41 WeakPolarHBondContact O-CA 3.49Å; F20-M41 WeakPolarHBondContact O-CE 3.47Å; A21-M41 HydrophobicContact CB-CE 4.4Å; A21-M41 HydrophobicContact CB-SD 3.68Å; M41-L54 HydrophobicContact CG-CD1 3.33Å; M41-L54 HydrophobicContact SD-CD1 4Å; M41-V82 HydrophobicContact CG-CB 4.4Å; M41-V82 PolarHBondContact N-O 2.92Å
42	L	67.4	Low	71.1	Confident	79 Å²	79	63.9 Å²	63.9	41%	0.414	33%	0.329	S	S	.	.			trans	-71.3	128.9	174.8	-67.7	173.9	0	0	0	110.5	F20 I22	F20-L42 PolarHBondContact O-N 2.66Å; I22-L42 HydrophobicContact CD1-CD2 4Å; I22-L42 HydrophobicContact CG1-CD2 4.07Å; I22-L42 HydrophobicContact CG1-CG 4.39Å
43	K	54.7	Low	69.9	Low	100 Å²	100	62.2 Å²	62.2	44%	0.435	32%	0.316	S	S	.	.	S	Bend	trans	-80.6	-33.1	-166.2	-168.3	178.1	173.8	-175.7	0	113.6	Q45 V47 S79	K43-Q45 PolarHBondContact O-N 3.38Å; K43-V47 WeakPolarHBondContact O-CG2 3.47Å; K43-S79 PolarHBondContact NZ-O 2.92Å
44	D	51.2	Low	68.9	Low	139 Å²	139	56.2 Å²	56.2	74%	0.743	28%	0.283	S	S	*	.	S	Bend	trans	-104.8	24.1	-154.1	-49.6	-47.3	0	0	0	115.4
45	Q	48.3	Very low	67.7	Low	94 Å²	94	55.7 Å²	55.7	44%	0.439	29%	0.289	S	S	.	.	S	Bend	trans	-132.5	-28	-179.6	-76.2	-68.9	-36.9	0	0	116.1	K43 S821 L823	K43-Q45 PolarHBondContact O-N 3.38Å; Q45-S821 PolarHBondContact NE2-OG 2.83Å; Q45-S821 PolarHBondContact OE1-OG 3.36Å; Q45-L823 HydrophobicContact CG-CD1 3.96Å
46	N	51.1	Low	66.4	Low	68 Å²	68	57.6 Å²	57.6	36%	0.364	30%	0.295	S	S	.	.			trans	-163.7	44.1	-175.5	-119	-76.1	0	0	0	115.4	L48 K49 S50	N46-L48 VanDerWaalsContact C-N 3.25Å; N46-L48 PolarHBondContact O-N 2.93Å; N46-K49 HydrophobicContact CB-CB 4.27Å; N46-K49 PolarHBondContact O-N 3.44Å; N46-K49 VanDerWaalsContact OD1-CD 3.24Å; N46-K49 WeakPolarHBondContact OD1-CD 3.34Å; N46-K49 VanDerWaalsContact OD1-CG 3.28Å; N46-K49 WeakPolarHBondContact OD1-CG 3.47Å; N46-S50 PolarHBondContact O-N 3.01Å; N46-S50 PolarHBondContact O-OG 3.01Å
47	V	47.9	Very low	65.3	Low	83 Å²	83	57.8 Å²	57.8	50%	0.503	30%	0.296	S	S	.	.	H	α-helix	trans	-39.5	-44.8	-170.7	-178.3	0	0	0	0	115.2	K43 K51	K43-V47 WeakPolarHBondContact O-CG2 3.47Å; V47-K51 WeakPolarHBondContact O-CB 3.44Å; V47-K51 WeakPolarHBondContact O-CG 3.31Å; V47-K51 PolarHBondContact O-N 2.99Å
48	L	50.7	Low	64.4	Low	108 Å²	108	58.1 Å²	58.1	57%	0.565	30%	0.296	S	S	*	.	H	α-helix	trans	-68.1	-48.8	178.6	-78	163	0	0	0	113.3	N46 K51 T52	N46-L48 VanDerWaalsContact C-N 3.25Å; N46-L48 PolarHBondContact O-N 2.93Å; L48-K51 PolarHBondContact O-N 3.19Å; L48-T52 PolarHBondContact O-N 3.2Å; L48-T52 PolarHBondContact O-OG1 2.99Å
49	K	51.5	Low	63.7	Low	127 Å²	127	61.3 Å²	61.3	55%	0.552	32%	0.318	S	S	*	.	H	α-helix	trans	-63.5	-44	175.1	-68.5	-170	-172.5	176.8	0	110.4	N46 K51 T52 L53	N46-K49 HydrophobicContact CB-CB 4.27Å; N46-K49 PolarHBondContact O-N 3.44Å; N46-K49 VanDerWaalsContact OD1-CD 3.24Å; N46-K49 WeakPolarHBondContact OD1-CD 3.34Å; N46-K49 VanDerWaalsContact OD1-CG 3.28Å; N46-K49 WeakPolarHBondContact OD1-CG 3.47Å; K49-K51 PolarHBondContact O-N 3.03Å; K49-T52 PolarHBondContact O-N 3.22Å; K49-T52 VanDerWaalsContact O-N 3.12Å; K49-L53 VanDerWaalsContact O-CG 3.32Å; K49-L53 WeakPolarHBondContact O-CG 3.18Å; K49-L53 PolarHBondContact O-N 3.33Å
50	S	55.3	Low	63	Low	11 Å²	11	60.9 Å²	60.9	8%	0.077	32%	0.316	C	S	.	.	H	α-helix	trans	-57.6	-46.9	176.3	-58.6	0	0	0	0	111.8	N46 T52 L54	N46-S50 PolarHBondContact O-N 3.01Å; N46-S50 PolarHBondContact O-OG 3.01Å; S50-T52 VanDerWaalsContact C-N 3.34Å; S50-T52 PolarHBondContact O-N 3.46Å; S50-L54 WeakPolarHBondContact O-CB 3.35Å; S50-L54 PolarHBondContact O-N 3.36Å
51	K	57.2	Low	62.8	Low	119 Å²	119	60.3 Å²	60.3	52%	0.517	31%	0.314	S	S	.	.	H	α-helix	trans	-58.6	-42.5	173.4	-89.3	-170.6	171.3	-171.9	0	112.6	V47 L48 K49 S55	V47-K51 WeakPolarHBondContact O-CB 3.44Å; V47-K51 WeakPolarHBondContact O-CG 3.31Å; V47-K51 PolarHBondContact O-N 2.99Å; L48-K51 PolarHBondContact O-N 3.19Å; K49-K51 PolarHBondContact O-N 3.03Å; K51-S55 VanDerWaalsContact O-CB 3.31Å; K51-S55 WeakPolarHBondContact O-CB 3.32Å; K51-S55 PolarHBondContact O-N 2.83Å; K51-S55 PolarHBondContact O-OG 2.9Å
52	T	61.3	Low	63.2	Low	39 Å²	39	64.9 Å²	64.9	24%	0.239	33%	0.333	C	S	.	.	H	α-helix	trans	-71.7	-41	-174.7	-50.7	0	0	0	0	112.1	L48 K49 S50 K56 I1011	L48-T52 PolarHBondContact O-N 3.2Å; L48-T52 PolarHBondContact O-OG1 2.99Å; K49-T52 PolarHBondContact O-N 3.22Å; K49-T52 VanDerWaalsContact O-N 3.12Å; S50-T52 VanDerWaalsContact C-N 3.34Å; S50-T52 PolarHBondContact O-N 3.46Å; T52-K56 WeakPolarHBondContact O-CG 3.3Å; T52-K56 PolarHBondContact O-N 2.6Å; T52-I1011 HydrophobicContact CG2-CD1 3.92Å
53	L	61.9	Low	63.8	Low	43 Å²	43	64.9 Å²	64.9	23%	0.225	33%	0.333	C	S	.	.	H	α-helix	trans	-66.8	-44.7	173.7	-63.8	170.4	0	0	0	110.8	K49 K56 E57 G166	K49-L53 VanDerWaalsContact O-CG 3.32Å; K49-L53 WeakPolarHBondContact O-CG 3.18Å; K49-L53 PolarHBondContact O-N 3.33Å; L53-K56 WeakPolarHBondContact O-CB 3.46Å; L53-K56 PolarHBondContact O-N 2.74Å; L53-E57 PolarHBondContact O-N 3.48Å; L53-G166 VanDerWaalsContact CD2-O 3.3Å; L53-G166 WeakPolarHBondContact CD2-O 3.39Å
54	L	66.6	Low	65	Low	3 Å²	3	60.4 Å²	60.4	2%	0.016	31%	0.314	C	S	.	.	H	α-helix	trans	-70.2	-33.9	-179.1	173.9	140.4	0	0	0	113.4	M41 S50 K56 E57 I58 V82 L84	M41-L54 HydrophobicContact CG-CD1 3.33Å; M41-L54 HydrophobicContact SD-CD1 4Å; S50-L54 WeakPolarHBondContact O-CB 3.35Å; S50-L54 PolarHBondContact O-N 3.36Å; L54-K56 PolarHBondContact O-N 3.38Å; L54-E57 PolarHBondContact O-N 2.89Å; L54-I58 HydrophobicContact CD2-CD1 3.4Å; L54-I58 VanDerWaalsContact CD2-CD1 3.4Å; L54-I58 HydrophobicContact CD2-CG1 4.37Å; L54-I58 HydrophobicContact CG-CD1 3.96Å; L54-I58 HydrophobicContact CG-CG1 4.45Å; L54-I58 WeakPolarHBondContact O-CB 3.24Å; L54-I58 WeakPolarHBondContact O-CG1 2.94Å; L54-I58 PolarHBondContact O-N 3.07Å; L54-V82 HydrophobicContact CD1-CB 3.73Å; L54-V82 HydrophobicContact CD1-CG1 3.58Å; L54-V82 HydrophobicContact CD2-CB 4.25Å; L54-V82 HydrophobicContact CD2-CG1 3.65Å; L54-V82 HydrophobicContact CD2-CG2 4.41Å; L54-V82 HydrophobicContact CG-CG1 4.27Å; L54-L84 HydrophobicContact CD1-CD1 3.9Å; L54-L84 HydrophobicContact CD1-CG 4.24Å; L54-L84 HydrophobicContact CG-CD1 4.49Å
55	S	67.5	Low	66.6	Low	73 Å²	73	59.8 Å²	59.8	51%	0.51	31%	0.311	S	S	.	.	H	α-helix	trans	-63.8	-33.3	174.2	-57.7	0	0	0	0	111.2	K51 C59	K51-S55 VanDerWaalsContact O-CB 3.31Å; K51-S55 WeakPolarHBondContact O-CB 3.32Å; K51-S55 PolarHBondContact O-N 2.83Å; K51-S55 PolarHBondContact O-OG 2.9Å; S55-C59 VanDerWaalsContact O-CB 3.29Å; S55-C59 WeakPolarHBondContact O-CB 3.29Å; S55-C59 PolarHBondContact O-N 3.03Å; S55-C59 VanDerWaalsContact O-N 3.09Å
56	K	66.8	Low	68.6	Low	61 Å²	61	57 Å²	57	27%	0.265	30%	0.298	S	S	.	.	H	α-helix	trans	-71.7	-46.6	171.7	-67.1	168.2	-175	174.9	0	111.6	T52 L53 L54 I58 C59 V60	T52-K56 WeakPolarHBondContact O-CG 3.3Å; T52-K56 PolarHBondContact O-N 2.6Å; L53-K56 WeakPolarHBondContact O-CB 3.46Å; L53-K56 PolarHBondContact O-N 2.74Å; L54-K56 PolarHBondContact O-N 3.38Å; K56-I58 VanDerWaalsContact C-N 3.32Å; K56-I58 PolarHBondContact O-N 2.99Å; K56-C59 PolarHBondContact O-N 3.5Å; K56-C59 VanDerWaalsContact O-N 3.14Å; K56-V60 WeakPolarHBondContact O-CB 3.34Å; K56-V60 WeakPolarHBondContact O-CG2 3.45Å; K56-V60 PolarHBondContact O-N 3.43Å
57	E	73.4	Confident	70.5	Confident	3 Å²	3	59.9 Å²	59.9	1%	0.014	31%	0.309	C	S	.	.	H	α-helix	trans	-57.2	-43.3	176.1	-178.2	160.7	-143.5	0	0	111.9	K39 L53 L54 L61 L84 F165	K39-E57 IonicContact NZ-OE1 3.21Å; K39-E57 PolarHBondContact NZ-OE1 3.38Å; K39-E57 IonicContact NZ-OE2 3.45Å; K39-E57 PolarHBondContact NZ-OE2 3.41Å; L53-E57 PolarHBondContact O-N 3.48Å; L54-E57 PolarHBondContact O-N 2.89Å; E57-L61 HydrophobicContact CG-CD1 3.75Å; E57-L61 HydrophobicContact CG-CG 4.42Å; E57-L61 VanDerWaalsContact O-CB 3.25Å; E57-L61 WeakPolarHBondContact O-CB 3.25Å; E57-L61 VanDerWaalsContact O-CG 3.25Å; E57-L61 WeakPolarHBondContact O-CG 3.48Å; E57-L61 PolarHBondContact O-N 2.87Å; E57-L84 HydrophobicContact CG-CD1 4.42Å; E57-F165 HydrophobicContact CG-CB 4.18Å; E57-F165 PolarHBondContact OE1-N 2.88Å
58	I	77.2	Confident	72.7	Confident	16 Å²	16	56.4 Å²	56.4	8%	0.082	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-46.9	173.8	-70.3	162.3	0	0	0	111.8	L54 K56 K62 L84	L54-I58 HydrophobicContact CD2-CD1 3.4Å; L54-I58 VanDerWaalsContact CD2-CD1 3.4Å; L54-I58 HydrophobicContact CD2-CG1 4.37Å; L54-I58 HydrophobicContact CG-CD1 3.96Å; L54-I58 HydrophobicContact CG-CG1 4.45Å; L54-I58 WeakPolarHBondContact O-CB 3.24Å; L54-I58 WeakPolarHBondContact O-CG1 2.94Å; L54-I58 PolarHBondContact O-N 3.07Å; K56-I58 VanDerWaalsContact C-N 3.32Å; K56-I58 PolarHBondContact O-N 2.99Å; I58-K62 HydrophobicContact CG2-CD 3.78Å; I58-K62 VanDerWaalsContact CG2-CE 3.46Å; I58-K62 HydrophobicContact CG2-CG 4.37Å; I58-K62 WeakPolarHBondContact O-CB 3.45Å; I58-K62 VanDerWaalsContact O-CG 3.28Å; I58-K62 WeakPolarHBondContact O-CG 3.27Å; I58-K62 PolarHBondContact O-N 3.12Å; I58-L84 HydrophobicContact CD1-CD2 4.17Å; I58-L84 HydrophobicContact CG1-CD2 3.5Å
59	C	77.5	Confident	74.7	Confident	68 Å²	68	51.2 Å²	51.2	46%	0.459	26%	0.261	S	S	.	.	H	α-helix	trans	-61.5	-51.4	-178.8	-174.2	0	0	0	0	110.7	S55 K56 L61 K62 D63	S55-C59 VanDerWaalsContact O-CB 3.29Å; S55-C59 WeakPolarHBondContact O-CB 3.29Å; S55-C59 PolarHBondContact O-N 3.03Å; S55-C59 VanDerWaalsContact O-N 3.09Å; K56-C59 PolarHBondContact O-N 3.5Å; K56-C59 VanDerWaalsContact O-N 3.14Å; C59-L61 PolarHBondContact O-N 2.61Å; C59-K62 PolarHBondContact O-N 3.01Å; C59-D63 PolarHBondContact O-N 3.49Å; C59-D63 VanDerWaalsContact O-N 3.1Å
60	V	75.1	Confident	76.7	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-60	-45.8	179.3	174.2	0	0	0	0	111.4	K56 D63 L64 F128 F165 A168	K56-V60 WeakPolarHBondContact O-CB 3.34Å; K56-V60 WeakPolarHBondContact O-CG2 3.45Å; K56-V60 PolarHBondContact O-N 3.43Å; V60-D63 PolarHBondContact O-N 2.97Å; V60-L64 HydrophobicContact CG1-CD1 3.59Å; V60-L64 HydrophobicContact CG1-CG 4.49Å; V60-L64 VanDerWaalsContact O-CB 3.27Å; V60-L64 WeakPolarHBondContact O-CB 3.48Å; V60-L64 VanDerWaalsContact O-CG 3.29Å; V60-L64 WeakPolarHBondContact O-CG 3.26Å; V60-L64 PolarHBondContact O-N 3.25Å; V60-L64 VanDerWaalsContact O-N 3.08Å; V60-F128 HydrophobicContact CG1-CD2 4.33Å; V60-F128 HydrophobicContact CG1-CG 4.37Å; V60-F128 HydrophobicContact CG2-CD1 3.8Å; V60-F128 HydrophobicContact CG2-CE1 3.64Å; V60-F128 HydrophobicContact CG2-CG 4.35Å; V60-F128 HydrophobicContact CG2-CZ 4.03Å; V60-F165 HydrophobicContact CG1-CB 4.17Å; V60-F165 HydrophobicContact CG1-CD1 3.5Å; V60-F165 VanDerWaalsContact CG1-CD1 3.5Å; V60-F165 HydrophobicContact CG1-CE1 4.14Å; V60-F165 HydrophobicContact CG1-CG 4.05Å; V60-A168 HydrophobicContact CG1-CB 4.17Å; V60-A168 HydrophobicContact CG2-CB 4.04Å
61	L	81	Confident	78.4	Confident	9 Å²	9	49.6 Å²	49.6	5%	0.047	25%	0.25	C	C	.	.	H	α-helix	trans	-73.7	-26.2	-179.6	-71.1	175.3	0	0	0	114.3	E57 C59 I69 V70 L72 F165	E57-L61 HydrophobicContact CG-CD1 3.75Å; E57-L61 HydrophobicContact CG-CG 4.42Å; E57-L61 VanDerWaalsContact O-CB 3.25Å; E57-L61 WeakPolarHBondContact O-CB 3.25Å; E57-L61 VanDerWaalsContact O-CG 3.25Å; E57-L61 WeakPolarHBondContact O-CG 3.48Å; E57-L61 PolarHBondContact O-N 2.87Å; C59-L61 PolarHBondContact O-N 2.61Å; L61-I69 HydrophobicContact CD2-CG2 4.2Å; L61-V70 WeakPolarHBondContact CD2-O 3.38Å; L61-L72 HydrophobicContact CB-CB 3.79Å; L61-L72 HydrophobicContact CB-CD2 4.15Å; L61-L72 HydrophobicContact CD1-CB 4.29Å; L61-F165 HydrophobicContact CD2-CD2 3.48Å; L61-F165 VanDerWaalsContact CD2-CD2 3.48Å; L61-F165 HydrophobicContact CD2-CE2 3.71Å; L61-F165 HydrophobicContact CD2-CG 4.16Å; L61-F165 HydrophobicContact CG-CD2 4.16Å; L61-F165 HydrophobicContact CG-CG 4.5Å
62	K	83.4	Confident	80.1	Confident	116 Å²	116	45.3 Å²	45.3	50%	0.504	23%	0.233	S	C	.	.	H	α-helix	trans	-70.8	-37	170.9	-78.3	175	179.1	169.9	0	111.8	I58 C59 L72 H75	I58-K62 HydrophobicContact CG2-CD 3.78Å; I58-K62 VanDerWaalsContact CG2-CE 3.46Å; I58-K62 HydrophobicContact CG2-CG 4.37Å; I58-K62 WeakPolarHBondContact O-CB 3.45Å; I58-K62 VanDerWaalsContact O-CG 3.28Å; I58-K62 WeakPolarHBondContact O-CG 3.27Å; I58-K62 PolarHBondContact O-N 3.12Å; C59-K62 PolarHBondContact O-N 3.01Å; K62-L72 HydrophobicContact CG-CD2 4.28Å; K62-H75 PolarHBondContact NZ-CE1 3.48Å; K62-H75 VanDerWaalsContact NZ-CE1 3.33Å; K62-H75 PolarHBondContact NZ-NE2 3.34Å
63	D	80.3	Confident	81.5	Confident	78 Å²	78	48.1 Å²	48.1	42%	0.417	24%	0.239	S	C	.	.	H	α-helix	trans	-81.9	-16.2	-178.8	-99.6	49	0	0	0	114.4	C59 V60 K126 F128	C59-D63 PolarHBondContact O-N 3.49Å; C59-D63 VanDerWaalsContact O-N 3.1Å; V60-D63 PolarHBondContact O-N 2.97Å; D63-K126 WeakPolarHBondContact O-CE 3.44Å; D63-K126 IonicContact OD2-NZ 3.2Å; D63-K126 PolarHBondContact OD2-NZ 3.11Å; D63-F128 HydrophobicContact CB-CE2 4.01Å; D63-F128 HydrophobicContact CB-CZ 4.36Å
64	L	80.9	Confident	82.9	Confident	7 Å²	7	49.1 Å²	49.1	4%	0.037	25%	0.245	C	C	.	.			trans	-114.4	68.6	-175.3	-67.6	177.3	0	0	0	113.5	V60 H66 I69 M123 K126 F128 F165	V60-L64 HydrophobicContact CG1-CD1 3.59Å; V60-L64 HydrophobicContact CG1-CG 4.49Å; V60-L64 VanDerWaalsContact O-CB 3.27Å; V60-L64 WeakPolarHBondContact O-CB 3.48Å; V60-L64 VanDerWaalsContact O-CG 3.29Å; V60-L64 WeakPolarHBondContact O-CG 3.26Å; V60-L64 PolarHBondContact O-N 3.25Å; V60-L64 VanDerWaalsContact O-N 3.08Å; L64-H66 PolarHBondContact O-N 3.1Å; L64-I69 HydrophobicContact CB-CD1 4.05Å; L64-I69 HydrophobicContact CD1-CD1 4.03Å; L64-I69 HydrophobicContact CG-CD1 4.46Å; L64-M123 HydrophobicContact CD1-CG 3.79Å; L64-K126 HydrophobicContact CD2-CB 4.21Å; L64-K126 HydrophobicContact CD2-CG 3.94Å; L64-F128 HydrophobicContact CD1-CD2 3.82Å; L64-F128 HydrophobicContact CD1-CE2 4.42Å; L64-F128 HydrophobicContact CD2-CD2 4.11Å; L64-F128 HydrophobicContact CG-CD2 3.96Å; L64-F128 HydrophobicContact CG-CE2 4.19Å; L64-F165 HydrophobicContact CD1-CE1 4.16Å
65	N	83.6	Confident	83.9	Confident	126 Å²	126	52 Å²	52	67%	0.674	26%	0.258	S	S	*	.			trans	-79.4	96.7	162.9	-175.4	17	0	0	0	110.2	R71	N65-R71 PolarHBondContact OD1-NE 3.46Å; N65-R71 VanDerWaalsContact OD1-NE 3.15Å
66	H	90.9	Very high	84.6	Confident	36 Å²	36	50.3 Å²	50.3	17%	0.167	25%	0.246	C	C	.	.			trans	-135.3	151.5	178.4	-178	-97.6	0	0	0	110.3	L64 N68 I69 S118 A119 A122	L64-H66 PolarHBondContact O-N 3.1Å; H66-N68 VanDerWaalsContact C-N 3.35Å; H66-N68 PolarHBondContact ND1-N 3.48Å; H66-N68 PolarHBondContact O-N 3Å; H66-I69 HydrophobicContact CB-CB 4.2Å; H66-I69 HydrophobicContact CB-CD1 3.99Å; H66-I69 HydrophobicContact CB-CG1 4.06Å; H66-I69 PolarHBondContact O-N 3Å; H66-S118 VanDerWaalsContact CE1-C 3.43Å; H66-S118 PolarHBondContact CE1-OG 3.01Å; H66-S118 PolarHBondContact NE2-OG 2.97Å; H66-A119 PolarHBondContact CE1-N 3.48Å; H66-A122 HydrophobicContact CB-CB 4.32Å
67	E	91.2	Very high	85	Confident	127 Å²	127	53.2 Å²	53.2	59%	0.593	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-44.6	-177.5	-173.5	178.3	155.5	0	0	112	I69 K161	E67-I69 VanDerWaalsContact C-N 3.28Å; E67-I69 PolarHBondContact O-N 3.23Å; E67-K161 PolarHBondContact O-NZ 2.72Å
68	N	93.6	Very high	84.8	Confident	10 Å²	10	55.6 Å²	55.6	5%	0.053	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	25	-178.8	-54.6	115.3	0	0	0	114.3	H66 Q115 A119 F160 K161 L162	H66-N68 VanDerWaalsContact C-N 3.35Å; H66-N68 PolarHBondContact ND1-N 3.48Å; H66-N68 PolarHBondContact O-N 3Å; N68-Q115 HydrophobicContact CB-CB 4.49Å; N68-Q115 WeakPolarHBondContact CB-O 3.35Å; N68-Q115 PolarHBondContact ND2-OE1 3.03Å; N68-Q115 PolarHBondContact OD1-O 2.98Å; N68-A119 HydrophobicContact CB-CB 3.88Å; N68-A119 WeakPolarHBondContact O-CB 3.32Å; N68-F160 WeakPolarHBondContact CA-O 3.49Å; N68-F160 WeakPolarHBondContact CB-O 3.28Å; N68-F160 PolarHBondContact ND2-O 3.39Å; N68-K161 WeakPolarHBondContact O-CA 3.25Å; N68-L162 PolarHBondContact O-N 3.15Å
69	I	92.3	Very high	84.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-126.5	140.6	171.9	-65.3	-177.7	0	0	0	107.7	L61 L64 H66 E67 R71 A119 M123 F165	L61-I69 HydrophobicContact CD2-CG2 4.2Å; L64-I69 HydrophobicContact CB-CD1 4.05Å; L64-I69 HydrophobicContact CD1-CD1 4.03Å; L64-I69 HydrophobicContact CG-CD1 4.46Å; H66-I69 HydrophobicContact CB-CB 4.2Å; H66-I69 HydrophobicContact CB-CD1 3.99Å; H66-I69 HydrophobicContact CB-CG1 4.06Å; H66-I69 PolarHBondContact O-N 3Å; E67-I69 VanDerWaalsContact C-N 3.28Å; E67-I69 PolarHBondContact O-N 3.23Å; I69-R71 PolarHBondContact O-N 3.28Å; I69-A119 HydrophobicContact CD1-CB 4.37Å; I69-A119 HydrophobicContact CG1-CB 3.88Å; I69-M123 HydrophobicContact CD1-CG 4.08Å; I69-F165 HydrophobicContact CD1-CZ 4.3Å; I69-F165 HydrophobicContact CG1-CZ 4.34Å; I69-F165 HydrophobicContact CG2-CE2 3.8Å; I69-F165 HydrophobicContact CG2-CZ 3.65Å
70	V	93	Very high	83.6	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.024	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-64.1	119	173.8	169.5	0	0	0	0	109.3	L61 M86 E87 L139 K161 L162 A163	L61-V70 WeakPolarHBondContact CD2-O 3.38Å; V70-M86 HydrophobicContact CG1-CB 3.88Å; V70-E87 HydrophobicContact CG1-CB 4.24Å; V70-L139 HydrophobicContact CG2-CD1 3.99Å; V70-K161 HydrophobicContact CG2-CB 3.87Å; V70-L162 WeakPolarHBondContact CG2-O 3.41Å; V70-L162 PolarHBondContact N-O 3.2Å; V70-A163 HydrophobicContact CB-CB 4.44Å; V70-A163 HydrophobicContact CG2-CB 3.76Å
71	R	92.3	Very high	83.4	Confident	99 Å²	99	60.6 Å²	60.6	37%	0.374	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-70.1	139.5	177.1	-64	178.2	176.9	135.6	2.5	111.7	N65 I69 Y73 M86 E87	N65-R71 PolarHBondContact OD1-NE 3.46Å; N65-R71 VanDerWaalsContact OD1-NE 3.15Å; I69-R71 PolarHBondContact O-N 3.28Å; R71-Y73 HydrophobicContact CB-CD1 4.19Å; R71-Y73 HydrophobicContact CB-CE1 3.79Å; R71-M86 CarbonylContact O-C 3.55Å; R71-M86 VanDerWaalsContact O-CA 3.24Å; R71-M86 WeakPolarHBondContact O-CA 3.41Å; R71-E87 HydrophobicContact CB-CB 4.23Å; R71-E87 PolarHBondContact N-OE2 2.9Å; R71-E87 PolarHBondContact O-N 3.37Å
72	L	91.7	Very high	83.2	Confident	30 Å²	30	61 Å²	61	16%	0.157	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.3	162	-177	71.7	0	0	0	108.6	L61 K62 D74 L84 M86	L61-L72 HydrophobicContact CB-CB 3.79Å; L61-L72 HydrophobicContact CB-CD2 4.15Å; L61-L72 HydrophobicContact CD1-CB 4.29Å; K62-L72 HydrophobicContact CG-CD2 4.28Å; L72-D74 WeakPolarHBondContact CD1-O 3.49Å; L72-L84 HydrophobicContact CD1-CB 3.97Å; L72-L84 HydrophobicContact CD1-CD2 3.75Å; L72-L84 HydrophobicContact CD2-CD2 4.44Å; L72-M86 HydrophobicContact CD1-CG 3.99Å
73	Y	91.5	Very high	83.4	Confident	98 Å²	98	56.4 Å²	56.4	38%	0.384	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-42.4	177.5	-59.5	-36	0	0	0	112	V36 R71 V85 E87	V36-Y73 HydrophobicContact CG1-CD2 3.89Å; V36-Y73 HydrophobicContact CG1-CE2 4.03Å; R71-Y73 HydrophobicContact CB-CD1 4.19Å; R71-Y73 HydrophobicContact CB-CE1 3.79Å; Y73-V85 PolarHBondContact N-O 3.25Å; Y73-E87 HydrophobicContact CE2-CB 4.28Å
74	D	90.6	Very high	83.8	Confident	64 Å²	64	52.7 Å²	52.7	34%	0.342	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	167.7	-179.9	-165.6	14.3	0	0	0	111.3	Y7 L72 V85	Y7-D74 HydrophobicContact CE2-CB 3.71Å; L72-D74 WeakPolarHBondContact CD1-O 3.49Å; D74-V85 HydrophobicContact CB-CB 4.15Å; D74-V85 HydrophobicContact CB-CG2 4.38Å; D74-V85 PolarHBondContact N-O 3.05Å; D74-V85 PolarHBondContact O-N 3.36Å
75	H	87.7	Confident	84.4	Confident	63 Å²	63	52.4 Å²	52.4	29%	0.292	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	138.3	179	64.8	-34.9	0	0	0	110.2	K62 Y83 L84	K62-H75 PolarHBondContact NZ-CE1 3.48Å; K62-H75 VanDerWaalsContact NZ-CE1 3.33Å; K62-H75 PolarHBondContact NZ-NE2 3.34Å; H75-Y83 CarbonylContact C-O 3.59Å; H75-Y83 VanDerWaalsContact CA-O 3.29Å; H75-Y83 WeakPolarHBondContact CA-O 3.29Å; H75-L84 HydrophobicContact CB-CD2 4.24Å
76	S	81.8	Confident	84.9	Confident	37 Å²	37	47.3 Å²	47.3	26%	0.259	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	129.3	175.7	68.5	0	0	0	0	111.6	Y83	S76-Y83 PolarHBondContact N-O 3.32Å; S76-Y83 PolarHBondContact O-N 2.99Å
77	I	77	Confident	85	Confident	122 Å²	122	46.9 Å²	46.9	63%	0.626	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.8	172.7	-62.5	165.5	0	0	0	107.2	V82	I77-V82 HydrophobicContact CB-CG1 4.46Å; I77-V82 HydrophobicContact CB-CG2 4.49Å; I77-V82 HydrophobicContact CG1-CG1 3.63Å; I77-V82 HydrophobicContact CG1-CG2 4.12Å; I77-V82 HydrophobicContact CG2-CG2 4.26Å
78	S	68.8	Low	85.2	Confident	54 Å²	54	42.8 Å²	42.8	38%	0.378	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	175.7	-174.7	86.9	0	0	0	0	114.4	S80 G81	S78-S80 PolarHBondContact O-N 3.28Å; S78-S80 VanDerWaalsContact O-N 3.16Å; S78-S80 PolarHBondContact OG-N 2.83Å; S78-S80 VanDerWaalsContact OG-N 3.14Å; S78-S80 PolarHBondContact OG-OG 3.23Å; S78-G81 PolarHBondContact N-O 3.44Å; S78-G81 PolarHBondContact O-N 3.49Å
79	S	64.5	Low	85.2	Confident	112 Å²	112	43 Å²	43	78%	0.783	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-32	-48.7	161.3	153.8	0	0	0	0	115.6	K43	K43-S79 PolarHBondContact NZ-O 2.92Å
80	S	64.8	Low	85.1	Confident	69 Å²	69	44.6 Å²	44.6	48%	0.483	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-13.4	-167.5	45.8	0	0	0	0	114.5	S78 Y83	S78-S80 PolarHBondContact O-N 3.28Å; S78-S80 VanDerWaalsContact O-N 3.16Å; S78-S80 PolarHBondContact OG-N 2.83Å; S78-S80 VanDerWaalsContact OG-N 3.14Å; S78-S80 PolarHBondContact OG-OG 3.23Å; S80-Y83 PolarHBondContact OG-OH 3.47Å
81	G	69.7	Low	84.9	Confident	11 Å²	11	44.8 Å²	44.8	11%	0.113	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.2	-158.5	-178.2	0	0	0	0	0	112.2	S78	S78-G81 PolarHBondContact N-O 3.44Å; S78-G81 PolarHBondContact O-N 3.49Å
82	V	78.3	Confident	84.7	Confident	18 Å²	18	41.3 Å²	41.3	11%	0.109	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.6	170.8	-166.8	0	0	0	0	109.6	I40 M41 L54 I77	I40-V82 WeakPolarHBondContact CA-O 3.27Å; M41-V82 HydrophobicContact CG-CB 4.4Å; M41-V82 PolarHBondContact N-O 2.92Å; L54-V82 HydrophobicContact CD1-CB 3.73Å; L54-V82 HydrophobicContact CD1-CG1 3.58Å; L54-V82 HydrophobicContact CD2-CB 4.25Å; L54-V82 HydrophobicContact CD2-CG1 3.65Å; L54-V82 HydrophobicContact CD2-CG2 4.41Å; L54-V82 HydrophobicContact CG-CG1 4.27Å; I77-V82 HydrophobicContact CB-CG1 4.46Å; I77-V82 HydrophobicContact CB-CG2 4.49Å; I77-V82 HydrophobicContact CG1-CG1 3.63Å; I77-V82 HydrophobicContact CG1-CG2 4.12Å; I77-V82 HydrophobicContact CG2-CG2 4.26Å
83	Y	86.9	Confident	84.8	Confident	20 Å²	20	41.6 Å²	41.6	8%	0.078	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.1	-172	-56.9	-111.4	0	0	0	108.8	L4 I38 K39 I40 H75 S76 S80	L4-Y83 HydrophobicContact CD1-CD1 3.55Å; L4-Y83 HydrophobicContact CD1-CD2 4.09Å; L4-Y83 HydrophobicContact CD1-CE1 3.87Å; L4-Y83 HydrophobicContact CD1-CE2 4.42Å; L4-Y83 HydrophobicContact CD1-CG 3.69Å; L4-Y83 HydrophobicContact CD2-CD1 3.83Å; L4-Y83 HydrophobicContact CD2-CG 3.99Å; L4-Y83 HydrophobicContact CG-CD1 4.33Å; I38-Y83 HydrophobicContact CG2-CD1 4.21Å; K39-Y83 CarbonylContact O-C 3.42Å; K39-Y83 WeakPolarHBondContact O-CA 3.3Å; I40-Y83 HydrophobicContact CB-CD1 4.46Å; I40-Y83 HydrophobicContact CD1-CD1 3.8Å; I40-Y83 HydrophobicContact CD1-CE1 3.57Å; I40-Y83 HydrophobicContact CG1-CD1 3.67Å; I40-Y83 HydrophobicContact CG1-CE1 3.91Å; I40-Y83 HydrophobicContact CG2-CD1 4.2Å; I40-Y83 HydrophobicContact CG2-CE1 3.98Å; H75-Y83 CarbonylContact C-O 3.59Å; H75-Y83 VanDerWaalsContact CA-O 3.29Å; H75-Y83 WeakPolarHBondContact CA-O 3.29Å; S76-Y83 PolarHBondContact N-O 3.32Å; S76-Y83 PolarHBondContact O-N 2.99Å; S80-Y83 PolarHBondContact OG-OH 3.47Å
84	L	89.3	Confident	84.8	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122.9	173.2	-63.8	155.7	0	0	0	107.5	I38 K39 L54 E57 I58 L72 H75 M86	I38-L84 CarbonylContact C-O 3.58Å; I38-L84 WeakPolarHBondContact CA-O 3.38Å; K39-L84 HydrophobicContact CB-CB 4.25Å; K39-L84 HydrophobicContact CB-CD1 4.49Å; K39-L84 HydrophobicContact CD-CD1 3.94Å; K39-L84 HydrophobicContact CG-CD1 4.36Å; K39-L84 PolarHBondContact N-O 2.76Å; K39-L84 PolarHBondContact O-N 3.4Å; L54-L84 HydrophobicContact CD1-CD1 3.9Å; L54-L84 HydrophobicContact CD1-CG 4.24Å; L54-L84 HydrophobicContact CG-CD1 4.49Å; E57-L84 HydrophobicContact CG-CD1 4.42Å; I58-L84 HydrophobicContact CD1-CD2 4.17Å; I58-L84 HydrophobicContact CG1-CD2 3.5Å; L72-L84 HydrophobicContact CD1-CB 3.97Å; L72-L84 HydrophobicContact CD1-CD2 3.75Å; L72-L84 HydrophobicContact CD2-CD2 4.44Å; H75-L84 HydrophobicContact CB-CD2 4.24Å; L84-M86 HydrophobicContact CB-CG 4.24Å; L84-M86 HydrophobicContact CB-SD 4.26Å
85	V	93.2	Very high	84.8	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	118.6	178.2	-174.1	0	0	0	0	108.4	L4 Y7 V36 I38 Y73 D74	L4-V85 HydrophobicContact CD2-CG2 3.78Å; Y7-V85 HydrophobicContact CD1-CG1 3.77Å; Y7-V85 HydrophobicContact CD2-CB 4.37Å; Y7-V85 HydrophobicContact CD2-CG1 3.94Å; Y7-V85 HydrophobicContact CD2-CG2 3.91Å; Y7-V85 HydrophobicContact CE1-CG1 3.74Å; Y7-V85 HydrophobicContact CE2-CB 4.27Å; Y7-V85 HydrophobicContact CE2-CG1 3.93Å; Y7-V85 HydrophobicContact CE2-CG2 4.17Å; Y7-V85 HydrophobicContact CG-CG1 3.86Å; Y7-V85 HydrophobicContact CG-CG2 4.39Å; V36-V85 HydrophobicContact CB-CG1 3.82Å; V36-V85 HydrophobicContact CG1-CG1 4.05Å; V36-V85 HydrophobicContact CG2-CG1 3.81Å; I38-V85 HydrophobicContact CD1-CG2 4.43Å; I38-V85 HydrophobicContact CG1-CG2 4.43Å; Y73-V85 PolarHBondContact N-O 3.25Å; D74-V85 HydrophobicContact CB-CB 4.15Å; D74-V85 HydrophobicContact CB-CG2 4.38Å; D74-V85 PolarHBondContact N-O 3.05Å; D74-V85 PolarHBondContact O-N 3.36Å
86	M	94	Very high	84.9	Confident	19 Å²	19	38.3 Å²	38.3	9%	0.094	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	166.5	-163.7	-54.3	179.1	-56.1	0	0	112	V36 A37 K39 V70 R71 L72 L84 Y88	V36-M86 CarbonylContact C-O 3.5Å; V36-M86 WeakPolarHBondContact CA-O 3.46Å; V36-M86 WeakPolarHBondContact CB-O 3.17Å; A37-M86 HydrophobicContact CB-CB 4.4Å; A37-M86 HydrophobicContact CB-CE 4.24Å; A37-M86 PolarHBondContact N-O 3.04Å; A37-M86 PolarHBondContact O-N 3.48Å; K39-M86 HydrophobicContact CB-CE 3.6Å; K39-M86 HydrophobicContact CB-SD 4.43Å; K39-M86 HydrophobicContact CD-CE 4.29Å; V70-M86 HydrophobicContact CG1-CB 3.88Å; R71-M86 CarbonylContact O-C 3.55Å; R71-M86 VanDerWaalsContact O-CA 3.24Å; R71-M86 WeakPolarHBondContact O-CA 3.41Å; L72-M86 HydrophobicContact CD1-CG 3.99Å; L84-M86 HydrophobicContact CB-CG 4.24Å; L84-M86 HydrophobicContact CB-SD 4.26Å; M86-Y88 PolarHBondContact O-N 3.03Å
87	E	93.7	Very high	85.3	Confident	27 Å²	27	36.9 Å²	36.9	13%	0.126	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	124	173.6	-176.2	173.1	-155.6	0	0	112.6	V70 R71 Y73 C89 K161	V70-E87 HydrophobicContact CG1-CB 4.24Å; R71-E87 HydrophobicContact CB-CB 4.23Å; R71-E87 PolarHBondContact N-OE2 2.9Å; R71-E87 PolarHBondContact O-N 3.37Å; Y73-E87 HydrophobicContact CE2-CB 4.28Å; E87-C89 PolarHBondContact O-N 3.49Å; E87-K161 VanDerWaalsContact CD-CE 3.43Å; E87-K161 WeakPolarHBondContact OE1-CE 3.29Å; E87-K161 IonicContact OE1-NZ 2.68Å; E87-K161 PolarHBondContact OE1-NZ 3.01Å; E87-K161 WeakPolarHBondContact OE2-CE 3.43Å; E87-K161 IonicContact OE2-NZ 2.7Å; E87-K161 PolarHBondContact OE2-NZ 3.43Å
88	Y	94.3	Very high	85.9	Confident	41 Å²	41	31.6 Å²	31.6	16%	0.161	19%	0.193	C	C	.	.			trans	-79.3	108	177.1	175.7	-112.7	0	0	0	111.7	L15 K25 P35 M86 N90	L15-Y88 HydrophobicContact CD1-CD2 3.77Å; L15-Y88 HydrophobicContact CD1-CE2 3.66Å; L15-Y88 HydrophobicContact CD2-CE2 3.88Å; L15-Y88 HydrophobicContact CG-CE2 4.45Å; K25-Y88 HydrophobicContact CD-CE2 3.99Å; K25-Y88 HydrophobicContact CG-CD2 4.34Å; K25-Y88 HydrophobicContact CG-CE2 4.08Å; K25-Y88 PolarHBondContact NZ-OH 3.49Å; P35-Y88 HydrophobicContact CB-CD1 3.78Å; P35-Y88 HydrophobicContact CB-CE1 4.43Å; P35-Y88 HydrophobicContact CB-CG 4.07Å; P35-Y88 HydrophobicContact CG-CD1 3.61Å; P35-Y88 HydrophobicContact CG-CE1 4.29Å; P35-Y88 HydrophobicContact CG-CG 4.29Å; P35-Y88 WeakPolarHBondContact O-CB 3.32Å; M86-Y88 PolarHBondContact O-N 3.03Å; Y88-N90 HydrophobicContact CD1-CB 4.27Å; Y88-N90 HydrophobicContact CE1-CB 3.78Å
89	C	93.2	Very high	86.9	Confident	14 Å²	14	35.5 Å²	35.5	10%	0.095	21%	0.205	C	C	.	.			trans	-82.1	117.5	172.1	-63.1	0	0	0	0	110.1	E87 L139 L140	E87-C89 PolarHBondContact O-N 3.49Å; C89-L139 HydrophobicContact CB-CB 3.59Å; C89-L139 HydrophobicContact CB-CD1 3.96Å; C89-L139 HydrophobicContact CB-CG 4.41Å; C89-L140 CarbonylContact C-O 3.56Å; C89-L140 WeakPolarHBondContact CB-O 3.43Å
90	N	89.8	Confident	88	Confident	34 Å²	34	33.2 Å²	33.2	18%	0.182	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-4.6	-167.1	58.9	-53.5	0	0	0	115.7	Y88 L140 S141 H142	Y88-N90 HydrophobicContact CD1-CB 4.27Å; Y88-N90 HydrophobicContact CE1-CB 3.78Å; N90-L140 PolarHBondContact N-O 3Å; N90-S141 VanDerWaalsContact OD1-CA 3.31Å; N90-S141 WeakPolarHBondContact OD1-CA 3.38Å; N90-S141 WeakPolarHBondContact OD1-CB 3.36Å; N90-S141 PolarHBondContact OD1-OG 2.93Å; N90-H142 PolarHBondContact ND2-CD2 2.92Å; N90-H142 VanDerWaalsContact ND2-CD2 3.32Å; N90-H142 PolarHBondContact ND2-CE1 2.94Å; N90-H142 VanDerWaalsContact ND2-CE1 3.27Å; N90-H142 PolarHBondContact ND2-ND1 3.22Å; N90-H142 PolarHBondContact ND2-NE2 3.1Å; N90-H142 VanDerWaalsContact ND2-NE2 3.18Å; N90-H142 PolarHBondContact ND2-O 2.63Å; N90-H142 PolarHBondContact OD1-N 3.29Å; N90-H142 VanDerWaalsContact OD1-N 3.16Å; N90-H142 PolarHBondContact OD1-O 3.41Å
91	G	88.8	Confident	89.2	Confident	7 Å²	7	33.7 Å²	33.7	7%	0.072	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	6.4	-179.5	0	0	0	0	0	115.5	L140	G91-L140 WeakPolarHBondContact CA-O 3.41Å; G91-L140 PolarHBondContact N-O 3.07Å
92	G	90	Very high	90.2	Very high	27 Å²	27	42.2 Å²	42.2	28%	0.278	22%	0.215	S	C	.	.			trans	76.9	-151.7	-173	0	0	0	0	0	112.5	L140	G92-L140 PolarHBondContact O-N 3.46Å
93	D	91.9	Very high	90.9	Very high	35 Å²	35	44.7 Å²	44.7	19%	0.187	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-111.7	167.4	177.1	79.6	35.3	0	0	0	113.5	S95 E96 Y97 G136 I138 L139	D93-S95 VanDerWaalsContact C-N 3.28Å; D93-S95 PolarHBondContact O-N 2.84Å; D93-S95 WeakPolarHBondContact OD1-CA 3.27Å; D93-S95 WeakPolarHBondContact OD1-CB 3.29Å; D93-S95 PolarHBondContact OD1-N 2.98Å; D93-E96 PolarHBondContact O-N 2.97Å; D93-E96 PolarHBondContact OD1-N 3.44Å; D93-Y97 WeakPolarHBondContact O-CB 3.26Å; D93-Y97 PolarHBondContact O-N 3.03Å; D93-Y97 VanDerWaalsContact O-N 3.09Å; D93-G136 WeakPolarHBondContact OD2-CA 3.22Å; D93-I138 CarbonylContact C-O 3.51Å; D93-I138 WeakPolarHBondContact CA-O 3.39Å; D93-L139 HydrophobicContact CB-CD2 3.8Å
94	L	91.6	Very high	91.1	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-68.5	-23.5	179.3	-179	63.5	0	0	0	112.9	Y97 L98 L104 F112 P135 I138 F160 I209	L94-Y97 HydrophobicContact CD1-CD1 4.28Å; L94-L98 HydrophobicContact CD1-CD1 4.18Å; L94-L98 HydrophobicContact CD1-CD2 4.49Å; L94-L98 HydrophobicContact CD1-CG 3.94Å; L94-L98 HydrophobicContact CD2-CD1 4.5Å; L94-L98 HydrophobicContact CG-CD1 3.93Å; L94-L98 HydrophobicContact CG-CG 4.16Å; L94-L98 VanDerWaalsContact O-CB 3.24Å; L94-L98 WeakPolarHBondContact O-CB 3.47Å; L94-L98 WeakPolarHBondContact O-CG 3.2Å; L94-L98 PolarHBondContact O-N 3.42Å; L94-L104 HydrophobicContact CD1-CD1 4.47Å; L94-F112 HydrophobicContact CD1-CD2 4.29Å; L94-F112 HydrophobicContact CD1-CE2 3.89Å; L94-P135 HydrophobicContact CB-CB 4.09Å; L94-P135 WeakPolarHBondContact CB-O 3.46Å; L94-P135 HydrophobicContact CD2-CB 4.38Å; L94-P135 HydrophobicContact CG-CB 4.15Å; L94-P135 PolarHBondContact N-O 3.19Å; L94-I138 HydrophobicContact CB-CB 4.05Å; L94-I138 HydrophobicContact CB-CG2 4.07Å; L94-I138 HydrophobicContact CD2-CB 4.38Å; L94-I138 HydrophobicContact CD2-CD1 4.07Å; L94-I138 HydrophobicContact CD2-CG2 4.18Å; L94-I138 PolarHBondContact N-O 3.4Å; L94-F160 HydrophobicContact CD1-CE1 4.12Å; L94-F160 HydrophobicContact CD1-CZ 4.2Å; L94-F160 HydrophobicContact CD2-CE1 4.28Å; L94-I209 HydrophobicContact CD2-CG2 3.69Å
95	S	90.9	Very high	91.2	Very high	37 Å²	37	48 Å²	48	26%	0.259	25%	0.254	S	S	.	.	H	α-helix	trans	-66	-50.7	173.6	-165.8	0	0	0	0	111.1	D93 L98 Q99	D93-S95 VanDerWaalsContact C-N 3.28Å; D93-S95 PolarHBondContact O-N 2.84Å; D93-S95 WeakPolarHBondContact OD1-CA 3.27Å; D93-S95 WeakPolarHBondContact OD1-CB 3.29Å; D93-S95 PolarHBondContact OD1-N 2.98Å; S95-L98 PolarHBondContact O-N 3.06Å; S95-Q99 VanDerWaalsContact O-CG 3.31Å; S95-Q99 WeakPolarHBondContact O-CG 3.43Å; S95-Q99 PolarHBondContact O-N 3.49Å; S95-Q99 PolarHBondContact OG-NE2 3.41Å
96	E	89.5	Confident	91.3	Very high	119 Å²	119	49.6 Å²	49.6	56%	0.556	26%	0.261	S	S	*	.	H	α-helix	trans	-61.4	-44.9	176.1	-65	-170.3	136.9	0	0	111.2	D93 L98 Q99 A100	D93-E96 PolarHBondContact O-N 2.97Å; D93-E96 PolarHBondContact OD1-N 3.44Å; E96-L98 PolarHBondContact O-N 3.08Å; E96-Q99 PolarHBondContact O-N 2.86Å; E96-A100 PolarHBondContact O-N 3.44Å
97	Y	90.6	Very high	91	Very high	6 Å²	6	52 Å²	52	2%	0.024	28%	0.275	C	S	.	.	H	α-helix	trans	-62.2	-40.5	177.8	-170.8	-103.5	0	0	0	112.4	D93 L94 A100 K101 L104 F112 L140 V150 L158	D93-Y97 WeakPolarHBondContact O-CB 3.26Å; D93-Y97 PolarHBondContact O-N 3.03Å; D93-Y97 VanDerWaalsContact O-N 3.09Å; L94-Y97 HydrophobicContact CD1-CD1 4.28Å; Y97-A100 PolarHBondContact O-N 2.99Å; Y97-K101 HydrophobicContact CD1-CG 4.26Å; Y97-K101 HydrophobicContact CE1-CG 3.94Å; Y97-K101 HydrophobicContact CE2-CG 4.2Å; Y97-K101 VanDerWaalsContact O-CB 3.26Å; Y97-K101 WeakPolarHBondContact O-CB 3.47Å; Y97-K101 WeakPolarHBondContact O-CG 3.4Å; Y97-K101 PolarHBondContact O-N 3.45Å; Y97-K101 WeakPolarHBondContact OH-CE 2.86Å; Y97-L104 HydrophobicContact CD1-CD1 4.45Å; Y97-L104 HydrophobicContact CD1-CD2 4.16Å; Y97-L104 HydrophobicContact CE1-CD1 4.23Å; Y97-L104 HydrophobicContact CE1-CD2 3.61Å; Y97-F112 HydrophobicContact CE1-CE2 4.4Å; Y97-F112 HydrophobicContact CE1-CZ 4.08Å; Y97-L140 HydrophobicContact CD1-CD1 4.4Å; Y97-L140 HydrophobicContact CD2-CD1 3.93Å; Y97-L140 HydrophobicContact CG-CD1 3.72Å; Y97-V150 HydrophobicContact CD2-CG1 4.35Å; Y97-V150 HydrophobicContact CD2-CG2 4.17Å; Y97-V150 HydrophobicContact CE2-CG2 4.25Å; Y97-L158 HydrophobicContact CE1-CD1 4.21Å; Y97-L158 HydrophobicContact CE2-CD1 3.82Å
98	L	90.3	Very high	90.9	Very high	11 Å²	11	51.4 Å²	51.4	6%	0.058	27%	0.273	C	S	.	.	H	α-helix	trans	-70.7	-36.3	174.7	-73.8	174.6	0	0	0	113	L94 S95 E96 A100 K101 R102 L104 Q212 C213	L94-L98 HydrophobicContact CD1-CD1 4.18Å; L94-L98 HydrophobicContact CD1-CD2 4.49Å; L94-L98 HydrophobicContact CD1-CG 3.94Å; L94-L98 HydrophobicContact CD2-CD1 4.5Å; L94-L98 HydrophobicContact CG-CD1 3.93Å; L94-L98 HydrophobicContact CG-CG 4.16Å; L94-L98 VanDerWaalsContact O-CB 3.24Å; L94-L98 WeakPolarHBondContact O-CB 3.47Å; L94-L98 WeakPolarHBondContact O-CG 3.2Å; L94-L98 PolarHBondContact O-N 3.42Å; S95-L98 PolarHBondContact O-N 3.06Å; E96-L98 PolarHBondContact O-N 3.08Å; L98-A100 VanDerWaalsContact C-N 3.3Å; L98-A100 PolarHBondContact O-N 3.24Å; L98-K101 PolarHBondContact O-N 3.18Å; L98-R102 VanDerWaalsContact O-CA 3.25Å; L98-R102 WeakPolarHBondContact O-CA 3.26Å; L98-R102 PolarHBondContact O-N 3.43Å; L98-L104 HydrophobicContact CD2-CD1 3.71Å; L98-L104 HydrophobicContact CD2-CD2 4.35Å; L98-L104 HydrophobicContact CD2-CG 3.73Å; L98-Q212 HydrophobicContact CD1-CG 4.28Å; L98-C213 HydrophobicContact CD2-CB 4.29Å
99	Q	89.2	Confident	90.8	Very high	136 Å²	136	49.5 Å²	49.5	64%	0.636	27%	0.265	S	S	*	.	H	α-helix	trans	-60.1	-42.6	173.1	-75.3	175.3	54.7	0	0	111.3	S95 E96	S95-Q99 VanDerWaalsContact O-CG 3.31Å; S95-Q99 WeakPolarHBondContact O-CG 3.43Å; S95-Q99 PolarHBondContact O-N 3.49Å; S95-Q99 PolarHBondContact OG-NE2 3.41Å; E96-Q99 PolarHBondContact O-N 2.86Å
100	A	88.3	Confident	90.8	Very high	65 Å²	65	49.7 Å²	49.7	54%	0.537	26%	0.264	S	S	.	.	H	α-helix	trans	-74.8	-38.4	178.2	0	0	0	0	0	113.8	E96 Y97 L98 T151	E96-A100 PolarHBondContact O-N 3.44Å; Y97-A100 PolarHBondContact O-N 2.99Å; L98-A100 VanDerWaalsContact C-N 3.3Å; L98-A100 PolarHBondContact O-N 3.24Å; A100-T151 HydrophobicContact CB-CG2 3.53Å
101	K	88.9	Confident	90.8	Very high	79 Å²	79	50.3 Å²	50.3	34%	0.343	27%	0.266	S	S	.	.	H	α-helix	trans	-84.3	-21.8	-179.1	-75.5	-75.1	-177.8	179.2	0	114.9	Y97 L98 T103 L104 T151	Y97-K101 HydrophobicContact CD1-CG 4.26Å; Y97-K101 HydrophobicContact CE1-CG 3.94Å; Y97-K101 HydrophobicContact CE2-CG 4.2Å; Y97-K101 VanDerWaalsContact O-CB 3.26Å; Y97-K101 WeakPolarHBondContact O-CB 3.47Å; Y97-K101 WeakPolarHBondContact O-CG 3.4Å; Y97-K101 PolarHBondContact O-N 3.45Å; Y97-K101 WeakPolarHBondContact OH-CE 2.86Å; L98-K101 PolarHBondContact O-N 3.18Å; K101-T103 PolarHBondContact O-N 3.04Å; K101-L104 HydrophobicContact CB-CD2 3.71Å; K101-L104 HydrophobicContact CD-CD2 4.47Å; K101-L104 HydrophobicContact CG-CD2 3.89Å; K101-T151 WeakPolarHBondContact CE-O 3.39Å; K101-T151 PolarHBondContact NZ-O 3.17Å
102	R	91	Very high	90.9	Very high	189 Å²	189	50.2 Å²	50.2	71%	0.713	26%	0.263	S	S	*	.	S	Bend	trans	62.4	-50.4	-166.1	-53.9	-60.6	-175.7	111.2	0.3	115	L98 G216	L98-R102 VanDerWaalsContact O-CA 3.25Å; L98-R102 WeakPolarHBondContact O-CA 3.26Å; L98-R102 PolarHBondContact O-N 3.43Å; R102-G216 WeakPolarHBondContact O-CA 3.28Å
103	T	93	Very high	90.9	Very high	71 Å²	71	49.1 Å²	49.1	44%	0.436	25%	0.251	S	S	.	.	S	Bend	trans	-149.9	152.8	-176.3	48.8	0	0	0	0	110.4	K101 C213 L214	K101-T103 PolarHBondContact O-N 3.04Å; T103-C213 CarbonylContact C-O 3.58Å; T103-C213 WeakPolarHBondContact CA-O 3.49Å; T103-L214 WeakPolarHBondContact CG2-O 3.49Å
104	L	91.8	Very high	90.9	Very high	10 Å²	10	51.3 Å²	51.3	5%	0.052	26%	0.262	C	S	.	.			trans	-116.4	144.6	-178.4	-55.4	-177.8	0	0	0	111.3	L94 Y97 L98 K101 T108 I109 F112 C213	L94-L104 HydrophobicContact CD1-CD1 4.47Å; Y97-L104 HydrophobicContact CD1-CD1 4.45Å; Y97-L104 HydrophobicContact CD1-CD2 4.16Å; Y97-L104 HydrophobicContact CE1-CD1 4.23Å; Y97-L104 HydrophobicContact CE1-CD2 3.61Å; L98-L104 HydrophobicContact CD2-CD1 3.71Å; L98-L104 HydrophobicContact CD2-CD2 4.35Å; L98-L104 HydrophobicContact CD2-CG 3.73Å; K101-L104 HydrophobicContact CB-CD2 3.71Å; K101-L104 HydrophobicContact CD-CD2 4.47Å; K101-L104 HydrophobicContact CG-CD2 3.89Å; L104-T108 HydrophobicContact CB-CG2 4.29Å; L104-T108 HydrophobicContact CD1-CG2 4.19Å; L104-I109 HydrophobicContact CB-CD1 4.29Å; L104-I109 HydrophobicContact CB-CG1 3.92Å; L104-I109 WeakPolarHBondContact O-CD1 3.35Å; L104-F112 HydrophobicContact CD1-CD2 4Å; L104-F112 HydrophobicContact CD1-CE2 3.31Å; L104-F112 HydrophobicContact CD1-CZ 4.11Å; L104-C213 HydrophobicContact CB-CB 4.48Å; L104-C213 HydrophobicContact CD1-CB 4.05Å; L104-C213 HydrophobicContact CG-CB 4.43Å; L104-C213 PolarHBondContact N-O 2.78Å
105	P	92.1	Very high	90.9	Very high	79 Å²	79	52 Å²	52	51%	0.513	27%	0.265	S	S	.	.			trans	-71.1	153.7	175.1	31.2	-35	0	0	0	110.9	D107 T108 I109	P105-D107 PolarHBondContact O-N 2.98Å; P105-D107 VanDerWaalsContact O-N 3.14Å; P105-T108 WeakPolarHBondContact CG-OG1 3.38Å; P105-T108 WeakPolarHBondContact O-CB 3.4Å; P105-T108 PolarHBondContact O-N 3.08Å; P105-I109 PolarHBondContact O-N 3.08Å
106	E	93.4	Very high	90.7	Very high	35 Å²	35	50.8 Å²	50.8	16%	0.164	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-30.6	-173.2	-67.1	-162.3	-158.9	0	0	114.2	I109 R110 T246 S247 L250 F276	E106-I109 PolarHBondContact O-N 3.16Å; E106-R110 WeakPolarHBondContact O-CB 3.43Å; E106-R110 PolarHBondContact O-N 3.08Å; E106-T246 WeakPolarHBondContact OE1-CA 3.46Å; E106-S247 PolarHBondContact OE1-N 3.37Å; E106-S247 WeakPolarHBondContact OE2-CB 3.44Å; E106-S247 PolarHBondContact OE2-OG 3.47Å; E106-L250 HydrophobicContact CB-CD2 4.47Å; E106-L250 HydrophobicContact CG-CD2 3.68Å; E106-L250 WeakPolarHBondContact OE2-CB 3.29Å; E106-F276 HydrophobicContact CB-CE2 4.33Å; E106-F276 HydrophobicContact CB-CZ 4.37Å
107	D	89.7	Confident	90.6	Very high	70 Å²	70	45.1 Å²	45.1	37%	0.374	23%	0.23	S	C	.	.	H	α-helix	trans	-69.9	-35.7	178.1	-57	-51.8	0	0	0	112.4	P105 R110 H111	P105-D107 PolarHBondContact O-N 2.98Å; P105-D107 VanDerWaalsContact O-N 3.14Å; D107-R110 IonicContact OD1-CZ 2.96Å; D107-R110 VanDerWaalsContact OD1-CZ 3.26Å; D107-R110 IonicContact OD1-NH1 2.74Å; D107-R110 PolarHBondContact OD1-NH1 3.23Å; D107-R110 IonicContact OD1-NH2 3.09Å; D107-R110 PolarHBondContact OD1-NH2 2.65Å; D107-H111 WeakPolarHBondContact O-CB 3.32Å; D107-H111 PolarHBondContact O-N 3.41Å
108	T	90.9	Very high	90.6	Very high	13 Å²	13	46.9 Å²	46.9	8%	0.08	24%	0.243	C	C	.	.	H	α-helix	trans	-66.1	-45	169.6	-64.6	0	0	0	0	110.2	L104 P105 R110 H111 F112	L104-T108 HydrophobicContact CB-CG2 4.29Å; L104-T108 HydrophobicContact CD1-CG2 4.19Å; P105-T108 WeakPolarHBondContact CG-OG1 3.38Å; P105-T108 WeakPolarHBondContact O-CB 3.4Å; P105-T108 PolarHBondContact O-N 3.08Å; T108-R110 VanDerWaalsContact C-N 3.3Å; T108-R110 PolarHBondContact O-N 2.8Å; T108-H111 PolarHBondContact O-N 2.92Å; T108-F112 HydrophobicContact CG2-CD1 4.02Å; T108-F112 HydrophobicContact CG2-CD2 4.32Å; T108-F112 HydrophobicContact CG2-CE1 3.36Å; T108-F112 HydrophobicContact CG2-CE2 3.74Å; T108-F112 HydrophobicContact CG2-CG 4.46Å; T108-F112 HydrophobicContact CG2-CZ 3.2Å; T108-F112 WeakPolarHBondContact O-CD1 3.44Å; T108-F112 VanDerWaalsContact O-CG 3.26Å; T108-F112 WeakPolarHBondContact O-CG 3.42Å; T108-F112 PolarHBondContact O-N 3.04Å
109	I	92.8	Very high	90.5	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-40.2	177.3	-67.2	176	0	0	0	111.2	L104 P105 E106 F112 L113 V210 C213 L214 L250 F276	L104-I109 HydrophobicContact CB-CD1 4.29Å; L104-I109 HydrophobicContact CB-CG1 3.92Å; L104-I109 WeakPolarHBondContact O-CD1 3.35Å; P105-I109 PolarHBondContact O-N 3.08Å; E106-I109 PolarHBondContact O-N 3.16Å; I109-F112 PolarHBondContact O-N 3.19Å; I109-L113 HydrophobicContact CG2-CD1 4.1Å; I109-L113 WeakPolarHBondContact O-CB 3.44Å; I109-L113 PolarHBondContact O-N 3.26Å; I109-V210 HydrophobicContact CG2-CG1 3.85Å; I109-C213 HydrophobicContact CD1-CB 3.87Å; I109-C213 HydrophobicContact CG1-CB 3.86Å; I109-L214 HydrophobicContact CD1-CB 4Å; I109-L214 HydrophobicContact CD1-CD1 4.35Å; I109-L250 HydrophobicContact CD1-CD2 4.47Å; I109-L250 HydrophobicContact CG2-CD1 4.36Å; I109-L250 HydrophobicContact CG2-CD2 4.38Å; I109-F276 HydrophobicContact CG2-CE1 4.37Å; I109-F276 HydrophobicContact CG2-CZ 4.42Å
110	R	92.6	Very high	90.3	Very high	17 Å²	17	40.1 Å²	40.1	6%	0.064	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-47.2	174.8	-167.6	-173	-52.4	106.4	14.6	111.8	E106 D107 T108 F112 L113 I114 F276 Q279	E106-R110 WeakPolarHBondContact O-CB 3.43Å; E106-R110 PolarHBondContact O-N 3.08Å; D107-R110 IonicContact OD1-CZ 2.96Å; D107-R110 VanDerWaalsContact OD1-CZ 3.26Å; D107-R110 IonicContact OD1-NH1 2.74Å; D107-R110 PolarHBondContact OD1-NH1 3.23Å; D107-R110 IonicContact OD1-NH2 3.09Å; D107-R110 PolarHBondContact OD1-NH2 2.65Å; T108-R110 VanDerWaalsContact C-N 3.3Å; T108-R110 PolarHBondContact O-N 2.8Å; R110-F112 VanDerWaalsContact C-N 3.29Å; R110-F112 PolarHBondContact O-N 3.05Å; R110-L113 PolarHBondContact O-N 2.67Å; R110-I114 HydrophobicContact CG-CD1 4.09Å; R110-I114 VanDerWaalsContact O-CG1 3.32Å; R110-I114 WeakPolarHBondContact O-CG1 3.26Å; R110-I114 PolarHBondContact O-N 3.2Å; R110-F276 HydrophobicContact CB-CE1 3.73Å; R110-F276 HydrophobicContact CB-CZ 3.77Å; R110-F276 WeakPolarHBondContact CD-O 3.36Å; R110-F276 HydrophobicContact CG-CD1 4.34Å; R110-F276 HydrophobicContact CG-CE1 4.03Å; R110-F276 HydrophobicContact CG-CZ 4.33Å; R110-F276 WeakPolarHBondContact CG-O 3.23Å; R110-F276 PolarHBondContact NE-O 2.79Å; R110-Q279 WeakPolarHBondContact CD-O 3.43Å; R110-Q279 PolarHBondContact NE-O 3.48Å
111	H	90.2	Very high	90	Very high	47 Å²	47	38.6 Å²	38.6	22%	0.218	19%	0.194	C	C	.	.	H	α-helix	trans	-60.4	-38.9	178	-174.1	72.6	0	0	0	112.2	D107 T108 Q115 G155 Y156 L158	D107-H111 WeakPolarHBondContact O-CB 3.32Å; D107-H111 PolarHBondContact O-N 3.41Å; T108-H111 PolarHBondContact O-N 2.92Å; H111-Q115 PolarHBondContact CD2-NE2 2.73Å; H111-Q115 PolarHBondContact NE2-NE2 3.17Å; H111-Q115 WeakPolarHBondContact O-CG 3.48Å; H111-Q115 PolarHBondContact O-N 2.95Å; H111-Q115 PolarHBondContact O-NE2 2.66Å; H111-G155 PolarHBondContact CD2-O 2.97Å; H111-Y156 PolarHBondContact NE2-O 3.05Å; H111-L158 PolarHBondContact NE2-O 2.87Å
112	F	90	Very high	89.9	Confident	6 Å²	6	35.5 Å²	35.5	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-69.2	-43.9	175.7	-63.9	4.4	0	0	0	111.2	L94 Y97 L104 T108 I109 R110 I114 Q115 I116 G155 L158 F160	L94-F112 HydrophobicContact CD1-CD2 4.29Å; L94-F112 HydrophobicContact CD1-CE2 3.89Å; Y97-F112 HydrophobicContact CE1-CE2 4.4Å; Y97-F112 HydrophobicContact CE1-CZ 4.08Å; L104-F112 HydrophobicContact CD1-CD2 4Å; L104-F112 HydrophobicContact CD1-CE2 3.31Å; L104-F112 HydrophobicContact CD1-CZ 4.11Å; T108-F112 HydrophobicContact CG2-CD1 4.02Å; T108-F112 HydrophobicContact CG2-CD2 4.32Å; T108-F112 HydrophobicContact CG2-CE1 3.36Å; T108-F112 HydrophobicContact CG2-CE2 3.74Å; T108-F112 HydrophobicContact CG2-CG 4.46Å; T108-F112 HydrophobicContact CG2-CZ 3.2Å; T108-F112 WeakPolarHBondContact O-CD1 3.44Å; T108-F112 VanDerWaalsContact O-CG 3.26Å; T108-F112 WeakPolarHBondContact O-CG 3.42Å; T108-F112 PolarHBondContact O-N 3.04Å; I109-F112 PolarHBondContact O-N 3.19Å; R110-F112 VanDerWaalsContact C-N 3.29Å; R110-F112 PolarHBondContact O-N 3.05Å; F112-I114 VanDerWaalsContact C-N 3.35Å; F112-I114 PolarHBondContact O-N 3.38Å; F112-Q115 PolarHBondContact O-N 3.49Å; F112-I116 WeakPolarHBondContact O-CG1 3.46Å; F112-I116 PolarHBondContact O-N 3.25Å; F112-G155 WeakPolarHBondContact CE1-O 3.16Å; F112-L158 HydrophobicContact CZ-CD1 4.38Å; F112-F160 HydrophobicContact CB-CD1 4.31Å; F112-F160 HydrophobicContact CB-CE1 4.17Å; F112-F160 HydrophobicContact CB-CZ 4.39Å; F112-F160 AromaticContact CD1-CD2 3.76Å; F112-F160 HydrophobicContact CD1-CD2 3.76Å; F112-F160 HydrophobicContact CD1-CE1 4.13Å; F112-F160 AromaticContact CD1-CE2 3.25Å; F112-F160 HydrophobicContact CD1-CE2 3.25Å; F112-F160 HydrophobicContact CD1-CG 4.42Å; F112-F160 AromaticContact CD1-CZ 3.49Å; F112-F160 HydrophobicContact CD1-CZ 3.49Å; F112-F160 VanDerWaalsContact CD1-CZ 3.49Å; F112-F160 HydrophobicContact CD2-CD1 4.47Å; F112-F160 AromaticContact CD2-CE1 3.56Å; F112-F160 HydrophobicContact CD2-CE1 3.56Å; F112-F160 HydrophobicContact CD2-CE2 4.01Å; F112-F160 AromaticContact CD2-CZ 3.3Å; F112-F160 HydrophobicContact CD2-CZ 3.3Å; F112-F160 AromaticContact CE1-CD2 3.98Å; F112-F160 HydrophobicContact CE1-CD2 3.98Å; F112-F160 HydrophobicContact CE1-CE1 4.41Å; F112-F160 AromaticContact CE1-CE2 3.08Å; F112-F160 HydrophobicContact CE1-CE2 3.08Å; F112-F160 AromaticContact CE1-CZ 3.38Å; F112-F160 HydrophobicContact CE1-CZ 3.38Å; F112-F160 AromaticContact CE2-CE1 3.84Å; F112-F160 HydrophobicContact CE2-CE1 3.84Å; F112-F160 AromaticContact CE2-CE2 3.84Å; F112-F160 HydrophobicContact CE2-CE2 3.84Å; F112-F160 AromaticContact CE2-CZ 3.14Å; F112-F160 HydrophobicContact CE2-CZ 3.14Å; F112-F160 HydrophobicContact CG-CD1 4.23Å; F112-F160 HydrophobicContact CG-CD2 4.24Å; F112-F160 AromaticContact CG-CE1 3.71Å; F112-F160 HydrophobicContact CG-CE1 3.71Å; F112-F160 AromaticContact CG-CE2 3.74Å; F112-F160 HydrophobicContact CG-CE2 3.74Å; F112-F160 AromaticContact CG-CZ 3.47Å; F112-F160 HydrophobicContact CG-CZ 3.47Å; F112-F160 VanDerWaalsContact CG-CZ 3.47Å; F112-F160 HydrophobicContact CZ-CE1 4.27Å; F112-F160 AromaticContact CZ-CE2 3.39Å; F112-F160 HydrophobicContact CZ-CE2 3.39Å; F112-F160 AromaticContact CZ-CZ 3.19Å; F112-F160 HydrophobicContact CZ-CZ 3.19Å
113	L	90.8	Very high	89.5	Confident	3 Å²	3	26.5 Å²	26.5	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-37.5	178.5	-100.8	165.2	0	0	0	113.5	I109 R110 G117 M206 V210 L253 F271 F276 L277	I109-L113 HydrophobicContact CG2-CD1 4.1Å; I109-L113 WeakPolarHBondContact O-CB 3.44Å; I109-L113 PolarHBondContact O-N 3.26Å; R110-L113 PolarHBondContact O-N 2.67Å; L113-G117 WeakPolarHBondContact O-CA 3.44Å; L113-G117 PolarHBondContact O-N 3.48Å; L113-M206 HydrophobicContact CD2-CG 4.04Å; L113-M206 HydrophobicContact CD2-SD 3.76Å; L113-V210 HydrophobicContact CD1-CG1 4.04Å; L113-V210 HydrophobicContact CD1-CG2 3.67Å; L113-V210 HydrophobicContact CD2-CG2 3.8Å; L113-V210 HydrophobicContact CG-CG2 3.63Å; L113-L253 HydrophobicContact CD1-CD2 3.81Å; L113-F271 HydrophobicContact CD2-CE2 3.65Å; L113-F271 HydrophobicContact CD2-CZ 3.6Å; L113-F276 HydrophobicContact CD1-CD1 4Å; L113-F276 HydrophobicContact CD1-CE1 3.73Å; L113-L277 HydrophobicContact CB-CD2 3.71Å; L113-L277 HydrophobicContact CD1-CD2 4.4Å; L113-L277 HydrophobicContact CG-CD2 4.48Å
114	I	91.2	Very high	88.8	Confident	81 Å²	81	26.3 Å²	26.3	42%	0.415	15%	0.145	S	C	.	.	H	α-helix	trans	-63.8	-46.6	175.3	-69.5	163.7	0	0	0	110.3	R110 F112 G117 S118 L277	R110-I114 HydrophobicContact CG-CD1 4.09Å; R110-I114 VanDerWaalsContact O-CG1 3.32Å; R110-I114 WeakPolarHBondContact O-CG1 3.26Å; R110-I114 PolarHBondContact O-N 3.2Å; F112-I114 VanDerWaalsContact C-N 3.35Å; F112-I114 PolarHBondContact O-N 3.38Å; I114-G117 PolarHBondContact O-N 3.33Å; I114-S118 PolarHBondContact O-N 2.72Å; I114-L277 HydrophobicContact CG1-CB 4.3Å; I114-L277 HydrophobicContact CG1-CD2 4.3Å
115	Q	91.3	Very high	88.2	Confident	17 Å²	17	33.9 Å²	33.9	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-67.2	-45.6	-179.3	-72.4	-175.3	82.4	0	0	112.8	N68 H111 F112 G117 S118 A119 L158 S159 F160	N68-Q115 HydrophobicContact CB-CB 4.49Å; N68-Q115 WeakPolarHBondContact CB-O 3.35Å; N68-Q115 PolarHBondContact ND2-OE1 3.03Å; N68-Q115 PolarHBondContact OD1-O 2.98Å; H111-Q115 PolarHBondContact CD2-NE2 2.73Å; H111-Q115 PolarHBondContact NE2-NE2 3.17Å; H111-Q115 WeakPolarHBondContact O-CG 3.48Å; H111-Q115 PolarHBondContact O-N 2.95Å; H111-Q115 PolarHBondContact O-NE2 2.66Å; F112-Q115 PolarHBondContact O-N 3.49Å; Q115-G117 VanDerWaalsContact C-N 3.33Å; Q115-S118 PolarHBondContact O-N 2.92Å; Q115-A119 PolarHBondContact O-N 3.21Å; Q115-A119 VanDerWaalsContact O-N 3.09Å; Q115-L158 PolarHBondContact NE2-O 3.5Å; Q115-S159 VanDerWaalsContact OE1-CA 3.31Å; Q115-F160 HydrophobicContact CB-CB 3.87Å
116	I	87.3	Confident	87.6	Confident	10 Å²	10	34.3 Å²	34.3	5%	0.051	17%	0.167	C	C	.	.	H	α-helix	trans	-63.6	-42.8	174.9	-62.9	164.6	0	0	0	109.7	F112 S118 A119 M120 I138 F160 M206	F112-I116 WeakPolarHBondContact O-CG1 3.46Å; F112-I116 PolarHBondContact O-N 3.25Å; I116-S118 VanDerWaalsContact C-N 3.34Å; I116-S118 PolarHBondContact O-N 3.03Å; I116-A119 PolarHBondContact O-N 3.47Å; I116-M120 HydrophobicContact CG2-CG 4.05Å; I116-M120 VanDerWaalsContact O-CB 3.25Å; I116-M120 WeakPolarHBondContact O-CB 3.36Å; I116-M120 VanDerWaalsContact O-CG 3.23Å; I116-M120 WeakPolarHBondContact O-CG 3.39Å; I116-M120 PolarHBondContact O-N 3.32Å; I116-I138 HydrophobicContact CD1-CD1 4.03Å; I116-F160 HydrophobicContact CD1-CD1 4.4Å; I116-F160 HydrophobicContact CG1-CD1 4.47Å; I116-M206 HydrophobicContact CB-SD 4.17Å; I116-M206 HydrophobicContact CG2-CG 4.26Å; I116-M206 HydrophobicContact CG2-SD 3.52Å; I116-M206 VanDerWaalsContact CG2-SD 3.52Å
117	G	87.6	Confident	86.6	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-56.9	-43	175	0	0	0	0	0	113.2	L113 I114 Q115 M120 D121	L113-G117 WeakPolarHBondContact O-CA 3.44Å; L113-G117 PolarHBondContact O-N 3.48Å; I114-G117 PolarHBondContact O-N 3.33Å; Q115-G117 VanDerWaalsContact C-N 3.33Å; G117-M120 PolarHBondContact O-N 3.46Å; G117-D121 VanDerWaalsContact O-CB 3.23Å; G117-D121 WeakPolarHBondContact O-CB 3.42Å; G117-D121 PolarHBondContact O-N 3.47Å
118	S	89.9	Confident	85.8	Confident	43 Å²	43	30.8 Å²	30.8	30%	0.301	15%	0.153	S	C	.	.	H	α-helix	trans	-65.1	-43.9	176.6	-163.3	0	0	0	0	112.5	H66 I114 Q115 I116 D121 A122	H66-S118 VanDerWaalsContact CE1-C 3.43Å; H66-S118 PolarHBondContact CE1-OG 3.01Å; H66-S118 PolarHBondContact NE2-OG 2.97Å; I114-S118 PolarHBondContact O-N 2.72Å; Q115-S118 PolarHBondContact O-N 2.92Å; I116-S118 VanDerWaalsContact C-N 3.34Å; I116-S118 PolarHBondContact O-N 3.03Å; S118-D121 PolarHBondContact O-N 2.98Å; S118-A122 PolarHBondContact O-N 2.83Å
119	A	89.2	Confident	85	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.3	-47.4	174.5	0	0	0	0	0	111.6	H66 N68 I69 Q115 I116 D121 A122 M123 L162	H66-A119 PolarHBondContact CE1-N 3.48Å; N68-A119 HydrophobicContact CB-CB 3.88Å; N68-A119 WeakPolarHBondContact O-CB 3.32Å; I69-A119 HydrophobicContact CD1-CB 4.37Å; I69-A119 HydrophobicContact CG1-CB 3.88Å; Q115-A119 PolarHBondContact O-N 3.21Å; Q115-A119 VanDerWaalsContact O-N 3.09Å; I116-A119 PolarHBondContact O-N 3.47Å; A119-D121 VanDerWaalsContact C-N 3.34Å; A119-D121 PolarHBondContact O-N 3.4Å; A119-A122 PolarHBondContact O-N 3.34Å; A119-M123 WeakPolarHBondContact O-CG 3.37Å; A119-M123 PolarHBondContact O-N 3.47Å; A119-L162 HydrophobicContact CB-CD1 3.67Å; A119-L162 HydrophobicContact CB-CG 3.98Å
120	M	83.6	Confident	84.4	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.02	15%	0.15	C	C	.	.	H	α-helix	trans	-65.8	-34.7	-178.8	-75.2	-54.5	-47.1	0	0	112.2	I116 G117 M123 N124 L133 L162 D202 F268	I116-M120 HydrophobicContact CG2-CG 4.05Å; I116-M120 VanDerWaalsContact O-CB 3.25Å; I116-M120 WeakPolarHBondContact O-CB 3.36Å; I116-M120 VanDerWaalsContact O-CG 3.23Å; I116-M120 WeakPolarHBondContact O-CG 3.39Å; I116-M120 PolarHBondContact O-N 3.32Å; G117-M120 PolarHBondContact O-N 3.46Å; M120-M123 HydrophobicContact CE-SD 4.39Å; M120-M123 WeakPolarHBondContact O-CB 3.06Å; M120-M123 PolarHBondContact O-N 3.05Å; M120-M123 HydrophobicContact SD-SD 3.86Å; M120-N124 VanDerWaalsContact O-CB 3.32Å; M120-N124 WeakPolarHBondContact O-CB 3.45Å; M120-N124 PolarHBondContact O-N 2.94Å; M120-L133 HydrophobicContact CE-CD1 4.5Å; M120-L133 HydrophobicContact SD-CD1 3.94Å; M120-L133 HydrophobicContact SD-CD2 4.49Å; M120-L162 HydrophobicContact CG-CD1 4.24Å; M120-L162 HydrophobicContact SD-CD1 3.76Å; M120-D202 HydrophobicContact CE-CB 3.59Å; M120-F268 VanDerWaalsContact C-CE1 3.43Å; M120-F268 HydrophobicContact CB-CE1 3.76Å; M120-F268 HydrophobicContact CB-CZ 3.67Å; M120-F268 HydrophobicContact CE-CE2 4.44Å; M120-F268 HydrophobicContact CE-CZ 3.89Å; M120-F268 WeakPolarHBondContact O-CE1 3.41Å; M120-F268 VanDerWaalsContact O-CZ 3.32Å; M120-F268 WeakPolarHBondContact O-CZ 3.27Å
121	D	83.9	Confident	83.6	Confident	34 Å²	34	30.9 Å²	30.9	18%	0.182	15%	0.152	C	C	.	.	H	α-helix	trans	-68.3	-41.1	173.6	172.4	45.7	0	0	0	111.9	G117 S118 A119 M123 N124 R125 L272	G117-D121 VanDerWaalsContact O-CB 3.23Å; G117-D121 WeakPolarHBondContact O-CB 3.42Å; G117-D121 PolarHBondContact O-N 3.47Å; S118-D121 PolarHBondContact O-N 2.98Å; A119-D121 VanDerWaalsContact C-N 3.34Å; A119-D121 PolarHBondContact O-N 3.4Å; D121-M123 VanDerWaalsContact C-N 3.34Å; D121-M123 PolarHBondContact O-N 2.89Å; D121-N124 PolarHBondContact O-N 3.4Å; D121-R125 VanDerWaalsContact CG-CZ 3.5Å; D121-R125 VanDerWaalsContact CG-NH2 3.35Å; D121-R125 PolarHBondContact O-N 3.38Å; D121-R125 IonicContact OD1-CZ 2.63Å; D121-R125 IonicContact OD1-NH1 2.73Å; D121-R125 PolarHBondContact OD1-NH1 3.49Å; D121-R125 IonicContact OD1-NH2 3.41Å; D121-R125 IonicContact OD2-CZ 2.68Å; D121-R125 IonicContact OD2-NH1 2.66Å; D121-R125 PolarHBondContact OD2-NH1 3.47Å; D121-R125 IonicContact OD2-NH2 3.66Å; D121-R125 PolarHBondContact OD2-NH2 3.44Å; D121-L272 HydrophobicContact CB-CD1 4.04Å; D121-L272 HydrophobicContact CB-CD2 4.46Å
122	A	85.4	Confident	83.2	Confident	14 Å²	14	29 Å²	29	12%	0.116	14%	0.143	C	C	.	.	H	α-helix	trans	-62.5	-38.4	171.7	0	0	0	0	0	112.7	H66 S118 A119	H66-A122 HydrophobicContact CB-CB 4.32Å; S118-A122 PolarHBondContact O-N 2.83Å; A119-A122 PolarHBondContact O-N 3.34Å
123	M	82.2	Confident	83	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-49.1	172	-70.1	-177.2	66.2	0	0	112.2	L64 I69 A119 M120 D121 R125 K126 G127 F128 H130 L162 F165	L64-M123 HydrophobicContact CD1-CG 3.79Å; I69-M123 HydrophobicContact CD1-CG 4.08Å; A119-M123 WeakPolarHBondContact O-CG 3.37Å; A119-M123 PolarHBondContact O-N 3.47Å; M120-M123 HydrophobicContact CE-SD 4.39Å; M120-M123 WeakPolarHBondContact O-CB 3.06Å; M120-M123 PolarHBondContact O-N 3.05Å; M120-M123 HydrophobicContact SD-SD 3.86Å; D121-M123 VanDerWaalsContact C-N 3.34Å; D121-M123 PolarHBondContact O-N 2.89Å; M123-R125 PolarHBondContact O-N 3.03Å; M123-K126 CarbonylContact O-C 3.55Å; M123-K126 WeakPolarHBondContact O-CA 3.39Å; M123-K126 WeakPolarHBondContact O-CB 3.22Å; M123-K126 PolarHBondContact O-N 3.01Å; M123-G127 PolarHBondContact O-N 3.04Å; M123-F128 CarbonylContact C-O 3.55Å; M123-F128 HydrophobicContact CB-CB 4.25Å; M123-F128 HydrophobicContact CE-CB 4.1Å; M123-F128 PolarHBondContact O-N 3.46Å; M123-H130 HydrophobicContact CE-CB 3.76Å; M123-H130 HydrophobicContact SD-CB 4.35Å; M123-L162 HydrophobicContact SD-CD1 4.04Å; M123-F165 HydrophobicContact CE-CD1 4.22Å; M123-F165 HydrophobicContact CE-CE1 3.75Å; M123-F165 HydrophobicContact CG-CE1 4.48Å; M123-F165 HydrophobicContact SD-CE1 3.7Å; M123-F165 HydrophobicContact SD-CZ 4.37Å
124	N	78.1	Confident	82.9	Confident	66 Å²	66	30.6 Å²	30.6	35%	0.353	15%	0.151	S	C	.	.	H	α-helix	trans	-63.5	-40.4	-176.2	-170.4	67.9	0	0	0	111.9	M120 D121 K126 G127 A199 F268	M120-N124 VanDerWaalsContact O-CB 3.32Å; M120-N124 WeakPolarHBondContact O-CB 3.45Å; M120-N124 PolarHBondContact O-N 2.94Å; D121-N124 PolarHBondContact O-N 3.4Å; N124-K126 PolarHBondContact O-N 3.37Å; N124-K126 VanDerWaalsContact O-N 3.17Å; N124-G127 PolarHBondContact O-N 3.25Å; N124-A199 WeakPolarHBondContact OD1-CB 3.44Å; N124-F268 HydrophobicContact CB-CD1 4.47Å; N124-F268 HydrophobicContact CB-CE1 4.07Å; N124-F268 HydrophobicContact CB-CE2 4.15Å; N124-F268 HydrophobicContact CB-CZ 3.85Å
125	R	79.8	Confident	82.8	Confident	169 Å²	169	26.8 Å²	26.8	64%	0.638	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.6	171.3	-84.1	-166.4	-69.6	-90.9	-9.9	114.7	D121 M123	D121-R125 VanDerWaalsContact CG-CZ 3.5Å; D121-R125 VanDerWaalsContact CG-NH2 3.35Å; D121-R125 PolarHBondContact O-N 3.38Å; D121-R125 IonicContact OD1-CZ 2.63Å; D121-R125 IonicContact OD1-NH1 2.73Å; D121-R125 PolarHBondContact OD1-NH1 3.49Å; D121-R125 IonicContact OD1-NH2 3.41Å; D121-R125 IonicContact OD2-CZ 2.68Å; D121-R125 IonicContact OD2-NH1 2.66Å; D121-R125 PolarHBondContact OD2-NH1 3.47Å; D121-R125 IonicContact OD2-NH2 3.66Å; D121-R125 PolarHBondContact OD2-NH2 3.44Å; M123-R125 PolarHBondContact O-N 3.03Å
126	K	79.1	Confident	82.6	Confident	88 Å²	88	27.2 Å²	27.2	38%	0.383	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	5.3	175.9	-79.5	-78.1	-159	163.5	0	112.7	D63 L64 M123 N124 F128 F170	D63-K126 WeakPolarHBondContact O-CE 3.44Å; D63-K126 IonicContact OD2-NZ 3.2Å; D63-K126 PolarHBondContact OD2-NZ 3.11Å; L64-K126 HydrophobicContact CD2-CB 4.21Å; L64-K126 HydrophobicContact CD2-CG 3.94Å; M123-K126 CarbonylContact O-C 3.55Å; M123-K126 WeakPolarHBondContact O-CA 3.39Å; M123-K126 WeakPolarHBondContact O-CB 3.22Å; M123-K126 PolarHBondContact O-N 3.01Å; N124-K126 PolarHBondContact O-N 3.37Å; N124-K126 VanDerWaalsContact O-N 3.17Å; K126-F128 HydrophobicContact CB-CD2 3.47Å; K126-F128 VanDerWaalsContact CB-CD2 3.47Å; K126-F128 HydrophobicContact CB-CE2 3.77Å; K126-F128 HydrophobicContact CB-CG 4.35Å; K126-F128 HydrophobicContact CG-CD2 4.42Å; K126-F128 HydrophobicContact CG-CE2 4.41Å; K126-F128 PolarHBondContact O-N 2.89Å; K126-F170 WeakPolarHBondContact O-CD2 3.44Å; K126-F170 VanDerWaalsContact O-CE2 3.28Å; K126-F170 WeakPolarHBondContact O-CE2 3.4Å
127	G	72.2	Confident	82.7	Confident	20 Å²	20	27.2 Å²	27.2	21%	0.206	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	17.6	-174.8	0	0	0	0	0	114	M123 N124 F170 L171	M123-G127 PolarHBondContact O-N 3.04Å; N124-G127 PolarHBondContact O-N 3.25Å; G127-F170 CarbonylContact O-C 3.34Å; G127-F170 WeakPolarHBondContact O-CA 3.47Å; G127-L171 PolarHBondContact O-N 3.3Å
128	F	74.5	Confident	82.9	Confident	12 Å²	12	27.2 Å²	27.2	5%	0.053	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	134.7	-179.2	-65.6	-52.1	0	0	0	112.4	V60 D63 L64 M123 K126 F170	V60-F128 HydrophobicContact CG1-CD2 4.33Å; V60-F128 HydrophobicContact CG1-CG 4.37Å; V60-F128 HydrophobicContact CG2-CD1 3.8Å; V60-F128 HydrophobicContact CG2-CE1 3.64Å; V60-F128 HydrophobicContact CG2-CG 4.35Å; V60-F128 HydrophobicContact CG2-CZ 4.03Å; D63-F128 HydrophobicContact CB-CE2 4.01Å; D63-F128 HydrophobicContact CB-CZ 4.36Å; L64-F128 HydrophobicContact CD1-CD2 3.82Å; L64-F128 HydrophobicContact CD1-CE2 4.42Å; L64-F128 HydrophobicContact CD2-CD2 4.11Å; L64-F128 HydrophobicContact CG-CD2 3.96Å; L64-F128 HydrophobicContact CG-CE2 4.19Å; M123-F128 CarbonylContact C-O 3.55Å; M123-F128 HydrophobicContact CB-CB 4.25Å; M123-F128 HydrophobicContact CE-CB 4.1Å; M123-F128 PolarHBondContact O-N 3.46Å; K126-F128 HydrophobicContact CB-CD2 3.47Å; K126-F128 VanDerWaalsContact CB-CD2 3.47Å; K126-F128 HydrophobicContact CB-CE2 3.77Å; K126-F128 HydrophobicContact CB-CG 4.35Å; K126-F128 HydrophobicContact CG-CD2 4.42Å; K126-F128 HydrophobicContact CG-CE2 4.41Å; K126-F128 PolarHBondContact O-N 2.89Å; F128-F170 HydrophobicContact CD1-CB 4.13Å; F128-F170 HydrophobicContact CD1-CD2 4.15Å; F128-F170 HydrophobicContact CE1-CB 3.93Å; F128-F170 AromaticContact CE1-CD2 3.83Å; F128-F170 HydrophobicContact CE1-CD2 3.83Å; F128-F170 HydrophobicContact CE1-CG 4.38Å; F128-F170 HydrophobicContact CZ-CD2 4.44Å
129	M	73.2	Confident	83.1	Confident	3 Å²	3	27.3 Å²	27.3	2%	0.015	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	146.7	165.5	-63.9	-174.1	-64.4	0	0	110.6	R131 A168 R169 L171 A177 Y197 A199	M129-R131 HydrophobicContact CB-CG 3.86Å; M129-A168 VanDerWaalsContact O-CA 3.28Å; M129-A168 WeakPolarHBondContact O-CA 3.38Å; M129-R169 PolarHBondContact N-O 2.9Å; M129-R169 VanDerWaalsContact N-O 3.09Å; M129-R169 PolarHBondContact O-N 3.1Å; M129-L171 HydrophobicContact CE-CB 4.26Å; M129-L171 HydrophobicContact CE-CD1 3.85Å; M129-L171 HydrophobicContact CE-CD2 3.83Å; M129-L171 HydrophobicContact CE-CG 4.21Å; M129-L171 HydrophobicContact CG-CD2 4.5Å; M129-L171 HydrophobicContact SD-CD2 3.89Å; M129-A177 HydrophobicContact CE-CB 4Å; M129-Y197 HydrophobicContact CE-CD2 4.27Å; M129-Y197 HydrophobicContact CE-CE2 4.05Å; M129-Y197 HydrophobicContact SD-CD2 4.42Å; M129-A199 HydrophobicContact CG-CB 4.44Å
130	H	80.6	Confident	83.2	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.136	C	C	.	.			trans	-84.6	-46.2	-178.5	-164.2	-84.8	0	0	0	112.2	M123 D132 L133 A163 F165 D202	M123-H130 HydrophobicContact CE-CB 3.76Å; M123-H130 HydrophobicContact SD-CB 4.35Å; H130-D132 PolarHBondContact CE1-O 3.4Å; H130-D132 PolarHBondContact ND1-O 3.33Å; H130-D132 PolarHBondContact O-N 3.16Å; H130-L133 HydrophobicContact CB-CD2 4.36Å; H130-L133 HydrophobicContact CB-CG 3.98Å; H130-L133 PolarHBondContact ND1-N 3.14Å; H130-A163 PolarHBondContact CE1-O 3.46Å; H130-A163 PolarHBondContact NE2-O 2.88Å; H130-F165 AromaticContact CD2-CD1 3.84Å; H130-F165 AromaticContact CD2-CE1 3.67Å; H130-D202 PolarHBondContact N-OD2 2.93Å
131	R	75.8	Confident	83.5	Confident	31 Å²	31	28.2 Å²	28.2	12%	0.117	14%	0.143	C	C	.	.	S	Bend	trans	66.6	-18.2	174.2	-46.1	-166.2	-65.3	156.7	0.6	117.3	M129 F167 Y197 D202	M129-R131 HydrophobicContact CB-CG 3.86Å; R131-F167 PolarHBondContact NE-O 3.24Å; R131-F167 PolarHBondContact NH2-O 3.05Å; R131-Y197 WeakPolarHBondContact CD-OH 3.45Å; R131-Y197 HydrophobicContact CG-CE2 4.27Å; R131-Y197 PolarHBondContact NH1-OH 2.93Å; R131-D202 PolarHBondContact N-OD1 3.33Å
132	D	82.2	Confident	83.6	Confident	6 Å²	6	28 Å²	28	3%	0.032	14%	0.141	C	C	.	.			trans	-124.6	52.6	167.5	-166.2	33.3	0	0	0	112.1	H130 K134 N137 F167 G182 S183	H130-D132 PolarHBondContact CE1-O 3.4Å; H130-D132 PolarHBondContact ND1-O 3.33Å; H130-D132 PolarHBondContact O-N 3.16Å; D132-K134 PolarHBondContact O-N 3.36Å; D132-K134 IonicContact OD2-NZ 2.7Å; D132-K134 PolarHBondContact OD2-NZ 2.94Å; D132-N137 PolarHBondContact O-ND2 3.01Å; D132-N137 PolarHBondContact OD2-ND2 3.25Å; D132-F167 HydrophobicContact CB-CB 4.29Å; D132-F167 HydrophobicContact CB-CD2 3.75Å; D132-F167 HydrophobicContact CB-CG 4.35Å; D132-G182 VanDerWaalsContact CG-CA 3.44Å; D132-G182 WeakPolarHBondContact OD1-CA 3.46Å; D132-S183 VanDerWaalsContact OD1-CB 3.31Å; D132-S183 WeakPolarHBondContact OD1-CB 3.45Å; D132-S183 PolarHBondContact OD1-N 3.49Å; D132-S183 PolarHBondContact OD1-OG 3.33Å
133	L	85.6	Confident	83.2	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.169	C	C	.	.			trans	-70.3	114.4	169.3	-81.8	176	0	0	0	110.2	M120 H130 L162 Y186 D202 I209	M120-L133 HydrophobicContact CE-CD1 4.5Å; M120-L133 HydrophobicContact SD-CD1 3.94Å; M120-L133 HydrophobicContact SD-CD2 4.49Å; H130-L133 HydrophobicContact CB-CD2 4.36Å; H130-L133 HydrophobicContact CB-CG 3.98Å; H130-L133 PolarHBondContact ND1-N 3.14Å; L133-L162 HydrophobicContact CD2-CD1 4.34Å; L133-L162 HydrophobicContact CD2-CD2 3.7Å; L133-Y186 VanDerWaalsContact O-CB 3.28Å; L133-Y186 WeakPolarHBondContact O-CB 3.37Å; L133-D202 HydrophobicContact CD1-CB 3.66Å; L133-I209 HydrophobicContact CB-CD1 4.33Å
134	K	88.2	Confident	82.1	Confident	43 Å²	43	38.6 Å²	38.6	19%	0.187	19%	0.193	C	C	.	.			trans	-150.2	159.8	176.7	71.5	-162.4	-173.3	-127.3	0	109.2	D132 G136 N137 S183 Y186	D132-K134 PolarHBondContact O-N 3.36Å; D132-K134 IonicContact OD2-NZ 2.7Å; D132-K134 PolarHBondContact OD2-NZ 2.94Å; K134-G136 PolarHBondContact O-N 3.48Å; K134-G136 VanDerWaalsContact O-N 3.17Å; K134-N137 VanDerWaalsContact CE-CG 3.43Å; K134-N137 WeakPolarHBondContact CE-OD1 3.33Å; K134-N137 HydrophobicContact CG-CB 4.02Å; K134-N137 VanDerWaalsContact NZ-CG 3.35Å; K134-N137 PolarHBondContact NZ-ND2 2.99Å; K134-N137 PolarHBondContact NZ-OD1 3.49Å; K134-N137 PolarHBondContact O-N 3.01Å; K134-S183 WeakPolarHBondContact CD-OG 3.49Å; K134-Y186 HydrophobicContact CB-CD2 3.75Å; K134-Y186 HydrophobicContact CB-CE2 3.91Å; K134-Y186 HydrophobicContact CB-CG 4.1Å
135	P	88.7	Confident	81.1	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.006	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-55.4	-35.1	179.9	-27.6	36.1	0	0	0	114.3	L94 N137 I138 Y186 I209	L94-P135 HydrophobicContact CB-CB 4.09Å; L94-P135 WeakPolarHBondContact CB-O 3.46Å; L94-P135 HydrophobicContact CD2-CB 4.38Å; L94-P135 HydrophobicContact CG-CB 4.15Å; L94-P135 PolarHBondContact N-O 3.19Å; P135-N137 PolarHBondContact O-N 3.47Å; P135-I138 PolarHBondContact O-N 2.88Å; P135-Y186 VanDerWaalsContact CD-CZ 3.41Å; P135-Y186 WeakPolarHBondContact CD-OH 2.97Å; P135-Y186 HydrophobicContact CG-CE1 3.99Å; P135-I209 HydrophobicContact CG-CG1 4.25Å
136	G	87.5	Confident	79.9	Confident	25 Å²	25	36.5 Å²	36.5	26%	0.258	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-70.2	-12.5	176	0	0	0	0	0	115.7	D93 K134	D93-G136 WeakPolarHBondContact OD2-CA 3.22Å; K134-G136 PolarHBondContact O-N 3.48Å; K134-G136 VanDerWaalsContact O-N 3.17Å
137	N	89.6	Confident	79	Confident	11 Å²	11	36.1 Å²	36.1	6%	0.059	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-102.3	10.4	174.2	-74.8	7.1	0	0	0	111.9	D132 K134 P135 A163 D164	D132-N137 PolarHBondContact O-ND2 3.01Å; D132-N137 PolarHBondContact OD2-ND2 3.25Å; K134-N137 VanDerWaalsContact CE-CG 3.43Å; K134-N137 WeakPolarHBondContact CE-OD1 3.33Å; K134-N137 HydrophobicContact CG-CB 4.02Å; K134-N137 VanDerWaalsContact NZ-CG 3.35Å; K134-N137 PolarHBondContact NZ-ND2 2.99Å; K134-N137 PolarHBondContact NZ-OD1 3.49Å; K134-N137 PolarHBondContact O-N 3.01Å; P135-N137 PolarHBondContact O-N 3.47Å; N137-A163 WeakPolarHBondContact CB-O 3.31Å; N137-A163 PolarHBondContact O-N 2.81Å; N137-D164 PolarHBondContact ND2-OD2 3.48Å
138	I	91.4	Very high	78.6	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	103.5	177.1	-64	172.7	0	0	0	107.3	D93 L94 I116 P135 F160 L162 I209	D93-I138 CarbonylContact C-O 3.51Å; D93-I138 WeakPolarHBondContact CA-O 3.39Å; L94-I138 HydrophobicContact CB-CB 4.05Å; L94-I138 HydrophobicContact CB-CG2 4.07Å; L94-I138 HydrophobicContact CD2-CB 4.38Å; L94-I138 HydrophobicContact CD2-CD1 4.07Å; L94-I138 HydrophobicContact CD2-CG2 4.18Å; L94-I138 PolarHBondContact N-O 3.4Å; I116-I138 HydrophobicContact CD1-CD1 4.03Å; P135-I138 PolarHBondContact O-N 2.88Å; I138-F160 HydrophobicContact CG2-CD1 3.37Å; I138-F160 HydrophobicContact CG2-CE1 3.6Å; I138-F160 HydrophobicContact CG2-CG 4.49Å; I138-L162 HydrophobicContact CG1-CD2 3.95Å; I138-I209 HydrophobicContact CD1-CD1 3.84Å; I138-I209 HydrophobicContact CD1-CG2 4.18Å
139	L	93.4	Very high	78.5	Confident	44 Å²	44	46.8 Å²	46.8	23%	0.23	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	152.7	-176.6	-55.7	-172.2	0	0	0	112	V70 C89 D93 K161 A163	V70-L139 HydrophobicContact CG2-CD1 3.99Å; C89-L139 HydrophobicContact CB-CB 3.59Å; C89-L139 HydrophobicContact CB-CD1 3.96Å; C89-L139 HydrophobicContact CB-CG 4.41Å; D93-L139 HydrophobicContact CB-CD2 3.8Å; L139-K161 PolarHBondContact N-O 3.46Å; L139-K161 PolarHBondContact O-N 3.02Å; L139-A163 HydrophobicContact CD1-CB 3.76Å; L139-A163 HydrophobicContact CG-CB 3.79Å
140	L	92.2	Very high	78.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.9	-175	-50.8	-176.2	0	0	0	110.9	C89 N90 G91 G92 Y97 V150 F160	C89-L140 CarbonylContact C-O 3.56Å; C89-L140 WeakPolarHBondContact CB-O 3.43Å; N90-L140 PolarHBondContact N-O 3Å; G91-L140 WeakPolarHBondContact CA-O 3.41Å; G91-L140 PolarHBondContact N-O 3.07Å; G92-L140 PolarHBondContact O-N 3.46Å; Y97-L140 HydrophobicContact CD1-CD1 4.4Å; Y97-L140 HydrophobicContact CD2-CD1 3.93Å; Y97-L140 HydrophobicContact CG-CD1 3.72Å; L140-V150 HydrophobicContact CD1-CG2 4.45Å; L140-F160 HydrophobicContact CD2-CD1 4.19Å; L140-F160 HydrophobicContact CD2-CD2 4.11Å; L140-F160 HydrophobicContact CD2-CE1 3.55Å; L140-F160 HydrophobicContact CD2-CE2 3.43Å; L140-F160 VanDerWaalsContact CD2-CE2 3.43Å; L140-F160 HydrophobicContact CD2-CG 4.41Å; L140-F160 HydrophobicContact CD2-CZ 3.08Å
141	S	89.9	Confident	78.8	Confident	24 Å²	24	49.6 Å²	49.6	17%	0.168	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	152.2	171.6	-173.7	0	0	0	0	111.9	N90 S159	N90-S141 VanDerWaalsContact OD1-CA 3.31Å; N90-S141 WeakPolarHBondContact OD1-CA 3.38Å; N90-S141 WeakPolarHBondContact OD1-CB 3.36Å; N90-S141 PolarHBondContact OD1-OG 2.93Å; S141-S159 PolarHBondContact N-O 2.93Å; S141-S159 PolarHBondContact O-N 3.27Å
142	H	86.6	Confident	79	Confident	30 Å²	30	51.4 Å²	51.4	14%	0.139	30%	0.297	C	S	.	.			trans	-150.2	157.5	177.7	63.7	88.9	0	0	0	109.9	N90 R144 C146 I153 L158	N90-H142 PolarHBondContact ND2-CD2 2.92Å; N90-H142 VanDerWaalsContact ND2-CD2 3.32Å; N90-H142 PolarHBondContact ND2-CE1 2.94Å; N90-H142 VanDerWaalsContact ND2-CE1 3.27Å; N90-H142 PolarHBondContact ND2-ND1 3.22Å; N90-H142 PolarHBondContact ND2-NE2 3.1Å; N90-H142 VanDerWaalsContact ND2-NE2 3.18Å; N90-H142 PolarHBondContact ND2-O 2.63Å; N90-H142 PolarHBondContact OD1-N 3.29Å; N90-H142 VanDerWaalsContact OD1-N 3.16Å; N90-H142 PolarHBondContact OD1-O 3.41Å; H142-R144 PolarHBondContact O-N 3.27Å; H142-C146 VanDerWaalsContact CE1-SG 3.51Å; H142-C146 PolarHBondContact ND1-SG 3.38Å; H142-C146 VanDerWaalsContact ND1-SG 3.42Å; H142-I153 HydrophobicContact CB-CD1 3.93Å; H142-I153 VanDerWaalsContact CG-CD1 3.4Å; H142-I153 WeakPolarHBondContact ND1-CD1 3.25Å; H142-L158 HydrophobicContact CB-CD2 4.2Å
143	C	75.6	Confident	78.9	Confident	104 Å²	104	51.7 Å²	51.7	70%	0.703	30%	0.299	S	S	*	.			trans	-59.7	138.5	172.9	-153.2	0	0	0	0	110	D145	C143-D145 VanDerWaalsContact C-N 3.32Å; C143-D145 PolarHBondContact O-N 2.95Å; C143-D145 PolarHBondContact SG-OD2 3.47Å; C143-D145 VanDerWaalsContact SG-OD2 3.33Å
144	R	59.3	Low	78.6	Confident	132 Å²	132	54.4 Å²	54.4	50%	0.498	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-75.5	-20.1	-163.8	-66.8	-169.8	-164.5	149	13.7	114.5	D33 P35 H142 C146	D33-R144 PolarHBondContact O-NH1 2.98Å; P35-R144 VanDerWaalsContact CD-NH2 3.33Å; H142-R144 PolarHBondContact O-N 3.27Å; R144-C146 PolarHBondContact O-N 3.24Å; R144-C146 VanDerWaalsContact O-N 3.13Å
145	D	57	Low	78	Confident	144 Å²	144	52.6 Å²	52.6	77%	0.77	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-80.2	3.9	-164.7	-42.2	-74.6	0	0	0	113.8	C143 G147	C143-D145 VanDerWaalsContact C-N 3.32Å; C143-D145 PolarHBondContact O-N 2.95Å; C143-D145 PolarHBondContact SG-OD2 3.47Å; C143-D145 VanDerWaalsContact SG-OD2 3.33Å; D145-G147 PolarHBondContact O-N 2.95Å
146	C	55.6	Low	77.5	Confident	47 Å²	47	59 Å²	59	32%	0.318	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-74.9	-19.6	-177.7	61.6	0	0	0	0	114.3	H142 R144 H148	H142-C146 VanDerWaalsContact CE1-SG 3.51Å; H142-C146 PolarHBondContact ND1-SG 3.38Å; H142-C146 VanDerWaalsContact ND1-SG 3.42Å; R144-C146 PolarHBondContact O-N 3.24Å; R144-C146 VanDerWaalsContact O-N 3.13Å; C146-H148 HydrophobicContact CB-CB 4.36Å; C146-H148 PolarHBondContact O-CD2 2.92Å; C146-H148 PolarHBondContact O-N 2.89Å
147	G	58.8	Low	77.3	Confident	79 Å²	79	62.6 Å²	62.6	81%	0.814	35%	0.348	S	S	*	.			trans	58.6	8	-177.6	0	0	0	0	0	115.2	D145	D145-G147 PolarHBondContact O-N 2.95Å
148	H	65.5	Low	77.2	Confident	126 Å²	126	62.1 Å²	62.1	58%	0.583	35%	0.345	S	S	*	.	S	Bend	trans	-111.5	140	-167.9	-77.7	-37.2	0	0	0	110.6	C146	C146-H148 HydrophobicContact CB-CB 4.36Å; C146-H148 PolarHBondContact O-CD2 2.92Å; C146-H148 PolarHBondContact O-N 2.89Å
149	H	72.2	Confident	77.1	Confident	131 Å²	131	63.4 Å²	63.4	61%	0.606	35%	0.354	S	S	*	.			trans	-60.3	143.6	174.6	-170.5	-100.9	0	0	0	110.4	T151 S152	H149-T151 PolarHBondContact ND1-OG1 3.46Å; H149-T151 PolarHBondContact O-N 3.18Å; H149-S152 PolarHBondContact O-N 3.17Å; H149-S152 PolarHBondContact O-OG 3.39Å
150	V	79.3	Confident	77	Confident	21 Å²	21	61.4 Å²	61.4	13%	0.127	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-53.7	-32.8	-173.4	67.3	0	0	0	0	113	Y97 L140 S152 I153 L158	Y97-V150 HydrophobicContact CD2-CG1 4.35Å; Y97-V150 HydrophobicContact CD2-CG2 4.17Å; Y97-V150 HydrophobicContact CE2-CG2 4.25Å; L140-V150 HydrophobicContact CD1-CG2 4.45Å; V150-S152 VanDerWaalsContact C-N 3.29Å; V150-S152 PolarHBondContact O-N 3.39Å; V150-I153 WeakPolarHBondContact O-CB 3.18Å; V150-I153 PolarHBondContact O-N 3.01Å; V150-I153 VanDerWaalsContact O-N 3.15Å; V150-L158 HydrophobicContact CG2-CD2 3.97Å
151	T	79.4	Confident	76.9	Confident	40 Å²	40	61.8 Å²	61.8	25%	0.245	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-71.1	-16.4	178.5	63.6	0	0	0	0	114.5	A100 K101 H149	A100-T151 HydrophobicContact CB-CG2 3.53Å; K101-T151 WeakPolarHBondContact CE-O 3.39Å; K101-T151 PolarHBondContact NZ-O 3.17Å; H149-T151 PolarHBondContact ND1-OG1 3.46Å; H149-T151 PolarHBondContact O-N 3.18Å
152	S	80.7	Confident	77	Confident	70 Å²	70	60.8 Å²	60.8	49%	0.49	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-94	-7.3	171.1	58.8	0	0	0	0	113.2	H149 V150	H149-S152 PolarHBondContact O-N 3.17Å; H149-S152 PolarHBondContact O-OG 3.39Å; V150-S152 VanDerWaalsContact C-N 3.29Å; V150-S152 PolarHBondContact O-N 3.39Å
153	I	79.8	Confident	77.1	Confident	12 Å²	12	59.9 Å²	59.9	6%	0.062	34%	0.336	C	S	.	.	S	Bend	trans	-74.6	132.3	174.4	-55.4	-179.7	0	0	0	109.4	H142 V150 G155 L157 L158	H142-I153 HydrophobicContact CB-CD1 3.93Å; H142-I153 VanDerWaalsContact CG-CD1 3.4Å; H142-I153 WeakPolarHBondContact ND1-CD1 3.25Å; V150-I153 WeakPolarHBondContact O-CB 3.18Å; V150-I153 PolarHBondContact O-N 3.01Å; V150-I153 VanDerWaalsContact O-N 3.15Å; I153-G155 PolarHBondContact O-N 3.38Å; I153-L157 HydrophobicContact CG2-CB 3.96Å; I153-L158 HydrophobicContact CB-CD2 4.17Å; I153-L158 HydrophobicContact CD1-CD2 4.4Å; I153-L158 HydrophobicContact CG2-CD2 3.86Å; I153-L158 HydrophobicContact CG2-CG 4.39Å
154	P	79.1	Confident	77.3	Confident	57 Å²	57	57.1 Å²	57.1	37%	0.37	31%	0.314	S	S	.	.			trans	-59.3	134	170.5	-23.7	33.2	0	0	0	111.8	Y156 L157	P154-Y156 HydrophobicContact CB-CD1 3.87Å; P154-Y156 HydrophobicContact CB-CE1 3.38Å; P154-Y156 HydrophobicContact CB-CE2 4.4Å; P154-Y156 HydrophobicContact CG-CE1 4.34Å; P154-Y156 PolarHBondContact O-N 2.98Å; P154-L157 HydrophobicContact CG-CD1 4.34Å; P154-L157 PolarHBondContact O-N 3.17Å
155	G	77.4	Confident	78.2	Confident	6 Å²	6	50.9 Å²	50.9	6%	0.062	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-60.6	-22.9	-171.7	0	0	0	0	0	115.6	H111 F112 I153 L157 L158	H111-G155 PolarHBondContact CD2-O 2.97Å; F112-G155 WeakPolarHBondContact CE1-O 3.16Å; I153-G155 PolarHBondContact O-N 3.38Å; G155-L157 PolarHBondContact O-N 2.9Å; G155-L158 PolarHBondContact O-N 3.08Å
156	Y	78	Confident	78.5	Confident	134 Å²	134	44.4 Å²	44.4	53%	0.525	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-77.8	-2.3	175.4	65	-98.5	0	0	0	114.3	H111 P154	H111-Y156 PolarHBondContact NE2-O 3.05Å; P154-Y156 HydrophobicContact CB-CD1 3.87Å; P154-Y156 HydrophobicContact CB-CE1 3.38Å; P154-Y156 HydrophobicContact CB-CE2 4.4Å; P154-Y156 HydrophobicContact CG-CE1 4.34Å; P154-Y156 PolarHBondContact O-N 2.98Å
157	L	82.7	Confident	78.8	Confident	101 Å²	101	44.2 Å²	44.2	53%	0.529	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-105	5.9	172.5	-60.1	-179.2	0	0	0	112.5	I153 P154 G155	I153-L157 HydrophobicContact CG2-CB 3.96Å; P154-L157 HydrophobicContact CG-CD1 4.34Å; P154-L157 PolarHBondContact O-N 3.17Å; G155-L157 PolarHBondContact O-N 2.9Å
158	L	87.8	Confident	78.6	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.213	C	C	.	.			trans	-97	119.4	178.1	-62	179.2	0	0	0	110.1	Y97 H111 F112 Q115 H142 V150 I153 G155 F160	Y97-L158 HydrophobicContact CE1-CD1 4.21Å; Y97-L158 HydrophobicContact CE2-CD1 3.82Å; H111-L158 PolarHBondContact NE2-O 2.87Å; F112-L158 HydrophobicContact CZ-CD1 4.38Å; Q115-L158 PolarHBondContact NE2-O 3.5Å; H142-L158 HydrophobicContact CB-CD2 4.2Å; V150-L158 HydrophobicContact CG2-CD2 3.97Å; I153-L158 HydrophobicContact CB-CD2 4.17Å; I153-L158 HydrophobicContact CD1-CD2 4.4Å; I153-L158 HydrophobicContact CG2-CD2 3.86Å; I153-L158 HydrophobicContact CG2-CG 4.39Å; G155-L158 PolarHBondContact O-N 3.08Å; L158-F160 HydrophobicContact CB-CD2 4.39Å; L158-F160 HydrophobicContact CB-CE2 3.9Å
159	S	88.4	Confident	78.4	Confident	28 Å²	28	35.4 Å²	35.4	20%	0.196	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	135.8	167.8	-176.4	0	0	0	0	109.9	Q115 S141	Q115-S159 VanDerWaalsContact OE1-CA 3.31Å; S141-S159 PolarHBondContact N-O 2.93Å; S141-S159 PolarHBondContact O-N 3.27Å
160	F	91	Very high	77.5	Confident	3 Å²	3	34.6 Å²	34.6	1%	0.013	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	131.6	-176.3	-90.3	-112.8	0	0	0	110.5	N68 L94 F112 Q115 I116 I138 L140 L158	N68-F160 WeakPolarHBondContact CA-O 3.49Å; N68-F160 WeakPolarHBondContact CB-O 3.28Å; N68-F160 PolarHBondContact ND2-O 3.39Å; L94-F160 HydrophobicContact CD1-CE1 4.12Å; L94-F160 HydrophobicContact CD1-CZ 4.2Å; L94-F160 HydrophobicContact CD2-CE1 4.28Å; F112-F160 HydrophobicContact CB-CD1 4.31Å; F112-F160 HydrophobicContact CB-CE1 4.17Å; F112-F160 HydrophobicContact CB-CZ 4.39Å; F112-F160 AromaticContact CD1-CD2 3.76Å; F112-F160 HydrophobicContact CD1-CD2 3.76Å; F112-F160 HydrophobicContact CD1-CE1 4.13Å; F112-F160 AromaticContact CD1-CE2 3.25Å; F112-F160 HydrophobicContact CD1-CE2 3.25Å; F112-F160 HydrophobicContact CD1-CG 4.42Å; F112-F160 AromaticContact CD1-CZ 3.49Å; F112-F160 HydrophobicContact CD1-CZ 3.49Å; F112-F160 VanDerWaalsContact CD1-CZ 3.49Å; F112-F160 HydrophobicContact CD2-CD1 4.47Å; F112-F160 AromaticContact CD2-CE1 3.56Å; F112-F160 HydrophobicContact CD2-CE1 3.56Å; F112-F160 HydrophobicContact CD2-CE2 4.01Å; F112-F160 AromaticContact CD2-CZ 3.3Å; F112-F160 HydrophobicContact CD2-CZ 3.3Å; F112-F160 AromaticContact CE1-CD2 3.98Å; F112-F160 HydrophobicContact CE1-CD2 3.98Å; F112-F160 HydrophobicContact CE1-CE1 4.41Å; F112-F160 AromaticContact CE1-CE2 3.08Å; F112-F160 HydrophobicContact CE1-CE2 3.08Å; F112-F160 AromaticContact CE1-CZ 3.38Å; F112-F160 HydrophobicContact CE1-CZ 3.38Å; F112-F160 AromaticContact CE2-CE1 3.84Å; F112-F160 HydrophobicContact CE2-CE1 3.84Å; F112-F160 AromaticContact CE2-CE2 3.84Å; F112-F160 HydrophobicContact CE2-CE2 3.84Å; F112-F160 AromaticContact CE2-CZ 3.14Å; F112-F160 HydrophobicContact CE2-CZ 3.14Å; F112-F160 HydrophobicContact CG-CD1 4.23Å; F112-F160 HydrophobicContact CG-CD2 4.24Å; F112-F160 AromaticContact CG-CE1 3.71Å; F112-F160 HydrophobicContact CG-CE1 3.71Å; F112-F160 AromaticContact CG-CE2 3.74Å; F112-F160 HydrophobicContact CG-CE2 3.74Å; F112-F160 AromaticContact CG-CZ 3.47Å; F112-F160 HydrophobicContact CG-CZ 3.47Å; F112-F160 VanDerWaalsContact CG-CZ 3.47Å; F112-F160 HydrophobicContact CZ-CE1 4.27Å; F112-F160 AromaticContact CZ-CE2 3.39Å; F112-F160 HydrophobicContact CZ-CE2 3.39Å; F112-F160 AromaticContact CZ-CZ 3.19Å; F112-F160 HydrophobicContact CZ-CZ 3.19Å; Q115-F160 HydrophobicContact CB-CB 3.87Å; I116-F160 HydrophobicContact CD1-CD1 4.4Å; I116-F160 HydrophobicContact CG1-CD1 4.47Å; I138-F160 HydrophobicContact CG2-CD1 3.37Å; I138-F160 HydrophobicContact CG2-CE1 3.6Å; I138-F160 HydrophobicContact CG2-CG 4.49Å; L140-F160 HydrophobicContact CD2-CD1 4.19Å; L140-F160 HydrophobicContact CD2-CD2 4.11Å; L140-F160 HydrophobicContact CD2-CE1 3.55Å; L140-F160 HydrophobicContact CD2-CE2 3.43Å; L140-F160 VanDerWaalsContact CD2-CE2 3.43Å; L140-F160 HydrophobicContact CD2-CG 4.41Å; L140-F160 HydrophobicContact CD2-CZ 3.08Å; L158-F160 HydrophobicContact CB-CD2 4.39Å; L158-F160 HydrophobicContact CB-CE2 3.9Å
161	K	91.7	Very high	76.3	Confident	8 Å²	8	34.7 Å²	34.7	4%	0.035	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	124.2	-178.5	-71.7	168.9	175.5	-73.8	0	111.6	E67 N68 V70 E87 L139	E67-K161 PolarHBondContact O-NZ 2.72Å; N68-K161 WeakPolarHBondContact O-CA 3.25Å; V70-K161 HydrophobicContact CG2-CB 3.87Å; E87-K161 VanDerWaalsContact CD-CE 3.43Å; E87-K161 WeakPolarHBondContact OE1-CE 3.29Å; E87-K161 IonicContact OE1-NZ 2.68Å; E87-K161 PolarHBondContact OE1-NZ 3.01Å; E87-K161 WeakPolarHBondContact OE2-CE 3.43Å; E87-K161 IonicContact OE2-NZ 2.7Å; E87-K161 PolarHBondContact OE2-NZ 3.43Å; L139-K161 PolarHBondContact N-O 3.46Å; L139-K161 PolarHBondContact O-N 3.02Å
162	L	91.2	Very high	74.6	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	140.5	170.7	-64.5	-174.9	0	0	0	110.8	N68 V70 A119 M120 M123 L133 I138 F165	N68-L162 PolarHBondContact O-N 3.15Å; V70-L162 WeakPolarHBondContact CG2-O 3.41Å; V70-L162 PolarHBondContact N-O 3.2Å; A119-L162 HydrophobicContact CB-CD1 3.67Å; A119-L162 HydrophobicContact CB-CG 3.98Å; M120-L162 HydrophobicContact CG-CD1 4.24Å; M120-L162 HydrophobicContact SD-CD1 3.76Å; M123-L162 HydrophobicContact SD-CD1 4.04Å; L133-L162 HydrophobicContact CD2-CD1 4.34Å; L133-L162 HydrophobicContact CD2-CD2 3.7Å; I138-L162 HydrophobicContact CG1-CD2 3.95Å; L162-F165 HydrophobicContact CB-CE2 4.35Å; L162-F165 HydrophobicContact CB-CZ 3.98Å; L162-F165 WeakPolarHBondContact O-CE2 3.36Å
163	A	88.4	Confident	72.9	Confident	11 Å²	11	43.2 Å²	43.2	9%	0.091	22%	0.219	C	C	.	.			trans	-143	168	-176.2	0	0	0	0	0	112.2	V70 H130 N137 L139	V70-A163 HydrophobicContact CB-CB 4.44Å; V70-A163 HydrophobicContact CG2-CB 3.76Å; H130-A163 PolarHBondContact CE1-O 3.46Å; H130-A163 PolarHBondContact NE2-O 2.88Å; N137-A163 WeakPolarHBondContact CB-O 3.31Å; N137-A163 PolarHBondContact O-N 2.81Å; L139-A163 HydrophobicContact CD1-CB 3.76Å; L139-A163 HydrophobicContact CG-CB 3.79Å
164	D	80.6	Confident	71	Confident	47 Å²	47	46.6 Å²	46.6	25%	0.251	26%	0.256	S	S	.	.			trans	62.7	61.6	179.2	-166.6	37.7	0	0	0	114.1	K39 N137 G166	K39-D164 IonicContact NZ-OD1 2.91Å; K39-D164 PolarHBondContact NZ-OD1 3.23Å; N137-D164 PolarHBondContact ND2-OD2 3.48Å; D164-G166 PolarHBondContact O-N 2.98Å; D164-G166 VanDerWaalsContact O-N 3.07Å
165	F	76.7	Confident	69	Low	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-76.4	15.5	176.2	-66.2	-100.9	0	0	0	112.7	E57 V60 L61 L64 I69 M123 H130 L162 F167 A168	E57-F165 HydrophobicContact CG-CB 4.18Å; E57-F165 PolarHBondContact OE1-N 2.88Å; V60-F165 HydrophobicContact CG1-CB 4.17Å; V60-F165 HydrophobicContact CG1-CD1 3.5Å; V60-F165 VanDerWaalsContact CG1-CD1 3.5Å; V60-F165 HydrophobicContact CG1-CE1 4.14Å; V60-F165 HydrophobicContact CG1-CG 4.05Å; L61-F165 HydrophobicContact CD2-CD2 3.48Å; L61-F165 VanDerWaalsContact CD2-CD2 3.48Å; L61-F165 HydrophobicContact CD2-CE2 3.71Å; L61-F165 HydrophobicContact CD2-CG 4.16Å; L61-F165 HydrophobicContact CG-CD2 4.16Å; L61-F165 HydrophobicContact CG-CG 4.5Å; L64-F165 HydrophobicContact CD1-CE1 4.16Å; I69-F165 HydrophobicContact CD1-CZ 4.3Å; I69-F165 HydrophobicContact CG1-CZ 4.34Å; I69-F165 HydrophobicContact CG2-CE2 3.8Å; I69-F165 HydrophobicContact CG2-CZ 3.65Å; M123-F165 HydrophobicContact CE-CD1 4.22Å; M123-F165 HydrophobicContact CE-CE1 3.75Å; M123-F165 HydrophobicContact CG-CE1 4.48Å; M123-F165 HydrophobicContact SD-CE1 3.7Å; M123-F165 HydrophobicContact SD-CZ 4.37Å; H130-F165 AromaticContact CD2-CD1 3.84Å; H130-F165 AromaticContact CD2-CE1 3.67Å; L162-F165 HydrophobicContact CB-CE2 4.35Å; L162-F165 HydrophobicContact CB-CZ 3.98Å; L162-F165 WeakPolarHBondContact O-CE2 3.36Å; F165-F167 PolarHBondContact O-N 3.47Å; F165-F167 VanDerWaalsContact O-N 3.13Å; F165-A168 HydrophobicContact CB-CB 3.92Å; F165-A168 HydrophobicContact CD1-CB 4.02Å; F165-A168 HydrophobicContact CG-CB 4.48Å; F165-A168 VanDerWaalsContact O-CB 3.25Å; F165-A168 WeakPolarHBondContact O-CB 3.5Å; F165-A168 PolarHBondContact O-N 3.15Å
166	G	63.2	Low	67.5	Low	9 Å²	9	51.5 Å²	51.5	9%	0.093	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-57.3	-25.6	176.5	0	0	0	0	0	113.8	L53 D164	L53-G166 VanDerWaalsContact CD2-O 3.3Å; L53-G166 WeakPolarHBondContact CD2-O 3.39Å; D164-G166 PolarHBondContact O-N 2.98Å; D164-G166 VanDerWaalsContact O-N 3.07Å
167	F	62.1	Low	65.7	Low	42 Å²	42	45.1 Å²	45.1	18%	0.184	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-99.5	0.6	173.2	-64	-69	0	0	0	114.5	F20 R131 D132 F165 C181	F20-F167 HydrophobicContact CE2-CZ 4.19Å; R131-F167 PolarHBondContact NE-O 3.24Å; R131-F167 PolarHBondContact NH2-O 3.05Å; D132-F167 HydrophobicContact CB-CB 4.29Å; D132-F167 HydrophobicContact CB-CD2 3.75Å; D132-F167 HydrophobicContact CB-CG 4.35Å; F165-F167 PolarHBondContact O-N 3.47Å; F165-F167 VanDerWaalsContact O-N 3.13Å; F167-C181 HydrophobicContact CB-CB 4.41Å; F167-C181 HydrophobicContact CD1-CB 3.77Å; F167-C181 HydrophobicContact CE1-CB 4.43Å; F167-C181 HydrophobicContact CG-CB 4.31Å
168	A	55.2	Low	63.9	Low	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.242	C	C	.	.			trans	-64.5	155	-177.9	0	0	0	0	0	112.5	V60 M129 F165	V60-A168 HydrophobicContact CG1-CB 4.17Å; V60-A168 HydrophobicContact CG2-CB 4.04Å; M129-A168 VanDerWaalsContact O-CA 3.28Å; M129-A168 WeakPolarHBondContact O-CA 3.38Å; F165-A168 HydrophobicContact CB-CB 3.92Å; F165-A168 HydrophobicContact CD1-CB 4.02Å; F165-A168 HydrophobicContact CG-CB 4.48Å; F165-A168 VanDerWaalsContact O-CB 3.25Å; F165-A168 WeakPolarHBondContact O-CB 3.5Å; F165-A168 PolarHBondContact O-N 3.15Å
169	R	62.4	Low	62.1	Low	20 Å²	20	45.5 Å²	45.5	8%	0.075	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	139	179.8	162.1	170.9	157.2	167.7	-14.3	110.6	M129 M176 Y1010	M129-R169 PolarHBondContact N-O 2.9Å; M129-R169 VanDerWaalsContact N-O 3.09Å; M129-R169 PolarHBondContact O-N 3.1Å; R169-M176 PolarHBondContact NH2-O 3.03Å; R169-Y1010 VanDerWaalsContact CZ-OH 3.28Å; R169-Y1010 PolarHBondContact NE-OH 3.25Å; R169-Y1010 PolarHBondContact NH2-OH 3.09Å
170	F	52	Low	60.4	Low	114 Å²	114	47.5 Å²	47.5	50%	0.5	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	132.7	162.9	-172.9	-100.6	0	0	0	110.6	K126 G127 F128 Q172 Y1010	K126-F170 WeakPolarHBondContact O-CD2 3.44Å; K126-F170 VanDerWaalsContact O-CE2 3.28Å; K126-F170 WeakPolarHBondContact O-CE2 3.4Å; G127-F170 CarbonylContact O-C 3.34Å; G127-F170 WeakPolarHBondContact O-CA 3.47Å; F128-F170 HydrophobicContact CD1-CB 4.13Å; F128-F170 HydrophobicContact CD1-CD2 4.15Å; F128-F170 HydrophobicContact CE1-CB 3.93Å; F128-F170 AromaticContact CE1-CD2 3.83Å; F128-F170 HydrophobicContact CE1-CD2 3.83Å; F128-F170 HydrophobicContact CE1-CG 4.38Å; F128-F170 HydrophobicContact CZ-CD2 4.44Å; F170-Q172 HydrophobicContact CE1-CB 4.14Å; F170-Y1010 PolarHBondContact O-OH 2.69Å
171	L	53.5	Low	58.5	Low	23 Å²	23	48.4 Å²	48.4	12%	0.12	27%	0.27	C	S	.	.			trans	-122.4	112.2	177.4	-162.8	72.4	0	0	0	107.2	G127 M129 M175	G127-L171 PolarHBondContact O-N 3.3Å; M129-L171 HydrophobicContact CE-CB 4.26Å; M129-L171 HydrophobicContact CE-CD1 3.85Å; M129-L171 HydrophobicContact CE-CD2 3.83Å; M129-L171 HydrophobicContact CE-CG 4.21Å; M129-L171 HydrophobicContact CG-CD2 4.5Å; M129-L171 HydrophobicContact SD-CD2 3.89Å; L171-M175 HydrophobicContact CD1-CB 4.16Å; L171-M175 WeakPolarHBondContact CD1-O 3.31Å; L171-M175 WeakPolarHBondContact CD2-O 3.5Å; L171-M175 WeakPolarHBondContact CG-O 3.31Å
172	Q	44.3	Very low	57.1	Low	124 Å²	124	49 Å²	49	58%	0.579	28%	0.278	S	S	*	.			trans	-73.8	144.6	170.2	-166.4	171.7	17.1	0	0	108.8	F170 G174 M175	F170-Q172 HydrophobicContact CE1-CB 4.14Å; Q172-G174 PolarHBondContact O-N 2.83Å; Q172-M175 HydrophobicContact CB-CG 4.11Å; Q172-M175 HydrophobicContact CB-SD 4.03Å; Q172-M175 VanDerWaalsContact O-CB 3.25Å; Q172-M175 WeakPolarHBondContact O-CB 3.37Å; Q172-M175 WeakPolarHBondContact O-CG 3.48Å; Q172-M175 PolarHBondContact O-N 3.47Å
173	D	45.4	Very low	56.2	Low	166 Å²	166	50.5 Å²	50.5	89%	0.888	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	133.5	-172.9	-68.5	-59.9	0	0	0	113.1	M175	D173-M175 PolarHBondContact O-N 2.95Å
174	G	39.4	Very low	55.6	Low	83 Å²	83	52 Å²	52	86%	0.856	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	-10.2	-176.7	0	0	0	0	0	115.6	Q172	Q172-G174 PolarHBondContact O-N 2.83Å
175	M	37	Very low	55.6	Low	80 Å²	80	52.4 Å²	52.4	39%	0.394	30%	0.298	S	S	.	.			trans	-75.2	152.9	168	-58.1	-160.1	96.1	0	0	110.8	L171 Q172 D173 Y1010	L171-M175 HydrophobicContact CD1-CB 4.16Å; L171-M175 WeakPolarHBondContact CD1-O 3.31Å; L171-M175 WeakPolarHBondContact CD2-O 3.5Å; L171-M175 WeakPolarHBondContact CG-O 3.31Å; Q172-M175 HydrophobicContact CB-CG 4.11Å; Q172-M175 HydrophobicContact CB-SD 4.03Å; Q172-M175 VanDerWaalsContact O-CB 3.25Å; Q172-M175 WeakPolarHBondContact O-CB 3.37Å; Q172-M175 WeakPolarHBondContact O-CG 3.48Å; Q172-M175 PolarHBondContact O-N 3.47Å; D173-M175 PolarHBondContact O-N 2.95Å; M175-Y1010 HydrophobicContact CE-CE2 3.83Å; M175-Y1010 HydrophobicContact SD-CE2 4.01Å
176	M	45.9	Very low	56.1	Low	85 Å²	85	53.8 Å²	53.8	42%	0.419	30%	0.304	S	S	.	.			trans	-130.8	150.8	173.6	-76.1	-174.1	-88.6	0	0	110.2	R169 K196 Y197 D198	R169-M176 PolarHBondContact NH2-O 3.03Å; M176-K196 HydrophobicContact CB-CB 3.59Å; M176-K196 HydrophobicContact CB-CD 4.33Å; M176-K196 HydrophobicContact CB-CG 4.05Å; M176-K196 HydrophobicContact CE-CB 4.05Å; M176-K196 HydrophobicContact CE-CD 4.29Å; M176-K196 HydrophobicContact CG-CB 4.26Å; M176-K196 HydrophobicContact SD-CB 3.7Å; M176-Y197 CarbonylContact C-O 3.59Å; M176-Y197 VanDerWaalsContact CA-O 3.31Å; M176-Y197 WeakPolarHBondContact CA-O 3.32Å; M176-Y197 WeakPolarHBondContact CB-O 3.29Å; M176-D198 HydrophobicContact CG-CB 4.32Å
177	A	40.2	Very low	57.1	Low	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-92.2	155.6	179.7	0	0	0	0	0	112.1	M129 K196 Y197	M129-A177 HydrophobicContact CE-CB 4Å; A177-K196 VanDerWaalsContact O-CA 3.31Å; A177-K196 WeakPolarHBondContact O-CA 3.31Å; A177-Y197 HydrophobicContact CB-CD1 4.34Å; A177-Y197 HydrophobicContact CB-CD2 4.04Å; A177-Y197 HydrophobicContact CB-CE1 3.87Å; A177-Y197 HydrophobicContact CB-CE2 3.53Å; A177-Y197 HydrophobicContact CB-CG 4.41Å; A177-Y197 VanDerWaalsContact CB-CZ 3.43Å; A177-Y197 PolarHBondContact N-O 3.36Å; A177-Y197 WeakPolarHBondContact O-CD1 3.21Å; A177-Y197 WeakPolarHBondContact O-CE1 3.47Å; A177-Y197 PolarHBondContact O-N 3.39Å
178	V	46.1	Very low	57.9	Low	63 Å²	63	52.1 Å²	52.1	38%	0.382	30%	0.295	S	S	.	.			trans	-127.5	-26.6	-175.2	-173.5	0	0	0	0	112.3	M180 K196	V178-M180 PolarHBondContact O-N 3.32Å; V178-K196 HydrophobicContact CG2-CG 4.12Å
179	T	49.6	Very low	59	Low	47 Å²	47	52.1 Å²	52.1	29%	0.288	30%	0.295	S	S	.	.			trans	-62.2	123.5	178.5	-19.4	0	0	0	0	111	C181 Y197 M1007	T179-C181 PolarHBondContact O-N 2.87Å; T179-Y197 WeakPolarHBondContact O-CE1 3.42Å; T179-Y197 PolarHBondContact O-OH 3.39Å; T179-M1007 HydrophobicContact CG2-SD 4.19Å; T179-M1007 PolarHBondContact OG1-SD 3.47Å
180	M	52.9	Low	59.8	Low	71 Å²	71	51.3 Å²	51.3	35%	0.35	29%	0.292	S	S	.	.			trans	-70.8	120.6	164.7	-70.7	-161.9	-62.1	0	0	109.3	V178 V191 C194 P828	V178-M180 PolarHBondContact O-N 3.32Å; M180-V191 WeakPolarHBondContact CG-O 3.44Å; M180-C194 PolarHBondContact SD-SG 3.08Å; M180-P828 HydrophobicContact CE-CG 3.64Å
181	C	50.9	Low	60.7	Low	22 Å²	22	46.4 Å²	46.4	15%	0.149	27%	0.271	C	S	.	.			trans	-144.1	150.9	176.6	-67.9	0	0	0	0	108.4	F167 T179 M187	F167-C181 HydrophobicContact CB-CB 4.41Å; F167-C181 HydrophobicContact CD1-CB 3.77Å; F167-C181 HydrophobicContact CE1-CB 4.43Å; F167-C181 HydrophobicContact CG-CB 4.31Å; T179-C181 PolarHBondContact O-N 2.87Å; C181-M187 WeakPolarHBondContact O-CE 3.47Å
182	G	61.4	Low	61.1	Low	21 Å²	21	45.7 Å²	45.7	22%	0.216	27%	0.267	C	S	.	.	S	Bend	trans	95	-164.8	179.2	0	0	0	0	0	115.1	D132 M187	D132-G182 VanDerWaalsContact CG-CA 3.44Å; D132-G182 WeakPolarHBondContact OD1-CA 3.46Å; G182-M187 VanDerWaalsContact C-CE 3.44Å; G182-M187 WeakPolarHBondContact O-CE 3.42Å
183	S	73.9	Confident	61.7	Low	32 Å²	32	41 Å²	41	22%	0.224	25%	0.245	C	C	.	.			trans	-100	112.4	-165.1	-58.5	0	0	0	0	112.6	D132 K134 M185 Y186 M187	D132-S183 VanDerWaalsContact OD1-CB 3.31Å; D132-S183 WeakPolarHBondContact OD1-CB 3.45Å; D132-S183 PolarHBondContact OD1-N 3.49Å; D132-S183 PolarHBondContact OD1-OG 3.33Å; K134-S183 WeakPolarHBondContact CD-OG 3.49Å; S183-M185 VanDerWaalsContact C-N 3.3Å; S183-M185 PolarHBondContact O-N 3.06Å; S183-Y186 PolarHBondContact O-N 3Å; S183-M187 PolarHBondContact O-N 3.19Å
184	P	74.5	Confident	62.2	Low	43 Å²	43	35.8 Å²	35.8	28%	0.279	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-32.1	-165	-32.6	37.3	0	0	0	117.4	Y186 M187 L192 P225 L228	P184-Y186 PolarHBondContact O-N 2.86Å; P184-M187 HydrophobicContact CG-CE 4.15Å; P184-M187 PolarHBondContact O-N 3.03Å; P184-L192 HydrophobicContact CB-CD1 4.25Å; P184-P225 HydrophobicContact CB-CB 3.99Å; P184-P225 HydrophobicContact CB-CG 4.2Å; P184-P225 HydrophobicContact CG-CB 4.08Å; P184-P225 HydrophobicContact CG-CG 3.98Å; P184-L228 WeakPolarHBondContact O-CD2 3.25Å
185	M	81.8	Confident	62.6	Low	55 Å²	55	39 Å²	39	27%	0.271	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.4	177.8	-168.9	-177.6	-58.1	0	0	113.3	S183 A218 Y221	S183-M185 VanDerWaalsContact C-N 3.3Å; S183-M185 PolarHBondContact O-N 3.06Å; M185-A218 HydrophobicContact CG-CB 3.98Å; M185-A218 HydrophobicContact SD-CB 3.75Å; M185-Y221 HydrophobicContact CE-CD2 3.92Å; M185-Y221 HydrophobicContact CE-CE2 4.1Å
186	Y	87.4	Confident	63.3	Low	30 Å²	30	41.9 Å²	41.9	12%	0.118	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-10.1	-178.5	-51.4	-85.7	0	0	0	112.3	L133 K134 P135 S183 P184 S205 I208 I209 Q212	L133-Y186 VanDerWaalsContact O-CB 3.28Å; L133-Y186 WeakPolarHBondContact O-CB 3.37Å; K134-Y186 HydrophobicContact CB-CD2 3.75Å; K134-Y186 HydrophobicContact CB-CE2 3.91Å; K134-Y186 HydrophobicContact CB-CG 4.1Å; P135-Y186 VanDerWaalsContact CD-CZ 3.41Å; P135-Y186 WeakPolarHBondContact CD-OH 2.97Å; P135-Y186 HydrophobicContact CG-CE1 3.99Å; S183-Y186 PolarHBondContact O-N 3Å; P184-Y186 PolarHBondContact O-N 2.86Å; Y186-S205 WeakPolarHBondContact O-CA 3.31Å; Y186-S205 WeakPolarHBondContact O-CB 3.12Å; Y186-S205 PolarHBondContact O-OG 3.17Å; Y186-I208 HydrophobicContact CD1-CB 4.13Å; Y186-I208 HydrophobicContact CD1-CG2 3.5Å; Y186-I208 HydrophobicContact CE1-CG2 3.88Å; Y186-I208 HydrophobicContact CG-CG2 4.42Å; Y186-I209 HydrophobicContact CD1-CG1 4.06Å; Y186-I209 HydrophobicContact CE1-CG1 4.29Å; Y186-Q212 PolarHBondContact OH-OE1 3.3Å
187	M	82.6	Confident	63.7	Low	15 Å²	15	38.1 Å²	38.1	7%	0.074	20%	0.2	C	C	.	.	S	Bend	trans	-62.3	141.5	175.5	-71.9	-172.6	-168.6	0	0	111.4	C181 G182 S183 P184 V191 L192 W204	C181-M187 WeakPolarHBondContact O-CE 3.47Å; G182-M187 VanDerWaalsContact C-CE 3.44Å; G182-M187 WeakPolarHBondContact O-CE 3.42Å; S183-M187 PolarHBondContact O-N 3.19Å; P184-M187 HydrophobicContact CG-CE 4.15Å; P184-M187 PolarHBondContact O-N 3.03Å; M187-V191 HydrophobicContact CB-CB 4.46Å; M187-V191 HydrophobicContact CG-CG1 4.31Å; M187-V191 HydrophobicContact SD-CG1 4.04Å; M187-L192 HydrophobicContact CB-CB 4.5Å; M187-L192 HydrophobicContact SD-CD1 3.77Å; M187-W204 PolarHBondContact O-NE1 2.97Å
188	A	80.5	Confident	65	Low	1 Å²	1	40.6 Å²	40.6	1%	0.008	21%	0.213	C	C	.	.			trans	-69.8	150.3	170.1	0	0	0	0	0	111.7	E190 V191 L192 A201 W204	A188-E190 VanDerWaalsContact C-N 3.26Å; A188-E190 HydrophobicContact CB-CG 4.48Å; A188-E190 WeakPolarHBondContact CB-OE1 3.49Å; A188-E190 WeakPolarHBondContact CB-OE2 3.39Å; A188-E190 PolarHBondContact O-N 3.43Å; A188-V191 HydrophobicContact CB-CG2 4.1Å; A188-V191 WeakPolarHBondContact O-CB 3.43Å; A188-V191 PolarHBondContact O-N 3.41Å; A188-L192 PolarHBondContact O-N 3.33Å; A188-L192 VanDerWaalsContact O-N 3.12Å; A188-A201 HydrophobicContact CB-CB 4.13Å; A188-W204 HydrophobicContact CB-CB 3.71Å; A188-W204 HydrophobicContact CB-CD2 4.4Å; A188-W204 HydrophobicContact CB-CG 3.71Å
189	P	76.7	Confident	66.1	Low	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-55	-39.3	-176	-31	39.5	0	0	0	113.6	L192 M193 W204 Y232 L238 R260	P189-L192 PolarHBondContact O-N 3.02Å; P189-M193 HydrophobicContact CB-CE 3.56Å; P189-M193 VanDerWaalsContact O-CB 3.24Å; P189-M193 WeakPolarHBondContact O-CB 3.16Å; P189-M193 VanDerWaalsContact O-CE 3.27Å; P189-M193 WeakPolarHBondContact O-CE 3.49Å; P189-M193 VanDerWaalsContact O-CG 3.23Å; P189-M193 WeakPolarHBondContact O-CG 3.12Å; P189-M193 PolarHBondContact O-N 3.13Å; P189-W204 HydrophobicContact CG-CD2 4.43Å; P189-W204 HydrophobicContact CG-CE3 4.24Å; P189-W204 HydrophobicContact CG-CH2 3.64Å; P189-W204 HydrophobicContact CG-CZ2 3.82Å; P189-W204 HydrophobicContact CG-CZ3 3.84Å; P189-Y232 HydrophobicContact CB-CD2 3.95Å; P189-Y232 HydrophobicContact CB-CG 4.11Å; P189-Y232 HydrophobicContact CG-CD1 4.46Å; P189-Y232 HydrophobicContact CG-CD2 3.98Å; P189-Y232 HydrophobicContact CG-CE2 4.2Å; P189-Y232 HydrophobicContact CG-CG 4.12Å; P189-L238 HydrophobicContact CG-CD1 3.99Å; P189-R260 HydrophobicContact CB-CG 3.9Å; P189-R260 HydrophobicContact CG-CG 4.05Å
190	E	79.6	Confident	67.7	Low	3 Å²	3	36.8 Å²	36.8	1%	0.014	19%	0.191	C	C	.	.	H	α-helix	trans	-64.1	-37.6	176.6	66.2	-78.8	-173.7	0	0	113.2	A188 M193 C194 R195 P262 R265	A188-E190 VanDerWaalsContact C-N 3.26Å; A188-E190 HydrophobicContact CB-CG 4.48Å; A188-E190 WeakPolarHBondContact CB-OE1 3.49Å; A188-E190 WeakPolarHBondContact CB-OE2 3.39Å; A188-E190 PolarHBondContact O-N 3.43Å; E190-M193 CarbonylContact O-C 3.56Å; E190-M193 PolarHBondContact O-N 2.99Å; E190-C194 PolarHBondContact O-N 3.31Å; E190-R195 HydrophobicContact CB-CB 4.21Å; E190-R195 WeakPolarHBondContact O-CB 3.05Å; E190-R195 PolarHBondContact O-N 3.49Å; E190-P262 HydrophobicContact CB-CG 3.92Å; E190-P262 HydrophobicContact CG-CG 3.61Å; E190-R265 IonicContact OE1-CZ 3.62Å; E190-R265 IonicContact OE1-NH1 3.25Å; E190-R265 PolarHBondContact OE1-NH1 2.93Å; E190-R265 IonicContact OE1-NH2 2.7Å; E190-R265 PolarHBondContact OE1-NH2 3.37Å; E190-R265 IonicContact OE2-CZ 2.7Å; E190-R265 IonicContact OE2-NH1 3.52Å; E190-R265 IonicContact OE2-NH2 2.96Å; E190-R265 PolarHBondContact OE2-NH2 2.92Å
191	V	71.7	Confident	69.2	Low	10 Å²	10	33.8 Å²	33.8	6%	0.061	18%	0.178	C	C	.	.	H	α-helix	trans	-66.5	-48.1	177	-177.9	0	0	0	0	109.6	M180 M187 A188 M193 C194 Y197 A201	M180-V191 WeakPolarHBondContact CG-O 3.44Å; M187-V191 HydrophobicContact CB-CB 4.46Å; M187-V191 HydrophobicContact CG-CG1 4.31Å; M187-V191 HydrophobicContact SD-CG1 4.04Å; A188-V191 HydrophobicContact CB-CG2 4.1Å; A188-V191 WeakPolarHBondContact O-CB 3.43Å; A188-V191 PolarHBondContact O-N 3.41Å; V191-M193 VanDerWaalsContact C-N 3.26Å; V191-M193 PolarHBondContact O-N 2.92Å; V191-C194 WeakPolarHBondContact O-CA 3.37Å; V191-C194 PolarHBondContact O-N 3.11Å; V191-Y197 HydrophobicContact CB-CD1 4.36Å; V191-Y197 HydrophobicContact CG1-CD1 4.33Å; V191-Y197 HydrophobicContact CG1-CE1 4.11Å; V191-Y197 HydrophobicContact CG2-CD1 3.86Å; V191-Y197 HydrophobicContact CG2-CD2 4.07Å; V191-Y197 HydrophobicContact CG2-CE1 4.34Å; V191-Y197 HydrophobicContact CG2-CG 3.72Å; V191-A201 HydrophobicContact CG2-CB 3.92Å
192	L	60.5	Low	70.8	Confident	9 Å²	9	32.9 Å²	32.9	5%	0.047	17%	0.171	C	C	.	.	H	α-helix	trans	-69.4	-24.7	179	-161.3	67.5	0	0	0	112.5	P184 M187 A188 P189 C194 L228 K229 Y232	P184-L192 HydrophobicContact CB-CD1 4.25Å; M187-L192 HydrophobicContact CB-CB 4.5Å; M187-L192 HydrophobicContact SD-CD1 3.77Å; A188-L192 PolarHBondContact O-N 3.33Å; A188-L192 VanDerWaalsContact O-N 3.12Å; P189-L192 PolarHBondContact O-N 3.02Å; L192-C194 VanDerWaalsContact C-N 3.26Å; L192-C194 PolarHBondContact O-N 3.24Å; L192-L228 HydrophobicContact CD2-CB 4.33Å; L192-L228 HydrophobicContact CD2-CD2 4.35Å; L192-L228 HydrophobicContact CD2-CG 4.16Å; L192-K229 HydrophobicContact CD2-CB 3.89Å; L192-K229 HydrophobicContact CG-CB 4.02Å; L192-K229 HydrophobicContact CG-CG 4.42Å; L192-K229 WeakPolarHBondContact O-CD 3.45Å; L192-K229 WeakPolarHBondContact O-CE 3.29Å; L192-K229 PolarHBondContact O-NZ 3.31Å; L192-Y232 HydrophobicContact CD2-CD2 3.78Å; L192-Y232 HydrophobicContact CD2-CE2 3.91Å
193	M	57.7	Low	72.1	Confident	24 Å²	24	32 Å²	32	12%	0.118	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	6.7	168.8	-74.5	-175	-102.9	0	0	113.9	P189 E190 V191 R195 E233	P189-M193 HydrophobicContact CB-CE 3.56Å; P189-M193 VanDerWaalsContact O-CB 3.24Å; P189-M193 WeakPolarHBondContact O-CB 3.16Å; P189-M193 VanDerWaalsContact O-CE 3.27Å; P189-M193 WeakPolarHBondContact O-CE 3.49Å; P189-M193 VanDerWaalsContact O-CG 3.23Å; P189-M193 WeakPolarHBondContact O-CG 3.12Å; P189-M193 PolarHBondContact O-N 3.13Å; E190-M193 CarbonylContact O-C 3.56Å; E190-M193 PolarHBondContact O-N 2.99Å; V191-M193 VanDerWaalsContact C-N 3.26Å; V191-M193 PolarHBondContact O-N 2.92Å; M193-R195 HydrophobicContact CB-CG 3.94Å; M193-R195 PolarHBondContact O-N 3.08Å; M193-E233 HydrophobicContact CG-CG 3.76Å; M193-E233 HydrophobicContact SD-CG 3.75Å
194	C	55.3	Low	73	Confident	58 Å²	58	30.4 Å²	30.4	39%	0.392	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	31.5	-178.5	-43.8	0	0	0	0	113.8	M180 E190 V191 L192	M180-C194 PolarHBondContact SD-SG 3.08Å; E190-C194 PolarHBondContact O-N 3.31Å; V191-C194 WeakPolarHBondContact O-CA 3.37Å; V191-C194 PolarHBondContact O-N 3.11Å; L192-C194 VanDerWaalsContact C-N 3.26Å; L192-C194 PolarHBondContact O-N 3.24Å
195	R	49	Very low	73.8	Confident	149 Å²	149	28.7 Å²	28.7	56%	0.562	14%	0.139	S	C	*	.			trans	-86.7	159.8	177.3	-57.9	-176.1	-176.2	-138	-1.9	110	E190 M193 Y197	E190-R195 HydrophobicContact CB-CB 4.21Å; E190-R195 WeakPolarHBondContact O-CB 3.05Å; E190-R195 PolarHBondContact O-N 3.49Å; M193-R195 HydrophobicContact CB-CG 3.94Å; M193-R195 PolarHBondContact O-N 3.08Å; R195-Y197 WeakPolarHBondContact O-CD1 3.28Å; R195-Y197 PolarHBondContact O-N 3.26Å
196	K	50.7	Low	74.2	Confident	142 Å²	142	26.1 Å²	26.1	62%	0.617	13%	0.127	S	C	*	.			trans	-53.6	122.2	165.7	-80.6	-174.4	177.1	-176.6	0	109.6	M176 A177 V178	M176-K196 HydrophobicContact CB-CB 3.59Å; M176-K196 HydrophobicContact CB-CD 4.33Å; M176-K196 HydrophobicContact CB-CG 4.05Å; M176-K196 HydrophobicContact CE-CB 4.05Å; M176-K196 HydrophobicContact CE-CD 4.29Å; M176-K196 HydrophobicContact CG-CB 4.26Å; M176-K196 HydrophobicContact SD-CB 3.7Å; A177-K196 VanDerWaalsContact O-CA 3.31Å; A177-K196 WeakPolarHBondContact O-CA 3.31Å; V178-K196 HydrophobicContact CG2-CG 4.12Å
197	Y	55.4	Low	74.5	Confident	5 Å²	5	24.7 Å²	24.7	2%	0.02	12%	0.121	C	C	.	.	B	Isolated β-bridge	trans	-129.2	159	-179.1	66.7	-96.8	0	0	0	113.6	M129 R131 M176 A177 T179 V191 R195 A201	M129-Y197 HydrophobicContact CE-CD2 4.27Å; M129-Y197 HydrophobicContact CE-CE2 4.05Å; M129-Y197 HydrophobicContact SD-CD2 4.42Å; R131-Y197 WeakPolarHBondContact CD-OH 3.45Å; R131-Y197 HydrophobicContact CG-CE2 4.27Å; R131-Y197 PolarHBondContact NH1-OH 2.93Å; M176-Y197 CarbonylContact C-O 3.59Å; M176-Y197 VanDerWaalsContact CA-O 3.31Å; M176-Y197 WeakPolarHBondContact CA-O 3.32Å; M176-Y197 WeakPolarHBondContact CB-O 3.29Å; A177-Y197 HydrophobicContact CB-CD1 4.34Å; A177-Y197 HydrophobicContact CB-CD2 4.04Å; A177-Y197 HydrophobicContact CB-CE1 3.87Å; A177-Y197 HydrophobicContact CB-CE2 3.53Å; A177-Y197 HydrophobicContact CB-CG 4.41Å; A177-Y197 VanDerWaalsContact CB-CZ 3.43Å; A177-Y197 PolarHBondContact N-O 3.36Å; A177-Y197 WeakPolarHBondContact O-CD1 3.21Å; A177-Y197 WeakPolarHBondContact O-CE1 3.47Å; A177-Y197 PolarHBondContact O-N 3.39Å; T179-Y197 WeakPolarHBondContact O-CE1 3.42Å; T179-Y197 PolarHBondContact O-OH 3.39Å; V191-Y197 HydrophobicContact CB-CD1 4.36Å; V191-Y197 HydrophobicContact CG1-CD1 4.33Å; V191-Y197 HydrophobicContact CG1-CE1 4.11Å; V191-Y197 HydrophobicContact CG2-CD1 3.86Å; V191-Y197 HydrophobicContact CG2-CD2 4.07Å; V191-Y197 HydrophobicContact CG2-CE1 4.34Å; V191-Y197 HydrophobicContact CG2-CG 3.72Å; R195-Y197 WeakPolarHBondContact O-CD1 3.28Å; R195-Y197 PolarHBondContact O-N 3.26Å; Y197-A201 HydrophobicContact CD2-CB 4.29Å
198	D	66	Low	75.1	Confident	53 Å²	53	24 Å²	24	28%	0.283	12%	0.118	S	C	.	.			trans	-138.8	-172.7	-168.8	65	-32.8	0	0	0	111.3	M176 V200 A201	M176-D198 HydrophobicContact CG-CB 4.32Å; D198-V200 PolarHBondContact O-N 3.21Å; D198-V200 VanDerWaalsContact O-N 3.12Å; D198-V200 WeakPolarHBondContact OD1-CG2 3.41Å; D198-A201 VanDerWaalsContact O-CB 3.25Å; D198-A201 WeakPolarHBondContact O-CB 3.5Å; D198-A201 PolarHBondContact O-N 3.4Å
199	A	69.4	Low	75.7	Confident	16 Å²	16	24.1 Å²	24.1	13%	0.132	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.1	-171.1	0	0	0	0	0	114.7	N124 M129 A201 D202 F268	N124-A199 WeakPolarHBondContact OD1-CB 3.44Å; M129-A199 HydrophobicContact CG-CB 4.44Å; A199-A201 PolarHBondContact O-N 3.1Å; A199-D202 PolarHBondContact O-N 2.96Å; A199-F268 HydrophobicContact CB-CD2 4.25Å; A199-F268 HydrophobicContact CB-CE2 4.01Å
200	V	82.7	Confident	76.5	Confident	14 Å²	14	24.5 Å²	24.5	9%	0.085	12%	0.121	C	C	.	.	H	α-helix	trans	-73.2	-7.2	174.2	-53.4	0	0	0	0	113.3	D198 I203 W204 P262 R265	D198-V200 PolarHBondContact O-N 3.21Å; D198-V200 VanDerWaalsContact O-N 3.12Å; D198-V200 WeakPolarHBondContact OD1-CG2 3.41Å; V200-I203 HydrophobicContact CB-CD1 4.43Å; V200-I203 HydrophobicContact CG1-CD1 4.2Å; V200-I203 PolarHBondContact O-N 2.82Å; V200-W204 PolarHBondContact O-N 2.56Å; V200-P262 HydrophobicContact CG2-CB 3.92Å; V200-R265 WeakPolarHBondContact O-CD 3.38Å; V200-R265 PolarHBondContact O-NH1 3.48Å
201	A	85.5	Confident	77.3	Confident	7 Å²	7	25 Å²	25	6%	0.058	12%	0.123	C	C	.	.	H	α-helix	trans	-65.2	-42.4	167.5	0	0	0	0	0	111.8	A188 V191 Y197 D198 A199 I203 W204 S205	A188-A201 HydrophobicContact CB-CB 4.13Å; V191-A201 HydrophobicContact CG2-CB 3.92Å; Y197-A201 HydrophobicContact CD2-CB 4.29Å; D198-A201 VanDerWaalsContact O-CB 3.25Å; D198-A201 WeakPolarHBondContact O-CB 3.5Å; D198-A201 PolarHBondContact O-N 3.4Å; A199-A201 PolarHBondContact O-N 3.1Å; A201-I203 VanDerWaalsContact C-N 3.27Å; A201-I203 PolarHBondContact O-N 3.15Å; A201-W204 WeakPolarHBondContact O-CB 3.25Å; A201-W204 PolarHBondContact O-N 2.87Å; A201-W204 VanDerWaalsContact O-N 3.13Å; A201-S205 PolarHBondContact O-N 3.03Å; A201-S205 PolarHBondContact O-OG 3.46Å
202	D	83.7	Confident	78.3	Confident	4 Å²	4	26 Å²	26	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-66.8	-29.5	176.7	-78.1	-33.2	0	0	0	111.3	M120 H130 R131 L133 A199 S205 M206	M120-D202 HydrophobicContact CE-CB 3.59Å; H130-D202 PolarHBondContact N-OD2 2.93Å; R131-D202 PolarHBondContact N-OD1 3.33Å; L133-D202 HydrophobicContact CD1-CB 3.66Å; A199-D202 PolarHBondContact O-N 2.96Å; D202-S205 PolarHBondContact O-N 3.12Å; D202-M206 WeakPolarHBondContact O-CB 3.34Å; D202-M206 PolarHBondContact O-N 2.98Å
203	I	89.7	Confident	79.9	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-63	-39.1	171.3	-65.6	-178.9	0	0	0	111.7	V200 A201 M206 G207 M257 I266 F268 F271	V200-I203 HydrophobicContact CB-CD1 4.43Å; V200-I203 HydrophobicContact CG1-CD1 4.2Å; V200-I203 PolarHBondContact O-N 2.82Å; A201-I203 VanDerWaalsContact C-N 3.27Å; A201-I203 PolarHBondContact O-N 3.15Å; I203-M206 HydrophobicContact CG1-CE 4.46Å; I203-M206 PolarHBondContact O-N 3.22Å; I203-G207 PolarHBondContact O-N 3.42Å; I203-M257 HydrophobicContact CG2-CB 4.26Å; I203-M257 HydrophobicContact CG2-CE 4.04Å; I203-M257 HydrophobicContact CG2-CG 4Å; I203-M257 WeakPolarHBondContact O-CE 3.19Å; I203-I266 WeakPolarHBondContact CD1-O 3.27Å; I203-I266 HydrophobicContact CG2-CG2 3.93Å; I203-F268 HydrophobicContact CD1-CB 4.47Å; I203-F268 HydrophobicContact CD1-CD2 3.8Å; I203-F268 HydrophobicContact CD1-CE2 4.38Å; I203-F268 HydrophobicContact CD1-CG 4.2Å; I203-F268 HydrophobicContact CG1-CD2 4.22Å; I203-F268 HydrophobicContact CG1-CE2 4.31Å; I203-F271 HydrophobicContact CD1-CB 4.39Å
204	W	92	Very high	81.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.4	-47	173.8	169.6	-77.9	0	0	0	111.1	M187 A188 P189 V200 A201 M206 G207 I208 F220 Y232 L238 L258	M187-W204 PolarHBondContact O-NE1 2.97Å; A188-W204 HydrophobicContact CB-CB 3.71Å; A188-W204 HydrophobicContact CB-CD2 4.4Å; A188-W204 HydrophobicContact CB-CG 3.71Å; P189-W204 HydrophobicContact CG-CD2 4.43Å; P189-W204 HydrophobicContact CG-CE3 4.24Å; P189-W204 HydrophobicContact CG-CH2 3.64Å; P189-W204 HydrophobicContact CG-CZ2 3.82Å; P189-W204 HydrophobicContact CG-CZ3 3.84Å; V200-W204 PolarHBondContact O-N 2.56Å; A201-W204 WeakPolarHBondContact O-CB 3.25Å; A201-W204 PolarHBondContact O-N 2.87Å; A201-W204 VanDerWaalsContact O-N 3.13Å; W204-M206 VanDerWaalsContact C-N 3.3Å; W204-M206 PolarHBondContact O-N 2.73Å; W204-G207 CarbonylContact O-C 3.45Å; W204-G207 WeakPolarHBondContact O-CA 3.49Å; W204-G207 PolarHBondContact O-N 2.72Å; W204-I208 HydrophobicContact CZ2-CD1 4.03Å; W204-I208 PolarHBondContact O-N 3.36Å; W204-F220 HydrophobicContact CH2-CD2 4.04Å; W204-F220 AromaticContact CH2-CE2 3.59Å; W204-F220 HydrophobicContact CH2-CE2 3.59Å; W204-F220 AromaticContact CZ2-CD2 3.86Å; W204-F220 HydrophobicContact CZ2-CD2 3.86Å; W204-F220 AromaticContact CZ2-CE2 3.83Å; W204-F220 HydrophobicContact CZ2-CE2 3.83Å; W204-Y232 HydrophobicContact CZ2-CE1 4.17Å; W204-Y232 AromaticContact CZ2-CZ 3.91Å; W204-L238 HydrophobicContact CH2-CD1 3.71Å; W204-L238 HydrophobicContact CZ3-CD1 4.41Å; W204-L258 HydrophobicContact CD2-CD2 4.05Å; W204-L258 HydrophobicContact CE3-CD2 4.16Å; W204-L258 HydrophobicContact CH2-CD2 4.43Å; W204-L258 HydrophobicContact CZ2-CD2 4.35Å; W204-L258 HydrophobicContact CZ3-CB 4.28Å; W204-L258 HydrophobicContact CZ3-CD2 4.36Å; W204-L258 WeakPolarHBondContact CZ3-O 3.28Å
205	S	91.1	Very high	83.5	Confident	6 Å²	6	24.4 Å²	24.4	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-58.7	-42.8	178.8	-56	0	0	0	0	111.6	Y186 A201 D202 G207 I208 I209	Y186-S205 WeakPolarHBondContact O-CA 3.31Å; Y186-S205 WeakPolarHBondContact O-CB 3.12Å; Y186-S205 PolarHBondContact O-OG 3.17Å; A201-S205 PolarHBondContact O-N 3.03Å; A201-S205 PolarHBondContact O-OG 3.46Å; D202-S205 PolarHBondContact O-N 3.12Å; S205-G207 VanDerWaalsContact C-N 3.32Å; S205-G207 PolarHBondContact O-N 2.84Å; S205-I208 WeakPolarHBondContact O-CB 3.04Å; S205-I208 PolarHBondContact O-N 2.86Å; S205-I209 WeakPolarHBondContact O-CD1 3.42Å; S205-I209 VanDerWaalsContact O-CG1 3.29Å; S205-I209 WeakPolarHBondContact O-CG1 3.46Å; S205-I209 PolarHBondContact O-N 3.49Å
206	M	91.4	Very high	85.5	Confident	2 Å²	2	19.1 Å²	19.1	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-60.2	-39.1	171.1	-174.3	168.6	41	0	0	112.1	L113 I116 D202 I203 W204 I209 V210 M257 F271	L113-M206 HydrophobicContact CD2-CG 4.04Å; L113-M206 HydrophobicContact CD2-SD 3.76Å; I116-M206 HydrophobicContact CB-SD 4.17Å; I116-M206 HydrophobicContact CG2-CG 4.26Å; I116-M206 HydrophobicContact CG2-SD 3.52Å; I116-M206 VanDerWaalsContact CG2-SD 3.52Å; D202-M206 WeakPolarHBondContact O-CB 3.34Å; D202-M206 PolarHBondContact O-N 2.98Å; I203-M206 HydrophobicContact CG1-CE 4.46Å; I203-M206 PolarHBondContact O-N 3.22Å; W204-M206 VanDerWaalsContact C-N 3.3Å; W204-M206 PolarHBondContact O-N 2.73Å; M206-I209 PolarHBondContact O-N 3.18Å; M206-V210 HydrophobicContact CG-CG2 4.44Å; M206-V210 WeakPolarHBondContact O-CB 3.16Å; M206-V210 VanDerWaalsContact O-CG2 3.22Å; M206-V210 WeakPolarHBondContact O-CG2 3.3Å; M206-V210 PolarHBondContact O-N 3.42Å; M206-M257 HydrophobicContact CB-CE 3.9Å; M206-M257 HydrophobicContact CE-CE 3.81Å; M206-M257 HydrophobicContact CG-CE 3.78Å; M206-M257 HydrophobicContact SD-CE 4.34Å; M206-F271 HydrophobicContact CE-CD1 4.19Å; M206-F271 HydrophobicContact CE-CD2 4.22Å; M206-F271 HydrophobicContact CE-CE1 3.6Å; M206-F271 HydrophobicContact CE-CE2 3.62Å; M206-F271 HydrophobicContact CE-CG 4.49Å; M206-F271 HydrophobicContact CE-CZ 3.29Å; M206-F271 HydrophobicContact SD-CE1 4.32Å; M206-F271 HydrophobicContact SD-CE2 4.21Å; M206-F271 HydrophobicContact SD-CZ 3.67Å
207	G	94.1	Very high	87.3	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.9	-39.8	173.8	0	0	0	0	0	113.7	I203 W204 S205 Y211 L254	I203-G207 PolarHBondContact O-N 3.42Å; W204-G207 CarbonylContact O-C 3.45Å; W204-G207 WeakPolarHBondContact O-CA 3.49Å; W204-G207 PolarHBondContact O-N 2.72Å; S205-G207 VanDerWaalsContact C-N 3.32Å; S205-G207 PolarHBondContact O-N 2.84Å; G207-Y211 WeakPolarHBondContact O-CB 3.41Å; G207-Y211 PolarHBondContact O-N 3.33Å; G207-L254 WeakPolarHBondContact O-CD2 3.5Å
208	I	94.3	Very high	88.9	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.6	-46.2	173.6	-60.3	-66	0	0	0	110	Y186 W204 S205 Y211 Q212 P219 F220 L258	Y186-I208 HydrophobicContact CD1-CB 4.13Å; Y186-I208 HydrophobicContact CD1-CG2 3.5Å; Y186-I208 HydrophobicContact CE1-CG2 3.88Å; Y186-I208 HydrophobicContact CG-CG2 4.42Å; W204-I208 HydrophobicContact CZ2-CD1 4.03Å; W204-I208 PolarHBondContact O-N 3.36Å; S205-I208 WeakPolarHBondContact O-CB 3.04Å; S205-I208 PolarHBondContact O-N 2.86Å; I208-Y211 PolarHBondContact O-N 3.12Å; I208-Q212 WeakPolarHBondContact O-CB 3.47Å; I208-Q212 PolarHBondContact O-N 3.41Å; I208-P219 HydrophobicContact CD1-CG 3.45Å; I208-P219 VanDerWaalsContact CD1-CG 3.45Å; I208-F220 HydrophobicContact CD1-CD2 4.3Å; I208-L258 HydrophobicContact CD1-CD2 3.63Å; I208-L258 HydrophobicContact CG1-CD2 4.06Å
209	I	93.2	Very high	89.9	Confident	4 Å²	4	18.7 Å²	18.7	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-63.4	-43.3	-179.7	-66.6	160.7	0	0	0	111.2	L94 L133 P135 I138 Y186 S205 M206 Q212 C213	L94-I209 HydrophobicContact CD2-CG2 3.69Å; L133-I209 HydrophobicContact CB-CD1 4.33Å; P135-I209 HydrophobicContact CG-CG1 4.25Å; I138-I209 HydrophobicContact CD1-CD1 3.84Å; I138-I209 HydrophobicContact CD1-CG2 4.18Å; Y186-I209 HydrophobicContact CD1-CG1 4.06Å; Y186-I209 HydrophobicContact CE1-CG1 4.29Å; S205-I209 WeakPolarHBondContact O-CD1 3.42Å; S205-I209 VanDerWaalsContact O-CG1 3.29Å; S205-I209 WeakPolarHBondContact O-CG1 3.46Å; S205-I209 PolarHBondContact O-N 3.49Å; M206-I209 PolarHBondContact O-N 3.18Å; I209-Q212 PolarHBondContact O-N 2.84Å; I209-C213 PolarHBondContact O-N 3.13Å; I209-C213 PolarHBondContact O-SG 3.3Å
210	V	94.5	Very high	90.8	Very high	7 Å²	7	19 Å²	19	4%	0.042	11%	0.107	C	C	.	.	H	α-helix	trans	-64	-43.5	176.9	171.1	0	0	0	0	111.5	I109 L113 M206 Q212 C213 L214 L250 L254	I109-V210 HydrophobicContact CG2-CG1 3.85Å; L113-V210 HydrophobicContact CD1-CG1 4.04Å; L113-V210 HydrophobicContact CD1-CG2 3.67Å; L113-V210 HydrophobicContact CD2-CG2 3.8Å; L113-V210 HydrophobicContact CG-CG2 3.63Å; M206-V210 HydrophobicContact CG-CG2 4.44Å; M206-V210 WeakPolarHBondContact O-CB 3.16Å; M206-V210 VanDerWaalsContact O-CG2 3.22Å; M206-V210 WeakPolarHBondContact O-CG2 3.3Å; M206-V210 PolarHBondContact O-N 3.42Å; V210-Q212 VanDerWaalsContact C-N 3.32Å; V210-Q212 PolarHBondContact O-N 3.32Å; V210-C213 WeakPolarHBondContact O-CB 3.24Å; V210-C213 PolarHBondContact O-N 3.32Å; V210-L214 WeakPolarHBondContact O-CB 3.44Å; V210-L214 PolarHBondContact O-N 2.7Å; V210-L250 HydrophobicContact CG1-CD1 3.71Å; V210-L254 HydrophobicContact CB-CD2 4.09Å; V210-L254 HydrophobicContact CG1-CD2 3.76Å; V210-L254 HydrophobicContact CG1-CG 4.2Å
211	Y	95.2	Very high	90.8	Very high	15 Å²	15	23.8 Å²	23.8	6%	0.059	13%	0.125	C	C	.	.	H	α-helix	trans	-62.8	-40.7	174.7	-175.8	-81.3	0	0	0	111.2	G207 I208 L214 T215 K217 P219 P240 K241 I242 L254	G207-Y211 WeakPolarHBondContact O-CB 3.41Å; G207-Y211 PolarHBondContact O-N 3.33Å; I208-Y211 PolarHBondContact O-N 3.12Å; Y211-L214 WeakPolarHBondContact O-CB 3.41Å; Y211-L214 PolarHBondContact O-N 3.26Å; Y211-T215 HydrophobicContact CD1-CG2 4.27Å; Y211-T215 WeakPolarHBondContact CD1-OG1 3.45Å; Y211-T215 HydrophobicContact CE1-CG2 3.91Å; Y211-T215 WeakPolarHBondContact CE1-OG1 3.2Å; Y211-T215 HydrophobicContact CE2-CG2 4.19Å; Y211-T215 PolarHBondContact O-N 3.01Å; Y211-T215 PolarHBondContact O-OG1 3.23Å; Y211-K217 VanDerWaalsContact CD1-O 3.26Å; Y211-K217 WeakPolarHBondContact CD1-O 3.43Å; Y211-P219 HydrophobicContact CD1-CB 3.6Å; Y211-P219 VanDerWaalsContact CD1-CD 3.49Å; Y211-P219 HydrophobicContact CD1-CG 3.92Å; Y211-P219 HydrophobicContact CD2-CB 4Å; Y211-P219 HydrophobicContact CE1-CB 3.6Å; Y211-P219 HydrophobicContact CE1-CG 4.38Å; Y211-P219 HydrophobicContact CE2-CB 4Å; Y211-P219 HydrophobicContact CG-CB 3.8Å; Y211-P219 HydrophobicContact CG-CG 4.04Å; Y211-P240 HydrophobicContact CD2-CB 3.95Å; Y211-P240 HydrophobicContact CE2-CB 3.7Å; Y211-K241 PolarHBondContact OH-N 2.96Å; Y211-K241 PolarHBondContact OH-O 2.7Å; Y211-I242 HydrophobicContact CD2-CG1 4.3Å; Y211-I242 HydrophobicContact CE2-CG1 4.07Å; Y211-L254 HydrophobicContact CD2-CD1 4.36Å
212	Q	93.7	Very high	90.6	Very high	29 Å²	29	24.6 Å²	24.6	14%	0.136	13%	0.131	C	C	.	.	H	α-helix	trans	-66.4	-36.2	176	-170.6	-179.9	1.1	0	0	112.7	L98 Y186 I208 I209 V210 L214 G216 K217	L98-Q212 HydrophobicContact CD1-CG 4.28Å; Y186-Q212 PolarHBondContact OH-OE1 3.3Å; I208-Q212 WeakPolarHBondContact O-CB 3.47Å; I208-Q212 PolarHBondContact O-N 3.41Å; I209-Q212 PolarHBondContact O-N 2.84Å; V210-Q212 VanDerWaalsContact C-N 3.32Å; V210-Q212 PolarHBondContact O-N 3.32Å; Q212-L214 VanDerWaalsContact C-N 3.3Å; Q212-L214 PolarHBondContact O-N 2.99Å; Q212-G216 WeakPolarHBondContact O-CA 3.41Å; Q212-G216 PolarHBondContact O-N 3.08Å; Q212-K217 VanDerWaalsContact CA-O 3.32Å; Q212-K217 WeakPolarHBondContact CA-O 3.36Å
213	C	94.1	Very high	90.2	Very high	4 Å²	4	31 Å²	31	3%	0.027	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-39.6	171.1	-67.1	0	0	0	0	111.9	L98 T103 L104 I109 I209 V210	L98-C213 HydrophobicContact CD2-CB 4.29Å; T103-C213 CarbonylContact C-O 3.58Å; T103-C213 WeakPolarHBondContact CA-O 3.49Å; L104-C213 HydrophobicContact CB-CB 4.48Å; L104-C213 HydrophobicContact CD1-CB 4.05Å; L104-C213 HydrophobicContact CG-CB 4.43Å; L104-C213 PolarHBondContact N-O 2.78Å; I109-C213 HydrophobicContact CD1-CB 3.87Å; I109-C213 HydrophobicContact CG1-CB 3.86Å; I209-C213 PolarHBondContact O-N 3.13Å; I209-C213 PolarHBondContact O-SG 3.3Å; V210-C213 WeakPolarHBondContact O-CB 3.24Å; V210-C213 PolarHBondContact O-N 3.32Å
214	L	94.8	Very high	89.4	Confident	26 Å²	26	34 Å²	34	14%	0.136	18%	0.184	C	C	.	.	H	α-helix	trans	-73.4	-39.6	-179.1	-179.3	63.6	0	0	0	113.1	T103 I109 V210 Y211 Q212 I242 T246 L250 L254	T103-L214 WeakPolarHBondContact CG2-O 3.49Å; I109-L214 HydrophobicContact CD1-CB 4Å; I109-L214 HydrophobicContact CD1-CD1 4.35Å; V210-L214 WeakPolarHBondContact O-CB 3.44Å; V210-L214 PolarHBondContact O-N 2.7Å; Y211-L214 WeakPolarHBondContact O-CB 3.41Å; Y211-L214 PolarHBondContact O-N 3.26Å; Q212-L214 VanDerWaalsContact C-N 3.3Å; Q212-L214 PolarHBondContact O-N 2.99Å; L214-I242 HydrophobicContact CD2-CG2 4.48Å; L214-T246 HydrophobicContact CD1-CG2 4.4Å; L214-T246 HydrophobicContact CD2-CG2 3.71Å; L214-L250 HydrophobicContact CD1-CD2 4.01Å; L214-L250 HydrophobicContact CD2-CD2 4.03Å; L214-L254 HydrophobicContact CD2-CD1 3.74Å
215	T	93.1	Very high	88.4	Confident	29 Å²	29	36.2 Å²	36.2	18%	0.178	20%	0.198	C	C	.	.	H	α-helix	trans	-118.5	-5.3	-169.1	75.4	0	0	0	0	115.4	Y211 K217 P243	Y211-T215 HydrophobicContact CD1-CG2 4.27Å; Y211-T215 WeakPolarHBondContact CD1-OG1 3.45Å; Y211-T215 HydrophobicContact CE1-CG2 3.91Å; Y211-T215 WeakPolarHBondContact CE1-OG1 3.2Å; Y211-T215 HydrophobicContact CE2-CG2 4.19Å; Y211-T215 PolarHBondContact O-N 3.01Å; Y211-T215 PolarHBondContact O-OG1 3.23Å; T215-K217 PolarHBondContact O-N 3.31Å; T215-K217 PolarHBondContact OG1-N 3.3Å; T215-K217 PolarHBondContact OG1-O 3.1Å; T215-P243 HydrophobicContact CG2-CG 3.92Å
216	G	90.3	Very high	87.6	Confident	37 Å²	37	37.6 Å²	37.6	38%	0.381	20%	0.204	S	C	.	.	S	Bend	trans	69.3	14	-174.7	0	0	0	0	0	114.8	R102 Q212	R102-G216 WeakPolarHBondContact O-CA 3.28Å; Q212-G216 WeakPolarHBondContact O-CA 3.41Å; Q212-G216 PolarHBondContact O-N 3.08Å
217	K	89.6	Confident	87.1	Confident	152 Å²	152	39.3 Å²	39.3	66%	0.661	22%	0.218	S	C	*	.	S	Bend	trans	-148.3	151.8	-170.4	-56.1	177.6	-169.4	-179	0	110.1	Y211 Q212 T215	Y211-K217 VanDerWaalsContact CD1-O 3.26Å; Y211-K217 WeakPolarHBondContact CD1-O 3.43Å; Q212-K217 VanDerWaalsContact CA-O 3.32Å; Q212-K217 WeakPolarHBondContact CA-O 3.36Å; T215-K217 PolarHBondContact O-N 3.31Å; T215-K217 PolarHBondContact OG1-N 3.3Å; T215-K217 PolarHBondContact OG1-O 3.1Å
218	A	88.2	Confident	86.5	Confident	20 Å²	20	39.6 Å²	39.6	17%	0.165	22%	0.22	C	C	.	.			trans	-67.9	150.5	166.7	0	0	0	0	0	111.1	M185 F220	M185-A218 HydrophobicContact CG-CB 3.98Å; M185-A218 HydrophobicContact SD-CB 3.75Å; A218-F220 VanDerWaalsContact C-N 3.35Å; A218-F220 WeakPolarHBondContact CB-O 3.49Å
219	P	88.1	Confident	85.7	Confident	20 Å²	20	42 Å²	42	13%	0.13	23%	0.23	C	C	.	.	S	Bend	trans	-73.4	-29.3	177.5	26.8	-30.1	0	0	0	112.7	I208 Y211 P240 L258	I208-P219 HydrophobicContact CD1-CG 3.45Å; I208-P219 VanDerWaalsContact CD1-CG 3.45Å; Y211-P219 HydrophobicContact CD1-CB 3.6Å; Y211-P219 VanDerWaalsContact CD1-CD 3.49Å; Y211-P219 HydrophobicContact CD1-CG 3.92Å; Y211-P219 HydrophobicContact CD2-CB 4Å; Y211-P219 HydrophobicContact CE1-CB 3.6Å; Y211-P219 HydrophobicContact CE1-CG 4.38Å; Y211-P219 HydrophobicContact CE2-CB 4Å; Y211-P219 HydrophobicContact CG-CB 3.8Å; Y211-P219 HydrophobicContact CG-CG 4.04Å; P219-P240 HydrophobicContact CB-CB 3.8Å; P219-L258 HydrophobicContact CB-CD1 4.37Å; P219-L258 HydrophobicContact CG-CD1 4.01Å
220	F	88	Confident	85.2	Confident	21 Å²	21	45.4 Å²	45.4	9%	0.092	25%	0.249	C	C	.	.	S	Bend	trans	-129.7	133.9	177.1	-43.8	-63.7	0	0	0	107.4	W204 I208 A218 L228 Y232 L238 P240	W204-F220 HydrophobicContact CH2-CD2 4.04Å; W204-F220 AromaticContact CH2-CE2 3.59Å; W204-F220 HydrophobicContact CH2-CE2 3.59Å; W204-F220 AromaticContact CZ2-CD2 3.86Å; W204-F220 HydrophobicContact CZ2-CD2 3.86Å; W204-F220 AromaticContact CZ2-CE2 3.83Å; W204-F220 HydrophobicContact CZ2-CE2 3.83Å; I208-F220 HydrophobicContact CD1-CD2 4.3Å; A218-F220 VanDerWaalsContact C-N 3.35Å; A218-F220 WeakPolarHBondContact CB-O 3.49Å; F220-L228 HydrophobicContact CB-CD1 4.11Å; F220-Y232 HydrophobicContact CB-CE1 3.92Å; F220-Y232 AromaticContact CD2-CE1 3.97Å; F220-Y232 HydrophobicContact CD2-CE1 3.97Å; F220-Y232 HydrophobicContact CG-CE1 4.04Å; F220-L238 HydrophobicContact CD1-CD2 4.36Å; F220-L238 HydrophobicContact CE1-CB 4.15Å; F220-L238 HydrophobicContact CE1-CD2 4.23Å; F220-L238 HydrophobicContact CE2-CB 4.38Å; F220-L238 HydrophobicContact CZ-CB 3.81Å; F220-P240 HydrophobicContact CZ-CB 4.32Å
221	Y	83.2	Confident	84.7	Confident	115 Å²	115	48 Å²	48	45%	0.451	26%	0.262	S	S	.	.			trans	-147.6	142.9	-176	171.3	-89.4	0	0	0	109.6	M185 N223	M185-Y221 HydrophobicContact CE-CD2 3.92Å; M185-Y221 HydrophobicContact CE-CE2 4.1Å; Y221-N223 VanDerWaalsContact CE1-OD1 3.27Å; Y221-N223 WeakPolarHBondContact CE1-OD1 3.36Å; Y221-N223 PolarHBondContact OH-OD1 3Å
222	A	80.6	Confident	84.3	Confident	24 Å²	24	47.3 Å²	47.3	20%	0.198	26%	0.259	C	S	.	.			trans	-149.2	160.4	168.3	0	0	0	0	0	109.9	T224 A227 L228 I231	A222-T224 VanDerWaalsContact C-N 3.27Å; A222-T224 PolarHBondContact O-N 3.41Å; A222-A227 HydrophobicContact CB-CB 3.67Å; A222-L228 HydrophobicContact CB-CB 4.01Å; A222-I231 HydrophobicContact CB-CD1 4.04Å
223	N	75.2	Confident	83.7	Confident	140 Å²	140	50 Å²	50	75%	0.749	27%	0.272	S	S	*	.	S	Bend	trans	-74.5	-13.9	-176.4	-63.9	-22.5	0	0	0	113.9	Y221	Y221-N223 VanDerWaalsContact CE1-OD1 3.27Å; Y221-N223 WeakPolarHBondContact CE1-OD1 3.36Å; Y221-N223 PolarHBondContact OH-OD1 3Å
224	T	73	Confident	83.3	Confident	64 Å²	64	58.4 Å²	58.4	39%	0.393	31%	0.308	S	S	.	.	S	Bend	trans	-138.3	155.8	173.8	74.8	0	0	0	0	111.3	A222 E226 A227 L228	A222-T224 VanDerWaalsContact C-N 3.27Å; A222-T224 PolarHBondContact O-N 3.41Å; T224-E226 WeakPolarHBondContact CB-OE2 3.39Å; T224-E226 PolarHBondContact O-N 3.32Å; T224-E226 PolarHBondContact OG1-OE2 3.12Å; T224-A227 PolarHBondContact O-N 2.94Å; T224-A227 WeakPolarHBondContact OG1-CB 3.4Å; T224-A227 PolarHBondContact OG1-N 2.86Å; T224-A227 VanDerWaalsContact OG1-N 3.08Å; T224-L228 PolarHBondContact O-N 2.61Å; T224-L228 VanDerWaalsContact O-N 3.09Å
225	P	71.8	Confident	82.8	Confident	45 Å²	45	59.8 Å²	59.8	29%	0.292	32%	0.317	S	S	.	.	H	α-helix	trans	-56.4	-37	173.6	-25.3	35.7	0	0	0	113.1	P184 L228 K229	P184-P225 HydrophobicContact CB-CB 3.99Å; P184-P225 HydrophobicContact CB-CG 4.2Å; P184-P225 HydrophobicContact CG-CB 4.08Å; P184-P225 HydrophobicContact CG-CG 3.98Å; P225-L228 PolarHBondContact O-N 3.49Å; P225-K229 WeakPolarHBondContact O-CB 3.17Å; P225-K229 PolarHBondContact O-N 2.9Å
226	E	72.5	Confident	82	Confident	36 Å²	36	62 Å²	62	17%	0.168	34%	0.338	C	S	.	.	H	α-helix	trans	-69	-40	179.6	-59.8	70.3	-150.1	0	0	111.4	T224 L228 K229 N230 P828 T829	T224-E226 WeakPolarHBondContact CB-OE2 3.39Å; T224-E226 PolarHBondContact O-N 3.32Å; T224-E226 PolarHBondContact OG1-OE2 3.12Å; E226-L228 VanDerWaalsContact C-N 3.33Å; E226-L228 PolarHBondContact O-N 3.27Å; E226-K229 WeakPolarHBondContact O-CB 2.89Å; E226-K229 PolarHBondContact O-N 3.1Å; E226-N230 WeakPolarHBondContact O-CB 3.5Å; E226-N230 PolarHBondContact O-N 2.99Å; E226-N230 PolarHBondContact O-OD1 3.44Å; E226-P828 WeakPolarHBondContact OE1-CA 3.39Å; E226-P828 WeakPolarHBondContact OE1-CB 3.31Å; E226-T829 VanDerWaalsContact CG-O 3.24Å; E226-T829 WeakPolarHBondContact CG-O 3.45Å; E226-T829 PolarHBondContact OE1-N 2.93Å
227	A	80.6	Confident	81.5	Confident	37 Å²	37	64 Å²	64	31%	0.306	35%	0.346	S	S	.	.	H	α-helix	trans	-66.4	-36.7	174.4	0	0	0	0	0	111.6	A222 T224 N230 I231	A222-A227 HydrophobicContact CB-CB 3.67Å; T224-A227 PolarHBondContact O-N 2.94Å; T224-A227 WeakPolarHBondContact OG1-CB 3.4Å; T224-A227 PolarHBondContact OG1-N 2.86Å; T224-A227 VanDerWaalsContact OG1-N 3.08Å; A227-N230 PolarHBondContact O-N 3.28Å; A227-I231 WeakPolarHBondContact O-CG1 3.13Å; A227-I231 PolarHBondContact O-N 2.73Å
228	L	82.9	Confident	81.2	Confident	6 Å²	6	57.4 Å²	57.4	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-67.3	-40.5	173.8	-174.4	60.9	0	0	0	111.4	P184 L192 F220 A222 T224 P225 E226 I231 Y232	P184-L228 WeakPolarHBondContact O-CD2 3.25Å; L192-L228 HydrophobicContact CD2-CB 4.33Å; L192-L228 HydrophobicContact CD2-CD2 4.35Å; L192-L228 HydrophobicContact CD2-CG 4.16Å; F220-L228 HydrophobicContact CB-CD1 4.11Å; A222-L228 HydrophobicContact CB-CB 4.01Å; T224-L228 PolarHBondContact O-N 2.61Å; T224-L228 VanDerWaalsContact O-N 3.09Å; P225-L228 PolarHBondContact O-N 3.49Å; E226-L228 VanDerWaalsContact C-N 3.33Å; E226-L228 PolarHBondContact O-N 3.27Å; L228-I231 WeakPolarHBondContact O-CB 3.34Å; L228-I231 PolarHBondContact O-N 3.38Å; L228-Y232 HydrophobicContact CD1-CD1 4.49Å; L228-Y232 HydrophobicContact CD1-CE1 3.86Å; L228-Y232 HydrophobicContact CD1-CE2 4.35Å; L228-Y232 HydrophobicContact CD2-CE2 4.27Å; L228-Y232 HydrophobicContact CG-CD2 4.48Å; L228-Y232 HydrophobicContact CG-CE1 4.35Å; L228-Y232 HydrophobicContact CG-CE2 3.95Å; L228-Y232 PolarHBondContact O-N 3.4Å
229	K	78.1	Confident	81	Confident	50 Å²	50	65.8 Å²	65.8	22%	0.217	35%	0.345	C	S	.	.	H	α-helix	trans	-59	-46.6	171.9	-176.9	174.9	-179.5	148.5	0	111.6	L192 P225 E226 I231 Y232 E233	L192-K229 HydrophobicContact CD2-CB 3.89Å; L192-K229 HydrophobicContact CG-CB 4.02Å; L192-K229 HydrophobicContact CG-CG 4.42Å; L192-K229 WeakPolarHBondContact O-CD 3.45Å; L192-K229 WeakPolarHBondContact O-CE 3.29Å; L192-K229 PolarHBondContact O-NZ 3.31Å; P225-K229 WeakPolarHBondContact O-CB 3.17Å; P225-K229 PolarHBondContact O-N 2.9Å; E226-K229 WeakPolarHBondContact O-CB 2.89Å; E226-K229 PolarHBondContact O-N 3.1Å; K229-I231 VanDerWaalsContact C-N 3.3Å; K229-I231 PolarHBondContact O-N 3.33Å; K229-Y232 CarbonylContact O-C 3.57Å; K229-Y232 WeakPolarHBondContact O-CA 3.45Å; K229-Y232 PolarHBondContact O-N 2.93Å; K229-E233 WeakPolarHBondContact CE-OE1 3.5Å; K229-E233 HydrophobicContact CG-CG 4.29Å; K229-E233 IonicContact NZ-OE1 2.69Å; K229-E233 PolarHBondContact O-N 2.96Å
230	N	81.2	Confident	81	Confident	77 Å²	77	65.4 Å²	65.4	41%	0.412	34%	0.342	S	S	.	.	H	α-helix	trans	-61.4	-37.4	177.9	-71.3	-6.2	0	0	0	112	E226 A227 E233 K234	E226-N230 WeakPolarHBondContact O-CB 3.5Å; E226-N230 PolarHBondContact O-N 2.99Å; E226-N230 PolarHBondContact O-OD1 3.44Å; A227-N230 PolarHBondContact O-N 3.28Å; N230-E233 PolarHBondContact O-N 3.5Å; N230-K234 WeakPolarHBondContact O-CB 3.39Å; N230-K234 WeakPolarHBondContact O-CG 3.49Å; N230-K234 PolarHBondContact O-N 3Å
231	I	84.5	Confident	81.1	Confident	62 Å²	62	73.2 Å²	73.2	32%	0.318	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-47.6	171.2	-68.5	166.4	0	0	0	110.4	A222 A227 L228 K229 T235 L238	A222-I231 HydrophobicContact CB-CD1 4.04Å; A227-I231 WeakPolarHBondContact O-CG1 3.13Å; A227-I231 PolarHBondContact O-N 2.73Å; L228-I231 WeakPolarHBondContact O-CB 3.34Å; L228-I231 PolarHBondContact O-N 3.38Å; K229-I231 VanDerWaalsContact C-N 3.3Å; K229-I231 PolarHBondContact O-N 3.33Å; I231-T235 WeakPolarHBondContact O-CB 3.43Å; I231-T235 PolarHBondContact O-N 2.88Å; I231-T235 PolarHBondContact O-OG1 3.27Å; I231-L238 HydrophobicContact CG2-CD2 4.39Å
232	Y	86.1	Confident	81.5	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-67.3	-32.2	179.2	-68.1	-12.9	0	0	0	113.6	P189 L192 W204 F220 L228 K229 L238 R260	P189-Y232 HydrophobicContact CB-CD2 3.95Å; P189-Y232 HydrophobicContact CB-CG 4.11Å; P189-Y232 HydrophobicContact CG-CD1 4.46Å; P189-Y232 HydrophobicContact CG-CD2 3.98Å; P189-Y232 HydrophobicContact CG-CE2 4.2Å; P189-Y232 HydrophobicContact CG-CG 4.12Å; L192-Y232 HydrophobicContact CD2-CD2 3.78Å; L192-Y232 HydrophobicContact CD2-CE2 3.91Å; W204-Y232 HydrophobicContact CZ2-CE1 4.17Å; W204-Y232 AromaticContact CZ2-CZ 3.91Å; F220-Y232 HydrophobicContact CB-CE1 3.92Å; F220-Y232 AromaticContact CD2-CE1 3.97Å; F220-Y232 HydrophobicContact CD2-CE1 3.97Å; F220-Y232 HydrophobicContact CG-CE1 4.04Å; L228-Y232 HydrophobicContact CD1-CD1 4.49Å; L228-Y232 HydrophobicContact CD1-CE1 3.86Å; L228-Y232 HydrophobicContact CD1-CE2 4.35Å; L228-Y232 HydrophobicContact CD2-CE2 4.27Å; L228-Y232 HydrophobicContact CG-CD2 4.48Å; L228-Y232 HydrophobicContact CG-CE1 4.35Å; L228-Y232 HydrophobicContact CG-CE2 3.95Å; L228-Y232 PolarHBondContact O-N 3.4Å; K229-Y232 CarbonylContact O-C 3.57Å; K229-Y232 WeakPolarHBondContact O-CA 3.45Å; K229-Y232 PolarHBondContact O-N 2.93Å; Y232-L238 HydrophobicContact CD1-CD1 3.57Å; Y232-L238 HydrophobicContact CD1-CD2 4.05Å; Y232-L238 HydrophobicContact CD1-CG 4.5Å; Y232-L238 HydrophobicContact CE1-CD1 3.98Å; Y232-L238 HydrophobicContact CG-CD1 4.31Å; Y232-R260 WeakPolarHBondContact O-CD 3.43Å; Y232-R260 PolarHBondContact O-NH1 3.38Å
233	E	82.5	Confident	82.1	Confident	85 Å²	85	69.8 Å²	69.8	40%	0.397	37%	0.365	S	S	.	.	H	α-helix	trans	-75.9	-50.4	177.9	-75.8	179.2	166.3	0	0	111.1	M193 K229 N230 R260	M193-E233 HydrophobicContact CG-CG 3.76Å; M193-E233 HydrophobicContact SD-CG 3.75Å; K229-E233 WeakPolarHBondContact CE-OE1 3.5Å; K229-E233 HydrophobicContact CG-CG 4.29Å; K229-E233 IonicContact NZ-OE1 2.69Å; K229-E233 PolarHBondContact O-N 2.96Å; N230-E233 PolarHBondContact O-N 3.5Å; E233-R260 PolarHBondContact O-NH1 3.04Å; E233-R260 VanDerWaalsContact O-NH1 3.09Å
234	K	84.1	Confident	82.7	Confident	180 Å²	180	70.1 Å²	70.1	78%	0.783	37%	0.372	S	S	*	.	H	α-helix	trans	-72.4	-31.2	-178.5	-62.8	-172	179	-166.6	0	113.4	N230 A236	N230-K234 WeakPolarHBondContact O-CB 3.39Å; N230-K234 WeakPolarHBondContact O-CG 3.49Å; N230-K234 PolarHBondContact O-N 3Å; K234-A236 PolarHBondContact O-N 3.39Å
235	T	84.8	Confident	83.6	Confident	56 Å²	56	73.1 Å²	73.1	34%	0.344	39%	0.39	S	S	.	.			trans	-91.5	94.4	-177	-45.1	0	0	0	0	111.7	I231 C237 L238 R260	I231-T235 WeakPolarHBondContact O-CB 3.43Å; I231-T235 PolarHBondContact O-N 2.88Å; I231-T235 PolarHBondContact O-OG1 3.27Å; T235-C237 VanDerWaalsContact C-N 3.35Å; T235-C237 PolarHBondContact O-N 3.23Å; T235-L238 HydrophobicContact CG2-CD2 3.83Å; T235-R260 WeakPolarHBondContact O-CD 3.44Å
236	A	75.8	Confident	84.7	Confident	74 Å²	74	71.5 Å²	71.5	61%	0.612	38%	0.379	S	S	*	.	S	Bend	trans	-60.5	-38.5	-177.6	0	0	0	0	0	114.3	K234 R260	K234-A236 PolarHBondContact O-N 3.39Å; A236-R260 PolarHBondContact O-NE 3.2Å; A236-R260 VanDerWaalsContact O-NE 3.16Å
237	C	80.4	Confident	85.8	Confident	80 Å²	80	71.7 Å²	71.7	54%	0.541	38%	0.384	S	S	.	.	S	Bend	trans	-115.9	88.9	178.5	-173.3	0	0	0	0	109.9	T235 R239	T235-C237 VanDerWaalsContact C-N 3.35Å; T235-C237 PolarHBondContact O-N 3.23Å; C237-R239 PolarHBondContact O-N 3.5Å; C237-R239 PolarHBondContact SG-NE 3.48Å
238	L	83.7	Confident	86.5	Confident	14 Å²	14	77.7 Å²	77.7	7%	0.073	40%	0.404	C	S	.	.			trans	-67.5	122.8	172.9	-67.2	171.4	0	0	0	109.2	P189 W204 F220 I231 Y232 T235 R260	P189-L238 HydrophobicContact CG-CD1 3.99Å; W204-L238 HydrophobicContact CH2-CD1 3.71Å; W204-L238 HydrophobicContact CZ3-CD1 4.41Å; F220-L238 HydrophobicContact CD1-CD2 4.36Å; F220-L238 HydrophobicContact CE1-CB 4.15Å; F220-L238 HydrophobicContact CE1-CD2 4.23Å; F220-L238 HydrophobicContact CE2-CB 4.38Å; F220-L238 HydrophobicContact CZ-CB 3.81Å; I231-L238 HydrophobicContact CG2-CD2 4.39Å; Y232-L238 HydrophobicContact CD1-CD1 3.57Å; Y232-L238 HydrophobicContact CD1-CD2 4.05Å; Y232-L238 HydrophobicContact CD1-CG 4.5Å; Y232-L238 HydrophobicContact CE1-CD1 3.98Å; Y232-L238 HydrophobicContact CG-CD1 4.31Å; T235-L238 HydrophobicContact CG2-CD2 3.83Å; L238-R260 HydrophobicContact CD1-CB 3.91Å; L238-R260 HydrophobicContact CD1-CG 3.73Å; L238-R260 HydrophobicContact CG-CB 4.3Å; L238-R260 HydrophobicContact CG-CG 4.32Å
239	R	84.7	Confident	87.1	Confident	195 Å²	195	77.5 Å²	77.5	74%	0.736	40%	0.403	S	S	*	.			trans	-124.8	112.9	176.9	-69.3	-170.6	178.6	-165	-1.3	110.4	C237	C237-R239 PolarHBondContact O-N 3.5Å; C237-R239 PolarHBondContact SG-NE 3.48Å
240	P	88.4	Confident	87.9	Confident	12 Å²	12	75.1 Å²	75.1	8%	0.078	39%	0.393	C	S	.	.			trans	-68.8	144.2	176.5	29.4	-35.4	0	0	0	111.2	Y211 P219 F220 I242 L255 L258	Y211-P240 HydrophobicContact CD2-CB 3.95Å; Y211-P240 HydrophobicContact CE2-CB 3.7Å; P219-P240 HydrophobicContact CB-CB 3.8Å; F220-P240 HydrophobicContact CZ-CB 4.32Å; P240-I242 HydrophobicContact CB-CG1 4.21Å; P240-I242 HydrophobicContact CG-CD1 3.98Å; P240-I242 HydrophobicContact CG-CG1 4Å; P240-I242 PolarHBondContact O-N 3.38Å; P240-L255 HydrophobicContact CG-CD2 4.22Å; P240-L258 HydrophobicContact CB-CD1 3.94Å; P240-L258 HydrophobicContact CG-CB 4.38Å; P240-L258 HydrophobicContact CG-CD1 3.92Å
241	K	89.9	Confident	88.6	Confident	185 Å²	185	74.7 Å²	74.7	80%	0.804	39%	0.388	S	S	*	.			trans	-82.8	61.3	-179	-67.2	-174.3	179	-179	0	111.9	Y211	Y211-K241 PolarHBondContact OH-N 2.96Å; Y211-K241 PolarHBondContact OH-O 2.7Å
242	I	91.7	Very high	89.1	Confident	22 Å²	22	74 Å²	74	11%	0.113	39%	0.385	C	S	.	.			trans	-60.9	129.4	-177.7	-58.6	170.4	0	0	0	110.3	Y211 L214 P240 T246 Q251 L254 L255	Y211-I242 HydrophobicContact CD2-CG1 4.3Å; Y211-I242 HydrophobicContact CE2-CG1 4.07Å; L214-I242 HydrophobicContact CD2-CG2 4.48Å; P240-I242 HydrophobicContact CB-CG1 4.21Å; P240-I242 HydrophobicContact CG-CD1 3.98Å; P240-I242 HydrophobicContact CG-CG1 4Å; P240-I242 PolarHBondContact O-N 3.38Å; I242-T246 HydrophobicContact CG2-CG2 3.94Å; I242-T246 WeakPolarHBondContact CG2-OG1 3.44Å; I242-Q251 HydrophobicContact CD1-CG 4.09Å; I242-Q251 HydrophobicContact CG2-CB 4.35Å; I242-Q251 HydrophobicContact CG2-CG 4.18Å; I242-L254 HydrophobicContact CD1-CB 3.72Å; I242-L254 HydrophobicContact CD1-CD1 4.29Å; I242-L254 HydrophobicContact CG1-CD1 4.35Å; I242-L255 HydrophobicContact CD1-CD2 4.01Å; I242-L255 HydrophobicContact CD1-CG 3.85Å
243	P	91.3	Very high	89.5	Confident	45 Å²	45	74 Å²	74	29%	0.292	39%	0.385	S	S	.	.			trans	-59	141.7	177	-24.9	34.1	0	0	0	113.2	T215 T245 T246	T215-P243 HydrophobicContact CG2-CG 3.92Å; P243-T245 PolarHBondContact O-N 2.89Å; P243-T245 VanDerWaalsContact O-N 3.15Å; P243-T246 VanDerWaalsContact O-CB 3.22Å; P243-T246 WeakPolarHBondContact O-CB 3.36Å; P243-T246 PolarHBondContact O-N 2.8Å; P243-T246 PolarHBondContact O-OG1 2.88Å
244	V	89.5	Confident	90.1	Very high	148 Å²	148	70 Å²	70	90%	0.897	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-14.7	178.7	-62.6	0	0	0	0	114.2	T246	V244-T246 VanDerWaalsContact C-N 3.34Å
245	T	91.7	Very high	90.6	Very high	127 Å²	127	65.2 Å²	65.2	78%	0.779	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-12.4	173.5	47.5	0	0	0	0	113.6	P243	P243-T245 PolarHBondContact O-N 2.89Å; P243-T245 VanDerWaalsContact O-N 3.15Å
246	T	94.5	Very high	91.1	Very high	10 Å²	10	66.2 Å²	66.2	6%	0.061	35%	0.349	C	S	.	.	S	Bend	trans	-66.9	139.4	179.6	-47.5	0	0	0	0	110.3	E106 L214 I242 P243 V244 L250 Q251	E106-T246 WeakPolarHBondContact OE1-CA 3.46Å; L214-T246 HydrophobicContact CD1-CG2 4.4Å; L214-T246 HydrophobicContact CD2-CG2 3.71Å; I242-T246 HydrophobicContact CG2-CG2 3.94Å; I242-T246 WeakPolarHBondContact CG2-OG1 3.44Å; P243-T246 VanDerWaalsContact O-CB 3.22Å; P243-T246 WeakPolarHBondContact O-CB 3.36Å; P243-T246 PolarHBondContact O-N 2.8Å; P243-T246 PolarHBondContact O-OG1 2.88Å; V244-T246 VanDerWaalsContact C-N 3.34Å; T246-L250 HydrophobicContact CG2-CB 3.86Å; T246-L250 HydrophobicContact CG2-CD2 3.99Å; T246-L250 HydrophobicContact CG2-CG 3.93Å; T246-Q251 HydrophobicContact CG2-CB 4.39Å
247	S	95.5	Very high	91.9	Very high	40 Å²	40	62.7 Å²	62.7	28%	0.28	32%	0.319	S	S	.	.			trans	-60.1	145.2	177	81.6	0	0	0	0	111.1	E106 A249 L250 Q251	E106-S247 PolarHBondContact OE1-N 3.37Å; E106-S247 WeakPolarHBondContact OE2-CB 3.44Å; E106-S247 PolarHBondContact OE2-OG 3.47Å; S247-A249 PolarHBondContact O-N 2.94Å; S247-A249 PolarHBondContact OG-N 3.25Å; S247-L250 PolarHBondContact O-N 3.5Å; S247-L250 PolarHBondContact OG-N 3.01Å; S247-L250 VanDerWaalsContact OG-N 3.17Å; S247-Q251 WeakPolarHBondContact O-CB 3.41Å; S247-Q251 PolarHBondContact O-N 3.39Å
248	K	94.5	Very high	92.6	Very high	164 Å²	164	59 Å²	59	71%	0.713	29%	0.294	S	S	*	.	H	α-helix	trans	-57.9	-15.3	175.3	-64.6	-173.9	178.8	-177.1	0	113	D252 R275	K248-D252 VanDerWaalsContact O-CB 3.3Å; K248-D252 WeakPolarHBondContact O-CB 3.45Å; K248-R275 PolarHBondContact O-NH2 3.31Å
249	A	95.3	Very high	92.9	Very high	2 Å²	2	60.7 Å²	60.7	2%	0.017	30%	0.303	C	S	.	.	H	α-helix	trans	-87	-45	178	0	0	0	0	0	112.2	S247 L253 H274 R275 F276	S247-A249 PolarHBondContact O-N 2.94Å; S247-A249 PolarHBondContact OG-N 3.25Å; A249-L253 PolarHBondContact O-N 3Å; A249-L253 VanDerWaalsContact O-N 3.12Å; A249-H274 PolarHBondContact O-CE1 2.74Å; A249-R275 HydrophobicContact CB-CG 4.23Å; A249-F276 HydrophobicContact CB-CB 4.15Å; A249-F276 HydrophobicContact CB-CD2 3.99Å
250	L	95.5	Very high	93.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-69.8	-36.4	174.1	-178.4	55.4	0	0	0	111.7	E106 I109 V210 L214 T246 S247 L253 L254 F276	E106-L250 HydrophobicContact CB-CD2 4.47Å; E106-L250 HydrophobicContact CG-CD2 3.68Å; E106-L250 WeakPolarHBondContact OE2-CB 3.29Å; I109-L250 HydrophobicContact CD1-CD2 4.47Å; I109-L250 HydrophobicContact CG2-CD1 4.36Å; I109-L250 HydrophobicContact CG2-CD2 4.38Å; V210-L250 HydrophobicContact CG1-CD1 3.71Å; L214-L250 HydrophobicContact CD1-CD2 4.01Å; L214-L250 HydrophobicContact CD2-CD2 4.03Å; T246-L250 HydrophobicContact CG2-CB 3.86Å; T246-L250 HydrophobicContact CG2-CD2 3.99Å; T246-L250 HydrophobicContact CG2-CG 3.93Å; S247-L250 PolarHBondContact O-N 3.5Å; S247-L250 PolarHBondContact OG-N 3.01Å; S247-L250 VanDerWaalsContact OG-N 3.17Å; L250-L253 PolarHBondContact O-N 3.16Å; L250-L254 HydrophobicContact CD1-CD1 4.26Å; L250-L254 HydrophobicContact CD1-CG 4.22Å; L250-L254 HydrophobicContact CG-CD1 4.12Å; L250-L254 WeakPolarHBondContact O-CB 3.32Å; L250-L254 WeakPolarHBondContact O-CG 3.4Å; L250-L254 PolarHBondContact O-N 2.73Å; L250-F276 HydrophobicContact CB-CD2 3.91Å; L250-F276 HydrophobicContact CB-CE2 3.69Å; L250-F276 HydrophobicContact CB-CZ 4.15Å; L250-F276 HydrophobicContact CD1-CD1 4.28Å; L250-F276 HydrophobicContact CD1-CE1 3.93Å; L250-F276 HydrophobicContact CD1-CE2 4.34Å; L250-F276 HydrophobicContact CD1-CZ 3.96Å; L250-F276 HydrophobicContact CD2-CE2 4.49Å; L250-F276 HydrophobicContact CD2-CZ 4.27Å; L250-F276 HydrophobicContact CG-CE2 4.39Å; L250-F276 HydrophobicContact CG-CZ 4.35Å
251	Q	95.6	Very high	92.9	Very high	68 Å²	68	59 Å²	59	32%	0.318	30%	0.298	S	S	.	.	H	α-helix	trans	-61.4	-45.6	174.7	-177.8	177.4	65.6	0	0	112.2	I242 T246 S247 L254 L255	I242-Q251 HydrophobicContact CD1-CG 4.09Å; I242-Q251 HydrophobicContact CG2-CB 4.35Å; I242-Q251 HydrophobicContact CG2-CG 4.18Å; T246-Q251 HydrophobicContact CG2-CB 4.39Å; S247-Q251 WeakPolarHBondContact O-CB 3.41Å; S247-Q251 PolarHBondContact O-N 3.39Å; Q251-L254 PolarHBondContact O-N 2.93Å; Q251-L255 HydrophobicContact CG-CD1 4.06Å; Q251-L255 WeakPolarHBondContact O-CB 3.29Å; Q251-L255 VanDerWaalsContact O-CG 3.26Å; Q251-L255 WeakPolarHBondContact O-CG 3.23Å; Q251-L255 PolarHBondContact O-N 2.9Å
252	D	95.1	Very high	92.8	Very high	47 Å²	47	52.2 Å²	52.2	25%	0.251	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-41	176.3	-178.4	50.9	0	0	0	111.8	K248 K256 H274	K248-D252 VanDerWaalsContact O-CB 3.3Å; K248-D252 WeakPolarHBondContact O-CB 3.45Å; D252-K256 WeakPolarHBondContact O-CB 3.19Å; D252-K256 WeakPolarHBondContact O-CD 3.42Å; D252-K256 VanDerWaalsContact O-CG 3.27Å; D252-K256 WeakPolarHBondContact O-CG 3.34Å; D252-K256 PolarHBondContact O-N 2.96Å; D252-K256 WeakPolarHBondContact OD1-CE 3.43Å; D252-K256 IonicContact OD1-NZ 2.92Å; D252-K256 PolarHBondContact OD1-NZ 2.99Å; D252-K256 IonicContact OD2-NZ 3.15Å; D252-K256 PolarHBondContact OD2-NZ 3.47Å; D252-H274 IonicContact OD2-CE1 3.71Å; D252-H274 IonicContact OD2-NE2 2.78Å; D252-H274 PolarHBondContact OD2-NE2 2.85Å; D252-H274 VanDerWaalsContact OD2-NE2 3.09Å
253	L	95.3	Very high	92.4	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-51.7	175.1	-178.1	54.5	0	0	0	111.9	L113 A249 L250 L255 K256 M257 F271 H274 F276	L113-L253 HydrophobicContact CD1-CD2 3.81Å; A249-L253 PolarHBondContact O-N 3Å; A249-L253 VanDerWaalsContact O-N 3.12Å; L250-L253 PolarHBondContact O-N 3.16Å; L253-L255 VanDerWaalsContact C-N 3.33Å; L253-L255 PolarHBondContact O-N 3.27Å; L253-K256 PolarHBondContact O-N 3.01Å; L253-M257 HydrophobicContact CD1-CG 3.92Å; L253-M257 HydrophobicContact CD1-SD 3.58Å; L253-M257 VanDerWaalsContact CD1-SD 3.58Å; L253-M257 HydrophobicContact CD2-SD 4.26Å; L253-M257 HydrophobicContact CG-CG 4.36Å; L253-M257 HydrophobicContact CG-SD 3.6Å; L253-M257 WeakPolarHBondContact O-CG 3.31Å; L253-M257 PolarHBondContact O-N 2.95Å; L253-F271 HydrophobicContact CD1-CD2 4.03Å; L253-F271 HydrophobicContact CD1-CE2 4.33Å; L253-H274 HydrophobicContact CD1-CB 4.16Å; L253-F276 HydrophobicContact CD2-CB 4.13Å; L253-F276 HydrophobicContact CD2-CD1 3.71Å; L253-F276 HydrophobicContact CD2-CG 4.24Å
254	L	95.3	Very high	92.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.6	-40.5	-179.3	-82	171.9	0	0	0	112.7	G207 V210 Y211 L214 I242 L250 Q251 K256 M257 L258	G207-L254 WeakPolarHBondContact O-CD2 3.5Å; V210-L254 HydrophobicContact CB-CD2 4.09Å; V210-L254 HydrophobicContact CG1-CD2 3.76Å; V210-L254 HydrophobicContact CG1-CG 4.2Å; Y211-L254 HydrophobicContact CD2-CD1 4.36Å; L214-L254 HydrophobicContact CD2-CD1 3.74Å; I242-L254 HydrophobicContact CD1-CB 3.72Å; I242-L254 HydrophobicContact CD1-CD1 4.29Å; I242-L254 HydrophobicContact CG1-CD1 4.35Å; L250-L254 HydrophobicContact CD1-CD1 4.26Å; L250-L254 HydrophobicContact CD1-CG 4.22Å; L250-L254 HydrophobicContact CG-CD1 4.12Å; L250-L254 WeakPolarHBondContact O-CB 3.32Å; L250-L254 WeakPolarHBondContact O-CG 3.4Å; L250-L254 PolarHBondContact O-N 2.73Å; Q251-L254 PolarHBondContact O-N 2.93Å; L254-K256 PolarHBondContact O-N 3.46Å; L254-M257 PolarHBondContact O-N 3.29Å; L254-L258 HydrophobicContact CD2-CD1 4.23Å; L254-L258 WeakPolarHBondContact O-CB 3.32Å; L254-L258 PolarHBondContact O-N 3.09Å
255	L	94.5	Very high	92.5	Very high	81 Å²	81	51.2 Å²	51.2	42%	0.424	27%	0.267	S	S	.	.	H	α-helix	trans	-67	-24.4	176.5	-71.9	172.1	0	0	0	113.2	P240 I242 Q251 L253 I259	P240-L255 HydrophobicContact CG-CD2 4.22Å; I242-L255 HydrophobicContact CD1-CD2 4.01Å; I242-L255 HydrophobicContact CD1-CG 3.85Å; Q251-L255 HydrophobicContact CG-CD1 4.06Å; Q251-L255 WeakPolarHBondContact O-CB 3.29Å; Q251-L255 VanDerWaalsContact O-CG 3.26Å; Q251-L255 WeakPolarHBondContact O-CG 3.23Å; Q251-L255 PolarHBondContact O-N 2.9Å; L253-L255 VanDerWaalsContact C-N 3.33Å; L253-L255 PolarHBondContact O-N 3.27Å; L255-I259 WeakPolarHBondContact O-CD1 3.38Å; L255-I259 WeakPolarHBondContact O-CG1 3.47Å
256	K	94.1	Very high	92.5	Very high	76 Å²	76	46 Å²	46	33%	0.33	23%	0.234	S	C	.	.	H	α-helix	trans	-88.3	-30	177.7	-76.2	171.1	178.2	164.9	0	113.7	D252 L253 L254 I266	D252-K256 WeakPolarHBondContact O-CB 3.19Å; D252-K256 WeakPolarHBondContact O-CD 3.42Å; D252-K256 VanDerWaalsContact O-CG 3.27Å; D252-K256 WeakPolarHBondContact O-CG 3.34Å; D252-K256 PolarHBondContact O-N 2.96Å; D252-K256 WeakPolarHBondContact OD1-CE 3.43Å; D252-K256 IonicContact OD1-NZ 2.92Å; D252-K256 PolarHBondContact OD1-NZ 2.99Å; D252-K256 IonicContact OD2-NZ 3.15Å; D252-K256 PolarHBondContact OD2-NZ 3.47Å; L253-K256 PolarHBondContact O-N 3.01Å; L254-K256 PolarHBondContact O-N 3.46Å; K256-I266 HydrophobicContact CB-CB 4.07Å; K256-I266 HydrophobicContact CB-CD1 4.26Å; K256-I266 HydrophobicContact CB-CG2 4.23Å; K256-I266 HydrophobicContact CD-CD1 4.34Å; K256-I266 WeakPolarHBondContact O-CG2 3.43Å; K256-I266 PolarHBondContact O-N 3.34Å; K256-I266 VanDerWaalsContact O-N 3.09Å
257	M	93.8	Very high	92.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-79.9	-39.9	175.6	-63.5	172.5	84.4	0	0	112.3	I203 M206 L253 L254 I259 R265 I266 F271	I203-M257 HydrophobicContact CG2-CB 4.26Å; I203-M257 HydrophobicContact CG2-CE 4.04Å; I203-M257 HydrophobicContact CG2-CG 4Å; I203-M257 WeakPolarHBondContact O-CE 3.19Å; M206-M257 HydrophobicContact CB-CE 3.9Å; M206-M257 HydrophobicContact CE-CE 3.81Å; M206-M257 HydrophobicContact CG-CE 3.78Å; M206-M257 HydrophobicContact SD-CE 4.34Å; L253-M257 HydrophobicContact CD1-CG 3.92Å; L253-M257 HydrophobicContact CD1-SD 3.58Å; L253-M257 VanDerWaalsContact CD1-SD 3.58Å; L253-M257 HydrophobicContact CD2-SD 4.26Å; L253-M257 HydrophobicContact CG-CG 4.36Å; L253-M257 HydrophobicContact CG-SD 3.6Å; L253-M257 WeakPolarHBondContact O-CG 3.31Å; L253-M257 PolarHBondContact O-N 2.95Å; L254-M257 PolarHBondContact O-N 3.29Å; M257-I259 PolarHBondContact O-N 3.16Å; M257-I259 VanDerWaalsContact O-N 3.11Å; M257-R265 VanDerWaalsContact O-CD 3.32Å; M257-R265 WeakPolarHBondContact O-CD 3.44Å; M257-R265 WeakPolarHBondContact O-CG 3.41Å; M257-I266 HydrophobicContact CB-CG2 4.49Å; M257-I266 HydrophobicContact CG-CG2 3.81Å; M257-F271 HydrophobicContact CE-CD2 3.99Å; M257-F271 HydrophobicContact CE-CE2 3.68Å; M257-F271 HydrophobicContact SD-CD2 4.24Å; M257-F271 HydrophobicContact SD-CE2 4.1Å
258	L	93.7	Very high	91.5	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.01	24%	0.238	C	C	.	.	S	Bend	trans	-88.3	40.7	-175.6	-64.1	175	0	0	0	113.2	W204 I208 P219 P240 L254	W204-L258 HydrophobicContact CD2-CD2 4.05Å; W204-L258 HydrophobicContact CE3-CD2 4.16Å; W204-L258 HydrophobicContact CH2-CD2 4.43Å; W204-L258 HydrophobicContact CZ2-CD2 4.35Å; W204-L258 HydrophobicContact CZ3-CB 4.28Å; W204-L258 HydrophobicContact CZ3-CD2 4.36Å; W204-L258 WeakPolarHBondContact CZ3-O 3.28Å; I208-L258 HydrophobicContact CD1-CD2 3.63Å; I208-L258 HydrophobicContact CG1-CD2 4.06Å; P219-L258 HydrophobicContact CB-CD1 4.37Å; P219-L258 HydrophobicContact CG-CD1 4.01Å; P240-L258 HydrophobicContact CB-CD1 3.94Å; P240-L258 HydrophobicContact CG-CB 4.38Å; P240-L258 HydrophobicContact CG-CD1 3.92Å; L254-L258 HydrophobicContact CD2-CD1 4.23Å; L254-L258 WeakPolarHBondContact O-CB 3.32Å; L254-L258 PolarHBondContact O-N 3.09Å
259	I	91.7	Very high	91.1	Very high	50 Å²	50	46.5 Å²	46.5	26%	0.256	24%	0.236	S	C	.	.			trans	-92.3	131.9	177.2	-61.8	-178.7	0	0	0	110.6	L255 M257 K261 D264 R265	L255-I259 WeakPolarHBondContact O-CD1 3.38Å; L255-I259 WeakPolarHBondContact O-CG1 3.47Å; M257-I259 PolarHBondContact O-N 3.16Å; M257-I259 VanDerWaalsContact O-N 3.11Å; I259-K261 PolarHBondContact O-N 3.46Å; I259-D264 WeakPolarHBondContact CD1-O 3.37Å; I259-D264 HydrophobicContact CG2-CB 3.78Å; I259-R265 HydrophobicContact CB-CB 4.16Å; I259-R265 HydrophobicContact CB-CG 4.38Å; I259-R265 PolarHBondContact O-NE 3.15Å; I259-R265 PolarHBondContact O-NH2 3.46Å
260	R	87.7	Confident	90.8	Very high	61 Å²	61	50.9 Å²	50.9	23%	0.23	26%	0.259	C	S	.	.	S	Bend	trans	-67.2	-36.2	-171.4	-168.4	-178.4	82.7	126.6	-1.3	114.4	P189 Y232 E233 T235 A236 L238	P189-R260 HydrophobicContact CB-CG 3.9Å; P189-R260 HydrophobicContact CG-CG 4.05Å; Y232-R260 WeakPolarHBondContact O-CD 3.43Å; Y232-R260 PolarHBondContact O-NH1 3.38Å; E233-R260 PolarHBondContact O-NH1 3.04Å; E233-R260 VanDerWaalsContact O-NH1 3.09Å; T235-R260 WeakPolarHBondContact O-CD 3.44Å; A236-R260 PolarHBondContact O-NE 3.2Å; A236-R260 VanDerWaalsContact O-NE 3.16Å; L238-R260 HydrophobicContact CD1-CB 3.91Å; L238-R260 HydrophobicContact CD1-CG 3.73Å; L238-R260 HydrophobicContact CG-CB 4.3Å; L238-R260 HydrophobicContact CG-CG 4.32Å
261	K	85.3	Confident	90.6	Very high	111 Å²	111	50.9 Å²	50.9	48%	0.483	26%	0.259	S	S	.	.	S	Bend	trans	-89.3	133.4	175.7	-76.8	167.4	158.1	-172.5	0	109.3	I259 S263 D264 R265	I259-K261 PolarHBondContact O-N 3.46Å; K261-S263 PolarHBondContact O-N 3.11Å; K261-D264 HydrophobicContact CB-CB 4.05Å; K261-D264 HydrophobicContact CD-CB 4.37Å; K261-D264 WeakPolarHBondContact CD-OD1 3.24Å; K261-D264 WeakPolarHBondContact CD-OD2 3.28Å; K261-D264 IonicContact NZ-OD1 2.73Å; K261-D264 IonicContact NZ-OD2 2.76Å; K261-D264 PolarHBondContact NZ-OD2 3.48Å; K261-D264 PolarHBondContact O-N 3.18Å; K261-R265 PolarHBondContact O-N 2.84Å
262	P	86.2	Confident	90.2	Very high	42 Å²	42	50 Å²	50	27%	0.273	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-58.8	-44.6	174.7	-26.1	35.4	0	0	0	113	E190 V200 D264 R265	E190-P262 HydrophobicContact CB-CG 3.92Å; E190-P262 HydrophobicContact CG-CG 3.61Å; V200-P262 HydrophobicContact CG2-CB 3.92Å; P262-D264 PolarHBondContact O-N 2.91Å; P262-D264 VanDerWaalsContact O-N 3.13Å; P262-R265 WeakPolarHBondContact O-CB 3.06Å; P262-R265 PolarHBondContact O-N 3.48Å; P262-R265 VanDerWaalsContact O-N 3.08Å
263	S	84.8	Confident	90	Very high	101 Å²	101	52.9 Å²	52.9	71%	0.706	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-59.1	-24.2	179.9	52.9	0	0	0	0	115.1	K261	K261-S263 PolarHBondContact O-N 3.11Å
264	D	89.3	Confident	90	Very high	80 Å²	80	53.5 Å²	53.5	43%	0.428	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-105.6	-4.7	-174.6	-54.5	22	0	0	0	110.2	I259 K261 P262	I259-D264 WeakPolarHBondContact CD1-O 3.37Å; I259-D264 HydrophobicContact CG2-CB 3.78Å; K261-D264 HydrophobicContact CB-CB 4.05Å; K261-D264 HydrophobicContact CD-CB 4.37Å; K261-D264 WeakPolarHBondContact CD-OD1 3.24Å; K261-D264 WeakPolarHBondContact CD-OD2 3.28Å; K261-D264 IonicContact NZ-OD1 2.73Å; K261-D264 IonicContact NZ-OD2 2.76Å; K261-D264 PolarHBondContact NZ-OD2 3.48Å; K261-D264 PolarHBondContact O-N 3.18Å; P262-D264 PolarHBondContact O-N 2.91Å; P262-D264 VanDerWaalsContact O-N 3.13Å
265	R	92.8	Very high	89.9	Confident	14 Å²	14	59.6 Å²	59.6	5%	0.053	30%	0.297	C	S	.	.	S	Bend	trans	-83.6	153.5	178.9	-166.5	-178.8	-60.2	146.7	8.1	110.1	E190 V200 M257 I259 K261 P262 D267	E190-R265 IonicContact OE1-CZ 3.62Å; E190-R265 IonicContact OE1-NH1 3.25Å; E190-R265 PolarHBondContact OE1-NH1 2.93Å; E190-R265 IonicContact OE1-NH2 2.7Å; E190-R265 PolarHBondContact OE1-NH2 3.37Å; E190-R265 IonicContact OE2-CZ 2.7Å; E190-R265 IonicContact OE2-NH1 3.52Å; E190-R265 IonicContact OE2-NH2 2.96Å; E190-R265 PolarHBondContact OE2-NH2 2.92Å; V200-R265 WeakPolarHBondContact O-CD 3.38Å; V200-R265 PolarHBondContact O-NH1 3.48Å; M257-R265 VanDerWaalsContact O-CD 3.32Å; M257-R265 WeakPolarHBondContact O-CD 3.44Å; M257-R265 WeakPolarHBondContact O-CG 3.41Å; I259-R265 HydrophobicContact CB-CB 4.16Å; I259-R265 HydrophobicContact CB-CG 4.38Å; I259-R265 PolarHBondContact O-NE 3.15Å; I259-R265 PolarHBondContact O-NH2 3.46Å; K261-R265 PolarHBondContact O-N 2.84Å; P262-R265 WeakPolarHBondContact O-CB 3.06Å; P262-R265 PolarHBondContact O-N 3.48Å; P262-R265 VanDerWaalsContact O-N 3.08Å; R265-D267 PolarHBondContact O-N 3.2Å
266	I	91.6	Very high	89.9	Confident	17 Å²	17	55.7 Å²	55.7	9%	0.087	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-61.9	126.2	173	-163.1	169.3	0	0	0	111.2	I203 K256 M257 N270 F271	I203-I266 WeakPolarHBondContact CD1-O 3.27Å; I203-I266 HydrophobicContact CG2-CG2 3.93Å; K256-I266 HydrophobicContact CB-CB 4.07Å; K256-I266 HydrophobicContact CB-CD1 4.26Å; K256-I266 HydrophobicContact CB-CG2 4.23Å; K256-I266 HydrophobicContact CD-CD1 4.34Å; K256-I266 WeakPolarHBondContact O-CG2 3.43Å; K256-I266 PolarHBondContact O-N 3.34Å; K256-I266 VanDerWaalsContact O-N 3.09Å; M257-I266 HydrophobicContact CB-CG2 4.49Å; M257-I266 HydrophobicContact CG-CG2 3.81Å; I266-N270 HydrophobicContact CD1-CB 4.23Å; I266-N270 HydrophobicContact CG1-CB 3.7Å; I266-F271 HydrophobicContact CD1-CB 4.33Å; I266-F271 HydrophobicContact CG1-CB 4.32Å; I266-F271 HydrophobicContact CG2-CB 4.49Å
267	D	86.9	Confident	89.8	Confident	62 Å²	62	53.1 Å²	53.1	33%	0.332	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-74.1	171.9	171.3	65.1	77.5	0	0	0	111.9	R265 Q269 N270 F271	R265-D267 PolarHBondContact O-N 3.2Å; D267-Q269 PolarHBondContact O-N 3.41Å; D267-Q269 WeakPolarHBondContact OD1-CA 3.32Å; D267-Q269 WeakPolarHBondContact OD1-CB 3.39Å; D267-Q269 PolarHBondContact OD1-N 3.36Å; D267-N270 PolarHBondContact OD1-N 3.28Å; D267-N270 PolarHBondContact OD2-ND2 3.3Å; D267-F271 WeakPolarHBondContact O-CB 3.44Å; D267-F271 PolarHBondContact O-N 3.19Å
268	F	83	Confident	89.5	Confident	18 Å²	18	58.8 Å²	58.8	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-58.2	-42.6	-179.4	-113.6	-86.3	0	0	0	114.3	M120 N124 A199 I203 F271 L272	M120-F268 VanDerWaalsContact C-CE1 3.43Å; M120-F268 HydrophobicContact CB-CE1 3.76Å; M120-F268 HydrophobicContact CB-CZ 3.67Å; M120-F268 HydrophobicContact CE-CE2 4.44Å; M120-F268 HydrophobicContact CE-CZ 3.89Å; M120-F268 WeakPolarHBondContact O-CE1 3.41Å; M120-F268 VanDerWaalsContact O-CZ 3.32Å; M120-F268 WeakPolarHBondContact O-CZ 3.27Å; N124-F268 HydrophobicContact CB-CD1 4.47Å; N124-F268 HydrophobicContact CB-CE1 4.07Å; N124-F268 HydrophobicContact CB-CE2 4.15Å; N124-F268 HydrophobicContact CB-CZ 3.85Å; A199-F268 HydrophobicContact CB-CD2 4.25Å; A199-F268 HydrophobicContact CB-CE2 4.01Å; I203-F268 HydrophobicContact CD1-CB 4.47Å; I203-F268 HydrophobicContact CD1-CD2 3.8Å; I203-F268 HydrophobicContact CD1-CE2 4.38Å; I203-F268 HydrophobicContact CD1-CG 4.2Å; I203-F268 HydrophobicContact CG1-CD2 4.22Å; I203-F268 HydrophobicContact CG1-CE2 4.31Å; F268-F271 PolarHBondContact O-N 3.23Å; F268-L272 HydrophobicContact CD1-CD1 4.41Å; F268-L272 VanDerWaalsContact O-CG 3.29Å; F268-L272 WeakPolarHBondContact O-CG 3.13Å; F268-L272 PolarHBondContact O-N 3.23Å
269	Q	84.9	Confident	88.6	Confident	144 Å²	144	62.9 Å²	62.9	67%	0.673	31%	0.312	S	S	*	.	H	α-helix	trans	-74	-40.9	-173.5	-170.3	172.4	-0.6	0	0	110.2	D267 N273	D267-Q269 PolarHBondContact O-N 3.41Å; D267-Q269 WeakPolarHBondContact OD1-CA 3.32Å; D267-Q269 WeakPolarHBondContact OD1-CB 3.39Å; D267-Q269 PolarHBondContact OD1-N 3.36Å; Q269-N273 WeakPolarHBondContact O-CB 3.39Å; Q269-N273 PolarHBondContact O-N 3.37Å; Q269-N273 VanDerWaalsContact O-N 3.12Å; Q269-N273 PolarHBondContact O-ND2 2.7Å
270	N	90.7	Very high	86.9	Confident	95 Å²	95	71.7 Å²	71.7	51%	0.508	34%	0.342	S	S	.	.	H	α-helix	trans	-70.1	-31.2	172.1	-78.9	-60.2	0	0	0	112.7	I266 D267 H274	I266-N270 HydrophobicContact CD1-CB 4.23Å; I266-N270 HydrophobicContact CG1-CB 3.7Å; D267-N270 PolarHBondContact OD1-N 3.28Å; D267-N270 PolarHBondContact OD2-ND2 3.3Å; N270-H274 PolarHBondContact O-N 3.21Å
271	F	91	Very high	85.1	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-64.1	-52.2	172	164.6	-96.5	0	0	0	111.7	L113 I203 M206 L253 M257 I266 D267 F268 N273 H274 L277	L113-F271 HydrophobicContact CD2-CE2 3.65Å; L113-F271 HydrophobicContact CD2-CZ 3.6Å; I203-F271 HydrophobicContact CD1-CB 4.39Å; M206-F271 HydrophobicContact CE-CD1 4.19Å; M206-F271 HydrophobicContact CE-CD2 4.22Å; M206-F271 HydrophobicContact CE-CE1 3.6Å; M206-F271 HydrophobicContact CE-CE2 3.62Å; M206-F271 HydrophobicContact CE-CG 4.49Å; M206-F271 HydrophobicContact CE-CZ 3.29Å; M206-F271 HydrophobicContact SD-CE1 4.32Å; M206-F271 HydrophobicContact SD-CE2 4.21Å; M206-F271 HydrophobicContact SD-CZ 3.67Å; L253-F271 HydrophobicContact CD1-CD2 4.03Å; L253-F271 HydrophobicContact CD1-CE2 4.33Å; M257-F271 HydrophobicContact CE-CD2 3.99Å; M257-F271 HydrophobicContact CE-CE2 3.68Å; M257-F271 HydrophobicContact SD-CD2 4.24Å; M257-F271 HydrophobicContact SD-CE2 4.1Å; I266-F271 HydrophobicContact CD1-CB 4.33Å; I266-F271 HydrophobicContact CG1-CB 4.32Å; I266-F271 HydrophobicContact CG2-CB 4.49Å; D267-F271 WeakPolarHBondContact O-CB 3.44Å; D267-F271 PolarHBondContact O-N 3.19Å; F268-F271 PolarHBondContact O-N 3.23Å; F271-N273 VanDerWaalsContact C-N 3.28Å; F271-N273 PolarHBondContact O-N 3.06Å; F271-H274 WeakPolarHBondContact O-CB 3.27Å; F271-H274 PolarHBondContact O-N 2.68Å; F271-L277 HydrophobicContact CE1-CD1 4.43Å; F271-L277 HydrophobicContact CZ-CD1 4.29Å; F271-L277 WeakPolarHBondContact O-CD1 3.34Å
272	L	87.3	Confident	82.8	Confident	50 Å²	50	77.8 Å²	77.8	26%	0.262	37%	0.372	S	S	.	.	H	α-helix	trans	-61.3	-37.9	179.4	-70	169.7	0	0	0	111.6	D121 F268 H274 H278	D121-L272 HydrophobicContact CB-CD1 4.04Å; D121-L272 HydrophobicContact CB-CD2 4.46Å; F268-L272 HydrophobicContact CD1-CD1 4.41Å; F268-L272 VanDerWaalsContact O-CG 3.29Å; F268-L272 WeakPolarHBondContact O-CG 3.13Å; F268-L272 PolarHBondContact O-N 3.23Å; L272-H274 PolarHBondContact O-N 2.88Å; L272-H278 PolarHBondContact O-CE1 3.36Å; L272-H278 VanDerWaalsContact O-CE1 3.26Å
273	N	91.1	Very high	80.2	Confident	107 Å²	107	83.6 Å²	83.6	57%	0.572	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	3.6	175.5	-73.8	-71.5	0	0	0	114.1	Q269 F271 R275	Q269-N273 WeakPolarHBondContact O-CB 3.39Å; Q269-N273 PolarHBondContact O-N 3.37Å; Q269-N273 VanDerWaalsContact O-N 3.12Å; Q269-N273 PolarHBondContact O-ND2 2.7Å; F271-N273 VanDerWaalsContact C-N 3.28Å; F271-N273 PolarHBondContact O-N 3.06Å; N273-R275 PolarHBondContact O-N 2.58Å
274	H	94.3	Very high	77.6	Confident	12 Å²	12	84.6 Å²	84.6	6%	0.056	40%	0.399	C	S	.	.			trans	-66.4	139.1	-173.8	-163	-97.1	0	0	0	112.7	A249 D252 L253 N270 F271 L272 F276 L277 H278	A249-H274 PolarHBondContact O-CE1 2.74Å; D252-H274 IonicContact OD2-CE1 3.71Å; D252-H274 IonicContact OD2-NE2 2.78Å; D252-H274 PolarHBondContact OD2-NE2 2.85Å; D252-H274 VanDerWaalsContact OD2-NE2 3.09Å; L253-H274 HydrophobicContact CD1-CB 4.16Å; N270-H274 PolarHBondContact O-N 3.21Å; F271-H274 WeakPolarHBondContact O-CB 3.27Å; F271-H274 PolarHBondContact O-N 2.68Å; L272-H274 PolarHBondContact O-N 2.88Å; H274-F276 PolarHBondContact ND1-N 3.1Å; H274-F276 PolarHBondContact O-N 3.45Å; H274-F276 VanDerWaalsContact O-N 3.07Å; H274-L277 PolarHBondContact O-N 2.96Å; H274-L277 VanDerWaalsContact O-N 3.07Å; H274-H278 PolarHBondContact O-ND1 3.43Å
275	R	94.1	Very high	74.7	Confident	128 Å²	128	90.6 Å²	90.6	48%	0.483	42%	0.416	S	S	.	.	H	α-helix	trans	-59.1	-27.5	-174.2	79.7	-178.4	-155.9	-157.8	-0.7	114.1	K248 A249 N273 L277 H278 Q279	K248-R275 PolarHBondContact O-NH2 3.31Å; A249-R275 HydrophobicContact CB-CG 4.23Å; N273-R275 PolarHBondContact O-N 2.58Å; R275-L277 VanDerWaalsContact C-N 3.33Å; R275-H278 PolarHBondContact O-N 2.99Å; R275-Q279 WeakPolarHBondContact O-CG 3.43Å; R275-Q279 PolarHBondContact O-N 2.87Å
276	F	94	Very high	71.6	Confident	0 Å²	0	94.9 Å²	94.9	0%	0	46%	0.455	C	S	.	.	H	α-helix	trans	-64.9	-37.1	179.2	178.6	-106.7	0	0	0	112.1	E106 I109 R110 L113 A249 L250 L253 H274 H278	E106-F276 HydrophobicContact CB-CE2 4.33Å; E106-F276 HydrophobicContact CB-CZ 4.37Å; I109-F276 HydrophobicContact CG2-CE1 4.37Å; I109-F276 HydrophobicContact CG2-CZ 4.42Å; R110-F276 HydrophobicContact CB-CE1 3.73Å; R110-F276 HydrophobicContact CB-CZ 3.77Å; R110-F276 WeakPolarHBondContact CD-O 3.36Å; R110-F276 HydrophobicContact CG-CD1 4.34Å; R110-F276 HydrophobicContact CG-CE1 4.03Å; R110-F276 HydrophobicContact CG-CZ 4.33Å; R110-F276 WeakPolarHBondContact CG-O 3.23Å; R110-F276 PolarHBondContact NE-O 2.79Å; L113-F276 HydrophobicContact CD1-CD1 4Å; L113-F276 HydrophobicContact CD1-CE1 3.73Å; A249-F276 HydrophobicContact CB-CB 4.15Å; A249-F276 HydrophobicContact CB-CD2 3.99Å; L250-F276 HydrophobicContact CB-CD2 3.91Å; L250-F276 HydrophobicContact CB-CE2 3.69Å; L250-F276 HydrophobicContact CB-CZ 4.15Å; L250-F276 HydrophobicContact CD1-CD1 4.28Å; L250-F276 HydrophobicContact CD1-CE1 3.93Å; L250-F276 HydrophobicContact CD1-CE2 4.34Å; L250-F276 HydrophobicContact CD1-CZ 3.96Å; L250-F276 HydrophobicContact CD2-CE2 4.49Å; L250-F276 HydrophobicContact CD2-CZ 4.27Å; L250-F276 HydrophobicContact CG-CE2 4.39Å; L250-F276 HydrophobicContact CG-CZ 4.35Å; L253-F276 HydrophobicContact CD2-CB 4.13Å; L253-F276 HydrophobicContact CD2-CD1 3.71Å; L253-F276 HydrophobicContact CD2-CG 4.24Å; H274-F276 PolarHBondContact ND1-N 3.1Å; H274-F276 PolarHBondContact O-N 3.45Å; H274-F276 VanDerWaalsContact O-N 3.07Å; F276-H278 VanDerWaalsContact C-N 3.32Å
277	L	91.4	Very high	68.6	Low	21 Å²	21	97 Å²	97	11%	0.11	48%	0.481	C	S	.	.	H	α-helix	trans	-70.6	-32.5	177.9	-52	-177	0	0	0	111.3	L113 I114 F271 H274 R275	L113-L277 HydrophobicContact CB-CD2 3.71Å; L113-L277 HydrophobicContact CD1-CD2 4.4Å; L113-L277 HydrophobicContact CG-CD2 4.48Å; I114-L277 HydrophobicContact CG1-CB 4.3Å; I114-L277 HydrophobicContact CG1-CD2 4.3Å; F271-L277 HydrophobicContact CE1-CD1 4.43Å; F271-L277 HydrophobicContact CZ-CD1 4.29Å; F271-L277 WeakPolarHBondContact O-CD1 3.34Å; H274-L277 PolarHBondContact O-N 2.96Å; H274-L277 VanDerWaalsContact O-N 3.07Å; R275-L277 VanDerWaalsContact C-N 3.33Å
278	H	86.9	Confident	65.8	Low	120 Å²	120	98.8 Å²	98.8	56%	0.556	50%	0.498	S	S	*	.	H	α-helix	trans	-87.7	-5.6	-176.5	-70.8	89.6	0	0	0	115	L272 H274 R275 F276 R280	L272-H278 PolarHBondContact O-CE1 3.36Å; L272-H278 VanDerWaalsContact O-CE1 3.26Å; H274-H278 PolarHBondContact O-ND1 3.43Å; R275-H278 PolarHBondContact O-N 2.99Å; F276-H278 VanDerWaalsContact C-N 3.32Å; H278-R280 PolarHBondContact O-N 3.41Å; H278-R280 VanDerWaalsContact O-N 3.09Å
279	Q	76.2	Confident	63.4	Low	87 Å²	87	100.6 Å²	100.6	41%	0.407	52%	0.522	S	S	.	.			trans	-71.3	104.4	174.8	-83.9	176.3	-49.7	0	0	110.4	R110 R275	R110-Q279 WeakPolarHBondContact CD-O 3.43Å; R110-Q279 PolarHBondContact NE-O 3.48Å; R275-Q279 WeakPolarHBondContact O-CG 3.43Å; R275-Q279 PolarHBondContact O-N 2.87Å
280	R	54.8	Low	61.1	Low	236 Å²	236	100.1 Å²	100.1	89%	0.891	53%	0.531	S	S	*	.			trans	-54	143.8	172.4	-70.3	-173.7	175.5	-172.4	-2	110.7	H278 F282	H278-R280 PolarHBondContact O-N 3.41Å; H278-R280 VanDerWaalsContact O-N 3.09Å; R280-F282 PolarHBondContact O-N 2.92Å
281	H	50.5	Low	58.3	Low	100 Å²	100	104.5 Å²	104.5	46%	0.463	55%	0.549	S	S	.	.			trans	-53.5	130.6	174.5	-74.8	-95.2	0	0	0	111	E283	H281-E283 PolarHBondContact O-N 2.96Å
282	F	36.9	Very low	55.5	Low	200 Å²	200	110.2 Å²	110.2	88%	0.877	59%	0.589	S	S	*	*			trans	-74	106.2	151.4	-108.3	-91.8	0	0	0	106.6	R280	R280-F282 PolarHBondContact O-N 2.92Å
283	E	31.1	Very low	53	Low	163 Å²	163	113.4 Å²	113.4	76%	0.762	62%	0.615	S	S	*	*			trans	-59.8	139	163.1	-70.4	-169.2	143.7	0	0	108.9	H281 R285	H281-E283 PolarHBondContact O-N 2.96Å; E283-R285 PolarHBondContact O-N 3.37Å
284	P	30.4	Very low	50.2	Low	122 Å²	122	113 Å²	113	79%	0.792	63%	0.627	S	S	*	*			trans	-61.6	114.2	168	27	-32.2	0	0	0	107.4	A286	P284-A286 VanDerWaalsContact C-N 3.31Å; P284-A286 PolarHBondContact O-N 3.37Å
285	R	28.3	Very low	47.4	Very low	206 Å²	206	118.9 Å²	118.9	78%	0.777	66%	0.664	S	S	*	*			trans	-63.5	83	-166	-172.3	-178.4	179	170.8	2.1	112.8	E283 G287	E283-R285 PolarHBondContact O-N 3.37Å; R285-G287 PolarHBondContact O-N 3.24Å; R285-G287 VanDerWaalsContact O-N 3.16Å
286	A	28	Very low	44.5	Very low	105 Å²	105	124 Å²	124	87%	0.868	68%	0.683	S	S	*	*			trans	-62.5	112.7	167.7	0	0	0	0	0	108.4	P284	P284-A286 VanDerWaalsContact C-N 3.31Å; P284-A286 PolarHBondContact O-N 3.37Å
287	G	29.5	Very low	41.7	Very low	62 Å²	62	130.1 Å²	130.1	64%	0.639	73%	0.725	S	S	*	*			trans	93.8	73.9	-174.9	0	0	0	0	0	114.2	R285	R285-G287 PolarHBondContact O-N 3.24Å; R285-G287 VanDerWaalsContact O-N 3.16Å
288	S	28.5	Very low	39	Very low	99 Å²	99	133.8 Å²	133.8	69%	0.692	75%	0.753	S	S	*	*			trans	-107.2	67.1	140.2	59.8	0	0	0	0	108.9
289	G	32.2	Very low	36.6	Very low	56 Å²	56	136.5 Å²	136.5	58%	0.577	77%	0.77	S	S	*	*			trans	-66.9	145.9	168.3	0	0	0	0	0	110.6	E291	G289-E291 VanDerWaalsContact C-N 3.33Å; G289-E291 PolarHBondContact O-N 3.47Å
290	P	36.6	Very low	34.4	Very low	133 Å²	133	136.6 Å²	136.6	86%	0.864	79%	0.785	S	S	*	*			trans	-83.8	69.9	-173.3	34.8	-36.6	0	0	0	112.1
291	E	31.5	Very low	33.8	Very low	187 Å²	187	131 Å²	131	87%	0.874	78%	0.78	S	S	*	*			trans	-90.3	119.7	175.3	-68.8	-144.6	125.2	0	0	112.9	G289	G289-E291 VanDerWaalsContact C-N 3.33Å; G289-E291 PolarHBondContact O-N 3.47Å
292	S	31.2	Very low	33	Very low	120 Å²	120	130 Å²	130	84%	0.839	79%	0.789	S	S	*	*			trans	-75.3	134.6	179.2	-64.7	0	0	0	0	111.8
293	S	35.1	Very low	32.7	Very low	117 Å²	117	128.4 Å²	128.4	82%	0.818	79%	0.789	S	S	*	*			trans	-128.9	83.6	160.8	33.1	0	0	0	0	109.7	T295	S293-T295 PolarHBondContact O-N 2.68Å
294	A	32	Very low	33.1	Very low	99 Å²	99	126.4 Å²	126.4	82%	0.818	79%	0.789	S	S	*	*			trans	-76.3	118.8	-177.2	0	0	0	0	0	111.6
295	T	36.9	Very low	33	Very low	135 Å²	135	126.1 Å²	126.1	83%	0.828	79%	0.79	S	S	*	*			trans	-127.9	71.8	167.3	-43.2	0	0	0	0	112.1	S293	S293-T295 PolarHBondContact O-N 2.68Å
296	R	31.9	Very low	33.3	Very low	237 Å²	237	127.8 Å²	127.8	89%	0.894	80%	0.797	S	S	*	*			trans	47.6	90.7	134.3	-162.7	-175.3	-165.4	-162.5	4.9	117.5
297	S	36.7	Very low	33.5	Very low	127 Å²	127	130 Å²	130	89%	0.888	79%	0.794	S	S	*	*			trans	-123	149	138.8	-169.1	0	0	0	0	109
298	S	34.5	Very low	33.7	Very low	99 Å²	99	137.6 Å²	137.6	69%	0.692	80%	0.803	S	S	*	*			trans	-125.4	128.6	-163.4	55.1	0	0	0	0	112.8
299	I	36.4	Very low	34.1	Very low	177 Å²	177	138.4 Å²	138.4	91%	0.908	81%	0.806	S	S	*	*			trans	-161.7	142.3	144.1	-95.4	141.3	0	0	0	107.4
300	A	30	Very low	34.2	Very low	88 Å²	88	140.7 Å²	140.7	73%	0.727	81%	0.809	S	S	*	*			trans	-141.5	161.5	169.8	0	0	0	0	0	107.7
301	P	42	Very low	34	Very low	119 Å²	119	141 Å²	141	77%	0.773	81%	0.808	S	S	*	*				-149	159.1	98.3	37.6	-21.3	0	0	0	116.9
302	A	33.5	Very low	34	Very low	80 Å²	80	143.7 Å²	143.7	66%	0.661	81%	0.81	S	S	*	*			trans	45.4	108.7	143.6	0	0	0	0	0	120.3
303	L	31	Very low	33.8	Very low	166 Å²	166	141.4 Å²	141.4	87%	0.869	81%	0.806	S	S	*	*				83.5	156.4	82.9	-78	167.3	0	0	0	114.7
304	P	38.2	Very low	34.3	Very low	120 Å²	120	142.4 Å²	142.4	78%	0.779	81%	0.81	S	S	*	*			cis	-128.7	-178.2	-15.9	38.7	-21.7	0	0	0	114.4
305	S	30.1	Very low	34.2	Very low	116 Å²	116	140.9 Å²	140.9	81%	0.811	80%	0.804	S	S	*	*			trans	-90.8	158.4	177.1	-177.5	0	0	0	0	114
306	R	32.7	Very low	34	Very low	242 Å²	242	141.9 Å²	141.9	91%	0.913	80%	0.803	S	S	*	*			trans	-147.9	149.1	164.3	-157.8	169.7	-174.9	174.6	1.9	113.6
307	N	33.2	Very low	34	Very low	151 Å²	151	136.7 Å²	136.7	81%	0.807	80%	0.797	S	S	*	*			trans	-81.1	162.2	-159.3	-54.1	-27.2	0	0	0	117.3
308	R	32.7	Very low	33.7	Very low	222 Å²	222	136.3 Å²	136.3	84%	0.838	79%	0.789	S	S	*	*			trans	-57	167.4	151.3	-115.3	-172	175.3	-169.7	-0.5	111.3
309	P	38.3	Very low	33.6	Very low	115 Å²	115	139.1 Å²	139.1	75%	0.747	80%	0.796	S	S	*	*			cis	-152.9	172.5	48.1	42.2	-20	0	0	0	120.8
310	T	33.1	Very low	33.3	Very low	105 Å²	105	134.1 Å²	134.1	64%	0.644	79%	0.787	S	S	*	*			trans	-3.6	145	152.8	-43.6	0	0	0	0	123.4
311	V	33.3	Very low	33.6	Very low	139 Å²	139	138.6 Å²	138.6	84%	0.842	79%	0.794	S	S	*	*			trans	-132.6	151.7	155.2	179.2	0	0	0	0	111.1
312	R	32.2	Very low	33.1	Very low	243 Å²	243	136.6 Å²	136.6	92%	0.917	80%	0.795	S	S	*	*			trans	-85.6	168	-178.4	-63.6	169.2	168.5	-179.5	-6.1	111.5
313	G	27.3	Very low	33	Very low	73 Å²	73	140 Å²	140	75%	0.753	81%	0.807	S	S	*	*			cis	104	157.3	38.4	0	0	0	0	0	110.5
314	P	45	Very low	33	Very low	137 Å²	137	135.2 Å²	135.2	89%	0.89	80%	0.798	S	S	*	*			cis	-135.7	-154.7	8.1	43.4	-21.7	0	0	0	115.9
315	G	30.3	Very low	32.7	Very low	68 Å²	68	139.4 Å²	139.4	70%	0.701	81%	0.807	S	S	*	*			trans	-96.4	-164.6	-176.5	0	0	0	0	0	117.5
316	I	31.9	Very low	32.7	Very low	156 Å²	156	137.3 Å²	137.3	80%	0.8	80%	0.804	S	S	*	*				-175.8	143.2	54.3	-100.9	168.1	0	0	0	114.7
317	T	32.1	Very low	33.1	Very low	127 Å²	127	130.8 Å²	130.8	78%	0.779	79%	0.793	S	S	*	*			trans	56.5	166.2	164	49.3	0	0	0	0	122.2
318	V	30.9	Very low	32.8	Very low	119 Å²	119	134.2 Å²	134.2	72%	0.721	80%	0.797	S	S	*	*			cis	-148.7	162.5	5.6	-141.6	0	0	0	0	112.4
319	L	32.7	Very low	32.6	Very low	159 Å²	159	134.4 Å²	134.4	83%	0.832	80%	0.799	S	S	*	*			trans	64.5	148.7	166.2	-56	170.2	0	0	0	116.7
320	G	29.9	Very low	32	Very low	71 Å²	71	137.3 Å²	137.3	73%	0.732	81%	0.807	S	S	*	*			cis	159	165.6	0.9	0	0	0	0	0	110
321	Q	35	Very low	31.8	Very low	183 Å²	183	136.5 Å²	136.5	86%	0.855	81%	0.811	S	S	*	*			cis	-160.2	131.5	-6.2	-70.6	173.6	-138.9	0	0	111.4
322	G	31.1	Very low	32	Very low	77 Å²	77	135.3 Å²	135.3	79%	0.794	81%	0.806	S	S	*	*			trans	75.2	158.1	161.4	0	0	0	0	0	118.8
323	T	33	Very low	31.8	Very low	150 Å²	150	133.3 Å²	133.3	92%	0.92	81%	0.807	S	S	*	*			cis	-150.4	158.7	-10.9	50.7	0	0	0	0	108.4
324	G	30.5	Very low	31.9	Very low	66 Å²	66	138 Å²	138	68%	0.68	82%	0.815	S	S	*	*			cis	-177.4	161.9	-6.3	0	0	0	0	0	111.6
325	E	31.6	Very low	31.3	Very low	208 Å²	208	135 Å²	135	97%	0.972	81%	0.809	S	S	*	*			trans	62.3	140.3	168.8	-56.5	-176	-168.1	0	0	119.1
326	G	29.7	Very low	31.5	Very low	73 Å²	73	139.2 Å²	139.2	75%	0.753	82%	0.815	S	S	*	*			cis	165.1	99.5	-5.3	0	0	0	0	0	112.8
327	P	41.1	Very low	31.5	Very low	105 Å²	105	143.6 Å²	143.6	68%	0.682	82%	0.822	S	S	*	*			trans	-124.9	171.4	-166.1	37.1	-22.5	0	0	0	118
328	Y	27.8	Very low	31.6	Very low	223 Å²	223	141.4 Å²	141.4	88%	0.875	82%	0.817	S	S	*	*			trans	89.8	154.7	161.6	-62.5	-66.2	0	0	0	121.6
329	Y	27.3	Very low	31.8	Very low	226 Å²	226	146.4 Å²	146.4	89%	0.886	82%	0.823	S	S	*	*			trans	-58.1	142.3	176.4	-84.6	-115.5	0	0	0	113.3
330	L	27	Very low	31.8	Very low	176 Å²	176	145.4 Å²	145.4	92%	0.921	82%	0.819	S	S	*	*				-169.4	158.2	129.1	-103.8	166.4	0	0	0	110.1
331	A	28.9	Very low	32.1	Very low	87 Å²	87	151.7 Å²	151.7	72%	0.719	83%	0.826	S	S	*	*			trans	-157.5	167.7	179.9	0	0	0	0	0	110.3
332	P	35.7	Very low	32	Very low	115 Å²	115	149.7 Å²	149.7	75%	0.747	83%	0.826	S	S	*	*				-131.1	169	-55.1	38.5	-26	0	0	0	111.9
333	Q	29.2	Very low	32.3	Very low	201 Å²	201	151.5 Å²	151.5	94%	0.939	82%	0.824	S	S	*	*			trans	-147.7	152.4	160.5	-79.5	-156.2	-24.4	0	0	112.4
334	D	29.8	Very low	32.2	Very low	170 Å²	170	153.8 Å²	153.8	91%	0.909	82%	0.824	S	S	*	*			trans	-101.9	164.7	-165.4	-65.1	-76	0	0	0	116
335	G	31.9	Very low	32.1	Very low	75 Å²	75	153.8 Å²	153.8	77%	0.773	82%	0.824	S	S	*	*			trans	177	147.2	155.5	0	0	0	0	0	114.4
336	N	33.6	Very low	32.2	Very low	156 Å²	156	154.5 Å²	154.5	83%	0.834	82%	0.824	S	S	*	*			cis	-167.1	132	-10.9	-164.4	-14.9	0	0	0	111.1
337	R	31.7	Very low	32.3	Very low	248 Å²	248	155.6 Å²	155.6	94%	0.936	83%	0.826	S	S	*	*			trans	175.9	132.2	155.3	-104.8	171.8	-178.1	-170.1	1.8	110.6
338	A	34.6	Very low	31.7	Very low	82 Å²	82	155 Å²	155	68%	0.678	82%	0.824	S	S	*	*			cis	-163.8	158.2	-20.7	0	0	0	0	0	110.5
339	R	35.6	Very low	32	Very low	223 Å²	223	151.6 Å²	151.6	84%	0.842	82%	0.821	S	S	*	*			trans	83.8	97.8	167.8	-64.5	-176.9	168.3	162.6	-1.6	119.6
340	D	33.1	Very low	32.3	Very low	139 Å²	139	147.8 Å²	147.8	74%	0.743	82%	0.816	S	S	*	*				42.2	133.1	118.9	-32.1	-35.5	0	0	0	119.2
341	K	35	Very low	33.5	Very low	202 Å²	202	145 Å²	145	88%	0.878	81%	0.809	S	S	*	*			cis	-147.5	146.3	34.5	-68	171	-179	174.6	0	113
342	T	34.4	Very low	34	Very low	141 Å²	141	147.2 Å²	147.2	87%	0.865	82%	0.816	S	S	*	*			trans	-97.2	154.4	171.6	42.2	0	0	0	0	112.9
343	P	36.9	Very low	33.8	Very low	115 Å²	115	145.7 Å²	145.7	75%	0.747	82%	0.821	S	S	*	*			trans	-107.8	144.9	171.7	37.5	-30.2	0	0	0	113.6
344	Q	30.7	Very low	33.9	Very low	199 Å²	199	142 Å²	142	93%	0.93	82%	0.818	S	S	*	*			trans	148.1	149.3	130.2	-81.8	-164.8	0.7	0	0	112.7
345	G	27.7	Very low	34.2	Very low	66 Å²	66	138.8 Å²	138.8	68%	0.68	81%	0.808	S	S	*	*			trans	147.4	83.5	163.3	0	0	0	0	0	116.3
346	K	34.3	Very low	34.3	Very low	223 Å²	223	143.1 Å²	143.1	97%	0.97	81%	0.813	S	S	*	*			trans	-177.6	168.1	135.3	-99.3	156.2	-171.8	178.5	0	111.3
347	A	31.1	Very low	34.1	Very low	96 Å²	96	138.9 Å²	138.9	79%	0.793	81%	0.807	S	S	*	*			trans	-125.4	174.7	-159.9	0	0	0	0	0	113.7
348	S	29.8	Very low	34.4	Very low	92 Å²	92	132.7 Å²	132.7	64%	0.643	80%	0.799	S	S	*	*			trans	69.8	117.4	165.7	-166.4	0	0	0	0	117.8
349	N	33.6	Very low	34.3	Very low	152 Å²	152	138.1 Å²	138.1	81%	0.813	80%	0.802	S	S	*	*				-167.6	165.3	105.9	-88	-15.9	0	0	0	111.6
350	N	33.4	Very low	33.9	Very low	145 Å²	145	136.4 Å²	136.4	78%	0.775	80%	0.803	S	S	*	*			trans	-87	157.4	-162.7	-61.9	-40.7	0	0	0	114.9
351	P	53.3	Low	33.7	Very low	118 Å²	118	139.1 Å²	139.1	77%	0.766	80%	0.803	S	S	*	*			trans	-75.2	160.9	159	36.1	-36.3	0	0	0	111
352	P	39.4	Very low	33.7	Very low	134 Å²	134	135.8 Å²	135.8	87%	0.87	80%	0.8	S	S	*	*				-149.7	169.8	100	39.8	-24.2	0	0	0	115.1
353	G	31	Very low	33.3	Very low	83 Å²	83	135.8 Å²	135.8	86%	0.856	80%	0.795	S	S	*	*			trans	165.8	124.5	166.5	0	0	0	0	0	113.1
354	S	30.3	Very low	33.3	Very low	124 Å²	124	136 Å²	136	87%	0.867	80%	0.796	S	S	*	*			trans	-140.5	143.3	-179.8	-179.9	0	0	0	0	111.3
355	S	35.8	Very low	33.2	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	79%	0.785	S	S	*	*			trans	-156.9	113.1	168.3	61.6	0	0	0	0	111.9
356	N	34	Very low	33.2	Very low	165 Å²	165	136 Å²	136	88%	0.882	79%	0.786	S	S	*	*			trans	28	143.5	137.2	-50.6	-22.4	0	0	0	120.3
357	G	29.3	Very low	32.8	Very low	68 Å²	68	137.5 Å²	137.5	70%	0.701	79%	0.786	S	S	*	*			cis	-164.2	-171.3	17.1	0	0	0	0	0	115.3
358	P	38.9	Very low	32.5	Very low	117 Å²	117	136.3 Å²	136.3	76%	0.76	77%	0.771	S	S	*	*			trans	-138.9	175.5	-148.2	44.9	-29.1	0	0	0	118.6
359	R	31.8	Very low	32.5	Very low	196 Å²	196	139.7 Å²	139.7	74%	0.74	78%	0.783	S	S	*	*			trans	69.3	123	155.4	-73.1	-178.8	177.2	-154.5	1.4	121.1
360	E	29.1	Very low	32.1	Very low	188 Å²	188	139.5 Å²	139.5	88%	0.879	78%	0.782	S	S	*	*				-140.3	139.6	105.6	-87.2	179.2	161	0	0	105.6
361	W	28.8	Very low	32	Very low	195 Å²	195	137.9 Å²	137.9	74%	0.739	78%	0.777	S	S	*	*				66.2	117	57.6	-70.7	44.6	0	0	0	110.7
362	T	33.4	Very low	30.9	Very low	133 Å²	133	138.3 Å²	138.3	82%	0.816	77%	0.773	S	S	*	*			cis	-139.8	166.6	32.5	49.1	0	0	0	0	115.2
363	N	27.1	Very low	30.3	Very low	141 Å²	141	138.9 Å²	138.9	75%	0.754	77%	0.769	S	S	*	*			trans	-111	-176.8	167.4	-134.4	-3.3	0	0	0	107.1
364	P	36.6	Very low	30.3	Very low	118 Å²	118	143.7 Å²	143.7	77%	0.766	77%	0.766	S	S	*	*			cis	-143.3	-175.2	30.8	43	-22	0	0	0	117.1
365	T	28.3	Very low	30.3	Very low	114 Å²	114	146.1 Å²	146.1	70%	0.699	76%	0.763	S	S	*	*			trans	-96.2	175.2	172.8	47.8	0	0	0	0	113.4
366	H	27.4	Very low	30.1	Very low	153 Å²	153	150.4 Å²	150.4	71%	0.708	77%	0.772	S	S	*	*			trans	70.2	119.4	160.6	-98.3	-86.2	0	0	0	119.8	S368	H366-S368 PolarHBondContact CE1-OG 3.32Å; H366-S368 PolarHBondContact ND1-OG 2.98Å; H366-S368 VanDerWaalsContact ND1-OG 3.1Å
367	W	26.2	Very low	30.3	Very low	254 Å²	254	148 Å²	148	96%	0.962	77%	0.766	S	S	*	*				-134.4	142.6	114.2	-140.3	-70.2	0	0	0	110.2
368	S	26.1	Very low	30.4	Very low	70 Å²	70	153 Å²	153	49%	0.49	78%	0.776	S	S	.	*			trans	-93.2	156	-178.2	-48.3	0	0	0	0	111.4	H366	H366-S368 PolarHBondContact CE1-OG 3.32Å; H366-S368 PolarHBondContact ND1-OG 2.98Å; H366-S368 VanDerWaalsContact ND1-OG 3.1Å
369	N	28.2	Very low	29.9	Very low	164 Å²	164	152.9 Å²	152.9	88%	0.877	78%	0.777	S	S	*	*			trans	-157.4	132.9	136.5	-108.5	-21.8	0	0	0	113.3
370	N	25.5	Very low	29.8	Very low	148 Å²	148	147.2 Å²	147.2	79%	0.791	78%	0.78	S	S	*	*			trans	-158.5	123.3	171.4	173.9	10.1	0	0	0	106.8
371	T	32.5	Very low	29.9	Very low	110 Å²	110	142.9 Å²	142.9	68%	0.675	78%	0.776	S	S	*	*			trans	-169.2	125.7	160.9	7.7	0	0	0	0	114.3
372	N	29.7	Very low	30.1	Very low	128 Å²	128	140.1 Å²	140.1	68%	0.684	78%	0.781	S	S	*	*			trans	61.7	109.3	135	-63.9	-14.5	0	0	0	123.5
373	N	27.4	Very low	30.1	Very low	146 Å²	146	138.9 Å²	138.9	78%	0.781	78%	0.778	S	S	*	*				46.5	120.2	115.9	-68.5	-32.2	0	0	0	121.5
374	K	29.7	Very low	30.3	Very low	184 Å²	184	137.4 Å²	137.4	80%	0.8	78%	0.779	S	S	*	*				-177.8	154.7	104.6	-103.8	171.3	-178.5	175.8	0	114.9
375	Q	31.5	Very low	29.9	Very low	174 Å²	174	137.3 Å²	137.3	81%	0.813	78%	0.781	S	S	*	*			trans	62.8	122.5	162.1	-66.2	158.8	-7.3	0	0	116.2
376	Q	31.2	Very low	30.3	Very low	192 Å²	192	137.4 Å²	137.4	90%	0.897	78%	0.783	S	S	*	*			cis	90.2	146	48.8	-78.5	-153.6	-20.2	0	0	115
377	P	37.4	Very low	30.3	Very low	115 Å²	115	135.2 Å²	135.2	75%	0.747	79%	0.785	S	S	*	*			trans	-118.9	176.1	-141.8	42.9	-33.2	0	0	0	115.4
378	L	30.9	Very low	30.4	Very low	174 Å²	174	128.4 Å²	128.4	91%	0.911	78%	0.776	S	S	*	*			trans	-144	169.6	162.6	-106.4	167.1	0	0	0	112.1
379	S	29.6	Very low	30.6	Very low	114 Å²	114	134.4 Å²	134.4	80%	0.797	80%	0.797	S	S	*	*			trans	-113.3	163.8	-150.9	51.2	0	0	0	0	116.8
380	G	30	Very low	30.6	Very low	77 Å²	77	135.3 Å²	135.3	79%	0.794	80%	0.795	S	S	*	*			trans	152.7	86.5	170.3	0	0	0	0	0	112.3
381	A	30.6	Very low	31.1	Very low	96 Å²	96	132.9 Å²	132.9	79%	0.793	79%	0.788	S	S	*	*			cis	91	87.9	36	0	0	0	0	0	115.2
382	T	33.6	Very low	30.9	Very low	137 Å²	137	134.2 Å²	134.2	84%	0.84	80%	0.796	S	S	*	*			trans	-150.8	138.1	146.2	44.3	0	0	0	0	112.1
383	S	32	Very low	30.9	Very low	108 Å²	108	131.4 Å²	131.4	76%	0.755	80%	0.797	S	S	*	*			trans	-20.4	157.4	155.8	44.7	0	0	0	0	119.7
384	S	31	Very low	30.8	Very low	110 Å²	110	131.4 Å²	131.4	77%	0.769	80%	0.797	S	S	*	*			cis	-178.2	159.8	-5.8	48.1	0	0	0	0	112.7
385	S	30	Very low	30.7	Very low	116 Å²	116	131.9 Å²	131.9	81%	0.811	80%	0.8	S	S	*	*			trans	-128.8	150.7	154.1	-55.9	0	0	0	0	108.2
386	P	35.2	Very low	30.7	Very low	116 Å²	116	130.4 Å²	130.4	75%	0.753	80%	0.798	S	S	*	*				-155.6	158.1	92.2	40.1	-21	0	0	0	118.5
387	S	29	Very low	30.8	Very low	106 Å²	106	126.1 Å²	126.1	74%	0.741	79%	0.786	S	S	*	*			trans	35.7	116.5	136.2	-47.9	0	0	0	0	124
388	S	27.6	Very low	30.2	Very low	111 Å²	111	129 Å²	129	78%	0.776	79%	0.787	S	S	*	*				58.7	119.9	127.4	66.4	0	0	0	0	122.7
389	Q	29.9	Very low	29.9	Very low	197 Å²	197	130.7 Å²	130.7	92%	0.921	78%	0.783	S	S	*	*			trans	-156.9	159.7	142.3	-114.4	172.7	27.6	0	0	112.5
390	Q	27.2	Very low	30.2	Very low	182 Å²	182	129.7 Å²	129.7	85%	0.85	77%	0.774	S	S	*	*			trans	-158.7	164.9	175.5	-112.9	-161.4	-11.4	0	0	107.2
391	P	37.7	Very low	30	Very low	97 Å²	97	133.7 Å²	133.7	63%	0.63	77%	0.772	S	S	*	*			cis	-133	-152	-21.7	37	-16.7	0	0	0	111.6
392	T	27.3	Very low	29.9	Very low	139 Å²	139	135.9 Å²	135.9	85%	0.853	77%	0.765	S	S	*	*			trans	104.1	138.4	159.3	70.3	0	0	0	0	119.8
393	G	29.1	Very low	29.7	Very low	69 Å²	69	135.7 Å²	135.7	71%	0.711	76%	0.764	S	S	*	*			trans	80.2	132.1	168.4	0	0	0	0	0	116.8
394	D	26.4	Very low	29.5	Very low	146 Å²	146	134 Å²	134	78%	0.781	76%	0.764	S	S	*	*			cis	-163.1	-178.1	-21.8	-133.2	-48.9	0	0	0	110.7
395	F	28.3	Very low	29.4	Very low	193 Å²	193	133.9 Å²	133.9	85%	0.846	77%	0.769	S	S	*	*			trans	101.7	74.7	174.2	-72.6	-82.2	0	0	0	120.3
396	N	30.5	Very low	29.3	Very low	144 Å²	144	131.7 Å²	131.7	77%	0.77	77%	0.765	S	S	*	*				51.2	156.3	114.1	-88.3	-0.9	0	0	0	125.1
397	P	33.5	Very low	29	Very low	101 Å²	101	133.2 Å²	133.2	66%	0.656	77%	0.766	S	S	*	*			trans	-145.8	-160	-140.7	37.1	-10.5	0	0	0	116.6
398	F	24.2	Very low	29.1	Very low	177 Å²	177	135.3 Å²	135.3	78%	0.776	77%	0.767	S	S	*	*			trans	68.3	108.3	157.6	-89.9	-97.8	0	0	0	122.3
399	Y	24.9	Very low	29.6	Very low	208 Å²	208	135 Å²	135	82%	0.816	76%	0.762	S	S	*	*				71.4	173.3	127.5	-92.4	-83	0	0	0	119.4
400	P	36.1	Very low	29.6	Very low	94 Å²	94	135 Å²	135	61%	0.61	76%	0.76	S	S	*	*				-130.9	-174.8	-118.6	48.3	-32.5	0	0	0	117.3
401	Q	26.5	Very low	29.8	Very low	161 Å²	161	132.8 Å²	132.8	75%	0.752	75%	0.753	S	S	*	*			trans	68	160.8	160.3	-76.2	175	-9.3	0	0	116.2
402	H	27.1	Very low	29.2	Very low	141 Å²	141	134.5 Å²	134.5	65%	0.653	76%	0.757	S	S	*	*			cis	-153.5	171.7	1.3	-130.3	-54.9	0	0	0	112.3
403	T	29.4	Very low	29.3	Very low	134 Å²	134	138.4 Å²	138.4	82%	0.822	76%	0.758	S	S	*	*			trans	66.9	151	157.3	53.2	0	0	0	0	121.8
404	G	27.7	Very low	29.4	Very low	72 Å²	72	141.5 Å²	141.5	74%	0.742	76%	0.758	S	S	*	*			cis	161.4	-174.9	-9.4	0	0	0	0	0	116.3
405	A	29.5	Very low	29.5	Very low	107 Å²	107	141.1 Å²	141.1	88%	0.884	76%	0.756	S	S	*	*			trans	93.1	140.3	166.2	0	0	0	0	0	120.9
406	G	28.7	Very low	29.6	Very low	70 Å²	70	137.1 Å²	137.1	72%	0.722	75%	0.749	S	S	*	*			trans	121.7	73.1	-178.9	0	0	0	0	0	114.5
407	I	29.2	Very low	29.4	Very low	149 Å²	149	133 Å²	133	76%	0.764	74%	0.741	S	S	*	*				72.2	121.1	51	-64.6	173.8	0	0	0	112.1
408	I	29.8	Very low	29.2	Very low	150 Å²	150	138.1 Å²	138.1	77%	0.769	75%	0.749	S	S	*	*			cis	-161.9	170.1	-8.1	-126.1	164.9	0	0	0	110.1
409	P	39.3	Very low	29.5	Very low	103 Å²	103	134.9 Å²	134.9	67%	0.669	75%	0.748	S	S	*	*			trans	-115.9	-172.3	-163.9	45	-37	0	0	0	116.4
410	F	30.3	Very low	29.9	Very low	199 Å²	199	130.1 Å²	130.1	87%	0.873	74%	0.736	S	S	*	*			trans	-163.7	151.6	156.9	-89.4	-57.2	0	0	0	109.1
411	N	30.9	Very low	29.6	Very low	135 Å²	135	133.3 Å²	133.3	72%	0.722	75%	0.748	S	S	*	*			cis	-151.6	171.4	-7	-154.1	4.8	0	0	0	111
412	N	25.1	Very low	29.7	Very low	132 Å²	132	132 Å²	132	71%	0.706	75%	0.746	S	S	*	*			trans	-78.3	162.8	-177.3	-60.2	-14.6	0	0	0	114.8
413	Y	29.5	Very low	30	Very low	222 Å²	222	132 Å²	132	87%	0.871	75%	0.749	S	S	*	*			trans	-149.6	141.2	130.7	-105.4	-66.5	0	0	0	112.6
414	D	30.6	Very low	30.3	Very low	134 Å²	134	132 Å²	132	72%	0.717	74%	0.744	S	S	*	*			trans	-53.4	159.7	-163.3	-50.6	-56.1	0	0	0	120.8
415	D	28.2	Very low	30.5	Very low	138 Å²	138	132.8 Å²	132.8	74%	0.738	73%	0.732	S	S	*	*			trans	-77.2	151.4	164.3	-175.5	56.4	0	0	0	111	G417	D415-G417 VanDerWaalsContact CG-N 3.25Å; D415-G417 PolarHBondContact OD1-N 3.2Å; D415-G417 PolarHBondContact OD2-N 3.49Å
416	P	30	Very low	30.8	Very low	109 Å²	109	135.1 Å²	135.1	71%	0.708	72%	0.724	S	S	*	*				-137.5	129.8	103.3	35.9	-24	0	0	0	113.7
417	G	26	Very low	31.1	Very low	57 Å²	57	137.1 Å²	137.1	59%	0.588	72%	0.716	S	S	*	*			trans	-64.5	148.2	-174.5	0	0	0	0	0	116	D415	D415-G417 VanDerWaalsContact CG-N 3.25Å; D415-G417 PolarHBondContact OD1-N 3.2Å; D415-G417 PolarHBondContact OD2-N 3.49Å
418	Y	30.1	Very low	31.3	Very low	209 Å²	209	133 Å²	133	82%	0.82	70%	0.698	S	S	*	*			trans	-122.5	116.3	165.6	-92.6	-91.1	0	0	0	110.5	L420	Y418-L420 HydrophobicContact CD1-CD1 4.33Å
419	S	30.1	Very low	31.2	Very low	109 Å²	109	133.3 Å²	133.3	76%	0.762	69%	0.694	S	S	*	*			trans	-67.5	134.3	156.3	-179	0	0	0	0	108.4
420	L	34.5	Very low	30.9	Very low	107 Å²	107	131.8 Å²	131.8	56%	0.56	68%	0.682	S	S	*	*			trans	-149.6	49.5	179.9	-140.7	108	0	0	0	114.1	Y418 D422 I423	Y418-L420 HydrophobicContact CD1-CD1 4.33Å; L420-D422 HydrophobicContact CG-CB 4.48Å; L420-D422 PolarHBondContact O-N 3.12Å; L420-I423 HydrophobicContact CD2-CD1 3.69Å; L420-I423 HydrophobicContact CD2-CG1 3.8Å
421	D	28.2	Very low	31	Very low	161 Å²	161	126.9 Å²	126.9	86%	0.861	67%	0.669	S	S	*	*			trans	-67.2	64.1	156.9	-73.6	-49.3	0	0	0	110.1
422	D	28.6	Very low	31.1	Very low	134 Å²	134	125.3 Å²	125.3	72%	0.717	66%	0.664	S	S	*	*			trans	-154.5	35	-169.2	-127.9	-18.1	0	0	0	114.8	L420	L420-D422 HydrophobicContact CG-CB 4.48Å; L420-D422 PolarHBondContact O-N 3.12Å
423	I	33.9	Very low	31.2	Very low	141 Å²	141	125.1 Å²	125.1	72%	0.723	66%	0.663	S	S	*	*	S	Bend	trans	-136.6	59.9	174.2	-38.7	179.4	0	0	0	113.4	L420	L420-I423 HydrophobicContact CD2-CD1 3.69Å; L420-I423 HydrophobicContact CD2-CG1 3.8Å
424	D	35.9	Very low	31.2	Very low	133 Å²	133	121.7 Å²	121.7	71%	0.711	66%	0.655	S	S	*	*	S	Bend	trans	-140.1	-8.6	159.5	-114.9	-31.4	0	0	0	113.6	E426	D424-E426 PolarHBondContact O-N 3.36Å
425	D	32	Very low	31.1	Very low	90 Å²	90	126.3 Å²	126.3	48%	0.481	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	10.6	-168.3	-154	47.2	0	0	0	115.3	T428 K429	D425-T428 PolarHBondContact OD1-OG1 3.39Å; D425-K429 IonicContact OD2-NZ 3.19Å; D425-K429 PolarHBondContact OD2-NZ 2.93Å
426	E	35.4	Very low	31.1	Very low	156 Å²	156	126.9 Å²	126.9	73%	0.729	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	10.8	176.6	-151.3	-156.7	-165	0	0	113	D424 K1036	D424-E426 PolarHBondContact O-N 3.36Å; E426-K1036 IonicContact OE2-NZ 3.96Å; E426-K1036 PolarHBondContact OE2-NZ 2.77Å
427	M	35.7	Very low	31	Very low	111 Å²	111	130.5 Å²	130.5	55%	0.547	67%	0.673	S	S	.	*	S	Bend	trans	-128.4	-0.3	176.7	-139.9	179.6	-54.3	0	0	114.8
428	T	32.9	Very low	31.1	Very low	62 Å²	62	135.2 Å²	135.2	38%	0.38	69%	0.685	S	S	.	*	S	Bend	trans	-105.2	-25.9	179.9	46.6	0	0	0	0	112.9	D425 T430 A986	D425-T428 PolarHBondContact OD1-OG1 3.39Å; T428-T430 VanDerWaalsContact C-N 3.28Å; T428-T430 PolarHBondContact O-N 2.86Å; T428-A986 HydrophobicContact CG2-CB 4.36Å
429	K	28	Very low	31	Very low	157 Å²	157	134.2 Å²	134.2	68%	0.683	69%	0.687	S	S	*	*			trans	-76.4	71.2	174.1	-73.3	176.7	175.8	124.7	0	112.6	D425	D425-K429 IonicContact OD2-NZ 3.19Å; D425-K429 PolarHBondContact OD2-NZ 2.93Å
430	T	32.1	Very low	30.9	Very low	71 Å²	71	137.8 Å²	137.8	44%	0.436	70%	0.697	S	S	.	*			trans	-120.6	101.8	145.2	62.4	0	0	0	0	108.5	T428 R919	T428-T430 VanDerWaalsContact C-N 3.28Å; T428-T430 PolarHBondContact O-N 2.86Å; T430-R919 PolarHBondContact OG1-NH1 3.31Å; T430-R919 PolarHBondContact OG1-NH2 3.01Å
431	T	32.6	Very low	30.5	Very low	96 Å²	96	140.2 Å²	140.2	59%	0.589	71%	0.711	S	S	*	*			trans	-47.2	140.1	165.8	31.6	0	0	0	0	109.8	D433 E434	T431-D433 PolarHBondContact O-N 3.24Å; T431-E434 PolarHBondContact OG1-OE2 2.81Å
432	V	32.6	Very low	30.5	Very low	103 Å²	103	136.7 Å²	136.7	62%	0.624	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-0.6	-171.8	169.6	0	0	0	0	112.1
433	D	27.7	Very low	30.5	Very low	128 Å²	128	136.6 Å²	136.6	68%	0.684	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.8	7.3	-158.8	-53	-66.9	0	0	0	114.5	T431	T431-D433 PolarHBondContact O-N 3.24Å
434	E	29.1	Very low	30.2	Very low	149 Å²	149	133.6 Å²	133.6	70%	0.696	72%	0.717	S	S	*	*	S	Bend	trans	-117.6	26.6	-179.1	-72.4	178.7	125.2	0	0	114.2	T431	T431-E434 PolarHBondContact OG1-OE2 2.81Å
435	Y	29.2	Very low	29.8	Very low	232 Å²	232	132.8 Å²	132.8	91%	0.91	72%	0.722	S	S	*	*	S	Bend	trans	-135	26.2	175.3	-99.9	-78.2	0	0	0	113.9
436	I	29.3	Very low	29.6	Very low	150 Å²	150	134.2 Å²	134.2	77%	0.769	74%	0.739	S	S	*	*	S	Bend	trans	-140.4	64.8	167.6	-45.4	178.8	0	0	0	109.9
437	E	26.9	Very low	29.3	Very low	185 Å²	185	132.4 Å²	132.4	86%	0.864	74%	0.741	S	S	*	*			trans	-161	163.2	148.2	-115.4	153.8	-140.6	0	0	111.1
438	D	27.4	Very low	29	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	75%	0.753	S	S	*	*	S	Bend	trans	67	148.5	176.3	-65.6	-19.9	0	0	0	122.3
439	E	28.8	Very low	29	Very low	188 Å²	188	135 Å²	135	88%	0.879	77%	0.773	S	S	*	*			trans	50.1	77.2	174.1	-60.5	-154.5	141	0	0	119.7
440	L	28.4	Very low	29.2	Very low	184 Å²	184	133.6 Å²	133.6	96%	0.963	77%	0.773	S	S	*	*			trans	-144.5	47.7	130.2	-114.8	-173.9	0	0	0	112.7
441	D	24.8	Very low	29.2	Very low	158 Å²	158	137.1 Å²	137.1	85%	0.845	78%	0.784	S	S	*	*			trans	-103.5	155.6	167.9	-135.9	-31.3	0	0	0	110.6
442	A	29.4	Very low	29.3	Very low	88 Å²	88	138.6 Å²	138.6	73%	0.727	79%	0.789	S	S	*	*			trans	57.8	98.5	178.8	0	0	0	0	0	119.2
443	S	28.1	Very low	29.5	Very low	132 Å²	132	141 Å²	141	92%	0.923	80%	0.798	S	S	*	*				-178.2	152.3	107.9	46.9	0	0	0	0	111.9
444	G	28.7	Very low	29.6	Very low	77 Å²	77	142.4 Å²	142.4	79%	0.794	80%	0.804	S	S	*	*			trans	137.4	37.6	-178	0	0	0	0	0	115.5
445	S	25.8	Very low	29.9	Very low	116 Å²	116	139.9 Å²	139.9	81%	0.811	80%	0.801	S	S	*	*			trans	-52.4	161.6	179.2	43.2	0	0	0	0	116.5
446	S	28.3	Very low	30.2	Very low	120 Å²	120	137.6 Å²	137.6	84%	0.839	80%	0.796	S	S	*	*			trans	-145.5	154.1	153.7	-79.7	0	0	0	0	110.6
447	P	30.4	Very low	30	Very low	118 Å²	118	138.2 Å²	138.2	77%	0.766	80%	0.8	S	S	*	*			trans	-117.1	-168.4	-145.4	42.1	-32.4	0	0	0	115.5
448	S	28.8	Very low	30.4	Very low	115 Å²	115	134.7 Å²	134.7	80%	0.804	79%	0.793	S	S	*	*			trans	78	141.4	-176.2	75.8	0	0	0	0	114.6
449	S	33.3	Very low	30.4	Very low	114 Å²	114	132.3 Å²	132.3	80%	0.797	79%	0.789	S	S	*	*			cis	-171	155.5	-6.9	39	0	0	0	0	109.2
450	D	31.4	Very low	30.5	Very low	126 Å²	126	130.1 Å²	130.1	67%	0.674	79%	0.787	S	S	*	*			cis	-175	171.6	-14.1	179.8	28.1	0	0	0	107.7
451	Q	33.2	Very low	30.6	Very low	146 Å²	146	130.7 Å²	130.7	68%	0.682	78%	0.782	S	S	*	*			trans	66.6	138.9	163.4	-75.4	160.6	58.6	0	0	118.5
452	N	33.3	Very low	31.4	Very low	127 Å²	127	128.5 Å²	128.5	68%	0.679	78%	0.777	S	S	*	*			cis	-144.3	159.5	-0.3	-80.4	-54.6	0	0	0	107.3
453	N	37.4	Very low	31.5	Very low	153 Å²	153	134.6 Å²	134.6	82%	0.818	78%	0.781	S	S	*	*			cis	-153.2	176.2	37.6	-110.3	-49.8	0	0	0	113
454	L	30.2	Very low	31.6	Very low	157 Å²	157	134.2 Å²	134.2	82%	0.822	77%	0.769	S	S	*	*			trans	-114.2	-170.7	-164	-117.6	67.3	0	0	0	112.9
455	P	35.4	Very low	31.5	Very low	96 Å²	96	135.6 Å²	135.6	62%	0.623	77%	0.765	S	S	*	*			cis	-145.4	-178.4	-17.9	33.6	-10.6	0	0	0	118.6
456	K	34.2	Very low	31.6	Very low	185 Å²	185	137.6 Å²	137.6	80%	0.804	76%	0.763	S	S	*	*			trans	87.9	127.8	157.9	-51.1	-179.6	-174.6	176.3	0	118.3
457	L	26.4	Very low	31.7	Very low	163 Å²	163	140.1 Å²	140.1	85%	0.853	76%	0.762	S	S	*	*			cis	84.5	144.6	26.9	-67	158.5	0	0	0	116
458	P	34.7	Very low	31.6	Very low	111 Å²	111	140.4 Å²	140.4	72%	0.721	76%	0.755	S	S	*	*			cis	-138.5	-177.3	-11.1	40	-20	0	0	0	117.5
459	S	27.8	Very low	31.5	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	75%	0.753	S	S	*	*			trans	-27.7	154.9	170.2	58.6	0	0	0	0	123.8
460	V	31.3	Very low	31.6	Very low	141 Å²	141	141.9 Å²	141.9	86%	0.855	76%	0.755	S	S	*	*				-179.2	162	120.1	145.4	0	0	0	0	113.2
461	K	30.2	Very low	31.5	Very low	196 Å²	196	142.5 Å²	142.5	85%	0.852	76%	0.758	S	S	*	*			trans	-149.6	169.5	175.2	-96.5	-171.3	178.5	-177.1	0	108.8
462	P	42.2	Very low	31.5	Very low	113 Å²	113	145.1 Å²	145.1	73%	0.734	77%	0.767	S	S	*	*			cis	-133.8	-148.4	-30.9	39.8	-19.5	0	0	0	111.7
463	R	30.4	Very low	31.3	Very low	215 Å²	215	148.9 Å²	148.9	81%	0.811	77%	0.773	S	S	*	*			trans	88.8	151.6	170.7	-60	-168.6	140.4	142.5	2.4	118.1
464	D	29.7	Very low	31.6	Very low	125 Å²	125	146.3 Å²	146.3	67%	0.668	77%	0.765	S	S	*	*			cis	-163.9	159.3	-21.2	-96.2	-21.9	0	0	0	111
465	C	27.7	Very low	31.8	Very low	106 Å²	106	144 Å²	144	72%	0.716	76%	0.758	S	S	*	*			trans	63.4	111.6	153.1	-68.1	0	0	0	0	125.5
466	M	27	Very low	31.6	Very low	157 Å²	157	145.6 Å²	145.6	77%	0.773	76%	0.761	S	S	*	*				48.4	121.5	124.1	-63.4	-161.2	-84.7	0	0	125
467	H	30.6	Very low	31.2	Very low	174 Å²	174	143 Å²	143	81%	0.806	76%	0.756	S	S	*	*				-178.1	132.6	118.9	-93.8	-75.4	0	0	0	106.8
468	I	27.7	Very low	31.7	Very low	123 Å²	123	142.4 Å²	142.4	63%	0.631	75%	0.748	S	S	*	*			cis	97.4	135.9	44.5	-72.3	174.4	0	0	0	113
469	D	28.4	Very low	31.3	Very low	141 Å²	141	144 Å²	144	75%	0.754	75%	0.746	S	S	*	*			trans	65.1	131.6	-179.4	-60	-36.2	0	0	0	117.6
470	S	34.9	Very low	31.5	Very low	120 Å²	120	145 Å²	145	84%	0.839	74%	0.742	S	S	*	*			cis	-155.5	160.1	46.8	-60.7	0	0	0	0	115
471	N	27.9	Very low	31.2	Very low	138 Å²	138	145 Å²	145	74%	0.738	74%	0.737	S	S	*	*			trans	-83.3	147	178.8	-71.6	-68.3	0	0	0	115.2
472	K	34	Very low	31.4	Very low	202 Å²	202	142 Å²	142	88%	0.878	74%	0.735	S	S	*	*			trans	-175.1	107.2	133.5	-107	169.9	-178.3	-179.3	0	116.7
473	Y	28.5	Very low	30.5	Very low	206 Å²	206	142.9 Å²	142.9	81%	0.808	73%	0.733	S	S	*	*				-3	165.5	124.8	-68.9	-84.5	0	0	0	120.7
474	P	43.9	Very low	30.5	Very low	98 Å²	98	137.3 Å²	137.3	64%	0.636	72%	0.723	S	S	*	*				-144.7	-127.6	-50.3	41.9	-19.4	0	0	0	110.8
475	T	34.4	Very low	30.5	Very low	110 Å²	110	136.7 Å²	136.7	68%	0.675	72%	0.72	S	S	*	*			trans	63.6	148.1	167.9	52.2	0	0	0	0	117.2
476	D	31.8	Very low	30.5	Very low	129 Å²	129	138.1 Å²	138.1	69%	0.69	71%	0.714	S	S	*	*			cis	-148.8	145.8	-18.3	-99.9	-34.3	0	0	0	105.8
477	N	26.6	Very low	30.7	Very low	130 Å²	130	142 Å²	142	70%	0.695	72%	0.722	S	S	*	*				69.8	139.6	67.7	-136.8	-0.2	0	0	0	113.8
478	H	35.8	Very low	30.7	Very low	151 Å²	151	136.7 Å²	136.7	70%	0.699	70%	0.704	S	S	*	*			trans	76.3	150.1	-174.7	-61.1	-79.3	0	0	0	118.5
479	Q	26.8	Very low	30.6	Very low	145 Å²	145	134.1 Å²	134.1	68%	0.678	70%	0.698	S	S	*	*			cis	-177	168.1	-36	-130.9	-177.3	-23.3	0	0	109.1
480	I	31	Very low	30.5	Very low	126 Å²	126	133.8 Å²	133.8	65%	0.646	70%	0.696	S	S	*	*			trans	66.6	111.4	149.6	-66.9	160.1	0	0	0	118.5
481	D	25.3	Very low	30.5	Very low	141 Å²	141	134.8 Å²	134.8	75%	0.754	69%	0.687	S	S	*	*			trans	-9.4	117.3	141.4	-44.8	-85.1	0	0	0	119
482	V	34.4	Very low	30.3	Very low	133 Å²	133	134.9 Å²	134.9	81%	0.806	68%	0.683	S	S	*	*				-146.7	106.2	116.5	-147.2	0	0	0	0	105.1
483	N	24.7	Very low	30.1	Very low	131 Å²	131	132 Å²	132	70%	0.701	67%	0.672	S	S	*	*				60	142.9	64.3	-161.5	8.4	0	0	0	113
484	T	29.5	Very low	30.1	Very low	98 Å²	98	128 Å²	128	60%	0.601	66%	0.661	S	S	*	*			trans	65.3	147.2	171.9	72.2	0	0	0	0	116.7
485	N	29.3	Very low	29.4	Very low	112 Å²	112	131.6 Å²	131.6	60%	0.599	66%	0.663	S	S	*	*			cis	-162.5	175.1	-12	-116.1	-22.2	0	0	0	111.7
486	F	27.8	Very low	29.3	Very low	136 Å²	136	132.4 Å²	132.4	60%	0.596	66%	0.662	S	S	*	*			trans	31.8	131.6	144.5	-57.3	-46.6	0	0	0	119.7	S488	F486-S488 WeakPolarHBondContact CB-OG 3.46Å; F486-S488 WeakPolarHBondContact CD1-OG 3.42Å; F486-S488 WeakPolarHBondContact CG-OG 3.5Å
487	Y	31.4	Very low	29.1	Very low	237 Å²	237	130.9 Å²	130.9	93%	0.929	66%	0.662	S	S	*	*			cis	-93.7	129.7	44.7	-78.4	-106.9	0	0	0	114.1
488	S	29.8	Very low	29.3	Very low	63 Å²	63	131.1 Å²	131.1	44%	0.441	66%	0.663	S	S	.	*			cis	71.4	147.1	43.2	-84.9	0	0	0	0	115.6	F486	F486-S488 WeakPolarHBondContact CB-OG 3.46Å; F486-S488 WeakPolarHBondContact CD1-OG 3.42Å; F486-S488 WeakPolarHBondContact CG-OG 3.5Å
489	S	27.2	Very low	29	Very low	70 Å²	70	129.5 Å²	129.5	49%	0.49	66%	0.659	S	S	.	*			cis	176.6	147.6	-21.7	-96	0	0	0	0	106.8
490	N	26.2	Very low	29.2	Very low	133 Å²	133	131.8 Å²	131.8	71%	0.711	66%	0.663	S	S	*	*			trans	62.1	167.5	164.7	-49.7	-31.4	0	0	0	114.5
491	H	33.5	Very low	28.9	Very low	141 Å²	141	137 Å²	137	65%	0.653	68%	0.675	S	S	*	*			cis	-110.9	138.6	-3.9	-88.1	-90.4	0	0	0	108.6
492	Q	24.9	Very low	29.7	Very low	141 Å²	141	135.9 Å²	135.9	66%	0.659	68%	0.675	S	S	*	*				67.1	147.4	66	-165.8	-158.7	57.8	0	0	111.4
493	Q	30	Very low	29.4	Very low	140 Å²	140	135 Å²	135	65%	0.654	68%	0.675	S	S	*	*			trans	81.9	141	178.2	-50.6	-179.3	18.4	0	0	113.8
494	Q	27.7	Very low	29.7	Very low	122 Å²	122	135.2 Å²	135.2	57%	0.57	68%	0.681	S	S	*	*			cis	-166.4	172.5	-12.7	-123.5	161.1	7.5	0	0	111.8
495	Y	30.1	Very low	29.9	Very low	175 Å²	175	135.5 Å²	135.5	69%	0.686	68%	0.684	S	S	*	*			trans	62.4	126.3	145.5	-68.6	-43.5	0	0	0	122.9
496	I	31.8	Very low	30.1	Very low	127 Å²	127	135.5 Å²	135.5	65%	0.651	69%	0.688	S	S	*	*				68.4	97	127.1	-59.5	169.5	0	0	0	117.3
497	S	27.1	Very low	30.1	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	70%	0.699	S	S	*	*				53.2	160.9	114	-42.7	0	0	0	0	121.9
498	N	31.5	Very low	30.1	Very low	135 Å²	135	134.8 Å²	134.8	72%	0.722	69%	0.686	S	S	*	*			trans	79.1	137.5	159.7	-58.7	-18.6	0	0	0	116.1
499	N	29.9	Very low	30.1	Very low	116 Å²	116	138.5 Å²	138.5	62%	0.62	70%	0.701	S	S	*	*			cis	-168.3	179.6	-16.5	-124.5	-27.3	0	0	0	112.2
500	Y	29.5	Very low	30.3	Very low	193 Å²	193	138 Å²	138	76%	0.757	71%	0.707	S	S	*	*			trans	33.6	115.8	155.7	-67	-70	0	0	0	119.7
501	R	26	Very low	30.5	Very low	237 Å²	237	141.2 Å²	141.2	89%	0.894	72%	0.715	S	S	*	*				66.9	150.8	83.2	-109	-155.8	168	-171	-2.8	115.6
502	P	40.7	Very low	30.2	Very low	116 Å²	116	141.1 Å²	141.1	75%	0.753	72%	0.719	S	S	*	*			trans	-101.5	171	-158.5	40.6	-38.8	0	0	0	115.4
503	S	29.9	Very low	30.5	Very low	116 Å²	116	139.1 Å²	139.1	81%	0.811	72%	0.716	S	S	*	*			trans	-151.8	123.7	159.3	56.4	0	0	0	0	113.5
504	V	30.1	Very low	30.4	Very low	135 Å²	135	139.3 Å²	139.3	82%	0.818	72%	0.722	S	S	*	*			trans	-73.2	145.4	158.1	170.1	0	0	0	0	106.7
505	P	34.7	Very low	30.5	Very low	104 Å²	104	140.2 Å²	140.2	68%	0.675	73%	0.726	S	S	*	*				-160.6	148.8	88.4	44.1	-22.1	0	0	0	121.5
506	T	32.1	Very low	30.5	Very low	111 Å²	111	139.1 Å²	139.1	68%	0.681	73%	0.727	S	S	*	*			trans	62.6	132.7	134.2	58.3	0	0	0	0	124.6
507	R	28.7	Very low	30.3	Very low	219 Å²	219	143.2 Å²	143.2	83%	0.826	73%	0.734	S	S	*	*			trans	75.8	154.3	134.4	-77.6	-179.8	172.6	175.6	-0.9	118
508	Q	31.4	Very low	30.2	Very low	140 Å²	140	143.6 Å²	143.6	65%	0.654	74%	0.737	S	S	*	*			cis	-149.2	167.8	9.8	-132.8	171.2	-78.2	0	0	112.9
509	D	30.2	Very low	30.1	Very low	140 Å²	140	143.8 Å²	143.8	75%	0.749	74%	0.744	S	S	*	*			trans	14.5	145.3	156.3	-43.5	-28.7	0	0	0	121.7
510	G	30.8	Very low	30.1	Very low	60 Å²	60	142.3 Å²	142.3	62%	0.619	75%	0.747	S	S	*	*			cis	161.5	164.6	-2.6	0	0	0	0	0	113.3
511	F	29.7	Very low	30	Very low	200 Å²	200	142.9 Å²	142.9	88%	0.877	75%	0.75	S	S	*	*			trans	58.6	124.3	169.2	-65.9	-91	0	0	0	119.3
512	N	28.4	Very low	30	Very low	140 Å²	140	141.8 Å²	141.8	75%	0.749	75%	0.745	S	S	*	*				72.3	131.9	79.5	-131.1	25.4	0	0	0	111.5
513	V	30	Very low	29.3	Very low	98 Å²	98	144.3 Å²	144.3	59%	0.594	75%	0.745	S	S	*	*			cis	-164.3	148.7	34.9	173	0	0	0	0	110.4
514	D	29.3	Very low	29.2	Very low	144 Å²	144	144.5 Å²	144.5	77%	0.77	74%	0.737	S	S	*	*			trans	48.2	171.8	155.9	-60	-12.1	0	0	0	121.6
515	E	29.6	Very low	29.1	Very low	141 Å²	141	144 Å²	144	66%	0.659	73%	0.726	S	S	*	*			cis	-156.5	155.7	-26.3	-118.3	-151.9	116	0	0	109.6
516	Q	29	Very low	28.6	Very low	152 Å²	152	149.9 Å²	149.9	71%	0.71	73%	0.734	S	S	*	*			trans	59.2	164.4	154.3	-65.2	-179.6	41.7	0	0	120.5
517	R	27.4	Very low	28.2	Very low	213 Å²	213	148 Å²	148	80%	0.804	74%	0.736	S	S	*	*			cis	-169.8	128.3	-37.4	-177.8	177.7	-169.5	-179.3	4.9	111.4
518	S	26.3	Very low	28	Very low	106 Å²	106	143.2 Å²	143.2	74%	0.741	73%	0.732	S	S	*	*			trans	65.9	157	167.3	-63.2	0	0	0	0	117.6
519	T	29.4	Very low	27.8	Very low	139 Å²	139	146 Å²	146	85%	0.853	74%	0.737	S	S	*	*			cis	-108.6	-137.5	10.5	53.2	0	0	0	0	112.9
520	A	29.6	Very low	27.7	Very low	85 Å²	85	146.3 Å²	146.3	70%	0.702	74%	0.736	S	S	*	*			cis	-150.6	-150.5	10	0	0	0	0	0	113.2
521	Y	27.5	Very low	27.3	Very low	205 Å²	205	151.1 Å²	151.1	80%	0.804	75%	0.748	S	S	*	*			trans	-115.6	134.3	-170.1	-78.9	-93.6	0	0	0	112
522	R	25.2	Very low	27	Very low	213 Å²	213	145.6 Å²	145.6	80%	0.804	74%	0.739	S	S	*	*				58.1	135.2	96	-65.3	-153.3	174.7	-178.8	-3.1	115.5
523	F	26.4	Very low	26.9	Very low	170 Å²	170	148.3 Å²	148.3	75%	0.746	75%	0.747	S	S	*	*			cis	-160.5	177.1	-2.2	-144.7	-107.3	0	0	0	111.5
524	D	28.1	Very low	26.6	Very low	119 Å²	119	152 Å²	152	64%	0.636	76%	0.76	S	S	*	*			trans	77	147	162.1	-111.5	22.3	0	0	0	118.6
525	Q	27	Very low	26.6	Very low	126 Å²	126	154.3 Å²	154.3	59%	0.589	77%	0.766	S	S	*	*			cis	-150.8	147.2	2.2	-156.4	-177.3	100	0	0	111.9
526	R	24.8	Very low	26.7	Very low	227 Å²	227	158.2 Å²	158.2	86%	0.857	78%	0.776	S	S	*	*			trans	64.7	109.9	168.5	-43.4	-168.2	-177.7	-144.6	-4.9	119.3
527	G	23.6	Very low	26.9	Very low	70 Å²	70	154.3 Å²	154.3	72%	0.722	78%	0.777	S	S	*	*			trans	154.3	130.2	149.5	0	0	0	0	0	118.2
528	V	24.1	Very low	27.3	Very low	120 Å²	120	152.6 Å²	152.6	73%	0.727	78%	0.778	S	S	*	*			trans	70.5	148.7	155.3	-137.8	0	0	0	0	120.3
529	Y	26.5	Very low	27.9	Very low	197 Å²	197	150.7 Å²	150.7	77%	0.773	76%	0.763	S	S	*	*			trans	76	154.7	158.5	-63.5	-54.8	0	0	0	119.7
530	M	28.3	Very low	28.7	Very low	147 Å²	147	147.1 Å²	147.1	72%	0.724	74%	0.743	S	S	*	*			cis	-128.5	160.1	2.3	-95.6	-50.2	167.5	0	0	112.6
531	N	22.3	Very low	29.7	Very low	162 Å²	162	147.5 Å²	147.5	87%	0.866	73%	0.732	S	S	*	*			trans	-114.3	119.5	156.1	-100.1	-10.3	0	0	0	108.3
532	A	24.1	Very low	30.9	Very low	84 Å²	84	143.4 Å²	143.4	69%	0.694	72%	0.721	S	S	*	*			trans	-165.4	143.3	161.8	0	0	0	0	0	111.6
533	E	26.5	Very low	32.4	Very low	197 Å²	197	135.9 Å²	135.9	92%	0.921	70%	0.696	S	S	*	*			trans	61.7	126.4	157.3	-71.8	158.7	-156.9	0	0	119.9
534	M	24.4	Very low	33.8	Very low	175 Å²	175	131.1 Å²	131.1	86%	0.862	67%	0.674	S	S	*	*			trans	-99.3	128	174.3	-73.3	178.5	-94.7	0	0	110
535	E	27.9	Very low	35.9	Very low	192 Å²	192	125.5 Å²	125.5	90%	0.897	64%	0.644	S	S	*	*			trans	-133.3	112.5	167.6	-169.9	173.8	-145.5	0	0	109.3	G537	E535-G537 PolarHBondContact O-N 3.09Å
536	Y	32.9	Very low	38.1	Very low	223 Å²	223	120.5 Å²	120.5	88%	0.875	62%	0.621	S	S	*	*			trans	-82.6	93.4	-180	-87.1	-87.9	0	0	0	110.5
537	G	33.3	Very low	40.5	Very low	70 Å²	70	111.1 Å²	111.1	72%	0.722	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-70.5	158.1	-177.7	0	0	0	0	0	115.6	E535	E535-G537 PolarHBondContact O-N 3.09Å
538	E	34.5	Very low	42.9	Very low	178 Å²	178	109.4 Å²	109.4	83%	0.832	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-64.8	150.7	173.8	-65.7	-169	118.3	0	0	112.8
539	P	39	Very low	44.7	Very low	66 Å²	66	110.3 Å²	110.3	43%	0.429	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-63.4	138.5	169.9	28.2	-34.7	0	0	0	110.8
540	P	47.2	Very low	46.7	Very low	64 Å²	64	106.8 Å²	106.8	42%	0.416	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-64.5	147	-171.4	26.3	-35.2	0	0	0	112.8	E542 D543	P540-E542 PolarHBondContact O-N 3.24Å; P540-D543 WeakPolarHBondContact O-CB 3.3Å; P540-D543 PolarHBondContact O-N 2.76Å; P540-D543 VanDerWaalsContact O-N 3.12Å
541	L	49.7	Very low	48.1	Very low	92 Å²	92	102.3 Å²	102.3	48%	0.482	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-61.6	-11.6	177.1	-78.4	99.8	0	0	0	114.1	D543 Y544 I556	L541-D543 PolarHBondContact O-N 2.8Å; L541-Y544 PolarHBondContact O-N 2.92Å; L541-I556 HydrophobicContact CD2-CD1 4.44Å; L541-I556 HydrophobicContact CD2-CG2 4.14Å
542	E	53.5	Low	50.3	Low	120 Å²	120	96.5 Å²	96.5	56%	0.561	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-63.1	-18.8	172	-70.5	106	-110	0	0	114	P540 Y544 R558	P540-E542 PolarHBondContact O-N 3.24Å; E542-Y544 PolarHBondContact O-N 2.76Å; E542-R558 IonicContact OE1-CZ 2.79Å; E542-R558 IonicContact OE1-NE 3.56Å; E542-R558 PolarHBondContact OE1-NE 3.28Å; E542-R558 IonicContact OE1-NH2 3.59Å; E542-R558 PolarHBondContact OE1-NH2 2.81Å; E542-R558 IonicContact OE2-NH2 3.72Å
543	D	55.6	Low	52.3	Low	54 Å²	54	95 Å²	95	29%	0.289	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-65.5	-12.2	172.8	-96.9	8.8	0	0	0	114.5	P540 L541 R582 N583 P584	P540-D543 WeakPolarHBondContact O-CB 3.3Å; P540-D543 PolarHBondContact O-N 2.76Å; P540-D543 VanDerWaalsContact O-N 3.12Å; L541-D543 PolarHBondContact O-N 2.8Å; D543-R582 HydrophobicContact CB-CG 4.14Å; D543-R582 IonicContact OD2-CZ 3.78Å; D543-R582 VanDerWaalsContact OD2-CZ 3.25Å; D543-R582 IonicContact OD2-NE 3.5Å; D543-R582 PolarHBondContact OD2-NE 3.1Å; D543-R582 IonicContact OD2-NH2 2.75Å; D543-R582 PolarHBondContact OD2-NH2 3.47Å; D543-N583 PolarHBondContact O-N 3.12Å; D543-N583 VanDerWaalsContact O-N 3.1Å; D543-P584 WeakPolarHBondContact O-CD 3.08Å
544	Y	55.7	Low	54.4	Low	70 Å²	70	90.1 Å²	90.1	28%	0.275	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.5	-165.6	-61.5	-93.4	0	0	0	112.3	L541 E542 I580 V581 R582	L541-Y544 PolarHBondContact O-N 2.92Å; E542-Y544 PolarHBondContact O-N 2.76Å; Y544-I580 HydrophobicContact CD1-CG2 3.85Å; Y544-I580 HydrophobicContact CG-CG2 4.37Å; Y544-V581 WeakPolarHBondContact CA-O 3.45Å; Y544-R582 HydrophobicContact CD1-CB 3.78Å; Y544-R582 HydrophobicContact CD1-CG 3.93Å; Y544-R582 HydrophobicContact CE1-CB 3.59Å; Y544-R582 HydrophobicContact CE1-CG 3.57Å; Y544-R582 HydrophobicContact CE2-CG 4.32Å; Y544-R582 HydrophobicContact CG-CG 4.46Å; Y544-R582 WeakPolarHBondContact OH-CD 3.48Å
545	V	73.8	Confident	56.2	Low	1 Å²	1	90.9 Å²	90.9	1%	0.006	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	144.7	173.4	-79.5	0	0	0	0	110.8	V553 Q554 R555 V581	V545-V553 HydrophobicContact CB-CG1 3.69Å; V545-V553 HydrophobicContact CG1-CG1 3.89Å; V545-V553 HydrophobicContact CG2-CG1 4.01Å; V545-Q554 WeakPolarHBondContact CA-O 3.42Å; V545-R555 HydrophobicContact CG1-CG 4.23Å; V545-V581 PolarHBondContact N-O 3.32Å; V545-V581 PolarHBondContact O-N 3.02Å
546	I	73.4	Confident	57.8	Low	22 Å²	22	83.3 Å²	83.3	11%	0.113	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	115.9	174.4	-58	173.9	0	0	0	107.1	N548 V553 Q554 I556 V577 I580	I546-N548 WeakPolarHBondContact CG2-OD1 3.44Å; I546-V553 WeakPolarHBondContact O-CA 3.44Å; I546-Q554 HydrophobicContact CB-CB 4.47Å; I546-Q554 PolarHBondContact N-O 3.44Å; I546-Q554 PolarHBondContact O-N 3.12Å; I546-I556 HydrophobicContact CD1-CG1 4.33Å; I546-I556 HydrophobicContact CG1-CG1 4.17Å; I546-V577 HydrophobicContact CD1-CG1 4.37Å; I546-V577 HydrophobicContact CG2-CG1 4.32Å; I546-I580 HydrophobicContact CG1-CG1 4.37Å
547	V	74.1	Confident	58.9	Low	30 Å²	30	77.8 Å²	77.8	18%	0.182	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	106.9	171.9	-175	0	0	0	0	108.4	G578 R579 V581	V547-G578 CarbonylContact O-C 3.57Å; V547-G578 WeakPolarHBondContact O-CA 3.43Å; V547-R579 PolarHBondContact N-O 2.65Å; V547-R579 PolarHBondContact O-N 3.38Å; V547-V581 HydrophobicContact CG2-CB 4.49Å; V547-V581 HydrophobicContact CG2-CG2 4Å
548	N	74.2	Confident	59.2	Low	34 Å²	34	82.5 Å²	82.5	18%	0.182	43%	0.432	C	S	.	.			trans	-74.9	165.9	-179.4	-66.1	-41.3	0	0	0	111.9	I546 D550 G551 S552 Q554	I546-N548 WeakPolarHBondContact CG2-OD1 3.44Å; N548-D550 WeakPolarHBondContact CB-OD1 3.39Å; N548-D550 PolarHBondContact O-N 3.41Å; N548-G551 PolarHBondContact O-N 3.32Å; N548-S552 WeakPolarHBondContact CB-OG 3.45Å; N548-S552 PolarHBondContact N-O 3.39Å; N548-S552 PolarHBondContact ND2-OG 3.45Å; N548-Q554 PolarHBondContact ND2-NE2 3.28Å
549	S	62.2	Low	59.4	Low	139 Å²	139	76 Å²	76	97%	0.972	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-13.3	179.9	51.2	0	0	0	0	114.7
550	D	68.6	Low	59.6	Low	123 Å²	123	81.6 Å²	81.6	66%	0.658	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	2.1	171.6	68.9	-16.5	0	0	0	113.2	N548 S552	N548-D550 WeakPolarHBondContact CB-OD1 3.39Å; N548-D550 PolarHBondContact O-N 3.41Å; D550-S552 VanDerWaalsContact C-N 3.28Å; D550-S552 VanDerWaalsContact CG-OG 3.3Å; D550-S552 PolarHBondContact O-N 2.75Å; D550-S552 VanDerWaalsContact OD1-CB 3.22Å; D550-S552 WeakPolarHBondContact OD1-CB 3.21Å; D550-S552 PolarHBondContact OD1-N 2.89Å; D550-S552 PolarHBondContact OD1-OG 3.09Å; D550-S552 PolarHBondContact OD2-OG 3.13Å
551	G	56.8	Low	59.2	Low	53 Å²	53	85 Å²	85	55%	0.546	43%	0.434	S	S	.	.	S	Bend	trans	79.1	2.3	-174.2	0	0	0	0	0	114.6	N548	N548-G551 PolarHBondContact O-N 3.32Å
552	S	69.3	Low	58.6	Low	39 Å²	39	91.6 Å²	91.6	27%	0.273	45%	0.453	S	S	.	.			trans	-72	141.1	174.9	68.6	0	0	0	0	111.6	N548 D550	N548-S552 WeakPolarHBondContact CB-OG 3.45Å; N548-S552 PolarHBondContact N-O 3.39Å; N548-S552 PolarHBondContact ND2-OG 3.45Å; D550-S552 VanDerWaalsContact C-N 3.28Å; D550-S552 VanDerWaalsContact CG-OG 3.3Å; D550-S552 PolarHBondContact O-N 2.75Å; D550-S552 VanDerWaalsContact OD1-CB 3.22Å; D550-S552 WeakPolarHBondContact OD1-CB 3.21Å; D550-S552 PolarHBondContact OD1-N 2.89Å; D550-S552 PolarHBondContact OD1-OG 3.09Å; D550-S552 PolarHBondContact OD2-OG 3.13Å
553	V	65.5	Low	57.8	Low	53 Å²	53	93.9 Å²	93.9	32%	0.321	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.9	-176.8	-174.9	0	0	0	0	109.2	V545 I546	V545-V553 HydrophobicContact CB-CG1 3.69Å; V545-V553 HydrophobicContact CG1-CG1 3.89Å; V545-V553 HydrophobicContact CG2-CG1 4.01Å; I546-V553 WeakPolarHBondContact O-CA 3.44Å
554	Q	71.1	Confident	56.8	Low	95 Å²	95	98.5 Å²	98.5	44%	0.444	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	135.4	177.7	-62.9	-176.2	21.5	0	0	111.1	V545 I546 N548	V545-Q554 WeakPolarHBondContact CA-O 3.42Å; I546-Q554 HydrophobicContact CB-CB 4.47Å; I546-Q554 PolarHBondContact N-O 3.44Å; I546-Q554 PolarHBondContact O-N 3.12Å; N548-Q554 PolarHBondContact ND2-NE2 3.28Å
555	R	61	Low	55.8	Low	190 Å²	190	101.9 Å²	101.9	72%	0.717	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	146.9	169.5	-72.3	-174	174.1	-166.5	-2.1	110.2	V545 D557	V545-R555 HydrophobicContact CG1-CG 4.23Å; R555-D557 PolarHBondContact O-N 3.24Å; R555-D557 VanDerWaalsContact O-N 3.13Å
556	I	63.1	Low	53.8	Low	33 Å²	33	111.1 Å²	111.1	17%	0.169	55%	0.55	C	S	.	.			trans	-75.4	101.5	176.4	-56.5	-178.5	0	0	0	109.3	L541 I546 F561	L541-I556 HydrophobicContact CD2-CD1 4.44Å; L541-I556 HydrophobicContact CD2-CG2 4.14Å; I546-I556 HydrophobicContact CD1-CG1 4.33Å; I546-I556 HydrophobicContact CG1-CG1 4.17Å; I556-F561 HydrophobicContact CG2-CD2 4.4Å; I556-F561 HydrophobicContact CG2-CE2 4.47Å
557	D	54.9	Low	51.8	Low	108 Å²	108	114.7 Å²	114.7	58%	0.578	58%	0.576	S	S	*	*			trans	-81.5	117.6	175.7	-172.8	-16.6	0	0	0	111	R555 G559 R560	R555-D557 PolarHBondContact O-N 3.24Å; R555-D557 VanDerWaalsContact O-N 3.13Å; D557-G559 PolarHBondContact O-N 3.46Å; D557-G559 VanDerWaalsContact O-N 3.09Å; D557-G559 PolarHBondContact OD1-N 2.67Å; D557-R560 PolarHBondContact O-N 2.9Å
558	R	40.3	Very low	49.7	Very low	168 Å²	168	120.4 Å²	120.4	63%	0.634	61%	0.612	S	S	*	*	H	α-helix	trans	-57.5	-21.8	178.6	-60.8	-173.8	-174.9	-158.3	5.1	112.8	E542	E542-R558 IonicContact OE1-CZ 2.79Å; E542-R558 IonicContact OE1-NE 3.56Å; E542-R558 PolarHBondContact OE1-NE 3.28Å; E542-R558 IonicContact OE1-NH2 3.59Å; E542-R558 PolarHBondContact OE1-NH2 2.81Å; E542-R558 IonicContact OE2-NH2 3.72Å
559	G	39.1	Very low	47.7	Very low	43 Å²	43	123.6 Å²	123.6	44%	0.443	63%	0.628	S	S	.	*	H	α-helix	trans	-69.6	-40	179.3	0	0	0	0	0	114.7	D557	D557-G559 PolarHBondContact O-N 3.46Å; D557-G559 VanDerWaalsContact O-N 3.09Å; D557-G559 PolarHBondContact OD1-N 2.67Å
560	R	43	Very low	46.1	Very low	183 Å²	183	122.9 Å²	122.9	69%	0.691	62%	0.621	S	S	*	*	H	α-helix	trans	-75.8	-42.7	-173.8	-87.7	-172.7	170.9	-174.5	-1.6	113.6	D557 R562 Q563	D557-R560 PolarHBondContact O-N 2.9Å; R560-R562 PolarHBondContact O-N 3.47Å; R560-R562 VanDerWaalsContact O-N 3.12Å; R560-Q563 PolarHBondContact O-N 2.92Å; R560-Q563 VanDerWaalsContact O-N 3.17Å
561	F	38.6	Very low	44.3	Very low	134 Å²	134	124.5 Å²	124.5	59%	0.588	63%	0.628	S	S	*	*	H	α-helix	trans	-61.4	-24.5	-176.2	-102.2	-84.9	0	0	0	113.8	I556	I556-F561 HydrophobicContact CG2-CD2 4.4Å; I556-F561 HydrophobicContact CG2-CE2 4.47Å
562	R	36	Very low	43	Very low	231 Å²	231	125.6 Å²	125.6	87%	0.872	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-8.3	-178.5	-147	173.4	-170.8	171	4	114.4	R560	R560-R562 PolarHBondContact O-N 3.47Å; R560-R562 VanDerWaalsContact O-N 3.12Å
563	Q	36.6	Very low	41.2	Very low	169 Å²	169	130.9 Å²	130.9	79%	0.79	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	-9.6	-177.9	-69.8	-171.7	-10.1	0	0	114.8	R560	R560-Q563 PolarHBondContact O-N 2.92Å; R560-Q563 VanDerWaalsContact O-N 3.17Å
564	Q	36.3	Very low	39.5	Very low	151 Å²	151	136.3 Å²	136.3	71%	0.706	67%	0.672	S	S	*	*	S	Bend	trans	-98.1	-13.9	-179.9	-67.5	-172.5	-53.7	0	0	114.4	Q566	Q564-Q566 PolarHBondContact O-N 2.96Å
565	N	33.3	Very low	37.8	Very low	140 Å²	140	136.5 Å²	136.5	75%	0.749	68%	0.683	S	S	*	*			trans	-84.1	50.5	178.6	-73.9	-8.1	0	0	0	113.5
566	Q	31.8	Very low	36.8	Very low	196 Å²	196	134.5 Å²	134.5	92%	0.916	69%	0.687	S	S	*	*			trans	-134.3	46.7	167.9	-69.6	-165.4	4.5	0	0	112	Q564	Q564-Q566 PolarHBondContact O-N 2.96Å
567	S	32.1	Very low	36.1	Very low	96 Å²	96	136.9 Å²	136.9	67%	0.671	70%	0.703	S	S	*	*	S	Bend	trans	-147.5	152.7	162.7	66.1	0	0	0	0	110.6	D569	S567-D569 PolarHBondContact O-N 3.38Å
568	T	29.8	Very low	36	Very low	151 Å²	151	132.3 Å²	132.3	93%	0.926	68%	0.682	S	S	*	*	S	Bend	trans	-97.8	71.2	-163.8	53.5	0	0	0	0	113.8
569	D	32.3	Very low	36.8	Very low	100 Å²	100	134.1 Å²	134.1	54%	0.535	69%	0.688	S	S	.	*			trans	-160.9	113.1	150.9	-155.9	-30.1	0	0	0	111.8	S567 L571	S567-D569 PolarHBondContact O-N 3.38Å; D569-L571 VanDerWaalsContact C-N 3.33Å; D569-L571 PolarHBondContact O-N 3.22Å; D569-L571 PolarHBondContact OD1-N 3.07Å
570	P	28.7	Very low	37.9	Very low	124 Å²	124	136.8 Å²	136.8	81%	0.805	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-11.7	-175.8	-19.9	33.7	0	0	0	116.3
571	L	29.8	Very low	38.7	Very low	157 Å²	157	129.5 Å²	129.5	82%	0.822	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	-6.9	-165.7	-78	166.2	0	0	0	115.8	D569	D569-L571 VanDerWaalsContact C-N 3.33Å; D569-L571 PolarHBondContact O-N 3.22Å; D569-L571 PolarHBondContact OD1-N 3.07Å
572	S	31.1	Very low	39.4	Very low	77 Å²	77	129 Å²	129	54%	0.538	66%	0.661	S	S	.	*	S	Bend	trans	-87.8	-18.7	-171.2	57.4	0	0	0	0	115.4
573	H	30.8	Very low	40.2	Very low	150 Å²	150	122.8 Å²	122.8	69%	0.694	65%	0.645	S	S	*	*	S	Bend	trans	-101.6	-4.4	-166.8	-94.5	-69.7	0	0	0	117	S575	H573-S575 VanDerWaalsContact C-N 3.27Å; H573-S575 PolarHBondContact O-N 3.11Å
574	M	30.7	Very low	40.7	Very low	167 Å²	167	116.2 Å²	116.2	82%	0.823	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-77.7	-0.9	-176	-68.3	-159.5	74	0	0	115.5	N576	M574-N576 PolarHBondContact O-N 2.95Å
575	S	35.2	Very low	41.1	Very low	98 Å²	98	111.5 Å²	111.5	69%	0.685	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-72.9	-21.5	-173.9	-168.4	0	0	0	0	115.5	H573	H573-S575 VanDerWaalsContact C-N 3.27Å; H573-S575 PolarHBondContact O-N 3.11Å
576	N	39.6	Very low	41.7	Very low	148 Å²	148	108.3 Å²	108.3	79%	0.791	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-126.4	19.4	-165.9	-74.5	-16.6	0	0	0	114.3	M574	M574-N576 PolarHBondContact O-N 2.95Å
577	V	48.5	Very low	42.3	Very low	83 Å²	83	104.8 Å²	104.8	50%	0.503	58%	0.582	S	S	.	*			trans	-95.2	127.9	175.2	-175.5	0	0	0	0	109.2	I546	I546-V577 HydrophobicContact CD1-CG1 4.37Å; I546-V577 HydrophobicContact CG2-CG1 4.32Å
578	G	53.6	Low	42.5	Very low	13 Å²	13	103.9 Å²	103.9	13%	0.134	57%	0.569	C	S	.	*			trans	-58.8	164.1	177.5	0	0	0	0	0	113.7	V547 I580	V547-G578 CarbonylContact O-C 3.57Å; V547-G578 WeakPolarHBondContact O-CA 3.43Å; G578-I580 PolarHBondContact O-N 2.97Å
579	R	56.6	Low	42.8	Very low	205 Å²	205	103.1 Å²	103.1	77%	0.774	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-61.2	113.3	-179.7	-173.6	179.2	-176.6	176	0.9	109.3	V547 V581	V547-R579 PolarHBondContact N-O 2.65Å; V547-R579 PolarHBondContact O-N 3.38Å; R579-V581 HydrophobicContact CG-CG2 4.06Å; R579-V581 PolarHBondContact O-N 3.07Å
580	I	61.5	Low	43	Very low	100 Å²	100	105.9 Å²	105.9	51%	0.513	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.4	119.9	173.1	-58.6	175.9	0	0	0	107.9	Y544 I546 G578	Y544-I580 HydrophobicContact CD1-CG2 3.85Å; Y544-I580 HydrophobicContact CG-CG2 4.37Å; I546-I580 HydrophobicContact CG1-CG1 4.37Å; G578-I580 PolarHBondContact O-N 2.97Å
581	V	60.2	Low	43.1	Very low	29 Å²	29	106.3 Å²	106.3	18%	0.176	58%	0.575	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.9	134.7	179.4	-176.1	0	0	0	0	109	Y544 V545 V547 R579 Y587	Y544-V581 WeakPolarHBondContact CA-O 3.45Å; V545-V581 PolarHBondContact N-O 3.32Å; V545-V581 PolarHBondContact O-N 3.02Å; V547-V581 HydrophobicContact CG2-CB 4.49Å; V547-V581 HydrophobicContact CG2-CG2 4Å; R579-V581 HydrophobicContact CG-CG2 4.06Å; R579-V581 PolarHBondContact O-N 3.07Å; V581-Y587 HydrophobicContact CG1-CE2 3.98Å
582	R	52.7	Low	43.2	Very low	124 Å²	124	106.5 Å²	106.5	47%	0.468	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.4	146.9	171.7	-158.5	-179.8	-178	-166.3	-3.6	109.4	D543 Y544	D543-R582 HydrophobicContact CB-CG 4.14Å; D543-R582 IonicContact OD2-CZ 3.78Å; D543-R582 VanDerWaalsContact OD2-CZ 3.25Å; D543-R582 IonicContact OD2-NE 3.5Å; D543-R582 PolarHBondContact OD2-NE 3.1Å; D543-R582 IonicContact OD2-NH2 2.75Å; D543-R582 PolarHBondContact OD2-NH2 3.47Å; Y544-R582 HydrophobicContact CD1-CB 3.78Å; Y544-R582 HydrophobicContact CD1-CG 3.93Å; Y544-R582 HydrophobicContact CE1-CB 3.59Å; Y544-R582 HydrophobicContact CE1-CG 3.57Å; Y544-R582 HydrophobicContact CE2-CG 4.32Å; Y544-R582 HydrophobicContact CG-CG 4.46Å; Y544-R582 WeakPolarHBondContact OH-CD 3.48Å
583	N	53.7	Low	43.2	Very low	100 Å²	100	110.1 Å²	110.1	54%	0.535	59%	0.59	S	S	.	*			trans	80.5	94.2	-169.1	-170.6	-4.1	0	0	0	113	D543 G585	D543-N583 PolarHBondContact O-N 3.12Å; D543-N583 VanDerWaalsContact O-N 3.1Å; N583-G585 VanDerWaalsContact C-N 3.28Å; N583-G585 PolarHBondContact O-N 2.94Å; N583-G585 PolarHBondContact OD1-N 3.47Å
584	P	45.4	Very low	43.3	Very low	31 Å²	31	110.7 Å²	110.7	20%	0.201	60%	0.598	C	S	.	*	G	3₁₀ helix	trans	-69.5	-21	176.9	-17.1	31.9	0	0	0	114	D543 A586 Y587 L588	D543-P584 WeakPolarHBondContact O-CD 3.08Å; P584-A586 VanDerWaalsContact C-N 3.26Å; P584-A586 PolarHBondContact O-N 3.3Å; P584-Y587 PolarHBondContact O-N 3.05Å; P584-L588 HydrophobicContact CB-CD1 3.91Å; P584-L588 WeakPolarHBondContact O-CB 3.23Å; P584-L588 PolarHBondContact O-N 3.34Å
585	G	45.7	Very low	43.1	Very low	52 Å²	52	110.9 Å²	110.9	54%	0.536	60%	0.602	S	S	.	*	G	3₁₀ helix	trans	-65.1	-24.6	-172.9	0	0	0	0	0	114.5	N583 Y587	N583-G585 VanDerWaalsContact C-N 3.28Å; N583-G585 PolarHBondContact O-N 2.94Å; N583-G585 PolarHBondContact OD1-N 3.47Å; G585-Y587 VanDerWaalsContact C-N 3.25Å; G585-Y587 PolarHBondContact O-N 2.98Å
586	A	46.3	Very low	42.8	Very low	74 Å²	74	115.9 Å²	115.9	61%	0.612	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-75	-11	175.4	0	0	0	0	0	114	P584	P584-A586 VanDerWaalsContact C-N 3.26Å; P584-A586 PolarHBondContact O-N 3.3Å
587	Y	44.7	Very low	42.3	Very low	122 Å²	122	120.5 Å²	120.5	48%	0.478	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-131	-3.7	-174	-62.5	-83.6	0	0	0	114.1	V581 P584 G585	V581-Y587 HydrophobicContact CG1-CE2 3.98Å; P584-Y587 PolarHBondContact O-N 3.05Å; G585-Y587 VanDerWaalsContact C-N 3.25Å; G585-Y587 PolarHBondContact O-N 2.98Å
588	L	35.1	Very low	41.3	Very low	76 Å²	76	128.8 Å²	128.8	40%	0.398	64%	0.643	S	S	.	*			trans	-131.8	85.3	-176.5	-64.1	178.7	0	0	0	111.4	P584 N590	P584-L588 HydrophobicContact CB-CD1 3.91Å; P584-L588 WeakPolarHBondContact O-CB 3.23Å; P584-L588 PolarHBondContact O-N 3.34Å; L588-N590 PolarHBondContact O-N 3.42Å
589	T	35.7	Very low	40.1	Very low	135 Å²	135	131.5 Å²	131.5	83%	0.828	67%	0.671	S	S	*	*			trans	-88.6	105.5	171.9	53.7	0	0	0	0	111.9
590	N	38	Very low	38.7	Very low	158 Å²	158	130.7 Å²	130.7	85%	0.845	68%	0.678	S	S	*	*			trans	77.9	140.6	162.8	-144.1	0.3	0	0	0	118.6	L588	L588-N590 PolarHBondContact O-N 3.42Å
591	N	30.5	Very low	37.1	Very low	134 Å²	134	131.2 Å²	131.2	72%	0.717	69%	0.686	S	S	*	*			trans	-83.6	124.5	177.5	-73	-44.6	0	0	0	110.5
592	N	32.6	Very low	35.4	Very low	160 Å²	160	136.7 Å²	136.7	86%	0.856	71%	0.714	S	S	*	*				-174.7	157.8	128.4	-98.1	-42.3	0	0	0	111.8	N594	N592-N594 PolarHBondContact O-N 2.87Å; N592-N594 VanDerWaalsContact O-N 3.15Å
593	N	30.3	Very low	34.5	Very low	154 Å²	154	139 Å²	139	82%	0.824	73%	0.734	S	S	*	*	S	Bend	trans	-73.8	101.6	-176.5	-63.8	-48.3	0	0	0	112
594	N	31.9	Very low	33.3	Very low	162 Å²	162	137 Å²	137	87%	0.866	74%	0.737	S	S	*	*			trans	170.7	145.9	136.9	-89.4	-41.1	0	0	0	111.9	N592	N592-N594 PolarHBondContact O-N 2.87Å; N592-N594 VanDerWaalsContact O-N 3.15Å
595	L	26.6	Very low	32.6	Very low	171 Å²	171	142 Å²	142	90%	0.895	77%	0.769	S	S	*	*			trans	-87.7	128.9	171.6	-80	79	0	0	0	111.3
596	Q	30.4	Very low	31.7	Very low	202 Å²	202	147.3 Å²	147.3	94%	0.944	79%	0.785	S	S	*	*			trans	-159.7	150.1	152.4	-113	165.8	27.1	0	0	111.9
597	R	27.6	Very low	30.9	Very low	245 Å²	245	149 Å²	149	93%	0.925	79%	0.79	S	S	*	*			trans	-93.2	139.1	-179.9	-67.5	-171.4	-175.1	-158.8	4.4	112.5
598	R	27.4	Very low	30	Very low	258 Å²	258	150.8 Å²	150.8	97%	0.974	81%	0.807	S	S	*	*			trans	-178.1	153.7	134.9	-102.8	171.6	179.5	-155.4	-0.9	108.6
599	G	29.8	Very low	29.6	Very low	70 Å²	70	153.1 Å²	153.1	72%	0.722	83%	0.825	S	S	*	*			cis	-174	175.1	-2	0	0	0	0	0	111
600	M	26.6	Very low	29	Very low	187 Å²	187	153.4 Å²	153.4	92%	0.921	83%	0.826	S	S	*	*			trans	-54.1	153.7	177.2	-54.4	167	74.2	0	0	111.5
601	T	27.1	Very low	28.6	Very low	111 Å²	111	152.8 Å²	152.8	68%	0.681	82%	0.821	S	S	*	*			cis	-147.2	-174.4	45.3	47.5	0	0	0	0	114.6
602	D	26.3	Very low	28.3	Very low	144 Å²	144	149.7 Å²	149.7	77%	0.77	82%	0.822	S	S	*	*			trans	71	74.4	161	-52.7	-28.9	0	0	0	119.3
603	I	32.2	Very low	28.1	Very low	172 Å²	172	148.1 Å²	148.1	88%	0.882	82%	0.818	S	S	*	*				-152.8	143.2	124.7	-97.1	148.9	0	0	0	107.5
604	G	29.4	Very low	28.1	Very low	59 Å²	59	148.9 Å²	148.9	61%	0.608	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-71.4	155.3	-174.1	0	0	0	0	0	114.2	L606	G604-L606 PolarHBondContact O-N 3.32Å
605	P	30.3	Very low	28	Very low	135 Å²	135	147 Å²	147	88%	0.877	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-73.7	127.7	-176.2	29.8	-34.4	0	0	0	112.4
606	L	27.3	Very low	28.2	Very low	165 Å²	165	144.8 Å²	144.8	86%	0.864	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-92.4	145.7	155.2	-83.7	159.5	0	0	0	108.6	G604	G604-L606 PolarHBondContact O-N 3.32Å
607	P	29.8	Very low	28.2	Very low	110 Å²	110	141.6 Å²	141.6	71%	0.714	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.2	148	-159.6	30	-36.5	0	0	0	114.2	V609	P607-V609 PolarHBondContact O-N 2.91Å
608	D	24.4	Very low	28.2	Very low	158 Å²	158	135 Å²	135	85%	0.845	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-59.2	126.7	171.9	-71.5	-62.8	0	0	0	112.1
609	V	27.1	Very low	28.1	Very low	126 Å²	126	134.5 Å²	134.5	76%	0.764	79%	0.785	S	S	*	*			trans	-107.2	98.3	162.4	177.8	0	0	0	0	107.8	P607 I611	P607-V609 PolarHBondContact O-N 2.91Å; V609-I611 HydrophobicContact CG1-CG1 4.47Å; V609-I611 PolarHBondContact O-N 3.22Å
610	T	24.2	Very low	28	Very low	140 Å²	140	140 Å²	140	86%	0.859	79%	0.785	S	S	*	*			trans	-75.4	104.5	-177.3	8.8	0	0	0	0	111.2
611	I	28.4	Very low	28.1	Very low	145 Å²	145	139 Å²	139	74%	0.744	77%	0.772	S	S	*	*			trans	-131.1	122.4	160.7	-54.3	177.7	0	0	0	106.3	V609	V609-I611 HydrophobicContact CG1-CG1 4.47Å; V609-I611 PolarHBondContact O-N 3.22Å
612	G	25.2	Very low	28.2	Very low	70 Å²	70	140.8 Å²	140.8	72%	0.722	77%	0.773	S	S	*	*			cis	120.8	13.6	14	0	0	0	0	0	113.1	N614	G612-N614 PolarHBondContact O-N 3.1Å
613	T	28.5	Very low	28.3	Very low	127 Å²	127	140.5 Å²	140.5	78%	0.779	77%	0.771	S	S	*	*			trans	-86.4	82.5	-178.5	53	0	0	0	0	111.7
614	N	29	Very low	28.1	Very low	170 Å²	170	138.6 Å²	138.6	91%	0.909	76%	0.761	S	S	*	*			trans	-83.2	112.6	164.6	-81.3	-11.7	0	0	0	110.1	G612	G612-N614 PolarHBondContact O-N 3.1Å
615	T	31	Very low	28.2	Very low	122 Å²	122	142.8 Å²	142.8	75%	0.748	77%	0.769	S	S	*	*			trans	-106.3	140.1	156.6	47	0	0	0	0	109.3
616	T	29.9	Very low	28	Very low	125 Å²	125	143.3 Å²	143.3	77%	0.767	77%	0.765	S	S	*	*			trans	-56.4	161.3	170.2	45.5	0	0	0	0	111.2
617	D	30	Very low	28.3	Very low	134 Å²	134	141.8 Å²	141.8	72%	0.717	76%	0.757	S	S	*	*			cis	-154	179.6	39.3	-138.6	-52.4	0	0	0	115.6
618	T	27.5	Very low	28.4	Very low	106 Å²	106	143.7 Å²	143.7	65%	0.65	76%	0.757	S	S	*	*			trans	-60.6	148.1	-173.4	48.1	0	0	0	0	116.5
619	R	26.7	Very low	28.5	Very low	249 Å²	249	142.5 Å²	142.5	94%	0.94	76%	0.759	S	S	*	*			trans	-130.4	109.6	141.9	-73.7	-168.3	-174	175.4	3.5	110.2
620	Y	27.3	Very low	28.7	Very low	184 Å²	184	142.5 Å²	142.5	72%	0.722	76%	0.755	S	S	*	*			trans	-63.9	160.5	146.3	-89.4	-82.9	0	0	0	108.7
621	Y	29.1	Very low	29	Very low	166 Å²	166	142.4 Å²	142.4	65%	0.651	75%	0.749	S	S	*	*			cis	-155	160.3	18.6	-128.9	-52.8	0	0	0	109.9
622	Q	28.8	Very low	29	Very low	150 Å²	150	140.6 Å²	140.6	70%	0.701	75%	0.749	S	S	*	*			trans	70	143.3	147.9	-85.2	150.5	5.5	0	0	117.8
623	L	28.4	Very low	29.5	Very low	138 Å²	138	142.4 Å²	142.4	72%	0.723	75%	0.748	S	S	*	*			cis	-139.3	154.8	8.3	-82.9	109.9	0	0	0	112.7
624	I	28.9	Very low	29.6	Very low	132 Å²	132	142.7 Å²	142.7	68%	0.677	75%	0.75	S	S	*	*			trans	56.6	116.1	142	-64.9	169.6	0	0	0	116.3
625	N	30.6	Very low	29.4	Very low	146 Å²	146	142 Å²	142	78%	0.781	75%	0.745	S	S	*	*				-153.8	129.7	70.1	-139.1	-3.2	0	0	0	113.6
626	D	26.6	Very low	29.3	Very low	147 Å²	147	143.2 Å²	143.2	79%	0.786	75%	0.747	S	S	*	*			trans	-76.2	149	166.9	-70.3	-74.7	0	0	0	110.9
627	N	33.1	Very low	29.1	Very low	132 Å²	132	143.4 Å²	143.4	71%	0.706	74%	0.743	S	S	*	*			trans	-156.1	114.1	152.4	-112	-46.5	0	0	0	112.7
628	H	32.2	Very low	29.1	Very low	151 Å²	151	143.2 Å²	143.2	70%	0.699	75%	0.747	S	S	*	*			trans	46.7	104.2	161.4	-65.3	-60.8	0	0	0	120.3
629	C	25.3	Very low	29.2	Very low	132 Å²	132	144 Å²	144	89%	0.892	75%	0.747	S	S	*	*			trans	-96.7	146.2	130.4	-75.9	0	0	0	0	109.2
630	N	31.9	Very low	29.3	Very low	126 Å²	126	140.1 Å²	140.1	67%	0.674	74%	0.739	S	S	*	*			trans	-144.4	126.5	175.4	-122	-25	0	0	0	109.9
631	N	30.9	Very low	29.4	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	74%	0.742	S	S	*	*			trans	13.7	142.2	145.2	-58.2	-50.8	0	0	0	120
632	S	27.8	Very low	29.3	Very low	106 Å²	106	135.3 Å²	135.3	74%	0.741	74%	0.743	S	S	*	*			cis	-168.5	172.1	-1.2	-112.5	0	0	0	0	111.3
633	P	35.8	Very low	29.4	Very low	109 Å²	109	137.4 Å²	137.4	71%	0.708	75%	0.753	S	S	*	*			trans	-109.8	161.4	-171.4	40.3	-34	0	0	0	116.2
634	T	30.1	Very low	29.3	Very low	133 Å²	133	133.9 Å²	133.9	82%	0.816	75%	0.75	S	S	*	*			trans	172	124.4	149.2	22.7	0	0	0	0	108.8
635	L	26.1	Very low	29.3	Very low	155 Å²	155	134.9 Å²	134.9	81%	0.812	76%	0.762	S	S	*	*				93.1	135.7	73.3	-98.7	177.7	0	0	0	115.9
636	L	29	Very low	29.1	Very low	148 Å²	148	134.4 Å²	134.4	78%	0.775	76%	0.76	S	S	*	*			trans	73.9	91.9	161.7	-62.5	170.5	0	0	0	122.1
637	N	24.5	Very low	29.1	Very low	128 Å²	128	133.6 Å²	133.6	68%	0.684	76%	0.755	S	S	*	*				43.9	111.5	107.9	-169	36.8	0	0	0	121
638	T	31.4	Very low	28.8	Very low	130 Å²	130	135.9 Å²	135.9	80%	0.798	76%	0.759	S	S	*	*				-175.7	154	113.4	22.5	0	0	0	0	114.5
639	N	29.3	Very low	28.3	Very low	123 Å²	123	136.5 Å²	136.5	66%	0.658	77%	0.766	S	S	*	*			trans	-36.9	155.9	-174.1	-69.2	20.2	0	0	0	123.2
640	E	28.1	Very low	28.2	Very low	167 Å²	167	134 Å²	134	78%	0.78	76%	0.755	S	S	*	*			trans	65.7	131.4	147.4	-69.3	158.7	-129.4	0	0	117.4
641	I	30.5	Very low	27.9	Very low	152 Å²	152	135 Å²	135	78%	0.779	76%	0.76	S	S	*	*			cis	-148.3	149.5	46.8	-76.7	177.3	0	0	0	112.4
642	S	26	Very low	27.8	Very low	97 Å²	97	136.3 Å²	136.3	68%	0.678	76%	0.762	S	S	*	*			trans	27.5	116.3	159.7	-57.7	0	0	0	0	122.8
643	H	30.7	Very low	27.7	Very low	194 Å²	194	142.6 Å²	142.6	90%	0.898	77%	0.771	S	S	*	*				175.9	137.1	118.3	-88.3	-69.8	0	0	0	106.1
644	G	26.8	Very low	27.3	Very low	65 Å²	65	144.7 Å²	144.7	67%	0.67	77%	0.77	S	S	*	*				82.2	115.3	51.2	0	0	0	0	0	108.4
645	V	28.9	Very low	27.4	Very low	153 Å²	153	147.3 Å²	147.3	93%	0.927	77%	0.772	S	S	*	*			cis	-147.5	164.6	23.6	166	0	0	0	0	111.2
646	N	25.6	Very low	27.5	Very low	136 Å²	136	146.8 Å²	146.8	73%	0.727	77%	0.765	S	S	*	*			trans	-108.1	146.9	179.7	-135.1	-23	0	0	0	111.3
647	N	26.6	Very low	27.4	Very low	129 Å²	129	146.6 Å²	146.6	69%	0.69	77%	0.765	S	S	*	*			trans	62.9	131.3	159.1	-78.6	-55.1	0	0	0	122.7
648	K	27.4	Very low	28.1	Very low	181 Å²	181	145.5 Å²	145.5	79%	0.787	76%	0.764	S	S	*	*			trans	69.7	138.1	136.7	-73.3	-172.6	176.7	-175.1	0	123
649	L	22.7	Very low	28.3	Very low	163 Å²	163	146 Å²	146	85%	0.853	77%	0.767	S	S	*	*			trans	85.5	130.3	146.9	-75.3	162.2	0	0	0	121.7
650	A	23.1	Very low	28.4	Very low	79 Å²	79	147.2 Å²	147.2	65%	0.653	77%	0.774	S	S	*	*			trans	64.5	114.1	142	0	0	0	0	0	122.2
651	D	25.1	Very low	28.7	Very low	147 Å²	147	144.4 Å²	144.4	79%	0.786	77%	0.772	S	S	*	*				60.2	108.7	129.4	-54.9	-18.6	0	0	0	123.1
652	Q	28.3	Very low	28.7	Very low	168 Å²	168	148.3 Å²	148.3	79%	0.785	78%	0.777	S	S	*	*			trans	33.9	136.2	131.4	-61.8	-169.6	-12.4	0	0	122.1
653	Y	26.5	Very low	29.2	Very low	238 Å²	238	150.8 Å²	150.8	93%	0.933	78%	0.783	S	S	*	*			trans	-135.4	161.4	148.1	-105.5	-86.2	0	0	0	112.5
654	F	27.4	Very low	29.1	Very low	153 Å²	153	146.8 Å²	146.8	67%	0.671	78%	0.777	S	S	*	*			trans	-97	166.4	-162.5	-107.7	-100	0	0	0	115.7
655	H	31.3	Very low	29.8	Very low	187 Å²	187	148.6 Å²	148.6	87%	0.866	78%	0.776	S	S	*	*			trans	-146.1	167.5	148.7	-107.9	-72.9	0	0	0	111.9
656	Q	28.7	Very low	30	Very low	144 Å²	144	147.5 Å²	147.5	67%	0.673	77%	0.77	S	S	*	*			trans	-163.4	163.7	-162	-108	177.1	59.5	0	0	109.8
657	L	26.9	Very low	30.3	Very low	145 Å²	145	145.7 Å²	145.7	76%	0.759	77%	0.768	S	S	*	*			cis	-139.8	168.5	4.8	-100.6	174.1	0	0	0	110.1
658	P	38	Very low	30.5	Very low	104 Å²	104	146.7 Å²	146.7	68%	0.675	77%	0.769	S	S	*	*			trans	-111.8	-170.8	-177.7	42.6	-33.5	0	0	0	115.2
659	V	36	Very low	30.7	Very low	141 Å²	141	146 Å²	146	86%	0.855	77%	0.765	S	S	*	*			trans	-140.3	136.6	173.4	-176.5	0	0	0	0	110.9
660	D	32.1	Very low	31	Very low	149 Å²	149	148.2 Å²	148.2	80%	0.797	76%	0.764	S	S	*	*			trans	-96.2	-178.1	-177.1	-61.3	-64.3	0	0	0	113
661	S	33.4	Very low	31.2	Very low	108 Å²	108	150.8 Å²	150.8	76%	0.755	77%	0.767	S	S	*	*			cis	-166.9	162.8	23.6	58.3	0	0	0	0	114.3
662	R	30.9	Very low	31.4	Very low	233 Å²	233	150.1 Å²	150.1	88%	0.879	77%	0.768	S	S	*	*			trans	-169.1	100.7	144	-107.1	178.5	-167.6	-169.3	5.1	112.4
663	N	36.8	Very low	31.5	Very low	150 Å²	150	151 Å²	151	80%	0.802	77%	0.772	S	S	*	*			trans	48	149.1	146.1	-57.2	-7.2	0	0	0	121.7
664	S	28.4	Very low	32	Very low	109 Å²	109	144.5 Å²	144.5	76%	0.762	76%	0.759	S	S	*	*			cis	164.1	167.8	-21.7	-98.4	0	0	0	0	107.3
665	P	41.6	Very low	32	Very low	103 Å²	103	145 Å²	145	67%	0.669	77%	0.767	S	S	*	*			cis	-138.1	163.5	11.2	41.9	-24.2	0	0	0	117.8
666	T	33.2	Very low	31.8	Very low	130 Å²	130	140.5 Å²	140.5	80%	0.798	76%	0.757	S	S	*	*			trans	60	143.4	145.8	48	0	0	0	0	122.1
667	S	31.7	Very low	31.7	Very low	98 Å²	98	142.5 Å²	142.5	69%	0.685	77%	0.766	S	S	*	*			cis	-147.5	142	5.2	47.1	0	0	0	0	114.5
668	H	31.9	Very low	32.1	Very low	151 Å²	151	140.6 Å²	140.6	70%	0.699	76%	0.763	S	S	*	*			trans	43.4	139.2	139.5	-59.3	-21.6	0	0	0	122.6
669	K	30.9	Very low	31.7	Very low	165 Å²	165	141.3 Å²	141.3	72%	0.717	77%	0.765	S	S	*	*			cis	-161	152.3	-4.6	-123.1	163.8	-179.1	174.2	0	112
670	Y	28.8	Very low	31.4	Very low	211 Å²	211	144.2 Å²	144.2	83%	0.827	77%	0.766	S	S	*	*			trans	-31.6	140.3	167.7	-58.7	-98.5	0	0	0	115.7
671	N	26.7	Very low	31.2	Very low	132 Å²	132	140.8 Å²	140.8	71%	0.706	77%	0.766	S	S	*	*			cis	77.5	100.8	40.7	-174.3	25.5	0	0	0	115.1
672	T	29.8	Very low	30.9	Very low	134 Å²	134	141 Å²	141	82%	0.822	77%	0.768	S	S	*	*			trans	178.9	152.7	130.8	22	0	0	0	0	113.3
673	Q	29.9	Very low	31	Very low	185 Å²	185	135 Å²	135	86%	0.864	76%	0.757	S	S	*	*			trans	-157.9	174.7	165	-107.5	-153.4	18.7	0	0	107.3
674	P	38.5	Very low	30.7	Very low	102 Å²	102	134.6 Å²	134.6	66%	0.662	76%	0.755	S	S	*	*			cis	-126.3	149.7	-8.4	35.9	-20.8	0	0	0	114.1
675	I	27.6	Very low	30.8	Very low	163 Å²	163	139.4 Å²	139.4	84%	0.836	76%	0.758	S	S	*	*			trans	-138.3	114.8	164.9	-73	-172.4	0	0	0	110.9
676	S	26.5	Very low	30.4	Very low	93 Å²	93	140.1 Å²	140.1	65%	0.65	76%	0.76	S	S	*	*			trans	46.6	140.4	147.5	74.8	0	0	0	0	124.4
677	E	26	Very low	30.4	Very low	186 Å²	186	141.5 Å²	141.5	87%	0.869	76%	0.755	S	S	*	*			trans	81.6	160.9	132.3	-82.1	-171.2	-175.9	0	0	120.7
678	P	36.4	Very low	30.5	Very low	105 Å²	105	141.7 Å²	141.7	68%	0.682	75%	0.748	S	S	*	*			trans	-131.3	-151.4	-133.3	47.1	-32.2	0	0	0	115.1
679	T	28.7	Very low	30.7	Very low	119 Å²	119	141 Å²	141	73%	0.73	75%	0.749	S	S	*	*			trans	76.5	107	165.5	37.6	0	0	0	0	120.2
680	K	29.4	Very low	30.8	Very low	203 Å²	203	137.6 Å²	137.6	88%	0.883	75%	0.746	S	S	*	*			trans	58.4	87.6	132.2	-62.7	-178.1	175.9	-179.4	0	120
681	G	27.5	Very low	31	Very low	76 Å²	76	136.2 Å²	136.2	78%	0.784	75%	0.746	S	S	*	*				91.7	157.6	109.1	0	0	0	0	0	120.3
682	S	27.6	Very low	31.1	Very low	114 Å²	114	133 Å²	133	80%	0.797	75%	0.745	S	S	*	*			trans	70.1	141.5	171.1	-111.7	0	0	0	0	116.9
683	T	32.5	Very low	31.2	Very low	106 Å²	106	133 Å²	133	65%	0.65	74%	0.744	S	S	*	*			cis	-161.7	145.9	-10.7	-5.8	0	0	0	0	112.4
684	D	30.4	Very low	31.2	Very low	141 Å²	141	132.5 Å²	132.5	75%	0.754	74%	0.742	S	S	*	*			trans	63.9	166.8	139.2	-77.8	-20.3	0	0	0	125.5
685	Y	31.4	Very low	30.8	Very low	211 Å²	211	133 Å²	133	83%	0.827	74%	0.743	S	S	*	*			trans	79.6	112.9	177.5	-64.4	-87.3	0	0	0	116.7
686	T	32.9	Very low	30.9	Very low	117 Å²	117	131.3 Å²	131.3	72%	0.718	74%	0.736	S	S	*	*			cis	-165.2	171.2	-11.3	2.1	0	0	0	0	106.7
687	K	33.3	Very low	31	Very low	160 Å²	160	135.3 Å²	135.3	70%	0.696	74%	0.744	S	S	*	*			cis	-154.2	179.8	11.3	-133.5	175.2	174.9	-77.1	0	105.9
688	D	33	Very low	31.2	Very low	101 Å²	101	130.1 Å²	130.1	54%	0.54	74%	0.74	S	S	.	*			cis	-158.4	-176.9	10	-144.6	-13.3	0	0	0	112.7
689	I	35.9	Very low	30.9	Very low	138 Å²	138	132.4 Å²	132.4	71%	0.708	75%	0.747	S	S	*	*			trans	8	135.6	149.6	-68.4	157.5	0	0	0	119.6
690	S	33.1	Very low	31	Very low	93 Å²	93	133.7 Å²	133.7	65%	0.65	75%	0.749	S	S	*	*			cis	-169.6	163	-17.1	62.8	0	0	0	0	112.1
691	H	33.9	Very low	30.9	Very low	181 Å²	181	129.3 Å²	129.3	84%	0.838	74%	0.743	S	S	*	*			trans	12.7	150.9	161.6	-49.7	-63.4	0	0	0	122.6
692	G	29.2	Very low	31.2	Very low	66 Å²	66	131.3 Å²	131.3	68%	0.68	75%	0.746	S	S	*	*			cis	92.1	141.3	18.4	0	0	0	0	0	112.8
693	T	31.5	Very low	31.1	Very low	132 Å²	132	133.5 Å²	133.5	81%	0.81	75%	0.747	S	S	*	*			cis	-166.6	130.5	-3.2	-69.6	0	0	0	0	109.6
694	Q	29.2	Very low	31.5	Very low	175 Å²	175	133.1 Å²	133.1	82%	0.818	75%	0.747	S	S	*	*			trans	35.8	146.7	144.8	-146.7	177.3	47.7	0	0	124
695	V	31.5	Very low	31.6	Very low	114 Å²	114	133.7 Å²	133.7	69%	0.691	74%	0.744	S	S	*	*			trans	120.9	114.1	147.3	-178.6	0	0	0	0	119.8
696	N	29.2	Very low	31.7	Very low	126 Å²	126	130.5 Å²	130.5	67%	0.674	74%	0.737	S	S	*	*			trans	56.4	134.7	145.4	-68.4	28.1	0	0	0	129.1
697	E	29.2	Very low	31.6	Very low	178 Å²	178	130.1 Å²	130.1	83%	0.832	73%	0.73	S	S	*	*			trans	85.6	142.1	131.3	-78.3	169.9	-118.9	0	0	125.5
698	G	29.5	Very low	31.5	Very low	76 Å²	76	127.7 Å²	127.7	78%	0.784	73%	0.729	S	S	*	*			trans	92.6	108.9	166.8	0	0	0	0	0	116.6
699	N	30.1	Very low	31.2	Very low	154 Å²	154	131.1 Å²	131.1	82%	0.824	74%	0.742	S	S	*	*			cis	116.4	151.6	12.1	-161.8	12.6	0	0	0	112.6
700	L	31	Very low	31.2	Very low	146 Å²	146	128.5 Å²	128.5	76%	0.764	73%	0.734	S	S	*	*			trans	75.2	107.7	-178.4	-59.7	164.5	0	0	0	115.7
701	S	28	Very low	30.8	Very low	110 Å²	110	133.7 Å²	133.7	77%	0.769	75%	0.745	S	S	*	*				97.8	136.9	71.8	72.5	0	0	0	0	112
702	S	32.5	Very low	30.3	Very low	119 Å²	119	132.4 Å²	132.4	83%	0.832	74%	0.742	S	S	*	*			cis	-149.2	162.1	42.2	58	0	0	0	0	116.8
703	L	25.9	Very low	30	Very low	160 Å²	160	134.7 Å²	134.7	84%	0.838	75%	0.748	S	S	*	*			trans	-80.3	-175.2	170.4	-83.4	160.1	0	0	0	112.6
704	P	40.6	Very low	29.5	Very low	98 Å²	98	138.5 Å²	138.5	64%	0.636	75%	0.749	S	S	*	*			cis	-115.1	-155	-5.6	45.6	-34	0	0	0	111
705	H	33.3	Very low	29.2	Very low	152 Å²	152	139.3 Å²	139.3	70%	0.704	76%	0.755	S	S	*	*			cis	-155	167.2	-0.1	-105.7	-49.5	0	0	0	104.3
706	H	32.2	Very low	28.8	Very low	145 Å²	145	142 Å²	142	67%	0.671	76%	0.76	S	S	*	*			cis	-164.6	168.3	-6.7	-124.6	-33.2	0	0	0	104.7
707	N	30.9	Very low	29.1	Very low	108 Å²	108	140.6 Å²	140.6	58%	0.578	76%	0.758	S	S	*	*			cis	-156.3	-176.2	-4.3	-160.6	25.7	0	0	0	109.2	E709	N707-E709 PolarHBondContact O-N 3.4Å
708	T	32.3	Very low	28.9	Very low	110 Å²	110	139.2 Å²	139.2	68%	0.675	76%	0.761	S	S	*	*			trans	9.9	100.2	153.3	51.6	0	0	0	0	116.8
709	E	26.6	Very low	28.6	Very low	172 Å²	172	143.6 Å²	143.6	80%	0.804	76%	0.764	S	S	*	*			cis	77.2	153.1	19.3	-114.5	-127.4	158.4	0	0	114.5	N707	N707-E709 PolarHBondContact O-N 3.4Å
710	P	35.6	Very low	28.5	Very low	84 Å²	84	142 Å²	142	55%	0.545	77%	0.765	S	S	.	*				-143.8	168.7	-66.2	44.8	-31.6	0	0	0	118.6
711	K	25.5	Very low	28.3	Very low	201 Å²	201	141.7 Å²	141.7	87%	0.874	76%	0.764	S	S	*	*			trans	54.1	152.4	131.8	-68.8	170.6	-177.3	170.8	0	125
712	I	21.6	Very low	28.2	Very low	154 Å²	154	145 Å²	145	79%	0.79	77%	0.772	S	S	*	*			trans	-93.5	146.7	169.2	-62.6	153.2	0	0	0	110.2
713	S	22.8	Very low	27.8	Very low	115 Å²	115	145.7 Å²	145.7	80%	0.804	77%	0.766	S	S	*	*			trans	-161.4	159.1	139.5	-157.1	0	0	0	0	113.4
714	Y	22	Very low	27.9	Very low	212 Å²	212	144.4 Å²	144.4	83%	0.831	77%	0.765	S	S	*	*			trans	-76.8	151.1	-171.9	-74.7	-106.9	0	0	0	115.3
715	M	22.7	Very low	27.2	Very low	192 Å²	192	145.2 Å²	145.2	95%	0.946	77%	0.773	S	S	*	*				-158.9	163.1	125.7	-120.1	-173.8	171.6	0	0	112.9
716	E	23.4	Very low	26.9	Very low	169 Å²	169	147.5 Å²	147.5	79%	0.79	78%	0.78	S	S	*	*			trans	-154	173.8	-171.6	-128.9	-139.9	150.1	0	0	108.2
717	P	35.3	Very low	26.7	Very low	97 Å²	97	147.7 Å²	147.7	63%	0.63	79%	0.792	S	S	*	*				-126.3	162.5	-54.7	34.6	-19.5	0	0	0	113
718	V	25.8	Very low	26.5	Very low	149 Å²	149	145.5 Å²	145.5	90%	0.903	80%	0.795	S	S	*	*			trans	-143	144.1	158.8	-174.5	0	0	0	0	111
719	M	23.1	Very low	26.3	Very low	169 Å²	169	147.1 Å²	147.1	83%	0.833	81%	0.805	S	S	*	*			trans	-78.5	160.9	-176.8	-47.7	172.3	-164.8	0	0	114.2
720	S	28.1	Very low	26.3	Very low	121 Å²	121	144.9 Å²	144.9	85%	0.846	80%	0.804	S	S	*	*			trans	-143.7	153.8	141.9	61	0	0	0	0	110.6
721	N	26.9	Very low	25.7	Very low	138 Å²	138	147.9 Å²	147.9	74%	0.738	81%	0.814	S	S	*	*			trans	-97.9	146.6	-164.1	-67.5	-79.1	0	0	0	113.8
722	L	25.2	Very low	25.7	Very low	181 Å²	181	146.9 Å²	146.9	95%	0.948	81%	0.813	S	S	*	*			trans	-135.3	136	144.1	-100.2	166.5	0	0	0	108.3
723	N	24.3	Very low	25.7	Very low	133 Å²	133	147 Å²	147	71%	0.711	81%	0.81	S	S	*	*			trans	-158.3	164.4	-164.4	-163.5	-9.3	0	0	0	110.1
724	V	27.5	Very low	25.8	Very low	133 Å²	133	148.2 Å²	148.2	81%	0.806	81%	0.806	S	S	*	*			trans	72.5	137.3	-176.6	-168.4	0	0	0	0	111.6
725	S	27	Very low	25.8	Very low	114 Å²	114	144.5 Å²	144.5	80%	0.797	80%	0.8	S	S	*	*			cis	-126	158.8	24.8	56	0	0	0	0	116.9
726	K	25.9	Very low	25.9	Very low	200 Å²	200	144.8 Å²	144.8	87%	0.87	80%	0.796	S	S	*	*			trans	-99.7	149	175.1	-56.2	172.4	-180	176.2	0	112.2
727	T	28.6	Very low	25.8	Very low	149 Å²	149	145.1 Å²	145.1	91%	0.914	80%	0.798	S	S	*	*			trans	-139.8	148.9	143.6	45	0	0	0	0	108.4
728	G	25.7	Very low	25.3	Very low	63 Å²	63	144.2 Å²	144.2	65%	0.649	80%	0.799	S	S	*	*			trans	-125.6	-148.9	-172.9	0	0	0	0	0	113.9
729	T	28.1	Very low	25.2	Very low	144 Å²	144	144.2 Å²	144.2	88%	0.883	79%	0.794	S	S	*	*			trans	67.3	137	-176.6	20.3	0	0	0	0	114.6
730	T	27.3	Very low	25.3	Very low	125 Å²	125	144.2 Å²	144.2	77%	0.767	80%	0.797	S	S	*	*			cis	-145	159.1	5.2	-54.4	0	0	0	0	111.1
731	L	22.5	Very low	25	Very low	146 Å²	146	149.3 Å²	149.3	76%	0.764	80%	0.798	S	S	*	*			trans	-59.6	145.6	167.4	-79.1	155.8	0	0	0	113.4
732	Q	25.5	Very low	24.8	Very low	181 Å²	181	150.7 Å²	150.7	85%	0.846	80%	0.8	S	S	*	*			trans	-145.8	116	135.8	-126.4	178.1	19	0	0	110.7
733	Q	21.9	Very low	24.7	Very low	157 Å²	157	151.1 Å²	151.1	73%	0.734	79%	0.794	S	S	*	*			trans	-86.3	137.3	165.1	-67.6	172.8	-70.8	0	0	108.4
734	I	25	Very low	24.8	Very low	140 Å²	140	151.4 Å²	151.4	72%	0.718	80%	0.801	S	S	*	*			trans	-117.4	107.7	161	-62.7	-179.6	0	0	0	107.2	F736	I734-F736 HydrophobicContact CG2-CD2 4.26Å
735	N	21.7	Very low	24.6	Very low	133 Å²	133	153.3 Å²	153.3	71%	0.711	80%	0.8	S	S	*	*			trans	-75.3	135.6	168.8	-84.8	-34.7	0	0	0	109.5
736	F	24.4	Very low	24.6	Very low	198 Å²	198	153.3 Å²	153.3	87%	0.868	80%	0.797	S	S	*	*			trans	-130.9	121.3	148.9	-101.7	-82.2	0	0	0	108.9	I734	I734-F736 HydrophobicContact CG2-CD2 4.26Å
737	Q	22.4	Very low	24.7	Very low	177 Å²	177	149 Å²	149	83%	0.827	79%	0.793	S	S	*	*			trans	-105.9	143.1	174	-80.9	-171.7	-31	0	0	110.6
738	A	23.9	Very low	24.5	Very low	78 Å²	78	146 Å²	146	65%	0.645	79%	0.791	S	S	*	*			trans	42.2	113.4	145.4	0	0	0	0	0	119
739	N	23.8	Very low	24.4	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	79%	0.793	S	S	*	*				178.4	125.8	88.7	-91.5	-50.3	0	0	0	113.1
740	N	25.2	Very low	24.4	Very low	168 Å²	168	151.6 Å²	151.6	90%	0.898	79%	0.794	S	S	*	*				-168.9	146	126.1	-98.7	-29.1	0	0	0	110.1
741	R	21.6	Very low	24.3	Very low	229 Å²	229	151.1 Å²	151.1	86%	0.864	79%	0.791	S	S	*	*			trans	-141.9	158	-178.6	-108.2	-172.3	174.7	-163.7	-0.3	109.5
742	Q	24.4	Very low	24.4	Very low	166 Å²	166	150 Å²	150	78%	0.776	79%	0.785	S	S	*	*			trans	69.1	146.9	178.9	-56.5	166.4	-47.5	0	0	113.6
743	F	22.9	Very low	24.4	Very low	190 Å²	190	145.4 Å²	145.4	83%	0.833	78%	0.777	S	S	*	*			cis	-111.9	152.4	4.3	-82.9	-102.6	0	0	0	112.8
744	V	24.6	Very low	24.5	Very low	139 Å²	139	144.4 Å²	144.4	84%	0.842	78%	0.781	S	S	*	*			trans	-116.9	133.3	169.7	174.8	0	0	0	0	108.4
745	H	24.9	Very low	24.6	Very low	174 Å²	174	146.8 Å²	146.8	81%	0.806	79%	0.789	S	S	*	*			trans	-116.2	130.6	169.8	-131.5	-80.5	0	0	0	108.3	S747	H745-S747 PolarHBondContact O-N 2.87Å
746	P	26.3	Very low	24.7	Very low	113 Å²	113	143.9 Å²	143.9	73%	0.734	79%	0.791	S	S	*	*			trans	-77.3	115.8	-176.2	29.2	-33.4	0	0	0	111.4
747	S	27.4	Very low	24.7	Very low	111 Å²	111	140.6 Å²	140.6	78%	0.776	79%	0.787	S	S	*	*			trans	-153.9	101.3	165.3	-70.7	0	0	0	0	107.5	H745 L749	H745-S747 PolarHBondContact O-N 2.87Å; S747-L749 PolarHBondContact O-N 3.29Å
748	G	24.5	Very low	24.9	Very low	84 Å²	84	139.9 Å²	139.9	87%	0.866	79%	0.789	S	S	*	*			trans	-77.6	82.2	-161.4	0	0	0	0	0	115.3
749	L	25.1	Very low	24.9	Very low	133 Å²	133	139.8 Å²	139.8	70%	0.696	80%	0.796	S	S	*	*			trans	-135	96.9	152.8	-79.5	177	0	0	0	108.1	S747 T751	S747-L749 PolarHBondContact O-N 3.29Å; L749-T751 PolarHBondContact O-N 3.38Å
750	Q	27.8	Very low	24.9	Very low	193 Å²	193	139.5 Å²	139.5	90%	0.902	80%	0.799	S	S	*	*			trans	-71.6	109.6	177.1	-84.9	-178.9	-36.4	0	0	110.4	I752	Q750-I752 PolarHBondContact O-N 3.31Å
751	T	24.2	Very low	24.7	Very low	115 Å²	115	140.3 Å²	140.3	71%	0.706	79%	0.791	S	S	*	*			trans	-64.3	122.8	160.8	-47.4	0	0	0	0	108.4	L749 A753	L749-T751 PolarHBondContact O-N 3.38Å; T751-A753 PolarHBondContact O-N 2.95Å
752	I	24.8	Very low	24.9	Very low	123 Å²	123	135 Å²	135	63%	0.631	79%	0.786	S	S	*	*			trans	-70.4	98	173.9	-61.1	176.1	0	0	0	107.9	Q750 V754	Q750-I752 PolarHBondContact O-N 3.31Å; I752-V754 PolarHBondContact O-N 3.15Å
753	A	25	Very low	24.9	Very low	84 Å²	84	133.9 Å²	133.9	69%	0.694	79%	0.79	S	S	*	*			trans	-81.1	111.8	172.8	0	0	0	0	0	109.5	T751 Q755	T751-A753 PolarHBondContact O-N 2.95Å; A753-Q755 PolarHBondContact O-N 3.36Å
754	V	23.9	Very low	24.9	Very low	135 Å²	135	131.7 Å²	131.7	82%	0.818	79%	0.786	S	S	*	*			trans	-77.4	91.2	172.7	-177.9	0	0	0	0	109.2	I752	I752-V754 PolarHBondContact O-N 3.15Å
755	Q	28.1	Very low	24.9	Very low	190 Å²	190	129.9 Å²	129.9	89%	0.888	79%	0.785	S	S	*	*			trans	-121.7	102.4	159.4	-83.7	-170.8	-35.5	0	0	108.2	A753	A753-Q755 PolarHBondContact O-N 3.36Å
756	G	23.9	Very low	24.8	Very low	72 Å²	72	127.9 Å²	127.9	74%	0.742	79%	0.785	S	S	*	*			trans	-95.6	132.5	174.6	0	0	0	0	0	111.8
757	V	25.1	Very low	24.7	Very low	130 Å²	130	125.7 Å²	125.7	79%	0.788	78%	0.784	S	S	*	*			trans	-144	127.2	141	-179.3	0	0	0	0	107.5
758	D	24.8	Very low	24.5	Very low	161 Å²	161	131.4 Å²	131.4	86%	0.861	79%	0.788	S	S	*	*			trans	52.8	118.9	162.2	-57.9	-16.5	0	0	0	123.2
759	G	23.9	Very low	24.5	Very low	77 Å²	77	134.7 Å²	134.7	79%	0.794	79%	0.786	S	S	*	*			trans	91.8	128	155	0	0	0	0	0	116.2
760	V	24.1	Very low	24.5	Very low	142 Å²	142	137.5 Å²	137.5	86%	0.861	79%	0.793	S	S	*	*			cis	-144.1	140.1	2	173.2	0	0	0	0	109.1
761	Y	21.6	Very low	24.2	Very low	185 Å²	185	136.3 Å²	136.3	73%	0.725	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-90.4	132	174.7	-84.4	-81.2	0	0	0	112.8	P1065	Y761-P1065 WeakPolarHBondContact OH-CB 3.43Å
762	P	25.7	Very low	24.2	Very low	119 Å²	119	138.5 Å²	138.5	77%	0.773	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-78.2	137.7	156.5	31.5	-30.3	0	0	0	111.1
763	V	24.6	Very low	24.2	Very low	141 Å²	141	137.9 Å²	137.9	86%	0.855	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-57.3	151	-169.1	175.1	0	0	0	0	115.6
764	I	21.8	Very low	24.4	Very low	145 Å²	145	141.6 Å²	141.6	74%	0.744	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-56.2	130.6	172.7	-56.7	164.1	0	0	0	112	T766	I764-T766 HydrophobicContact CG2-CG2 3.71Å
765	A	24.9	Very low	24.7	Very low	101 Å²	101	140.9 Å²	140.9	84%	0.835	80%	0.796	S	S	*	*			trans	-99.2	106.6	162.1	0	0	0	0	0	110.4	G767	A765-G767 PolarHBondContact O-N 3.26Å
766	T	23.7	Very low	24.7	Very low	131 Å²	131	136.3 Å²	136.3	80%	0.804	79%	0.785	S	S	*	*			trans	-84.9	106.8	-178.2	51.2	0	0	0	0	112.9	I764	I764-T766 HydrophobicContact CG2-CG2 3.71Å
767	G	23.3	Very low	25	Very low	68 Å²	68	136.1 Å²	136.1	70%	0.701	78%	0.783	S	S	*	*			trans	74	113.6	145.1	0	0	0	0	0	119.1	A765	A765-G767 PolarHBondContact O-N 3.26Å
768	R	24.6	Very low	26	Very low	230 Å²	230	132.7 Å²	132.7	87%	0.868	77%	0.774	S	S	*	*			trans	-162.8	142.5	130	-105	162.8	-162.6	-163.4	4.5	110.8
769	N	24.1	Very low	27.3	Very low	154 Å²	154	126.6 Å²	126.6	82%	0.824	74%	0.742	S	S	*	*			trans	19.3	101.9	162.5	-54.9	13.8	0	0	0	117.9
770	F	24	Very low	28.9	Very low	192 Å²	192	125.4 Å²	125.4	84%	0.842	71%	0.713	S	S	*	*			trans	-94.7	89.8	160.5	-105.2	-86	0	0	0	110.1
771	E	22.6	Very low	29.9	Very low	168 Å²	168	126.5 Å²	126.5	79%	0.785	71%	0.709	S	S	*	*			trans	-134.4	136.4	159.4	-74	-169.8	130.3	0	0	108.8
772	N	24.7	Very low	30.8	Very low	160 Å²	160	121.1 Å²	121.1	86%	0.856	70%	0.703	S	S	*	*	S	Bend	trans	67	37.2	164.3	-54.2	-35.5	0	0	0	119.6
773	D	24.1	Very low	31.4	Very low	110 Å²	110	120.2 Å²	120.2	59%	0.588	71%	0.705	S	S	*	*			trans	-149.7	109.9	152.2	-142.9	-29.9	0	0	0	112.3	S776	D773-S776 PolarHBondContact OD1-OG 3.5Å
774	L	29.2	Very low	32.1	Very low	162 Å²	162	119 Å²	119	85%	0.848	69%	0.69	S	S	*	*			trans	-140.3	8.1	-172.7	-110.9	166.6	0	0	0	114.1
775	T	30.4	Very low	32.7	Very low	120 Å²	120	121.8 Å²	121.8	74%	0.736	70%	0.697	S	S	*	*	S	Bend	trans	-90.9	-11.3	176.6	38.4	0	0	0	0	114
776	S	27.8	Very low	33.3	Very low	95 Å²	95	120.3 Å²	120.3	66%	0.664	68%	0.681	S	S	*	*	S	Bend	trans	-121.2	15.7	-154.3	-46.5	0	0	0	0	114.8	D773	D773-S776 PolarHBondContact OD1-OG 3.5Å
777	G	30.4	Very low	34.1	Very low	68 Å²	68	121.6 Å²	121.6	70%	0.701	68%	0.683	S	S	*	*	S	Bend	trans	-117.5	125.5	-168.8	0	0	0	0	0	117.3	L779	G777-L779 PolarHBondContact O-N 3.38Å
778	G	46.1	Very low	35.4	Very low	58 Å²	58	119.6 Å²	119.6	60%	0.598	66%	0.655	S	S	*	*	S	Bend	trans	80.5	-35.4	141.3	0	0	0	0	0	121.1	W780 E781	G778-W780 PolarHBondContact O-N 3.35Å; G778-E781 PolarHBondContact O-N 3Å
779	L	52.7	Low	36.6	Very low	33 Å²	33	115.6 Å²	115.6	17%	0.173	65%	0.649	C	S	.	*	T	Hydrogen-bonded Turn	trans	-65.2	-21.6	-167	-169.6	62.1	0	0	0	115.1	G777 K1022 I1025 Y1055	G777-L779 PolarHBondContact O-N 3.38Å; L779-K1022 HydrophobicContact CD1-CG 4.35Å; L779-I1025 HydrophobicContact CD2-CB 4.45Å; L779-I1025 HydrophobicContact CD2-CD1 4.4Å; L779-I1025 HydrophobicContact CD2-CG2 3.69Å; L779-Y1055 HydrophobicContact CD1-CD1 4.15Å; L779-Y1055 HydrophobicContact CD1-CE1 3.77Å; L779-Y1055 HydrophobicContact CD1-CE2 4.5Å
780	W	55.9	Low	37.9	Very low	51 Å²	51	116.2 Å²	116.2	19%	0.193	65%	0.652	C	S	.	*	T	Hydrogen-bonded Turn	trans	-123.5	38.9	-174.2	-57	113	0	0	0	111.9	G778 A782 K800 M804 E807 K1022 T1026	G778-W780 PolarHBondContact O-N 3.35Å; W780-A782 PolarHBondContact O-N 3.05Å; W780-K800 HydrophobicContact CB-CB 4.29Å; W780-K800 HydrophobicContact CB-CD 4.47Å; W780-K800 HydrophobicContact CB-CG 4.01Å; W780-K800 WeakPolarHBondContact O-CG 3.34Å; W780-M804 HydrophobicContact CD2-CB 4.29Å; W780-M804 HydrophobicContact CD2-CG 4.36Å; W780-M804 HydrophobicContact CH2-CG 4.16Å; W780-M804 HydrophobicContact CZ2-CB 4.28Å; W780-M804 HydrophobicContact CZ2-CG 3.58Å; W780-E807 HydrophobicContact CZ3-CG 4.49Å; W780-E807 WeakPolarHBondContact CZ3-OE1 3.15Å; W780-E807 WeakPolarHBondContact CZ3-OE2 3.39Å; W780-K1022 HydrophobicContact CH2-CG 4.39Å; W780-T1026 WeakPolarHBondContact CH2-OG1 3.47Å
781	E	46.3	Very low	39.6	Very low	166 Å²	166	109.6 Å²	109.6	78%	0.776	62%	0.624	S	S	*	*			trans	-65.6	131.8	176.9	-161.2	152.2	-113.3	0	0	110.9	G778 A783	G778-E781 PolarHBondContact O-N 3Å; E781-A783 PolarHBondContact O-N 3.49Å
782	A	41.2	Very low	41.7	Very low	72 Å²	72	106.9 Å²	106.9	60%	0.595	61%	0.612	S	S	*	*			trans	-77.6	96.6	-166.9	0	0	0	0	0	111.4	W780 E784	W780-A782 PolarHBondContact O-N 3.05Å; A782-E784 PolarHBondContact O-N 2.78Å
783	A	36.5	Very low	44.1	Very low	100 Å²	100	103.7 Å²	103.7	83%	0.826	60%	0.602	S	S	*	*			trans	-77.2	62.1	-176.8	0	0	0	0	0	113.9	E781	E781-A783 PolarHBondContact O-N 3.49Å
784	E	39.5	Very low	46.9	Very low	115 Å²	115	103.4 Å²	103.4	54%	0.537	60%	0.597	S	S	.	*			trans	-148.6	109	163.3	-115.9	162.5	-142.7	0	0	109.4	A782 S786	A782-E784 PolarHBondContact O-N 2.78Å; E784-S786 PolarHBondContact O-N 3.36Å
785	F	34.3	Very low	49.5	Very low	204 Å²	204	95.7 Å²	95.7	90%	0.895	56%	0.557	S	S	*	*			trans	-78.7	82.6	-176.7	-92.1	-86.5	0	0	0	111.6	I789	F785-I789 HydrophobicContact CE1-CD1 4.49Å
786	S	38	Very low	51.9	Low	69 Å²	69	92 Å²	92	48%	0.483	53%	0.532	S	S	.	.	S	Bend	trans	-154.8	107.6	169.7	54.1	0	0	0	0	112.1	E784 E788	E784-S786 PolarHBondContact O-N 3.36Å; S786-E788 PolarHBondContact O-N 3.25Å
787	D	41.8	Very low	54.7	Low	158 Å²	158	91.4 Å²	91.4	85%	0.845	52%	0.519	S	S	*	.	S	Bend	trans	52.2	-18.5	165.6	-57	-18.1	0	0	0	120.7	I789 L790	D787-I789 PolarHBondContact O-N 3.1Å; D787-I789 VanDerWaalsContact O-N 3.16Å; D787-L790 PolarHBondContact O-N 3.46Å
788	E	49.2	Very low	57.5	Low	27 Å²	27	88.8 Å²	88.8	13%	0.126	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-72.8	-6.4	-175	-73.8	-175.5	139.7	0	0	115	S786 L790 M791 H795 N796 T944 T946	S786-E788 PolarHBondContact O-N 3.25Å; E788-L790 PolarHBondContact O-N 3.36Å; E788-M791 HydrophobicContact CB-CG 4.3Å; E788-M791 HydrophobicContact CG-CG 4.35Å; E788-M791 WeakPolarHBondContact O-CB 3.46Å; E788-M791 PolarHBondContact O-N 2.66Å; E788-M791 VanDerWaalsContact O-N 3.08Å; E788-H795 IonicContact OE1-NE2 3.47Å; E788-N796 PolarHBondContact O-ND2 3.38Å; E788-T944 WeakPolarHBondContact OE1-CB 3.24Å; E788-T944 VanDerWaalsContact OE1-CG2 3.29Å; E788-T944 WeakPolarHBondContact OE1-CG2 3.27Å; E788-T944 PolarHBondContact OE1-OG1 3.23Å; E788-T946 PolarHBondContact OE1-OG1 2.89Å; E788-T946 WeakPolarHBondContact OE2-CB 3.42Å; E788-T946 PolarHBondContact OE2-OG1 2.85Å
789	I	50.2	Low	59.4	Low	145 Å²	145	86.5 Å²	86.5	74%	0.744	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-63.3	-23.2	174.6	-60.1	177.2	0	0	0	111.5	F785 D787	F785-I789 HydrophobicContact CE1-CD1 4.49Å; D787-I789 PolarHBondContact O-N 3.1Å; D787-I789 VanDerWaalsContact O-N 3.16Å
790	L	51.7	Low	61	Low	168 Å²	168	88 Å²	88	88%	0.88	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-88.1	2.2	176.2	-122.7	80.1	0	0	0	114.6	D787 E788	D787-L790 PolarHBondContact O-N 3.46Å; E788-L790 PolarHBondContact O-N 3.36Å
791	M	58.6	Low	62.5	Low	52 Å²	52	90.6 Å²	90.6	26%	0.256	48%	0.48	S	S	.	.	S	Bend	trans	-80.1	152.3	-178.9	-68.3	-75.2	-79.5	0	0	112.5	E788 H795 K942 T944	E788-M791 HydrophobicContact CB-CG 4.3Å; E788-M791 HydrophobicContact CG-CG 4.35Å; E788-M791 WeakPolarHBondContact O-CB 3.46Å; E788-M791 PolarHBondContact O-N 2.66Å; E788-M791 VanDerWaalsContact O-N 3.08Å; M791-H795 HydrophobicContact CE-CB 4.48Å; M791-H795 WeakPolarHBondContact CE-CD2 3.29Å; M791-H795 WeakPolarHBondContact CE-NE2 3.27Å; M791-K942 HydrophobicContact CE-CB 3.94Å; M791-K942 HydrophobicContact CE-CD 3.87Å; M791-K942 HydrophobicContact CE-CG 4.32Å; M791-T944 HydrophobicContact CE-CG2 3.62Å
792	E	67.4	Low	64.7	Low	112 Å²	112	83 Å²	83	52%	0.523	45%	0.445	S	S	.	.			trans	-53.6	137.7	174.6	-76.4	143.4	-143.5	0	0	111.8	E794 H795 N796 K942	E792-E794 PolarHBondContact O-N 2.98Å; E792-E794 VanDerWaalsContact O-N 3.14Å; E792-H795 WeakPolarHBondContact O-CB 3.36Å; E792-H795 PolarHBondContact O-N 3.4Å; E792-N796 PolarHBondContact O-N 2.81Å; E792-K942 IonicContact OE1-NZ 3.63Å; E792-K942 PolarHBondContact OE1-NZ 2.76Å; E792-K942 WeakPolarHBondContact OE2-CE 3.5Å; E792-K942 IonicContact OE2-NZ 2.66Å; E792-K942 PolarHBondContact OE2-NZ 2.64Å
793	S	76	Confident	67.1	Low	93 Å²	93	80.6 Å²	80.6	65%	0.65	42%	0.423	S	S	*	.	H	α-helix	trans	-56.2	-35.1	-174.8	50.8	0	0	0	0	113.5	H795 N796 E797	S793-H795 VanDerWaalsContact C-N 3.32Å; S793-H795 PolarHBondContact O-N 2.92Å; S793-N796 PolarHBondContact O-N 3.27Å; S793-E797 PolarHBondContact O-N 3.45Å
794	E	81.7	Confident	69.8	Low	104 Å²	104	77 Å²	77	49%	0.486	39%	0.389	S	S	.	.	H	α-helix	trans	-60.9	-38.6	176.6	-63.6	-162.7	-170.2	0	0	112.9	E792 E797 E798 R940	E792-E794 PolarHBondContact O-N 2.98Å; E792-E794 VanDerWaalsContact O-N 3.14Å; E794-E797 PolarHBondContact O-N 2.99Å; E794-E798 WeakPolarHBondContact O-CG 3.28Å; E794-E798 PolarHBondContact O-N 3.06Å; E794-R940 HydrophobicContact CB-CB 4.47Å; E794-R940 WeakPolarHBondContact OE2-CD 3.43Å; E794-R940 WeakPolarHBondContact OE2-CG 3.5Å
795	H	84.6	Confident	72.3	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-63.9	-44	178.6	175.8	62.1	0	0	0	111.6	E788 M791 E792 S793 E797 E798 I799 R940 K942 T944	E788-H795 IonicContact OE1-NE2 3.47Å; M791-H795 HydrophobicContact CE-CB 4.48Å; M791-H795 WeakPolarHBondContact CE-CD2 3.29Å; M791-H795 WeakPolarHBondContact CE-NE2 3.27Å; E792-H795 WeakPolarHBondContact O-CB 3.36Å; E792-H795 PolarHBondContact O-N 3.4Å; S793-H795 VanDerWaalsContact C-N 3.32Å; S793-H795 PolarHBondContact O-N 2.92Å; H795-E797 VanDerWaalsContact C-N 3.32Å; H795-E797 PolarHBondContact O-N 2.92Å; H795-E798 PolarHBondContact O-N 3.31Å; H795-I799 VanDerWaalsContact NE2-CD1 3.34Å; H795-I799 WeakPolarHBondContact NE2-CD1 3.25Å; H795-I799 PolarHBondContact O-N 3.37Å; H795-R940 WeakPolarHBondContact CA-O 3.43Å; H795-R940 PolarHBondContact N-O 3.08Å; H795-K942 PolarHBondContact CE1-O 3.37Å; H795-K942 VanDerWaalsContact CE1-O 3.28Å; H795-K942 PolarHBondContact ND1-N 2.85Å; H795-T944 VanDerWaalsContact NE2-CG2 3.3Å; H795-T944 WeakPolarHBondContact NE2-CG2 3.25Å
796	N	81.1	Confident	75.1	Confident	43 Å²	43	62.7 Å²	62.7	23%	0.23	33%	0.326	C	S	.	.	H	α-helix	trans	-68.1	-33.5	178.9	-68.6	-15.1	0	0	0	111.2	E788 E792 S793 I799 K800	E788-N796 PolarHBondContact O-ND2 3.38Å; E792-N796 PolarHBondContact O-N 2.81Å; S793-N796 PolarHBondContact O-N 3.27Å; N796-I799 PolarHBondContact O-N 3.01Å; N796-K800 VanDerWaalsContact O-CG 3.27Å; N796-K800 WeakPolarHBondContact O-CG 3.11Å; N796-K800 PolarHBondContact O-N 3.31Å
797	E	85.2	Confident	77.9	Confident	81 Å²	81	61.9 Å²	61.9	38%	0.379	32%	0.315	S	S	.	.	H	α-helix	trans	-68.3	-35.4	170.8	-70.2	-50.6	128.8	0	0	113.8	S793 E794 H795 K800 K801	S793-E797 PolarHBondContact O-N 3.45Å; E794-E797 PolarHBondContact O-N 2.99Å; H795-E797 VanDerWaalsContact C-N 3.32Å; H795-E797 PolarHBondContact O-N 2.92Å; E797-K800 PolarHBondContact O-N 2.84Å; E797-K800 WeakPolarHBondContact OE1-CD 3.47Å; E797-K800 WeakPolarHBondContact OE1-CE 3.36Å; E797-K800 IonicContact OE1-NZ 2.66Å; E797-K800 PolarHBondContact OE1-NZ 3.33Å; E797-K801 WeakPolarHBondContact O-CD 3.49Å; E797-K801 VanDerWaalsContact O-CG 3.28Å; E797-K801 WeakPolarHBondContact O-CG 3.33Å; E797-K801 PolarHBondContact O-N 3.37Å; E797-K801 VanDerWaalsContact O-N 3.1Å
798	E	88.7	Confident	80.4	Confident	13 Å²	13	54.4 Å²	54.4	6%	0.061	28%	0.275	C	S	.	.	H	α-helix	trans	-69.3	-39.3	172.8	-61.4	-59.1	111.7	0	0	111.8	E794 H795 K800 K801 I802 A935 R940 L941	E794-E798 WeakPolarHBondContact O-CG 3.28Å; E794-E798 PolarHBondContact O-N 3.06Å; H795-E798 PolarHBondContact O-N 3.31Å; E798-K800 VanDerWaalsContact C-N 3.34Å; E798-K800 PolarHBondContact O-N 2.9Å; E798-K801 PolarHBondContact O-N 3.05Å; E798-K801 IonicContact OE1-NZ 3.77Å; E798-K801 PolarHBondContact OE1-NZ 3.27Å; E798-I802 WeakPolarHBondContact O-CD1 3.23Å; E798-I802 VanDerWaalsContact O-CG1 3.26Å; E798-I802 WeakPolarHBondContact O-CG1 3.38Å; E798-I802 PolarHBondContact O-N 3.47Å; E798-A935 HydrophobicContact CG-CB 4.04Å; E798-A935 VanDerWaalsContact OE2-CB 3.3Å; E798-A935 WeakPolarHBondContact OE2-CB 3.25Å; E798-R940 IonicContact OE1-CZ 3.4Å; E798-R940 IonicContact OE1-NH1 2.67Å; E798-R940 PolarHBondContact OE1-NH1 3.31Å; E798-R940 IonicContact OE1-NH2 2.73Å; E798-R940 PolarHBondContact OE1-NH2 3.08Å; E798-R940 IonicContact OE2-CZ 2.76Å; E798-R940 IonicContact OE2-NH1 3.12Å; E798-R940 PolarHBondContact OE2-NH1 2.94Å; E798-R940 IonicContact OE2-NH2 2.68Å; E798-R940 PolarHBondContact OE2-NH2 3.45Å; E798-L941 HydrophobicContact CB-CB 4.38Å; E798-L941 HydrophobicContact CB-CD1 3.77Å
799	I	87.3	Confident	82.7	Confident	10 Å²	10	53.1 Å²	53.1	5%	0.051	27%	0.269	C	S	.	.	H	α-helix	trans	-61.7	-40.3	173.1	-73.3	-176.5	0	0	0	111.7	H795 N796 I802 T803 L941 T946 A947	H795-I799 VanDerWaalsContact NE2-CD1 3.34Å; H795-I799 WeakPolarHBondContact NE2-CD1 3.25Å; H795-I799 PolarHBondContact O-N 3.37Å; N796-I799 PolarHBondContact O-N 3.01Å; I799-I802 PolarHBondContact O-N 2.93Å; I799-T803 WeakPolarHBondContact O-CB 3.49Å; I799-T803 PolarHBondContact O-N 3.08Å; I799-T803 PolarHBondContact O-OG1 3.09Å; I799-L941 HydrophobicContact CG1-CD1 4.13Å; I799-T946 HydrophobicContact CD1-CG2 4.46Å; I799-T946 HydrophobicContact CG2-CG2 4.46Å; I799-A947 HydrophobicContact CD1-CB 4.22Å; I799-A947 HydrophobicContact CG1-CB 4.41Å
800	K	85.9	Confident	84.9	Confident	65 Å²	65	50.6 Å²	50.6	28%	0.283	25%	0.254	S	S	.	.	H	α-helix	trans	-59.1	-45.8	173.6	-74.7	170.5	-171.1	174.2	0	111.9	W780 N796 E797 E798 T803 M804	W780-K800 HydrophobicContact CB-CB 4.29Å; W780-K800 HydrophobicContact CB-CD 4.47Å; W780-K800 HydrophobicContact CB-CG 4.01Å; W780-K800 WeakPolarHBondContact O-CG 3.34Å; N796-K800 VanDerWaalsContact O-CG 3.27Å; N796-K800 WeakPolarHBondContact O-CG 3.11Å; N796-K800 PolarHBondContact O-N 3.31Å; E797-K800 PolarHBondContact O-N 2.84Å; E797-K800 WeakPolarHBondContact OE1-CD 3.47Å; E797-K800 WeakPolarHBondContact OE1-CE 3.36Å; E797-K800 IonicContact OE1-NZ 2.66Å; E797-K800 PolarHBondContact OE1-NZ 3.33Å; E798-K800 VanDerWaalsContact C-N 3.34Å; E798-K800 PolarHBondContact O-N 2.9Å; K800-T803 PolarHBondContact O-N 3.37Å; K800-M804 WeakPolarHBondContact O-CB 3.35Å; K800-M804 PolarHBondContact O-N 3.26Å
801	K	88.4	Confident	87	Confident	105 Å²	105	43.7 Å²	43.7	46%	0.457	22%	0.218	S	C	.	.	H	α-helix	trans	-61	-46.8	177.5	-68.9	163.7	-161.4	172	0	111.8	E797 E798 T803 M804 V805	E797-K801 WeakPolarHBondContact O-CD 3.49Å; E797-K801 VanDerWaalsContact O-CG 3.28Å; E797-K801 WeakPolarHBondContact O-CG 3.33Å; E797-K801 PolarHBondContact O-N 3.37Å; E797-K801 VanDerWaalsContact O-N 3.1Å; E798-K801 PolarHBondContact O-N 3.05Å; E798-K801 IonicContact OE1-NZ 3.77Å; E798-K801 PolarHBondContact OE1-NZ 3.27Å; K801-T803 VanDerWaalsContact C-N 3.35Å; K801-T803 PolarHBondContact O-N 2.97Å; K801-M804 PolarHBondContact O-N 3.21Å; K801-V805 WeakPolarHBondContact O-CG2 3.25Å; K801-V805 PolarHBondContact O-N 3.31Å
802	I	91.2	Very high	88.8	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.036	21%	0.205	C	C	.	.	H	α-helix	trans	-60.2	-46.3	177.4	-61.6	159.9	0	0	0	110.3	E798 I799 V805 L806 V928 V932 L941 R950	E798-I802 WeakPolarHBondContact O-CD1 3.23Å; E798-I802 VanDerWaalsContact O-CG1 3.26Å; E798-I802 WeakPolarHBondContact O-CG1 3.38Å; E798-I802 PolarHBondContact O-N 3.47Å; I799-I802 PolarHBondContact O-N 2.93Å; I802-V805 PolarHBondContact O-N 3.05Å; I802-L806 WeakPolarHBondContact O-CB 3.3Å; I802-L806 PolarHBondContact O-N 3.22Å; I802-V928 HydrophobicContact CG1-CG2 4.44Å; I802-V932 HydrophobicContact CD1-CG2 3.68Å; I802-V932 HydrophobicContact CG1-CG2 3.71Å; I802-L941 HydrophobicContact CD1-CD1 4.14Å; I802-L941 HydrophobicContact CD1-CD2 4.11Å; I802-R950 HydrophobicContact CG2-CB 3.84Å
803	T	92	Very high	90.1	Very high	22 Å²	22	35.9 Å²	35.9	14%	0.135	18%	0.18	C	C	.	.	H	α-helix	trans	-65.3	-42.5	-178.7	-55.9	0	0	0	0	112.1	I799 K800 K801 V805 L806 E807	I799-T803 WeakPolarHBondContact O-CB 3.49Å; I799-T803 PolarHBondContact O-N 3.08Å; I799-T803 PolarHBondContact O-OG1 3.09Å; K800-T803 PolarHBondContact O-N 3.37Å; K801-T803 VanDerWaalsContact C-N 3.35Å; K801-T803 PolarHBondContact O-N 2.97Å; T803-V805 PolarHBondContact O-N 2.95Å; T803-L806 PolarHBondContact O-N 3.14Å; T803-E807 PolarHBondContact O-N 3.46Å
804	M	92.2	Very high	91	Very high	23 Å²	23	34.7 Å²	34.7	11%	0.113	17%	0.165	C	C	.	.	H	α-helix	trans	-65.6	-37.1	177.3	-171.3	-131.3	75.6	0	0	112.5	W780 K800 K801 L808 H1029	W780-M804 HydrophobicContact CD2-CB 4.29Å; W780-M804 HydrophobicContact CD2-CG 4.36Å; W780-M804 HydrophobicContact CH2-CG 4.16Å; W780-M804 HydrophobicContact CZ2-CB 4.28Å; W780-M804 HydrophobicContact CZ2-CG 3.58Å; K800-M804 WeakPolarHBondContact O-CB 3.35Å; K800-M804 PolarHBondContact O-N 3.26Å; K801-M804 PolarHBondContact O-N 3.21Å; M804-L808 WeakPolarHBondContact O-CB 3.38Å; M804-L808 PolarHBondContact O-N 3.27Å; M804-L808 VanDerWaalsContact O-N 3.08Å; M804-H1029 PolarHBondContact SD-CE1 2.71Å; M804-H1029 PolarHBondContact SD-ND1 3.47Å
805	V	93	Very high	91.5	Very high	13 Å²	13	29.9 Å²	29.9	8%	0.079	14%	0.142	C	C	.	.	H	α-helix	trans	-71.7	-36.9	174.9	174.7	0	0	0	0	111.3	K801 I802 T803 L808 C809 V928	K801-V805 WeakPolarHBondContact O-CG2 3.25Å; K801-V805 PolarHBondContact O-N 3.31Å; I802-V805 PolarHBondContact O-N 3.05Å; T803-V805 PolarHBondContact O-N 2.95Å; V805-L808 PolarHBondContact O-N 3.09Å; V805-C809 WeakPolarHBondContact O-CB 3.14Å; V805-C809 PolarHBondContact O-N 2.93Å; V805-C809 PolarHBondContact O-SG 3.33Å; V805-V928 HydrophobicContact CB-CB 4.49Å; V805-V928 HydrophobicContact CB-CG2 3.82Å; V805-V928 HydrophobicContact CG1-CB 3.95Å; V805-V928 HydrophobicContact CG1-CG2 3.84Å; V805-V928 HydrophobicContact CG2-CG2 4.14Å
806	L	94.1	Very high	91.9	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.037	14%	0.142	C	C	.	.	H	α-helix	trans	-60	-52.7	173.3	177.8	59.5	0	0	0	111.3	I802 T803 L808 C809 E810 D953 L957	I802-L806 WeakPolarHBondContact O-CB 3.3Å; I802-L806 PolarHBondContact O-N 3.22Å; T803-L806 PolarHBondContact O-N 3.14Å; L806-L808 VanDerWaalsContact C-N 3.29Å; L806-L808 PolarHBondContact O-N 3.4Å; L806-C809 PolarHBondContact O-N 2.87Å; L806-C809 VanDerWaalsContact O-N 3.1Å; L806-E810 HydrophobicContact CD1-CG 4.28Å; L806-E810 WeakPolarHBondContact O-CG 3.3Å; L806-E810 PolarHBondContact O-N 3.42Å; L806-D953 HydrophobicContact CD1-CB 4.33Å; L806-D953 HydrophobicContact CD2-CB 3.72Å; L806-L957 HydrophobicContact CD1-CD2 4.05Å
807	E	94.8	Very high	92.4	Very high	52 Å²	52	31.7 Å²	31.7	24%	0.243	15%	0.149	C	C	.	.	H	α-helix	trans	-61	-36.4	177.8	-77.2	-167.8	-145.8	0	0	112.5	W780 T803 E810 L811 K1022	W780-E807 HydrophobicContact CZ3-CG 4.49Å; W780-E807 WeakPolarHBondContact CZ3-OE1 3.15Å; W780-E807 WeakPolarHBondContact CZ3-OE2 3.39Å; T803-E807 PolarHBondContact O-N 3.46Å; E807-E810 PolarHBondContact O-N 3.43Å; E807-L811 VanDerWaalsContact O-CG 3.29Å; E807-L811 WeakPolarHBondContact O-CG 3.32Å; E807-L811 PolarHBondContact O-N 2.89Å; E807-K1022 IonicContact OE1-NZ 3.17Å; E807-K1022 PolarHBondContact OE1-NZ 2.83Å; E807-K1022 WeakPolarHBondContact OE2-CE 3.43Å; E807-K1022 IonicContact OE2-NZ 3.78Å; E807-K1022 PolarHBondContact OE2-NZ 3.29Å
808	L	95.5	Very high	92.5	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-61	-49.6	172.4	178.2	57.7	0	0	0	111.2	M804 V805 L806 E810 L811 L812 Y924 T1026 L1027	M804-L808 WeakPolarHBondContact O-CB 3.38Å; M804-L808 PolarHBondContact O-N 3.27Å; M804-L808 VanDerWaalsContact O-N 3.08Å; V805-L808 PolarHBondContact O-N 3.09Å; L806-L808 VanDerWaalsContact C-N 3.29Å; L806-L808 PolarHBondContact O-N 3.4Å; L808-E810 VanDerWaalsContact C-N 3.3Å; L808-E810 PolarHBondContact O-N 2.92Å; L808-L811 PolarHBondContact O-N 3.07Å; L808-L812 HydrophobicContact CD1-CD1 4.08Å; L808-L812 HydrophobicContact CD1-CG 4.18Å; L808-L812 HydrophobicContact CG-CD1 4.08Å; L808-L812 WeakPolarHBondContact O-CB 3.43Å; L808-L812 WeakPolarHBondContact O-CG 3.36Å; L808-L812 PolarHBondContact O-N 3.07Å; L808-Y924 HydrophobicContact CD2-CD1 4.01Å; L808-Y924 HydrophobicContact CD2-CD2 4.32Å; L808-Y924 HydrophobicContact CD2-CE1 3.57Å; L808-Y924 HydrophobicContact CD2-CE2 3.94Å; L808-Y924 HydrophobicContact CD2-CG 4.37Å; L808-Y924 HydrophobicContact CG-CE2 4.34Å; L808-T1026 HydrophobicContact CB-CG2 3.72Å; L808-T1026 HydrophobicContact CD1-CG2 4.21Å; L808-L1027 HydrophobicContact CD1-CD2 4.16Å
809	C	97	Very high	92.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.7	-35	178.7	-71.8	0	0	0	0	112.9	V805 L806 L812 A813 V921 Y924 L925 L957	V805-C809 WeakPolarHBondContact O-CB 3.14Å; V805-C809 PolarHBondContact O-N 2.93Å; V805-C809 PolarHBondContact O-SG 3.33Å; L806-C809 PolarHBondContact O-N 2.87Å; L806-C809 VanDerWaalsContact O-N 3.1Å; C809-L812 PolarHBondContact O-N 2.98Å; C809-A813 WeakPolarHBondContact O-CB 3.34Å; C809-A813 PolarHBondContact O-N 2.86Å; C809-V921 HydrophobicContact CB-CG1 4.04Å; C809-Y924 WeakPolarHBondContact SG-CB 3.49Å; C809-L925 HydrophobicContact CB-CD2 4.11Å; C809-L925 HydrophobicContact CB-CG 4.3Å; C809-L957 HydrophobicContact CB-CD2 3.49Å; C809-L957 VanDerWaalsContact CB-CD2 3.49Å
810	E	96.2	Very high	92.1	Very high	92 Å²	92	34.5 Å²	34.5	43%	0.43	17%	0.165	S	C	.	.	H	α-helix	trans	-67.2	-45.7	174.8	-71.6	-176.6	151.9	0	0	112.1	L806 E807 L808 L812 A813 E814 L957	L806-E810 HydrophobicContact CD1-CG 4.28Å; L806-E810 WeakPolarHBondContact O-CG 3.3Å; L806-E810 PolarHBondContact O-N 3.42Å; E807-E810 PolarHBondContact O-N 3.43Å; L808-E810 VanDerWaalsContact C-N 3.3Å; L808-E810 PolarHBondContact O-N 2.92Å; E810-L812 VanDerWaalsContact C-N 3.28Å; E810-L812 PolarHBondContact O-N 3.27Å; E810-A813 PolarHBondContact O-N 2.85Å; E810-E814 WeakPolarHBondContact O-CB 3.36Å; E810-E814 PolarHBondContact O-N 3.22Å; E810-L957 HydrophobicContact CG-CD2 3.83Å
811	L	96.8	Very high	91.6	Very high	22 Å²	22	32.6 Å²	32.6	12%	0.115	16%	0.16	C	C	.	.	H	α-helix	trans	-61.5	-36.1	175.1	-71.3	166.5	0	0	0	112.4	E807 L808 L815 Y997 A1023 T1026 L1027	E807-L811 VanDerWaalsContact O-CG 3.29Å; E807-L811 WeakPolarHBondContact O-CG 3.32Å; E807-L811 PolarHBondContact O-N 2.89Å; L808-L811 PolarHBondContact O-N 3.07Å; L811-L815 WeakPolarHBondContact O-CB 3.26Å; L811-L815 PolarHBondContact O-N 3.35Å; L811-Y997 WeakPolarHBondContact O-CE1 3.49Å; L811-A1023 HydrophobicContact CD1-CB 3.84Å; L811-A1023 HydrophobicContact CD2-CB 3.78Å; L811-A1023 HydrophobicContact CG-CB 4.5Å; L811-T1026 HydrophobicContact CD1-CG2 4.07Å; L811-L1027 HydrophobicContact CB-CD2 4.12Å; L811-L1027 HydrophobicContact CD1-CG 4.28Å
812	L	96	Very high	90.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-73.1	-37.7	176.6	-67.6	178.1	0	0	0	112.7	L808 C809 E810 L815 A816 L917 R920 V921 Y924 I994 L1027	L808-L812 HydrophobicContact CD1-CD1 4.08Å; L808-L812 HydrophobicContact CD1-CG 4.18Å; L808-L812 HydrophobicContact CG-CD1 4.08Å; L808-L812 WeakPolarHBondContact O-CB 3.43Å; L808-L812 WeakPolarHBondContact O-CG 3.36Å; L808-L812 PolarHBondContact O-N 3.07Å; C809-L812 PolarHBondContact O-N 2.98Å; E810-L812 VanDerWaalsContact C-N 3.28Å; E810-L812 PolarHBondContact O-N 3.27Å; L812-L815 PolarHBondContact O-N 2.92Å; L812-A816 PolarHBondContact O-N 2.96Å; L812-L917 HydrophobicContact CD2-CD2 4.48Å; L812-R920 HydrophobicContact CD1-CG 4.44Å; L812-V921 HydrophobicContact CB-CG2 3.44Å; L812-V921 VanDerWaalsContact CB-CG2 3.44Å; L812-V921 HydrophobicContact CD1-CG2 4.35Å; L812-Y924 HydrophobicContact CD1-CD2 3.67Å; L812-Y924 HydrophobicContact CD1-CE2 3.53Å; L812-I994 HydrophobicContact CD1-CD1 4.38Å; L812-I994 HydrophobicContact CD2-CB 4.4Å; L812-I994 HydrophobicContact CD2-CD1 3.49Å; L812-I994 VanDerWaalsContact CD2-CD1 3.49Å; L812-I994 HydrophobicContact CD2-CG1 3.38Å; L812-I994 HydrophobicContact CD2-CG2 4.22Å; L812-L1027 HydrophobicContact CD2-CD2 3.99Å
813	A	95	Very high	88.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.3	-40.1	172.3	0	0	0	0	0	111.4	C809 E810 A816 E817 L957	C809-A813 WeakPolarHBondContact O-CB 3.34Å; C809-A813 PolarHBondContact O-N 2.86Å; E810-A813 PolarHBondContact O-N 2.85Å; A813-A816 PolarHBondContact O-N 3.45Å; A813-E817 WeakPolarHBondContact O-CG 3.32Å; A813-E817 PolarHBondContact O-N 3.43Å; A813-L957 HydrophobicContact CB-CD1 4.18Å
814	E	93.7	Very high	86.6	Confident	69 Å²	69	34 Å²	34	32%	0.322	18%	0.182	S	C	.	.	H	α-helix	trans	-61.4	-43.4	173.5	-165.6	-155.6	177.5	0	0	111.5	E810 A816 E817 R818 Y997	E810-E814 WeakPolarHBondContact O-CB 3.36Å; E810-E814 PolarHBondContact O-N 3.22Å; E814-A816 VanDerWaalsContact C-N 3.34Å; E814-A816 PolarHBondContact O-N 2.89Å; E814-E817 PolarHBondContact O-N 3.43Å; E814-R818 WeakPolarHBondContact O-CB 3.39Å; E814-R818 VanDerWaalsContact O-CG 3.29Å; E814-R818 WeakPolarHBondContact O-CG 3.29Å; E814-R818 PolarHBondContact O-N 2.94Å; E814-R818 IonicContact OE1-CZ 3.7Å; E814-R818 VanDerWaalsContact OE1-CZ 3.24Å; E814-R818 IonicContact OE1-NE 3.88Å; E814-R818 PolarHBondContact OE1-NE 3.09Å; E814-R818 IonicContact OE1-NH2 3.51Å; E814-R818 PolarHBondContact OE1-NH2 3.47Å; E814-R818 IonicContact OE2-NH2 2.56Å; E814-Y997 VanDerWaalsContact CD-OH 3.31Å; E814-Y997 PolarHBondContact OE2-OH 2.92Å
815	L	93.5	Very high	84.3	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-42.6	175.5	-178	59.7	0	0	0	111.8	L811 L812 R818 R819 L917 L993 Y997	L811-L815 WeakPolarHBondContact O-CB 3.26Å; L811-L815 PolarHBondContact O-N 3.35Å; L812-L815 PolarHBondContact O-N 2.92Å; L815-R818 PolarHBondContact O-N 3.13Å; L815-R819 WeakPolarHBondContact O-CG 3.06Å; L815-R819 PolarHBondContact O-N 3.07Å; L815-L917 HydrophobicContact CB-CD1 4.25Å; L815-L917 HydrophobicContact CD2-CD1 3.86Å; L815-L917 HydrophobicContact CD2-CD2 3.82Å; L815-L917 HydrophobicContact CG-CD1 3.67Å; L815-L917 HydrophobicContact CG-CD2 4.49Å; L815-L993 HydrophobicContact CD2-CB 4.4Å; L815-Y997 HydrophobicContact CB-CD1 3.83Å; L815-Y997 HydrophobicContact CB-CE1 3.96Å; L815-Y997 HydrophobicContact CB-CG 4.35Å; L815-Y997 HydrophobicContact CD1-CD1 4.05Å; L815-Y997 HydrophobicContact CD1-CD2 3.82Å; L815-Y997 HydrophobicContact CD1-CE2 4.35Å; L815-Y997 HydrophobicContact CD1-CG 3.66Å; L815-Y997 HydrophobicContact CD2-CD1 3.87Å; L815-Y997 HydrophobicContact CD2-CG 3.91Å; L815-Y997 HydrophobicContact CG-CD1 4.12Å; L815-Y997 HydrophobicContact CG-CG 4.17Å
816	A	93	Very high	81.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63	-46.8	175.2	0	0	0	0	0	111.7	L812 A813 E814 R818 R819 A820 Q914 L917 Y918	L812-A816 PolarHBondContact O-N 2.96Å; A813-A816 PolarHBondContact O-N 3.45Å; E814-A816 VanDerWaalsContact C-N 3.34Å; E814-A816 PolarHBondContact O-N 2.89Å; A816-R818 VanDerWaalsContact C-N 3.27Å; A816-R818 PolarHBondContact O-N 2.88Å; A816-R819 PolarHBondContact O-N 3.49Å; A816-R819 VanDerWaalsContact O-N 3.11Å; A816-A820 PolarHBondContact O-N 3.31Å; A816-A820 VanDerWaalsContact O-N 3.15Å; A816-Q914 HydrophobicContact CB-CG 4.44Å; A816-Q914 VanDerWaalsContact O-CG 3.31Å; A816-Q914 WeakPolarHBondContact O-CG 3.43Å; A816-L917 HydrophobicContact CB-CB 3.97Å; A816-L917 HydrophobicContact CB-CD1 4.22Å; A816-Y918 HydrophobicContact CB-CD1 4.32Å; A816-Y918 HydrophobicContact CB-CD2 4.06Å; A816-Y918 HydrophobicContact CB-CE1 3.98Å; A816-Y918 HydrophobicContact CB-CE2 3.72Å; A816-Y918 HydrophobicContact CB-CG 4.35Å
817	E	90.8	Very high	78.9	Confident	82 Å²	82	42.7 Å²	42.7	38%	0.383	24%	0.238	S	C	.	.	H	α-helix	trans	-60.6	-35.3	176.4	-72.5	178.8	177.2	0	0	111.8	A813 E814 A820 Y918 R960	A813-E817 WeakPolarHBondContact O-CG 3.32Å; A813-E817 PolarHBondContact O-N 3.43Å; E814-E817 PolarHBondContact O-N 3.43Å; E817-A820 WeakPolarHBondContact O-CB 3.13Å; E817-A820 PolarHBondContact O-N 2.96Å; E817-Y918 WeakPolarHBondContact CG-OH 3.29Å; E817-R960 IonicContact OE1-CZ 2.7Å; E817-R960 IonicContact OE1-NH1 3.9Å; E817-R960 PolarHBondContact OE1-NH1 3.27Å; E817-R960 IonicContact OE2-NH1 2.69Å
818	R	88	Confident	75.9	Confident	98 Å²	98	43.7 Å²	43.7	37%	0.37	25%	0.249	S	C	.	.	H	α-helix	trans	-64.8	-46.9	171.1	-71.5	171.1	179.3	-153.2	12.9	112.1	E814 L815 A816 A820 S821 A824 Y997	E814-R818 WeakPolarHBondContact O-CB 3.39Å; E814-R818 VanDerWaalsContact O-CG 3.29Å; E814-R818 WeakPolarHBondContact O-CG 3.29Å; E814-R818 PolarHBondContact O-N 2.94Å; E814-R818 IonicContact OE1-CZ 3.7Å; E814-R818 VanDerWaalsContact OE1-CZ 3.24Å; E814-R818 IonicContact OE1-NE 3.88Å; E814-R818 PolarHBondContact OE1-NE 3.09Å; E814-R818 IonicContact OE1-NH2 3.51Å; E814-R818 PolarHBondContact OE1-NH2 3.47Å; E814-R818 IonicContact OE2-NH2 2.56Å; L815-R818 PolarHBondContact O-N 3.13Å; A816-R818 VanDerWaalsContact C-N 3.27Å; A816-R818 PolarHBondContact O-N 2.88Å; R818-A820 PolarHBondContact O-N 2.93Å; R818-S821 PolarHBondContact O-N 2.88Å; R818-S821 VanDerWaalsContact O-N 3.09Å; R818-A824 WeakPolarHBondContact O-CB 3.38Å; R818-Y997 PolarHBondContact NH1-OH 2.74Å; R818-Y997 PolarHBondContact NH2-OH 3.48Å; R818-Y997 VanDerWaalsContact NH2-OH 3.12Å
819	R	85.6	Confident	72.8	Confident	21 Å²	21	47.7 Å²	47.7	8%	0.079	27%	0.273	C	S	.	.	H	α-helix	trans	-65.6	-14.1	178.8	-66	-49.1	-172.8	-153.8	-4.2	114.4	L815 A816 S821 D825 R910 E913 Q914 L917	L815-R819 WeakPolarHBondContact O-CG 3.06Å; L815-R819 PolarHBondContact O-N 3.07Å; A816-R819 PolarHBondContact O-N 3.49Å; A816-R819 VanDerWaalsContact O-N 3.11Å; R819-S821 VanDerWaalsContact C-N 3.28Å; R819-S821 PolarHBondContact O-N 3.04Å; R819-D825 IonicContact CZ-OD1 2.84Å; R819-D825 IonicContact CZ-OD2 3.23Å; R819-D825 IonicContact NH1-OD1 3.3Å; R819-D825 PolarHBondContact NH1-OD1 3.38Å; R819-D825 IonicContact NH1-OD2 3.44Å; R819-D825 PolarHBondContact NH1-OD2 2.95Å; R819-D825 IonicContact NH2-OD1 3.32Å; R819-R910 WeakPolarHBondContact O-CB 3.45Å; R819-R910 WeakPolarHBondContact O-CD 3.35Å; R819-R910 WeakPolarHBondContact O-CG 3.5Å; R819-E913 HydrophobicContact CB-CB 4.2Å; R819-E913 WeakPolarHBondContact CD-OE2 3.28Å; R819-E913 HydrophobicContact CG-CB 4.22Å; R819-E913 WeakPolarHBondContact CG-OE2 3.35Å; R819-E913 IonicContact NE-OE2 3.7Å; R819-E913 PolarHBondContact NE-OE2 2.95Å; R819-Q914 HydrophobicContact CB-CG 4.4Å; R819-L917 HydrophobicContact CG-CD1 4.45Å
820	A	80.7	Confident	69.4	Low	44 Å²	44	58.7 Å²	58.7	36%	0.364	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-32.5	169.7	0	0	0	0	0	113	A816 E817 R818 R910	A816-A820 PolarHBondContact O-N 3.31Å; A816-A820 VanDerWaalsContact O-N 3.15Å; E817-A820 WeakPolarHBondContact O-CB 3.13Å; E817-A820 PolarHBondContact O-N 2.96Å; R818-A820 PolarHBondContact O-N 2.93Å; A820-R910 PolarHBondContact O-NE 3.36Å
821	S	76.2	Confident	66.3	Low	25 Å²	25	58.8 Å²	58.8	18%	0.175	32%	0.322	C	S	.	.	S	Bend	trans	-73.7	129.6	-176.2	-175.3	0	0	0	0	112.3	Q45 R818 R819 L823 A824 R910	Q45-S821 PolarHBondContact NE2-OG 2.83Å; Q45-S821 PolarHBondContact OE1-OG 3.36Å; R818-S821 PolarHBondContact O-N 2.88Å; R818-S821 VanDerWaalsContact O-N 3.09Å; R819-S821 VanDerWaalsContact C-N 3.28Å; R819-S821 PolarHBondContact O-N 3.04Å; S821-L823 PolarHBondContact O-N 3.48Å; S821-L823 VanDerWaalsContact O-N 3.11Å; S821-L823 PolarHBondContact OG-N 3.39Å; S821-A824 WeakPolarHBondContact O-CB 3.38Å; S821-A824 PolarHBondContact O-N 3.02Å; S821-R910 WeakPolarHBondContact O-CD 3.35Å
822	A	59.8	Low	63	Low	41 Å²	41	63.7 Å²	63.7	34%	0.339	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-14	171.3	0	0	0	0	0	113.6
823	L	56.1	Low	59.8	Low	82 Å²	82	68.6 Å²	68.6	43%	0.429	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	2.5	-179.5	-64	169.5	0	0	0	113.5	Q45 S821 D825 F904	Q45-L823 HydrophobicContact CG-CD1 3.96Å; S821-L823 PolarHBondContact O-N 3.48Å; S821-L823 VanDerWaalsContact O-N 3.11Å; S821-L823 PolarHBondContact OG-N 3.39Å; L823-D825 VanDerWaalsContact C-N 3.33Å; L823-D825 PolarHBondContact O-N 2.91Å; L823-F904 HydrophobicContact CD2-CE1 4Å
824	A	50.7	Low	56.7	Low	39 Å²	39	74.8 Å²	74.8	32%	0.322	42%	0.416	S	S	.	.	S	Bend	trans	-60.7	-37.7	-173.2	0	0	0	0	0	114	R818 S821	R818-A824 WeakPolarHBondContact O-CB 3.38Å; S821-A824 WeakPolarHBondContact O-CB 3.38Å; S821-A824 PolarHBondContact O-N 3.02Å
825	D	42.8	Very low	53.7	Low	48 Å²	48	76.9 Å²	76.9	26%	0.257	43%	0.43	S	S	.	.			trans	-115	66.6	-170.8	-67.8	-76.4	0	0	0	112.8	R819 L823 T827 V905	R819-D825 IonicContact CZ-OD1 2.84Å; R819-D825 IonicContact CZ-OD2 3.23Å; R819-D825 IonicContact NH1-OD1 3.3Å; R819-D825 PolarHBondContact NH1-OD1 3.38Å; R819-D825 IonicContact NH1-OD2 3.44Å; R819-D825 PolarHBondContact NH1-OD2 2.95Å; R819-D825 IonicContact NH2-OD1 3.32Å; L823-D825 VanDerWaalsContact C-N 3.33Å; L823-D825 PolarHBondContact O-N 2.91Å; D825-T827 PolarHBondContact O-N 3.44Å; D825-V905 HydrophobicContact CB-CG2 3.8Å
826	C	40.3	Very low	50.9	Low	88 Å²	88	84.8 Å²	84.8	60%	0.595	47%	0.472	S	S	*	.			trans	-86.6	63.8	159.1	-68	0	0	0	0	110.2
827	T	35.2	Very low	47.9	Very low	91 Å²	91	92 Å²	92	56%	0.558	51%	0.511	S	S	*	.	S	Bend	trans	-125.8	137.6	179.4	47.7	0	0	0	0	111.1	D825 T829	D825-T827 PolarHBondContact O-N 3.44Å; T827-T829 PolarHBondContact O-N 2.67Å
828	P	30.4	Very low	45.1	Very low	73 Å²	73	95 Å²	95	47%	0.474	53%	0.53	S	S	.	.			trans	-65.9	129.4	176.8	26.8	-32.4	0	0	0	109.8	M180 E226 R830	M180-P828 HydrophobicContact CE-CG 3.64Å; E226-P828 WeakPolarHBondContact OE1-CA 3.39Å; E226-P828 WeakPolarHBondContact OE1-CB 3.31Å; P828-R830 PolarHBondContact O-N 2.93Å
829	T	30.9	Very low	42.4	Very low	84 Å²	84	94.7 Å²	94.7	52%	0.515	54%	0.542	S	S	.	.			trans	-87.3	100	-168.9	-53.8	0	0	0	0	109.5	E226 T827 V831	E226-T829 VanDerWaalsContact CG-O 3.24Å; E226-T829 WeakPolarHBondContact CG-O 3.45Å; E226-T829 PolarHBondContact OE1-N 2.93Å; T827-T829 PolarHBondContact O-N 2.67Å; T829-V831 PolarHBondContact O-N 3.27Å
830	R	26.4	Very low	39.8	Very low	232 Å²	232	99 Å²	99	88%	0.875	57%	0.571	S	S	*	*			trans	-61.1	93	175	-170	178.7	-172.9	178.6	0.3	110.3	P828 V832	P828-R830 PolarHBondContact O-N 2.93Å; R830-V832 PolarHBondContact O-N 3.38Å
831	V	30.8	Very low	37.4	Very low	94 Å²	94	103.1 Å²	103.1	57%	0.57	59%	0.591	S	S	*	*			trans	-63.6	120.5	175.3	-178.1	0	0	0	0	108.3	T829 N833	T829-V831 PolarHBondContact O-N 3.27Å; V831-N833 PolarHBondContact O-N 3Å
832	V	26.7	Very low	35.2	Very low	125 Å²	125	107.3 Å²	107.3	76%	0.758	62%	0.616	S	S	*	*			trans	-82	98.8	164.4	178.4	0	0	0	0	106.2	R830 T834	R830-V832 PolarHBondContact O-N 3.38Å; V832-T834 PolarHBondContact O-N 2.92Å
833	N	29	Very low	33.7	Very low	102 Å²	102	111.3 Å²	111.3	55%	0.545	64%	0.637	S	S	.	*			trans	-71.1	119.2	160.6	-95.8	40.9	0	0	0	107.8	V831 D835	V831-N833 PolarHBondContact O-N 3Å; N833-D835 VanDerWaalsContact C-N 3.27Å; N833-D835 WeakPolarHBondContact CB-OD1 3.48Å; N833-D835 PolarHBondContact ND2-OD1 3.03Å; N833-D835 PolarHBondContact O-N 2.81Å
834	T	30.9	Very low	32.5	Very low	131 Å²	131	114 Å²	114	80%	0.804	66%	0.657	S	S	*	*			trans	-80.9	81.4	156.9	48.9	0	0	0	0	107.5	V832 N836	V832-T834 PolarHBondContact O-N 2.92Å; T834-N836 PolarHBondContact O-N 2.75Å
835	D	29.9	Very low	31.3	Very low	112 Å²	112	119.5 Å²	119.5	60%	0.599	68%	0.681	S	S	*	*			trans	-73.5	113.9	172.1	-63.1	-35	0	0	0	108.3	N833	N833-D835 VanDerWaalsContact C-N 3.27Å; N833-D835 WeakPolarHBondContact CB-OD1 3.48Å; N833-D835 PolarHBondContact ND2-OD1 3.03Å; N833-D835 PolarHBondContact O-N 2.81Å
836	N	33.7	Very low	31.1	Very low	168 Å²	168	122.3 Å²	122.3	90%	0.898	70%	0.702	S	S	*	*			trans	-115.3	109.8	163	-92.5	-6	0	0	0	106.9	T834	T834-N836 PolarHBondContact O-N 2.75Å
837	D	30	Very low	30.6	Very low	152 Å²	152	124 Å²	124	81%	0.813	71%	0.714	S	S	*	*			trans	-99.3	175.6	178.8	-98	-42.5	0	0	0	111.7
838	D	32.6	Very low	30.3	Very low	146 Å²	146	123.8 Å²	123.8	78%	0.781	72%	0.722	S	S	*	*			trans	80.9	117.2	178.3	-71.9	-44.6	0	0	0	117.4
839	S	31.5	Very low	30.4	Very low	90 Å²	90	126.4 Å²	126.4	63%	0.629	74%	0.736	S	S	*	*			cis	92.8	144.9	38.9	89.8	0	0	0	0	112.9
840	T	31.8	Very low	30.4	Very low	113 Å²	113	128.6 Å²	128.6	69%	0.693	75%	0.745	S	S	*	*			cis	-158.8	146.9	-8.1	5.4	0	0	0	0	112.9
841	T	28.7	Very low	30.6	Very low	129 Å²	129	124.5 Å²	124.5	79%	0.791	74%	0.74	S	S	*	*			trans	63.7	163.1	155.8	63.5	0	0	0	0	118.8
842	T	30.9	Very low	30.4	Very low	114 Å²	114	123.5 Å²	123.5	70%	0.699	75%	0.749	S	S	*	*			cis	-142.2	144.6	15	50.5	0	0	0	0	114.2
843	T	27.6	Very low	30.6	Very low	124 Å²	124	124.9 Å²	124.9	76%	0.761	76%	0.758	S	S	*	*			trans	27.1	128.3	145.7	62.2	0	0	0	0	120.6
844	T	32.1	Very low	30.6	Very low	140 Å²	140	125.3 Å²	125.3	86%	0.859	77%	0.768	S	S	*	*				-166.7	154.8	67.2	41.9	0	0	0	0	114.3
845	D	24.8	Very low	30.2	Very low	154 Å²	154	126.4 Å²	126.4	82%	0.824	77%	0.768	S	S	*	*			trans	-89.7	-177.9	173.1	-117.3	-32.9	0	0	0	112.7
846	P	38.8	Very low	30.2	Very low	107 Å²	107	127.2 Å²	127.2	70%	0.695	78%	0.777	S	S	*	*			cis	-137.8	168.5	-21.8	38.6	-22.5	0	0	0	115.3
847	S	30.2	Very low	29.9	Very low	122 Å²	122	127.9 Å²	127.9	85%	0.853	77%	0.772	S	S	*	*			trans	179.2	157	131.1	62.8	0	0	0	0	114.7
848	A	29.6	Very low	29.8	Very low	87 Å²	87	129 Å²	129	72%	0.719	78%	0.777	S	S	*	*			trans	-58.8	172	-179.2	0	0	0	0	0	115.4
849	V	32.4	Very low	29.6	Very low	128 Å²	128	128.7 Å²	128.7	78%	0.776	78%	0.776	S	S	*	*			cis	-155.8	137.9	39.5	-170.7	0	0	0	0	113.3
850	N	30	Very low	29.3	Very low	130 Å²	130	132.4 Å²	132.4	70%	0.695	79%	0.788	S	S	*	*			trans	53.5	149.6	152.5	-93.8	43.5	0	0	0	125.3
851	D	30	Very low	29.2	Very low	146 Å²	146	135.9 Å²	135.9	78%	0.781	80%	0.797	S	S	*	*			trans	62.6	132.1	153.3	-53	-30.7	0	0	0	120.7
852	G	27.2	Very low	29.2	Very low	74 Å²	74	138.2 Å²	138.2	76%	0.763	80%	0.799	S	S	*	*			cis	152.8	72.1	-6.9	0	0	0	0	0	116.1
853	V	30.2	Very low	29.2	Very low	154 Å²	154	139.5 Å²	139.5	93%	0.933	81%	0.806	S	S	*	*			trans	-130.9	138.5	168	-178	0	0	0	0	109.9
854	S	28.8	Very low	29.2	Very low	110 Å²	110	142.8 Å²	142.8	77%	0.769	81%	0.81	S	S	*	*			trans	-110.8	154.2	-160.8	-161.6	0	0	0	0	115.1	V856	S854-V856 PolarHBondContact O-N 3.29Å
855	L	24.2	Very low	28.8	Very low	154 Å²	154	141.8 Å²	141.8	81%	0.806	81%	0.808	S	S	*	*			trans	-67.3	111.8	179.9	-176.1	76.5	0	0	0	111.8	K857	L855-K857 PolarHBondContact O-N 3.35Å
856	V	29.9	Very low	29	Very low	129 Å²	129	139.8 Å²	139.8	78%	0.782	81%	0.806	S	S	*	*			trans	-76.6	110.8	176.6	178.1	0	0	0	0	110.9	S854	S854-V856 PolarHBondContact O-N 3.29Å
857	K	26.3	Very low	28.6	Very low	183 Å²	183	140.7 Å²	140.7	80%	0.796	82%	0.815	S	S	*	*			trans	-77.7	115.7	165	-67.4	173.8	180	172	0	109.5	L855	L855-K857 PolarHBondContact O-N 3.35Å
858	L	28.5	Very low	28.4	Very low	174 Å²	174	142 Å²	142	91%	0.911	81%	0.812	S	S	*	*			trans	-85.4	110.4	164.1	-106.9	163.9	0	0	0	109.4
859	N	27.9	Very low	28.5	Very low	141 Å²	141	143.4 Å²	143.4	75%	0.754	81%	0.812	S	S	*	*			trans	-108.7	136.1	-176.9	-143.8	17.8	0	0	0	108.8	Q861	N859-Q861 PolarHBondContact O-N 3.34Å
860	N	25.7	Very low	28.4	Very low	168 Å²	168	144.3 Å²	144.3	90%	0.898	81%	0.812	S	S	*	*			trans	-59.8	132.3	174.8	-89.9	-23.4	0	0	0	110.9
861	Q	29.2	Very low	28.5	Very low	185 Å²	185	143.2 Å²	143.2	86%	0.864	82%	0.815	S	S	*	*			trans	-125.7	140	159.4	-75.8	-163.4	-5.5	0	0	110.8	N859	N859-Q861 PolarHBondContact O-N 3.34Å
862	Q	28.3	Very low	28.5	Very low	179 Å²	179	143 Å²	143	84%	0.836	81%	0.813	S	S	*	*			trans	-83.8	122.4	179.6	-65	170.5	-33.8	0	0	110.1	K864	Q862-K864 PolarHBondContact O-N 2.69Å; Q862-K864 VanDerWaalsContact O-N 3.1Å
863	T	30.8	Very low	28.8	Very low	140 Å²	140	145.5 Å²	145.5	86%	0.859	81%	0.809	S	S	*	*			trans	-77.1	90	167	37.3	0	0	0	0	110.5
864	K	27.9	Very low	28.9	Very low	193 Å²	193	143.9 Å²	143.9	84%	0.839	80%	0.795	S	S	*	*			trans	-82.7	108.5	161	-87.4	-171	174.6	-178.1	0	109.6	Q862 S866	Q862-K864 PolarHBondContact O-N 2.69Å; Q862-K864 VanDerWaalsContact O-N 3.1Å; K864-S866 PolarHBondContact O-N 2.68Å
865	C	24.6	Very low	29.1	Very low	120 Å²	120	144.5 Å²	144.5	81%	0.811	79%	0.79	S	S	*	*			trans	-80.8	109.3	167.4	-63.5	0	0	0	0	110.7
866	S	29.2	Very low	29.5	Very low	111 Å²	111	144.6 Å²	144.6	78%	0.776	79%	0.786	S	S	*	*			trans	-177.4	145.6	148.7	-86.2	0	0	0	0	111.7	K864	K864-S866 PolarHBondContact O-N 2.68Å
867	S	30.4	Very low	29.4	Very low	127 Å²	127	144.1 Å²	144.1	89%	0.888	79%	0.786	S	S	*	*			trans	53	116	167.3	53.8	0	0	0	0	117.8
868	N	24.6	Very low	29.5	Very low	150 Å²	150	138.9 Å²	138.9	80%	0.802	79%	0.785	S	S	*	*			trans	-131.9	177.9	163.4	-165	1.4	0	0	0	108
869	T	33	Very low	29.7	Very low	115 Å²	115	138 Å²	138	71%	0.706	79%	0.786	S	S	*	*			trans	76	141.2	-176.8	79.3	0	0	0	0	115
870	N	30.2	Very low	29.8	Very low	148 Å²	148	134.4 Å²	134.4	79%	0.791	78%	0.782	S	S	*	*			cis	-160.7	172.1	-12.7	-115.2	-13.9	0	0	0	112
871	S	31.5	Very low	30.1	Very low	107 Å²	107	131.8 Å²	131.8	75%	0.748	78%	0.777	S	S	*	*			trans	77.9	152	164	-158.8	0	0	0	0	117
872	L	30.8	Very low	30	Very low	141 Å²	141	134.3 Å²	134.3	74%	0.738	78%	0.781	S	S	*	*				177.9	163.8	-51.5	-107.2	166.8	0	0	0	107.1
873	D	32.1	Very low	30.1	Very low	127 Å²	127	129.5 Å²	129.5	68%	0.679	78%	0.779	S	S	*	*			trans	66.8	143.3	159.7	-67.4	-28	0	0	0	120.2
874	N	33.8	Very low	30	Very low	120 Å²	120	130.7 Å²	130.7	64%	0.642	78%	0.78	S	S	*	*			cis	-163.1	164.5	-29.7	-140	-45.1	0	0	0	112.2
875	N	33.4	Very low	30	Very low	122 Å²	122	125.8 Å²	125.8	65%	0.652	77%	0.77	S	S	*	*			trans	72.2	126.5	149.4	-79.9	-48.2	0	0	0	124.8
876	H	32	Very low	30.2	Very low	157 Å²	157	126.8 Å²	126.8	73%	0.727	77%	0.767	S	S	*	*				101.3	98.4	126.8	-90.9	54.6	0	0	0	123.5
877	C	27.2	Very low	30	Very low	118 Å²	118	129.6 Å²	129.6	80%	0.797	77%	0.768	S	S	*	*				66.6	128.2	122.2	-61.3	0	0	0	0	122.6
878	G	29.4	Very low	30.1	Very low	74 Å²	74	131.5 Å²	131.5	76%	0.763	76%	0.763	S	S	*	*			trans	176.7	51.9	171.4	0	0	0	0	0	120.2
879	V	32.8	Very low	30.1	Very low	155 Å²	155	130.4 Å²	130.4	94%	0.939	76%	0.757	S	S	*	*			trans	31.3	127	149.8	-174.5	0	0	0	0	121.5
880	G	29.6	Very low	30	Very low	65 Å²	65	131.5 Å²	131.5	67%	0.67	76%	0.764	S	S	*	*				128.1	105.1	124.8	0	0	0	0	0	122.2
881	S	31.6	Very low	29.8	Very low	113 Å²	113	129.5 Å²	129.5	79%	0.79	76%	0.761	S	S	*	*			trans	56.8	112.2	138.5	-58.4	0	0	0	0	124.7
882	Y	27.4	Very low	29.9	Very low	239 Å²	239	134 Å²	134	94%	0.937	77%	0.767	S	S	*	*				19.3	133.1	129.6	-60.9	-81.6	0	0	0	122.5
883	G	30.4	Very low	29.8	Very low	78 Å²	78	134.6 Å²	134.6	80%	0.804	77%	0.771	S	S	*	*			trans	158.6	103.2	148.6	0	0	0	0	0	117.8
884	N	27.9	Very low	29.5	Very low	165 Å²	165	133.6 Å²	133.6	88%	0.882	77%	0.773	S	S	*	*			trans	-20.7	152.9	159.1	-75	12.7	0	0	0	118.9
885	S	29.1	Very low	29.1	Very low	89 Å²	89	137 Å²	137	62%	0.622	79%	0.785	S	S	*	*			cis	-163	178.1	8.5	44.2	0	0	0	0	114.5
886	D	27.9	Very low	29	Very low	142 Å²	142	139.4 Å²	139.4	76%	0.759	79%	0.792	S	S	*	*			trans	89.7	134.8	149	-54.5	-43.8	0	0	0	123
887	E	25.5	Very low	28.7	Very low	169 Å²	169	136.7 Å²	136.7	79%	0.79	80%	0.797	S	S	*	*			trans	35.5	109.7	157	-58.3	-172.7	144.4	0	0	122
888	H	31.4	Very low	28.9	Very low	167 Å²	167	135.6 Å²	135.6	77%	0.773	79%	0.791	S	S	*	*				-176.3	175.6	89.4	-117.1	-70.5	0	0	0	114
889	D	24.7	Very low	29	Very low	128 Å²	128	137.1 Å²	137.1	68%	0.684	79%	0.789	S	S	*	*			trans	-51.8	147.6	-178.4	-59.8	-100.6	0	0	0	117.1
890	T	32.2	Very low	29	Very low	138 Å²	138	136 Å²	136	85%	0.847	78%	0.784	S	S	*	*				-159.3	118.8	120.2	4.4	0	0	0	0	113
891	S	25.2	Very low	29	Very low	106 Å²	106	137.1 Å²	137.1	74%	0.741	79%	0.786	S	S	*	*			trans	-68.4	138.3	167.7	60.4	0	0	0	0	111.7
892	K	32.6	Very low	29.1	Very low	202 Å²	202	136.6 Å²	136.6	88%	0.878	77%	0.774	S	S	*	*			trans	-119.2	127.9	160	-76.3	-176.2	177.4	174.1	0	110.2
893	N	30.1	Very low	29.9	Very low	153 Å²	153	133.9 Å²	133.9	82%	0.818	77%	0.767	S	S	*	*			trans	-66.1	135.1	-169.6	-80.8	-58.6	0	0	0	112.9
894	C	24.8	Very low	31.4	Very low	106 Å²	106	136.2 Å²	136.2	72%	0.716	76%	0.755	S	S	*	*			trans	-81.1	113.6	156.3	-170.1	0	0	0	0	108.8	Q896	C894-Q896 PolarHBondContact O-N 3.09Å
895	Q	26.7	Very low	33.5	Very low	191 Å²	191	129.3 Å²	129.3	89%	0.893	72%	0.719	S	S	*	*			trans	-87	91.3	168	-75.9	-174.6	-15.2	0	0	109.1
896	Q	29.6	Very low	36.2	Very low	173 Å²	173	127.8 Å²	127.8	81%	0.808	71%	0.708	S	S	*	*			trans	-109.1	98.3	174.3	-152.2	170.1	20.3	0	0	109.5	C894 S898	C894-Q896 PolarHBondContact O-N 3.09Å; Q896-S898 PolarHBondContact O-N 3.19Å
897	A	25.7	Very low	38.9	Very low	99 Å²	99	124.8 Å²	124.8	82%	0.818	69%	0.69	S	S	*	*			trans	-75.6	114.1	175.2	0	0	0	0	0	109.7	S899	A897-S899 PolarHBondContact O-N 3.48Å; A897-S899 VanDerWaalsContact O-N 3.14Å
898	S	32.2	Very low	41.9	Very low	96 Å²	96	117 Å²	117	67%	0.671	65%	0.654	S	S	*	*			trans	-81.8	86.7	180	48.7	0	0	0	0	111.5	Q896	Q896-S898 PolarHBondContact O-N 3.19Å
899	S	31.6	Very low	44.7	Very low	105 Å²	105	112 Å²	112	73%	0.734	63%	0.631	S	S	*	*			trans	-69.1	140.6	161.1	55.1	0	0	0	0	110	A897 A901	A897-S899 PolarHBondContact O-N 3.48Å; A897-S899 VanDerWaalsContact O-N 3.14Å; S899-A901 VanDerWaalsContact C-N 3.32Å; S899-A901 PolarHBondContact O-N 3.11Å
900	T	31.9	Very low	47.9	Very low	133 Å²	133	107.9 Å²	107.9	82%	0.816	61%	0.606	S	S	*	*			trans	-72.2	89.4	170.1	46.6	0	0	0	0	108.8	L902	T900-L902 PolarHBondContact O-N 3.15Å
901	A	29.6	Very low	50.7	Low	88 Å²	88	101.6 Å²	101.6	73%	0.727	57%	0.567	S	S	*	*			trans	-63.4	105.2	-179.7	0	0	0	0	0	110.8	S899 K903	S899-A901 VanDerWaalsContact C-N 3.32Å; S899-A901 PolarHBondContact O-N 3.11Å; A901-K903 PolarHBondContact O-N 3.17Å
902	L	34.7	Very low	53.9	Low	101 Å²	101	96.6 Å²	96.6	53%	0.529	53%	0.532	S	S	.	.			trans	-58.1	119.8	164.6	-67.9	172.4	0	0	0	107.8	T900 F904	T900-L902 PolarHBondContact O-N 3.15Å; L902-F904 HydrophobicContact CB-CD2 4.37Å; L902-F904 HydrophobicContact CB-CE2 3.91Å; L902-F904 HydrophobicContact CB-CZ 4.07Å; L902-F904 HydrophobicContact CD1-CZ 4.23Å; L902-F904 WeakPolarHBondContact O-CD2 3.26Å; L902-F904 PolarHBondContact O-N 3.33Å
903	K	44.7	Very low	56.8	Low	182 Å²	182	87.5 Å²	87.5	79%	0.791	49%	0.492	S	S	*	.			trans	-80.8	74.9	-177.5	-166.8	-176.4	-179.7	-173.1	0	109.9	A901 V905	A901-K903 PolarHBondContact O-N 3.17Å; K903-V905 PolarHBondContact O-N 3.06Å
904	F	61.9	Low	59.9	Low	127 Å²	127	81.1 Å²	81.1	56%	0.557	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-52.2	129	176.5	-64.9	-81	0	0	0	111.1	L823 L902 S906	L823-F904 HydrophobicContact CD2-CE1 4Å; L902-F904 HydrophobicContact CB-CD2 4.37Å; L902-F904 HydrophobicContact CB-CE2 3.91Å; L902-F904 HydrophobicContact CB-CZ 4.07Å; L902-F904 HydrophobicContact CD1-CZ 4.23Å; L902-F904 WeakPolarHBondContact O-CD2 3.26Å; L902-F904 PolarHBondContact O-N 3.33Å; F904-S906 PolarHBondContact O-N 3.49Å
905	V	72.2	Confident	63.2	Low	20 Å²	20	77.2 Å²	77.2	12%	0.121	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-61.4	131.2	172	-178.2	0	0	0	0	108.7	D825 K903 Q909 R910	D825-V905 HydrophobicContact CB-CG2 3.8Å; K903-V905 PolarHBondContact O-N 3.06Å; V905-Q909 HydrophobicContact CG1-CB 3.73Å; V905-Q909 VanDerWaalsContact CG1-CD 3.49Å; V905-Q909 HydrophobicContact CG1-CG 3.51Å; V905-R910 HydrophobicContact CB-CG 4Å; V905-R910 HydrophobicContact CG1-CG 3.63Å; V905-R910 PolarHBondContact O-NH1 3.31Å
906	S	84.2	Confident	66.4	Low	57 Å²	57	69.3 Å²	69.3	40%	0.399	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-64.2	154.2	-175.5	72.8	0	0	0	0	112	F904 A908 Q909 R910	F904-S906 PolarHBondContact O-N 3.49Å; S906-A908 VanDerWaalsContact C-N 3.3Å; S906-A908 PolarHBondContact O-N 2.87Å; S906-Q909 PolarHBondContact O-N 3.33Å; S906-Q909 VanDerWaalsContact O-N 3.14Å; S906-Q909 VanDerWaalsContact OG-CB 3.31Å; S906-Q909 WeakPolarHBondContact OG-CB 3.48Å; S906-Q909 PolarHBondContact OG-N 3.34Å; S906-Q909 VanDerWaalsContact OG-N 3.13Å; S906-R910 WeakPolarHBondContact O-CG 3.09Å; S906-R910 PolarHBondContact O-N 3.39Å
907	E	86.3	Confident	69.6	Low	80 Å²	80	61 Å²	61	37%	0.374	36%	0.356	S	S	.	.	H	α-helix	trans	-59	-43.1	178.1	-174.1	167.6	144.3	0	0	111.7	Q909 R910 I911 R974 L977	E907-Q909 PolarHBondContact O-N 3.25Å; E907-R910 PolarHBondContact O-N 3.28Å; E907-I911 HydrophobicContact CG-CD1 3.86Å; E907-I911 WeakPolarHBondContact O-CB 3.33Å; E907-I911 VanDerWaalsContact O-CG1 3.28Å; E907-I911 WeakPolarHBondContact O-CG1 3.22Å; E907-I911 PolarHBondContact O-N 3.38Å; E907-R974 IonicContact OE1-CZ 3.79Å; E907-R974 IonicContact OE1-NH1 3.2Å; E907-R974 PolarHBondContact OE1-NH1 3.29Å; E907-R974 IonicContact OE1-NH2 2.68Å; E907-L977 HydrophobicContact CB-CD2 4.37Å; E907-L977 HydrophobicContact CG-CD1 4.46Å; E907-L977 HydrophobicContact CG-CD2 4.45Å
908	A	87.3	Confident	73	Confident	4 Å²	4	56.5 Å²	56.5	3%	0.033	32%	0.317	C	S	.	.	H	α-helix	trans	-56.7	-44.8	172.9	0	0	0	0	0	112.7	S906 I911 V912 L977 P980 V981 L984	S906-A908 VanDerWaalsContact C-N 3.3Å; S906-A908 PolarHBondContact O-N 2.87Å; A908-I911 PolarHBondContact O-N 3.38Å; A908-V912 WeakPolarHBondContact O-CG2 3.48Å; A908-V912 PolarHBondContact O-N 3.37Å; A908-L977 HydrophobicContact CB-CD2 4.04Å; A908-P980 HydrophobicContact CB-CB 3.64Å; A908-V981 HydrophobicContact CB-CG2 3.97Å; A908-L984 HydrophobicContact CB-CD1 3.82Å
909	Q	90.4	Very high	76	Confident	62 Å²	62	58.7 Å²	58.7	29%	0.29	31%	0.311	S	S	.	.	H	α-helix	trans	-65.5	-46	178.2	178.5	172.3	-7.6	0	0	111.8	V905 S906 E907 I911 V912 E913 L984 I988	V905-Q909 HydrophobicContact CG1-CB 3.73Å; V905-Q909 VanDerWaalsContact CG1-CD 3.49Å; V905-Q909 HydrophobicContact CG1-CG 3.51Å; S906-Q909 PolarHBondContact O-N 3.33Å; S906-Q909 VanDerWaalsContact O-N 3.14Å; S906-Q909 VanDerWaalsContact OG-CB 3.31Å; S906-Q909 WeakPolarHBondContact OG-CB 3.48Å; S906-Q909 PolarHBondContact OG-N 3.34Å; S906-Q909 VanDerWaalsContact OG-N 3.13Å; E907-Q909 PolarHBondContact O-N 3.25Å; Q909-I911 VanDerWaalsContact C-N 3.26Å; Q909-I911 PolarHBondContact O-N 3.09Å; Q909-V912 PolarHBondContact O-N 2.93Å; Q909-E913 HydrophobicContact CG-CG 4.31Å; Q909-E913 VanDerWaalsContact CG-OE1 3.28Å; Q909-E913 WeakPolarHBondContact CG-OE1 3.45Å; Q909-E913 PolarHBondContact NE2-OE1 2.98Å; Q909-E913 WeakPolarHBondContact O-CG 3.37Å; Q909-E913 PolarHBondContact O-N 3.44Å; Q909-L984 HydrophobicContact CB-CD1 4Å; Q909-I988 HydrophobicContact CG-CD1 3.78Å
910	R	91.3	Very high	79	Confident	43 Å²	43	55.4 Å²	55.4	16%	0.162	28%	0.282	C	S	.	.	H	α-helix	trans	-60.8	-35.9	176.6	-64.1	-163.8	-45.1	-77.8	-5.1	112.3	R819 A820 S821 V905 S906 E907 Q914	R819-R910 WeakPolarHBondContact O-CB 3.45Å; R819-R910 WeakPolarHBondContact O-CD 3.35Å; R819-R910 WeakPolarHBondContact O-CG 3.5Å; A820-R910 PolarHBondContact O-NE 3.36Å; S821-R910 WeakPolarHBondContact O-CD 3.35Å; V905-R910 HydrophobicContact CB-CG 4Å; V905-R910 HydrophobicContact CG1-CG 3.63Å; V905-R910 PolarHBondContact O-NH1 3.31Å; S906-R910 WeakPolarHBondContact O-CG 3.09Å; S906-R910 PolarHBondContact O-N 3.39Å; E907-R910 PolarHBondContact O-N 3.28Å; R910-Q914 WeakPolarHBondContact O-CG 3.39Å; R910-Q914 PolarHBondContact O-N 3.5Å; R910-Q914 PolarHBondContact O-NE2 2.9Å
911	I	91.1	Very high	82	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-68.8	-46.8	175.6	-71.6	167.3	0	0	0	110.7	E907 A908 Q909 Q914 I915 L968 Q971 L977	E907-I911 HydrophobicContact CG-CD1 3.86Å; E907-I911 WeakPolarHBondContact O-CB 3.33Å; E907-I911 VanDerWaalsContact O-CG1 3.28Å; E907-I911 WeakPolarHBondContact O-CG1 3.22Å; E907-I911 PolarHBondContact O-N 3.38Å; A908-I911 PolarHBondContact O-N 3.38Å; Q909-I911 VanDerWaalsContact C-N 3.26Å; Q909-I911 PolarHBondContact O-N 3.09Å; I911-Q914 PolarHBondContact O-N 3.08Å; I911-I915 HydrophobicContact CG2-CD1 3.64Å; I911-I915 HydrophobicContact CG2-CG1 4.37Å; I911-I915 WeakPolarHBondContact O-CB 3.29Å; I911-I915 VanDerWaalsContact O-CG1 3.29Å; I911-I915 WeakPolarHBondContact O-CG1 3.44Å; I911-I915 PolarHBondContact O-N 3.11Å; I911-L968 HydrophobicContact CG1-CD2 4.25Å; I911-L968 HydrophobicContact CG2-CD2 4.38Å; I911-Q971 HydrophobicContact CD1-CB 4.18Å; I911-L977 HydrophobicContact CD1-CD1 3.83Å
912	V	92.3	Very high	85.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.9	-47	178.5	168.2	0	0	0	0	112.1	A908 Q909 Q914 I915 V916 V981 L984 L985 I988	A908-V912 WeakPolarHBondContact O-CG2 3.48Å; A908-V912 PolarHBondContact O-N 3.37Å; Q909-V912 PolarHBondContact O-N 2.93Å; V912-Q914 VanDerWaalsContact C-N 3.31Å; V912-Q914 PolarHBondContact O-N 3.29Å; V912-I915 PolarHBondContact O-N 2.85Å; V912-I915 VanDerWaalsContact O-N 3.11Å; V912-V916 PolarHBondContact O-N 3.33Å; V912-V981 HydrophobicContact CG2-CB 4.21Å; V912-V981 HydrophobicContact CG2-CG1 3.81Å; V912-V981 HydrophobicContact CG2-CG2 4.16Å; V912-L984 HydrophobicContact CB-CB 4.38Å; V912-L984 HydrophobicContact CG1-CB 4.34Å; V912-L984 HydrophobicContact CG2-CB 4.01Å; V912-L985 HydrophobicContact CG1-CD2 3.97Å; V912-L985 HydrophobicContact CG1-CG 4.19Å; V912-L985 HydrophobicContact CG2-CD2 4.31Å; V912-L985 HydrophobicContact CG2-CG 3.98Å; V912-I988 HydrophobicContact CB-CD1 4.45Å; V912-I988 HydrophobicContact CG1-CB 3.86Å; V912-I988 HydrophobicContact CG1-CD1 3.97Å; V912-I988 HydrophobicContact CG1-CG1 4.38Å; V912-I988 HydrophobicContact CG1-CG2 4.12Å
913	E	94	Very high	88	Confident	11 Å²	11	46.4 Å²	46.4	5%	0.051	21%	0.209	C	C	.	.	H	α-helix	trans	-58.9	-42.4	178.5	-72.5	-179.6	-166.1	0	0	111.8	R819 Q909 V916 L917 I988 L993	R819-E913 HydrophobicContact CB-CB 4.2Å; R819-E913 WeakPolarHBondContact CD-OE2 3.28Å; R819-E913 HydrophobicContact CG-CB 4.22Å; R819-E913 WeakPolarHBondContact CG-OE2 3.35Å; R819-E913 IonicContact NE-OE2 3.7Å; R819-E913 PolarHBondContact NE-OE2 2.95Å; Q909-E913 HydrophobicContact CG-CG 4.31Å; Q909-E913 VanDerWaalsContact CG-OE1 3.28Å; Q909-E913 WeakPolarHBondContact CG-OE1 3.45Å; Q909-E913 PolarHBondContact NE2-OE1 2.98Å; Q909-E913 WeakPolarHBondContact O-CG 3.37Å; Q909-E913 PolarHBondContact O-N 3.44Å; E913-V916 WeakPolarHBondContact O-CG2 3.43Å; E913-L917 WeakPolarHBondContact O-CB 3.47Å; E913-L917 WeakPolarHBondContact O-CD1 3.42Å; E913-L917 WeakPolarHBondContact O-CG 3.36Å; E913-L917 PolarHBondContact O-N 3.29Å; E913-I988 HydrophobicContact CG-CD1 4.14Å; E913-I988 HydrophobicContact CG-CG2 3.67Å; E913-L993 HydrophobicContact CB-CD1 3.97Å; E913-L993 HydrophobicContact CG-CD1 3.97Å; E913-L993 HydrophobicContact CG-CD2 4.08Å
914	Q	94.8	Very high	90.4	Very high	20 Å²	20	38.2 Å²	38.2	9%	0.093	17%	0.173	C	C	.	.	H	α-helix	trans	-64.9	-43.1	172.9	-74.7	171.9	88.4	0	0	112.7	A816 R819 R910 I911 V912 L917 Y918 L968	A816-Q914 HydrophobicContact CB-CG 4.44Å; A816-Q914 VanDerWaalsContact O-CG 3.31Å; A816-Q914 WeakPolarHBondContact O-CG 3.43Å; R819-Q914 HydrophobicContact CB-CG 4.4Å; R910-Q914 WeakPolarHBondContact O-CG 3.39Å; R910-Q914 PolarHBondContact O-N 3.5Å; R910-Q914 PolarHBondContact O-NE2 2.9Å; I911-Q914 PolarHBondContact O-N 3.08Å; V912-Q914 VanDerWaalsContact C-N 3.31Å; V912-Q914 PolarHBondContact O-N 3.29Å; Q914-L917 PolarHBondContact O-N 2.76Å; Q914-Y918 HydrophobicContact CB-CD2 4.19Å; Q914-Y918 HydrophobicContact CB-CE2 4.23Å; Q914-Y918 WeakPolarHBondContact O-CB 3.16Å; Q914-Y918 WeakPolarHBondContact O-CD2 3.34Å; Q914-Y918 PolarHBondContact O-N 2.88Å; Q914-L968 HydrophobicContact CB-CD1 3.55Å; Q914-L968 HydrophobicContact CB-CD2 4.21Å; Q914-L968 HydrophobicContact CG-CD1 4.45Å
915	I	94.5	Very high	92	Very high	24 Å²	24	32.2 Å²	32.2	12%	0.123	15%	0.147	C	C	.	.	H	α-helix	trans	-60.1	-48.2	-179.5	-76	171.2	0	0	0	110.9	I911 V912 L917 R919 L965 L968	I911-I915 HydrophobicContact CG2-CD1 3.64Å; I911-I915 HydrophobicContact CG2-CG1 4.37Å; I911-I915 WeakPolarHBondContact O-CB 3.29Å; I911-I915 VanDerWaalsContact O-CG1 3.29Å; I911-I915 WeakPolarHBondContact O-CG1 3.44Å; I911-I915 PolarHBondContact O-N 3.11Å; V912-I915 PolarHBondContact O-N 2.85Å; V912-I915 VanDerWaalsContact O-N 3.11Å; I915-L917 VanDerWaalsContact C-N 3.33Å; I915-L917 PolarHBondContact O-N 2.92Å; I915-R919 VanDerWaalsContact O-CB 3.27Å; I915-R919 WeakPolarHBondContact O-CB 3.49Å; I915-R919 PolarHBondContact O-N 3.22Å; I915-L965 HydrophobicContact CB-CD1 4.27Å; I915-L965 HydrophobicContact CG1-CD1 4.17Å; I915-L965 HydrophobicContact CG2-CD1 4.07Å; I915-L968 HydrophobicContact CD1-CB 4.14Å; I915-L968 HydrophobicContact CG1-CB 3.74Å; I915-L968 HydrophobicContact CG1-CD1 4.46Å
916	V	94.7	Very high	93	Very high	24 Å²	24	35.5 Å²	35.5	15%	0.145	16%	0.161	C	C	.	.	H	α-helix	trans	-69.3	-31.7	-178.3	-57.7	0	0	0	0	112.4	V912 E913 R920 L985 I988 A990 L993	V912-V916 PolarHBondContact O-N 3.33Å; E913-V916 WeakPolarHBondContact O-CG2 3.43Å; V916-R920 WeakPolarHBondContact O-CB 3.32Å; V916-R920 PolarHBondContact O-N 2.86Å; V916-L985 HydrophobicContact CG1-CD2 4.21Å; V916-I988 HydrophobicContact CG2-CG2 4.26Å; V916-A990 HydrophobicContact CB-CB 4.27Å; V916-A990 HydrophobicContact CG2-CB 4.26Å; V916-L993 HydrophobicContact CG2-CD1 3.73Å
917	L	95.9	Very high	93.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-72.3	-48.9	174.7	-70.7	171	0	0	0	112.1	L812 L815 A816 R819 E913 Q914 I915 R919 R920 V921 L993 I994	L812-L917 HydrophobicContact CD2-CD2 4.48Å; L815-L917 HydrophobicContact CB-CD1 4.25Å; L815-L917 HydrophobicContact CD2-CD1 3.86Å; L815-L917 HydrophobicContact CD2-CD2 3.82Å; L815-L917 HydrophobicContact CG-CD1 3.67Å; L815-L917 HydrophobicContact CG-CD2 4.49Å; A816-L917 HydrophobicContact CB-CB 3.97Å; A816-L917 HydrophobicContact CB-CD1 4.22Å; R819-L917 HydrophobicContact CG-CD1 4.45Å; E913-L917 WeakPolarHBondContact O-CB 3.47Å; E913-L917 WeakPolarHBondContact O-CD1 3.42Å; E913-L917 WeakPolarHBondContact O-CG 3.36Å; E913-L917 PolarHBondContact O-N 3.29Å; Q914-L917 PolarHBondContact O-N 2.76Å; I915-L917 VanDerWaalsContact C-N 3.33Å; I915-L917 PolarHBondContact O-N 2.92Å; L917-R919 PolarHBondContact O-N 3.14Å; L917-R920 PolarHBondContact O-N 3.21Å; L917-R920 VanDerWaalsContact O-N 3.1Å; L917-V921 WeakPolarHBondContact O-CG2 3.38Å; L917-V921 PolarHBondContact O-N 3.34Å; L917-L993 HydrophobicContact CD1-CD1 4.08Å; L917-L993 HydrophobicContact CD2-CB 4.13Å; L917-L993 HydrophobicContact CD2-CD1 4.31Å; L917-L993 HydrophobicContact CG-CD1 3.95Å; L917-I994 HydrophobicContact CD2-CD1 4.47Å; L917-I994 HydrophobicContact CD2-CG1 3.98Å
918	Y	97.2	Very high	93.7	Very high	3 Å²	3	34.5 Å²	34.5	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-38.6	176.9	-75.9	-57	0	0	0	112.1	A816 E817 Q914 R920 V921 L922 C961 R964 L968	A816-Y918 HydrophobicContact CB-CD1 4.32Å; A816-Y918 HydrophobicContact CB-CD2 4.06Å; A816-Y918 HydrophobicContact CB-CE1 3.98Å; A816-Y918 HydrophobicContact CB-CE2 3.72Å; A816-Y918 HydrophobicContact CB-CG 4.35Å; E817-Y918 WeakPolarHBondContact CG-OH 3.29Å; Q914-Y918 HydrophobicContact CB-CD2 4.19Å; Q914-Y918 HydrophobicContact CB-CE2 4.23Å; Q914-Y918 WeakPolarHBondContact O-CB 3.16Å; Q914-Y918 WeakPolarHBondContact O-CD2 3.34Å; Q914-Y918 PolarHBondContact O-N 2.88Å; Y918-R920 VanDerWaalsContact C-N 3.26Å; Y918-R920 PolarHBondContact O-N 3.48Å; Y918-V921 PolarHBondContact O-N 3.15Å; Y918-L922 WeakPolarHBondContact O-CG 3.43Å; Y918-L922 PolarHBondContact O-N 3.41Å; Y918-C961 HydrophobicContact CD1-CB 3.76Å; Y918-C961 HydrophobicContact CE1-CB 4.28Å; Y918-R964 HydrophobicContact CD2-CB 4.2Å; Y918-R964 HydrophobicContact CE1-CB 4.21Å; Y918-R964 HydrophobicContact CE2-CB 3.77Å; Y918-R964 HydrophobicContact CE2-CG 4.41Å; Y918-L968 HydrophobicContact CD2-CD1 3.6Å; Y918-L968 HydrophobicContact CE2-CD1 3.76Å
919	R	95	Very high	94.1	Very high	143 Å²	143	37.3 Å²	37.3	54%	0.54	16%	0.158	S	C	.	.	H	α-helix	trans	-58.4	-38.9	172.1	-171.2	178.9	-174.8	-179	4.7	111.3	T430 I915 L917 Y923	T430-R919 PolarHBondContact OG1-NH1 3.31Å; T430-R919 PolarHBondContact OG1-NH2 3.01Å; I915-R919 VanDerWaalsContact O-CB 3.27Å; I915-R919 WeakPolarHBondContact O-CB 3.49Å; I915-R919 PolarHBondContact O-N 3.22Å; L917-R919 PolarHBondContact O-N 3.14Å; R919-Y923 PolarHBondContact O-N 3.38Å
920	R	94.4	Very high	94.2	Very high	36 Å²	36	37.5 Å²	37.5	14%	0.136	16%	0.161	C	C	.	.	H	α-helix	trans	-71.6	-35.2	175.9	-174.7	61	68.1	96.9	14.6	113	L812 V916 L917 Y918 Y923 Y924 A990 N991 I994 H1034	L812-R920 HydrophobicContact CD1-CG 4.44Å; V916-R920 WeakPolarHBondContact O-CB 3.32Å; V916-R920 PolarHBondContact O-N 2.86Å; L917-R920 PolarHBondContact O-N 3.21Å; L917-R920 VanDerWaalsContact O-N 3.1Å; Y918-R920 VanDerWaalsContact C-N 3.26Å; Y918-R920 PolarHBondContact O-N 3.48Å; R920-Y923 PolarHBondContact O-N 3.36Å; R920-Y924 HydrophobicContact CG-CD2 3.89Å; R920-Y924 HydrophobicContact CG-CE2 3.53Å; R920-Y924 WeakPolarHBondContact O-CD2 3.4Å; R920-Y924 PolarHBondContact O-N 3.26Å; R920-Y924 VanDerWaalsContact O-N 3.16Å; R920-A990 HydrophobicContact CB-CB 4.28Å; R920-N991 PolarHBondContact NH1-OD1 2.62Å; R920-N991 VanDerWaalsContact NH1-OD1 3.15Å; R920-N991 PolarHBondContact NH2-OD1 2.89Å; R920-I994 HydrophobicContact CG-CD1 4.21Å; R920-H1034 PolarHBondContact NH1-CD2 2.91Å
921	V	96	Very high	94.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-46.7	173.1	173	0	0	0	0	111.4	C809 L812 L917 Y918 Y923 Y924 L925 C961	C809-V921 HydrophobicContact CB-CG1 4.04Å; L812-V921 HydrophobicContact CB-CG2 3.44Å; L812-V921 VanDerWaalsContact CB-CG2 3.44Å; L812-V921 HydrophobicContact CD1-CG2 4.35Å; L917-V921 WeakPolarHBondContact O-CG2 3.38Å; L917-V921 PolarHBondContact O-N 3.34Å; Y918-V921 PolarHBondContact O-N 3.15Å; V921-Y923 PolarHBondContact O-N 3.46Å; V921-Y924 PolarHBondContact O-N 3.29Å; V921-L925 HydrophobicContact CG1-CD1 3.8Å; V921-L925 HydrophobicContact CG1-CG 4.45Å; V921-L925 WeakPolarHBondContact O-CG 3.06Å; V921-L925 PolarHBondContact O-N 3.09Å; V921-L925 VanDerWaalsContact O-N 3.11Å; V921-C961 HydrophobicContact CG1-CB 4.12Å
922	L	96	Very high	94.2	Very high	11 Å²	11	39.1 Å²	39.1	6%	0.058	17%	0.172	C	C	.	.	H	α-helix	trans	-60.7	-45	178.9	-62.9	177.1	0	0	0	111.4	Y918 Y924 L925 E926 Y958 C961 Y962 L965	Y918-L922 WeakPolarHBondContact O-CG 3.43Å; Y918-L922 PolarHBondContact O-N 3.41Å; L922-Y924 PolarHBondContact O-N 3.33Å; L922-L925 PolarHBondContact O-N 2.92Å; L922-L925 VanDerWaalsContact O-N 3.15Å; L922-E926 WeakPolarHBondContact O-CB 3.37Å; L922-E926 WeakPolarHBondContact O-CG 3.19Å; L922-E926 PolarHBondContact O-N 3.32Å; L922-Y958 HydrophobicContact CB-CE2 4.08Å; L922-Y958 HydrophobicContact CD2-CD2 3.53Å; L922-Y958 HydrophobicContact CD2-CE2 3.5Å; L922-Y958 HydrophobicContact CD2-CG 4.18Å; L922-Y958 HydrophobicContact CG-CE2 4.32Å; L922-C961 HydrophobicContact CD2-CB 3.98Å; L922-Y962 HydrophobicContact CD1-CD2 3.99Å; L922-L965 HydrophobicContact CD1-CD2 3.53Å
923	Y	94.6	Very high	94.2	Very high	121 Å²	121	45.3 Å²	45.3	48%	0.475	20%	0.199	S	C	.	.	H	α-helix	trans	-54.9	-46.6	175.2	176.6	-87.1	0	0	0	113.1	R919 R920 V921 L925 E926 Y927 H1034	R919-Y923 PolarHBondContact O-N 3.38Å; R920-Y923 PolarHBondContact O-N 3.36Å; V921-Y923 PolarHBondContact O-N 3.46Å; Y923-L925 VanDerWaalsContact C-N 3.34Å; Y923-L925 PolarHBondContact O-N 2.92Å; Y923-E926 PolarHBondContact O-N 3.39Å; Y923-Y927 WeakPolarHBondContact O-CB 3.35Å; Y923-Y927 PolarHBondContact O-N 2.92Å; Y923-H1034 AromaticContact CD1-NE2 3.82Å; Y923-H1034 AromaticContact CE1-CE1 3.99Å; Y923-H1034 AromaticContact CE1-NE2 3.21Å; Y923-H1034 WeakPolarHBondContact CE1-NE2 3.39Å
924	Y	94.2	Very high	94.1	Very high	11 Å²	11	48.9 Å²	48.9	4%	0.043	21%	0.214	C	C	.	.	H	α-helix	trans	-64.8	-36.5	178.3	-81.3	-64.4	0	0	0	112.7	L808 C809 L812 R920 V921 L922 V928 G1030 H1034	L808-Y924 HydrophobicContact CD2-CD1 4.01Å; L808-Y924 HydrophobicContact CD2-CD2 4.32Å; L808-Y924 HydrophobicContact CD2-CE1 3.57Å; L808-Y924 HydrophobicContact CD2-CE2 3.94Å; L808-Y924 HydrophobicContact CD2-CG 4.37Å; L808-Y924 HydrophobicContact CG-CE2 4.34Å; C809-Y924 WeakPolarHBondContact SG-CB 3.49Å; L812-Y924 HydrophobicContact CD1-CD2 3.67Å; L812-Y924 HydrophobicContact CD1-CE2 3.53Å; R920-Y924 HydrophobicContact CG-CD2 3.89Å; R920-Y924 HydrophobicContact CG-CE2 3.53Å; R920-Y924 WeakPolarHBondContact O-CD2 3.4Å; R920-Y924 PolarHBondContact O-N 3.26Å; R920-Y924 VanDerWaalsContact O-N 3.16Å; V921-Y924 PolarHBondContact O-N 3.29Å; L922-Y924 PolarHBondContact O-N 3.33Å; Y924-V928 PolarHBondContact O-N 2.72Å; Y924-G1030 VanDerWaalsContact OH-C 3.24Å; Y924-G1030 WeakPolarHBondContact OH-CA 3.49Å; Y924-G1030 PolarHBondContact OH-O 3.08Å; Y924-H1034 AromaticContact CE1-CE1 3.29Å; Y924-H1034 WeakPolarHBondContact CE1-CE1 3.5Å; Y924-H1034 AromaticContact CE1-ND1 3.89Å; Y924-H1034 AromaticContact CZ-CE1 3.49Å; Y924-H1034 VanDerWaalsContact CZ-CE1 3.49Å; Y924-H1034 AromaticContact CZ-ND1 3.8Å; Y924-H1034 PolarHBondContact OH-CE1 2.82Å; Y924-H1034 PolarHBondContact OH-ND1 2.93Å
925	L	95	Very high	94	Very high	0 Å²	0	48 Å²	48	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-73.6	-41.5	177.9	-66.9	170.9	0	0	0	111.7	C809 V921 L922 Y923 Y927 V928 F929 C954 L957 Y958	C809-L925 HydrophobicContact CB-CD2 4.11Å; C809-L925 HydrophobicContact CB-CG 4.3Å; V921-L925 HydrophobicContact CG1-CD1 3.8Å; V921-L925 HydrophobicContact CG1-CG 4.45Å; V921-L925 WeakPolarHBondContact O-CG 3.06Å; V921-L925 PolarHBondContact O-N 3.09Å; V921-L925 VanDerWaalsContact O-N 3.11Å; L922-L925 PolarHBondContact O-N 2.92Å; L922-L925 VanDerWaalsContact O-N 3.15Å; Y923-L925 VanDerWaalsContact C-N 3.34Å; Y923-L925 PolarHBondContact O-N 2.92Å; L925-Y927 VanDerWaalsContact C-N 3.33Å; L925-Y927 PolarHBondContact O-N 2.95Å; L925-V928 WeakPolarHBondContact O-CG1 3.32Å; L925-V928 PolarHBondContact O-N 3.35Å; L925-V928 VanDerWaalsContact O-N 3.1Å; L925-F929 HydrophobicContact CB-CE2 4.11Å; L925-F929 WeakPolarHBondContact O-CD2 3.44Å; L925-F929 VanDerWaalsContact O-CG 3.31Å; L925-F929 WeakPolarHBondContact O-CG 3.42Å; L925-F929 PolarHBondContact O-N 3.09Å; L925-C954 HydrophobicContact CD2-CB 4.07Å; L925-L957 HydrophobicContact CD1-CB 4.3Å; L925-L957 HydrophobicContact CD1-CD2 4.42Å; L925-L957 HydrophobicContact CD1-CG 4.15Å; L925-Y958 HydrophobicContact CB-CD2 3.9Å; L925-Y958 HydrophobicContact CD1-CD2 4.15Å
926	E	94.2	Very high	93.7	Very high	90 Å²	90	52.7 Å²	52.7	42%	0.421	23%	0.23	S	C	.	.	H	α-helix	trans	-58.6	-44.6	172.7	-76.2	157.7	-167.1	0	0	111.3	L922 Y923 V928 F929 D930 Y958	L922-E926 WeakPolarHBondContact O-CB 3.37Å; L922-E926 WeakPolarHBondContact O-CG 3.19Å; L922-E926 PolarHBondContact O-N 3.32Å; Y923-E926 PolarHBondContact O-N 3.39Å; E926-V928 PolarHBondContact O-N 3.16Å; E926-F929 PolarHBondContact O-N 3.26Å; E926-D930 PolarHBondContact O-N 3.4Å; E926-D930 VanDerWaalsContact O-N 3.12Å; E926-Y958 HydrophobicContact CG-CE2 3.77Å; E926-Y958 VanDerWaalsContact OE1-CE2 3.23Å; E926-Y958 WeakPolarHBondContact OE1-CE2 3.43Å; E926-Y958 PolarHBondContact OE1-OH 3.13Å
927	Y	92.3	Very high	93.6	Very high	111 Å²	111	58 Å²	58	44%	0.435	25%	0.253	S	S	.	.	H	α-helix	trans	-58.8	-43.9	171.3	177.3	-97.1	0	0	0	112.4	Y923 L925 F929 D930 Q931	Y923-Y927 WeakPolarHBondContact O-CB 3.35Å; Y923-Y927 PolarHBondContact O-N 2.92Å; L925-Y927 VanDerWaalsContact C-N 3.33Å; L925-Y927 PolarHBondContact O-N 2.95Å; Y927-F929 PolarHBondContact O-N 2.95Å; Y927-D930 PolarHBondContact O-N 2.73Å; Y927-Q931 HydrophobicContact CD1-CG 4.21Å; Y927-Q931 HydrophobicContact CD2-CG 4.26Å; Y927-Q931 HydrophobicContact CE1-CG 3.83Å; Y927-Q931 HydrophobicContact CE2-CG 3.89Å; Y927-Q931 HydrophobicContact CG-CG 4.41Å; Y927-Q931 WeakPolarHBondContact O-CB 3.42Å; Y927-Q931 WeakPolarHBondContact O-CG 3.41Å; Y927-Q931 PolarHBondContact O-N 3.2Å; Y927-Q931 PolarHBondContact OH-NE2 2.86Å
928	V	92.5	Very high	93.3	Very high	5 Å²	5	63.4 Å²	63.4	3%	0.03	28%	0.282	C	S	.	.	H	α-helix	trans	-65.9	-37.9	178.9	106.2	0	0	0	0	112.1	I802 V805 Y924 L925 E926 Q931 V932	I802-V928 HydrophobicContact CG1-CG2 4.44Å; V805-V928 HydrophobicContact CB-CB 4.49Å; V805-V928 HydrophobicContact CB-CG2 3.82Å; V805-V928 HydrophobicContact CG1-CB 3.95Å; V805-V928 HydrophobicContact CG1-CG2 3.84Å; V805-V928 HydrophobicContact CG2-CG2 4.14Å; Y924-V928 PolarHBondContact O-N 2.72Å; L925-V928 WeakPolarHBondContact O-CG1 3.32Å; L925-V928 PolarHBondContact O-N 3.35Å; L925-V928 VanDerWaalsContact O-N 3.1Å; E926-V928 PolarHBondContact O-N 3.16Å; V928-Q931 PolarHBondContact O-N 3.18Å; V928-V932 VanDerWaalsContact O-CB 3.27Å; V928-V932 WeakPolarHBondContact O-CB 3.45Å; V928-V932 WeakPolarHBondContact O-CG2 3.49Å; V928-V932 PolarHBondContact O-N 3.43Å
929	F	94.9	Very high	92.8	Very high	62 Å²	62	65.3 Å²	65.3	27%	0.272	30%	0.302	S	S	.	.	H	α-helix	trans	-67.2	-40.5	178.6	-62.8	-46.6	0	0	0	112.5	L925 E926 Y927 K933 C954 N955 Y958	L925-F929 HydrophobicContact CB-CE2 4.11Å; L925-F929 WeakPolarHBondContact O-CD2 3.44Å; L925-F929 VanDerWaalsContact O-CG 3.31Å; L925-F929 WeakPolarHBondContact O-CG 3.42Å; L925-F929 PolarHBondContact O-N 3.09Å; E926-F929 PolarHBondContact O-N 3.26Å; Y927-F929 PolarHBondContact O-N 2.95Å; F929-K933 WeakPolarHBondContact O-CB 3.41Å; F929-K933 PolarHBondContact O-N 3.22Å; F929-C954 HydrophobicContact CE1-CB 3.88Å; F929-C954 HydrophobicContact CZ-CB 4.07Å; F929-N955 HydrophobicContact CZ-CB 4.3Å; F929-Y958 HydrophobicContact CE2-CD2 4.17Å; F929-Y958 HydrophobicContact CE2-CG 4.18Å
930	D	92.6	Very high	92.5	Very high	66 Å²	66	61.7 Å²	61.7	35%	0.353	29%	0.289	S	S	.	.	H	α-helix	trans	-65.6	-44.2	174.2	173.7	55.7	0	0	0	112.1	E926 Y927 V932 K933 K934	E926-D930 PolarHBondContact O-N 3.4Å; E926-D930 VanDerWaalsContact O-N 3.12Å; Y927-D930 PolarHBondContact O-N 2.73Å; D930-V932 PolarHBondContact O-N 2.97Å; D930-K933 WeakPolarHBondContact O-CB 3.32Å; D930-K933 PolarHBondContact O-N 3.47Å; D930-K934 WeakPolarHBondContact O-CG 3.48Å; D930-K934 PolarHBondContact O-N 2.78Å; D930-K934 WeakPolarHBondContact OD1-CE 3.29Å; D930-K934 IonicContact OD1-NZ 3.48Å; D930-K934 PolarHBondContact OD1-NZ 2.99Å; D930-K934 WeakPolarHBondContact OD2-CE 3.28Å; D930-K934 IonicContact OD2-NZ 2.76Å; D930-K934 PolarHBondContact OD2-NZ 3.47Å
931	Q	90.5	Very high	92.2	Very high	65 Å²	65	60.3 Å²	60.3	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-66.3	-38.1	177.7	-66.6	-73.8	73	0	0	112.3	Y927 V928 K934 A935	Y927-Q931 HydrophobicContact CD1-CG 4.21Å; Y927-Q931 HydrophobicContact CD2-CG 4.26Å; Y927-Q931 HydrophobicContact CE1-CG 3.83Å; Y927-Q931 HydrophobicContact CE2-CG 3.89Å; Y927-Q931 HydrophobicContact CG-CG 4.41Å; Y927-Q931 WeakPolarHBondContact O-CB 3.42Å; Y927-Q931 WeakPolarHBondContact O-CG 3.41Å; Y927-Q931 PolarHBondContact O-N 3.2Å; Y927-Q931 PolarHBondContact OH-NE2 2.86Å; V928-Q931 PolarHBondContact O-N 3.18Å; Q931-K934 PolarHBondContact O-N 3Å; Q931-A935 VanDerWaalsContact O-CB 3.29Å; Q931-A935 WeakPolarHBondContact O-CB 3.04Å; Q931-A935 PolarHBondContact O-N 2.71Å
932	V	92.6	Very high	91.7	Very high	19 Å²	19	64 Å²	64	12%	0.115	30%	0.3	C	S	.	.	H	α-helix	trans	-61.1	-45.3	171.8	163.7	0	0	0	0	111.4	I802 V928 D930 K934 A935 F936 L941 L951	I802-V932 HydrophobicContact CD1-CG2 3.68Å; I802-V932 HydrophobicContact CG1-CG2 3.71Å; V928-V932 VanDerWaalsContact O-CB 3.27Å; V928-V932 WeakPolarHBondContact O-CB 3.45Å; V928-V932 WeakPolarHBondContact O-CG2 3.49Å; V928-V932 PolarHBondContact O-N 3.43Å; D930-V932 PolarHBondContact O-N 2.97Å; V932-K934 VanDerWaalsContact C-N 3.34Å; V932-K934 PolarHBondContact O-N 3.24Å; V932-A935 PolarHBondContact O-N 2.93Å; V932-F936 WeakPolarHBondContact O-CB 3.22Å; V932-F936 PolarHBondContact O-N 2.9Å; V932-L941 HydrophobicContact CG1-CD2 3.92Å; V932-L941 HydrophobicContact CG2-CD2 4.48Å; V932-L951 HydrophobicContact CB-CD2 4.25Å; V932-L951 HydrophobicContact CG1-CD1 3.91Å; V932-L951 HydrophobicContact CG1-CD2 3.78Å; V932-L951 HydrophobicContact CG2-CD2 3.73Å
933	K	92.4	Very high	91.3	Very high	130 Å²	130	67 Å²	67	57%	0.565	32%	0.322	S	S	*	.	H	α-helix	trans	-58.6	-46.5	177.4	-177.7	-178.4	178.2	-176	0	110.9	F929 D930 F936 Q937	F929-K933 WeakPolarHBondContact O-CB 3.41Å; F929-K933 PolarHBondContact O-N 3.22Å; D930-K933 WeakPolarHBondContact O-CB 3.32Å; D930-K933 PolarHBondContact O-N 3.47Å; K933-F936 PolarHBondContact O-N 3.49Å; K933-Q937 WeakPolarHBondContact O-CB 3.17Å; K933-Q937 VanDerWaalsContact O-CG 3.26Å; K933-Q937 WeakPolarHBondContact O-CG 3.33Å; K933-Q937 PolarHBondContact O-N 3.48Å
934	K	92.3	Very high	91	Very high	86 Å²	86	62 Å²	62	37%	0.374	30%	0.304	S	S	.	.	H	α-helix	trans	-64.3	-41.6	175	-70.4	163.3	175.8	170.3	0	112.7	D930 Q931 V932 Q937 N938	D930-K934 WeakPolarHBondContact O-CG 3.48Å; D930-K934 PolarHBondContact O-N 2.78Å; D930-K934 WeakPolarHBondContact OD1-CE 3.29Å; D930-K934 IonicContact OD1-NZ 3.48Å; D930-K934 PolarHBondContact OD1-NZ 2.99Å; D930-K934 WeakPolarHBondContact OD2-CE 3.28Å; D930-K934 IonicContact OD2-NZ 2.76Å; D930-K934 PolarHBondContact OD2-NZ 3.47Å; Q931-K934 PolarHBondContact O-N 3Å; V932-K934 VanDerWaalsContact C-N 3.34Å; V932-K934 PolarHBondContact O-N 3.24Å; K934-Q937 PolarHBondContact O-N 2.94Å; K934-N938 WeakPolarHBondContact O-CB 3.5Å; K934-N938 VanDerWaalsContact O-CG 3.24Å; K934-N938 PolarHBondContact O-N 3.46Å; K934-N938 PolarHBondContact O-OD1 3.17Å
935	A	91.3	Very high	90.6	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.008	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-40.4	178.4	0	0	0	0	0	112.4	E798 Q931 V932 G939 R940 L941	E798-A935 HydrophobicContact CG-CB 4.04Å; E798-A935 VanDerWaalsContact OE2-CB 3.3Å; E798-A935 WeakPolarHBondContact OE2-CB 3.25Å; Q931-A935 VanDerWaalsContact O-CB 3.29Å; Q931-A935 WeakPolarHBondContact O-CB 3.04Å; Q931-A935 PolarHBondContact O-N 2.71Å; V932-A935 PolarHBondContact O-N 2.93Å; A935-G939 PolarHBondContact O-N 3.19Å; A935-R940 PolarHBondContact O-N 3.27Å; A935-L941 HydrophobicContact CB-CB 3.68Å; A935-L941 HydrophobicContact CB-CD2 4.49Å; A935-L941 PolarHBondContact O-N 3.48Å
936	F	90.1	Very high	90.2	Very high	123 Å²	123	66.4 Å²	66.4	54%	0.539	33%	0.334	S	S	.	.	H	α-helix	trans	-69.7	-44.8	176	-170.9	-95.1	0	0	0	111.9	V932 K933 N938 G939 L941	V932-F936 WeakPolarHBondContact O-CB 3.22Å; V932-F936 PolarHBondContact O-N 2.9Å; K933-F936 PolarHBondContact O-N 3.49Å; F936-N938 VanDerWaalsContact C-N 3.29Å; F936-N938 PolarHBondContact O-N 2.98Å; F936-G939 PolarHBondContact O-N 3.12Å; F936-G939 VanDerWaalsContact O-N 3.08Å; F936-L941 VanDerWaalsContact CD2-O 3.25Å; F936-L941 WeakPolarHBondContact CD2-O 3.4Å
937	Q	91.2	Very high	89.9	Confident	134 Å²	134	62.3 Å²	62.3	63%	0.626	32%	0.315	S	S	*	.	H	α-helix	trans	-60.4	-36.7	175.9	-76.5	176.6	-34	0	0	112.8	K933 K934 G939	K933-Q937 WeakPolarHBondContact O-CB 3.17Å; K933-Q937 VanDerWaalsContact O-CG 3.26Å; K933-Q937 WeakPolarHBondContact O-CG 3.33Å; K933-Q937 PolarHBondContact O-N 3.48Å; K934-Q937 PolarHBondContact O-N 2.94Å; Q937-G939 VanDerWaalsContact C-N 3.26Å; Q937-G939 PolarHBondContact O-N 2.57Å
938	N	90.7	Very high	89.8	Confident	115 Å²	115	62.4 Å²	62.4	62%	0.615	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	7.7	178	-64.6	8.4	0	0	0	113.1	K934 F936 R940	K934-N938 WeakPolarHBondContact O-CB 3.5Å; K934-N938 VanDerWaalsContact O-CG 3.24Å; K934-N938 PolarHBondContact O-N 3.46Å; K934-N938 PolarHBondContact O-OD1 3.17Å; F936-N938 VanDerWaalsContact C-N 3.29Å; F936-N938 PolarHBondContact O-N 2.98Å; N938-R940 HydrophobicContact CB-CG 4.03Å; N938-R940 PolarHBondContact O-N 3.32Å; N938-R940 VanDerWaalsContact O-N 3.1Å
939	G	86.5	Confident	89.7	Confident	43 Å²	43	69 Å²	69	44%	0.443	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	-8.6	179.9	0	0	0	0	0	116.1	A935 F936 Q937 L941	A935-G939 PolarHBondContact O-N 3.19Å; F936-G939 PolarHBondContact O-N 3.12Å; F936-G939 VanDerWaalsContact O-N 3.08Å; Q937-G939 VanDerWaalsContact C-N 3.26Å; Q937-G939 PolarHBondContact O-N 2.57Å; G939-L941 VanDerWaalsContact C-N 3.31Å; G939-L941 PolarHBondContact O-N 2.89Å
940	R	88.3	Confident	89.5	Confident	67 Å²	67	69.3 Å²	69.3	25%	0.253	34%	0.339	S	S	.	.	S	Bend	trans	-68.9	-26.1	-175.3	-49.1	-173.2	-55.5	98.8	8.6	113.1	E794 H795 E798 A935 N938	E794-R940 HydrophobicContact CB-CB 4.47Å; E794-R940 WeakPolarHBondContact OE2-CD 3.43Å; E794-R940 WeakPolarHBondContact OE2-CG 3.5Å; H795-R940 WeakPolarHBondContact CA-O 3.43Å; H795-R940 PolarHBondContact N-O 3.08Å; E798-R940 IonicContact OE1-CZ 3.4Å; E798-R940 IonicContact OE1-NH1 2.67Å; E798-R940 PolarHBondContact OE1-NH1 3.31Å; E798-R940 IonicContact OE1-NH2 2.73Å; E798-R940 PolarHBondContact OE1-NH2 3.08Å; E798-R940 IonicContact OE2-CZ 2.76Å; E798-R940 IonicContact OE2-NH1 3.12Å; E798-R940 PolarHBondContact OE2-NH1 2.94Å; E798-R940 IonicContact OE2-NH2 2.68Å; E798-R940 PolarHBondContact OE2-NH2 3.45Å; A935-R940 PolarHBondContact O-N 3.27Å; N938-R940 HydrophobicContact CB-CG 4.03Å; N938-R940 PolarHBondContact O-N 3.32Å; N938-R940 VanDerWaalsContact O-N 3.1Å
941	L	88.4	Confident	89.5	Confident	7 Å²	7	68.4 Å²	68.4	4%	0.037	33%	0.333	C	S	.	.	S	Bend	trans	-116.3	119.8	174.3	-175.8	79.1	0	0	0	110.3	E798 I799 I802 V932 A935 F936 G939 A947	E798-L941 HydrophobicContact CB-CB 4.38Å; E798-L941 HydrophobicContact CB-CD1 3.77Å; I799-L941 HydrophobicContact CG1-CD1 4.13Å; I802-L941 HydrophobicContact CD1-CD1 4.14Å; I802-L941 HydrophobicContact CD1-CD2 4.11Å; V932-L941 HydrophobicContact CG1-CD2 3.92Å; V932-L941 HydrophobicContact CG2-CD2 4.48Å; A935-L941 HydrophobicContact CB-CB 3.68Å; A935-L941 HydrophobicContact CB-CD2 4.49Å; A935-L941 PolarHBondContact O-N 3.48Å; F936-L941 VanDerWaalsContact CD2-O 3.25Å; F936-L941 WeakPolarHBondContact CD2-O 3.4Å; G939-L941 VanDerWaalsContact C-N 3.31Å; G939-L941 PolarHBondContact O-N 2.89Å; L941-A947 HydrophobicContact CD1-CB 4.44Å
942	K	85.7	Confident	89.7	Confident	77 Å²	77	70 Å²	70	34%	0.335	34%	0.343	S	S	.	.			trans	-97.2	155.6	177.6	-57.4	-178	-171.2	180	0	110.6	M791 E792 H795 T944	M791-K942 HydrophobicContact CE-CB 3.94Å; M791-K942 HydrophobicContact CE-CD 3.87Å; M791-K942 HydrophobicContact CE-CG 4.32Å; E792-K942 IonicContact OE1-NZ 3.63Å; E792-K942 PolarHBondContact OE1-NZ 2.76Å; E792-K942 WeakPolarHBondContact OE2-CE 3.5Å; E792-K942 IonicContact OE2-NZ 2.66Å; E792-K942 PolarHBondContact OE2-NZ 2.64Å; H795-K942 PolarHBondContact CE1-O 3.37Å; H795-K942 VanDerWaalsContact CE1-O 3.28Å; H795-K942 PolarHBondContact ND1-N 2.85Å; K942-T944 PolarHBondContact O-N 2.99Å
943	S	87.2	Confident	89.7	Confident	74 Å²	74	70.6 Å²	70.6	52%	0.517	35%	0.346	S	S	.	.			trans	-80.5	82	-179.2	-168.9	0	0	0	0	111.1	R948	S943-R948 PolarHBondContact O-NH1 3.22Å; S943-R948 PolarHBondContact OG-NH1 3.11Å
944	T	88	Confident	89.8	Confident	15 Å²	15	64.4 Å²	64.4	9%	0.092	32%	0.319	C	S	.	.			trans	-93.1	164.9	173.8	68.1	0	0	0	0	112.1	E788 M791 H795 K942 T946 A947 R948	E788-T944 WeakPolarHBondContact OE1-CB 3.24Å; E788-T944 VanDerWaalsContact OE1-CG2 3.29Å; E788-T944 WeakPolarHBondContact OE1-CG2 3.27Å; E788-T944 PolarHBondContact OE1-OG1 3.23Å; M791-T944 HydrophobicContact CE-CG2 3.62Å; H795-T944 VanDerWaalsContact NE2-CG2 3.3Å; H795-T944 WeakPolarHBondContact NE2-CG2 3.25Å; K942-T944 PolarHBondContact O-N 2.99Å; T944-T946 VanDerWaalsContact C-N 3.3Å; T944-T946 PolarHBondContact O-N 2.92Å; T944-A947 PolarHBondContact O-N 3.23Å; T944-A947 WeakPolarHBondContact OG1-CB 3.39Å; T944-A947 PolarHBondContact OG1-N 2.7Å; T944-A947 VanDerWaalsContact OG1-N 3.17Å; T944-R948 WeakPolarHBondContact O-CG 3.31Å; T944-R948 PolarHBondContact O-N 2.89Å; T944-R948 PolarHBondContact O-NH1 3.45Å
945	P	86.6	Confident	89.8	Confident	91 Å²	91	63.7 Å²	63.7	59%	0.591	32%	0.319	S	S	*	.	H	α-helix	trans	-56.3	-44.4	173.3	-23.6	35	0	0	0	112.1	R948 R949	P945-R948 PolarHBondContact O-N 2.72Å; P945-R949 WeakPolarHBondContact O-CB 3.47Å; P945-R949 PolarHBondContact O-N 3.19Å
946	T	85.5	Confident	90	Very high	13 Å²	13	67.8 Å²	67.8	8%	0.08	34%	0.344	C	S	.	.	H	α-helix	trans	-62.4	-47.9	180	-41.7	0	0	0	0	111.9	E788 I799 T944 R948 R949 R950	E788-T946 PolarHBondContact OE1-OG1 2.89Å; E788-T946 WeakPolarHBondContact OE2-CB 3.42Å; E788-T946 PolarHBondContact OE2-OG1 2.85Å; I799-T946 HydrophobicContact CD1-CG2 4.46Å; I799-T946 HydrophobicContact CG2-CG2 4.46Å; T944-T946 VanDerWaalsContact C-N 3.3Å; T944-T946 PolarHBondContact O-N 2.92Å; T946-R948 PolarHBondContact O-N 3.03Å; T946-R949 WeakPolarHBondContact O-CB 3.49Å; T946-R949 PolarHBondContact O-N 3.36Å; T946-R950 PolarHBondContact O-N 3.05Å
947	A	88.6	Confident	90.3	Very high	4 Å²	4	62.2 Å²	62.2	3%	0.033	32%	0.32	C	S	.	.	H	α-helix	trans	-60.7	-45.3	175.4	0	0	0	0	0	111.7	I799 L941 T944 R949 L951	I799-A947 HydrophobicContact CD1-CB 4.22Å; I799-A947 HydrophobicContact CG1-CB 4.41Å; L941-A947 HydrophobicContact CD1-CB 4.44Å; T944-A947 PolarHBondContact O-N 3.23Å; T944-A947 WeakPolarHBondContact OG1-CB 3.39Å; T944-A947 PolarHBondContact OG1-N 2.7Å; T944-A947 VanDerWaalsContact OG1-N 3.17Å; A947-R949 PolarHBondContact O-N 3.4Å; A947-L951 VanDerWaalsContact O-CG 3.25Å; A947-L951 WeakPolarHBondContact O-CG 3.46Å; A947-L951 PolarHBondContact O-N 3.18Å; A947-L951 VanDerWaalsContact O-N 3.13Å
948	R	89.3	Confident	90.6	Very high	114 Å²	114	58.1 Å²	58.1	43%	0.43	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-41.6	175.4	-74	-171.2	-64.2	-85.2	0.4	112.3	S943 T944 P945 T946 L951 I952	S943-R948 PolarHBondContact O-NH1 3.22Å; S943-R948 PolarHBondContact OG-NH1 3.11Å; T944-R948 WeakPolarHBondContact O-CG 3.31Å; T944-R948 PolarHBondContact O-N 2.89Å; T944-R948 PolarHBondContact O-NH1 3.45Å; P945-R948 PolarHBondContact O-N 2.72Å; T946-R948 PolarHBondContact O-N 3.03Å; R948-L951 PolarHBondContact O-N 3.18Å; R948-I952 VanDerWaalsContact O-CG1 3.31Å; R948-I952 WeakPolarHBondContact O-CG1 3.26Å; R948-I952 PolarHBondContact O-N 3.2Å
949	R	91.8	Very high	90.8	Very high	143 Å²	143	57.2 Å²	57.2	54%	0.54	29%	0.291	S	S	.	.	H	α-helix	trans	-57.9	-54.8	178.3	-173.5	73.1	-142.9	-160	0.2	110.8	P945 T946 A947 L951 I952 D953	P945-R949 WeakPolarHBondContact O-CB 3.47Å; P945-R949 PolarHBondContact O-N 3.19Å; T946-R949 WeakPolarHBondContact O-CB 3.49Å; T946-R949 PolarHBondContact O-N 3.36Å; A947-R949 PolarHBondContact O-N 3.4Å; R949-L951 VanDerWaalsContact C-N 3.28Å; R949-L951 PolarHBondContact O-N 3.07Å; R949-I952 WeakPolarHBondContact O-CB 3.43Å; R949-I952 PolarHBondContact O-N 3.4Å; R949-I952 VanDerWaalsContact O-N 3.1Å; R949-D953 IonicContact CZ-OD1 3.67Å; R949-D953 IonicContact NE-OD1 2.89Å; R949-D953 PolarHBondContact NE-OD1 3.37Å; R949-D953 IonicContact NH2-OD1 3.23Å; R949-D953 PolarHBondContact O-N 3.07Å
950	R	90.9	Very high	91.2	Very high	69 Å²	69	60.2 Å²	60.2	26%	0.26	29%	0.289	S	S	.	.	H	α-helix	trans	-61	-34.8	-180	-68	-70.2	174.9	-112.7	-4.5	112.9	I802 T946 D953 C954	I802-R950 HydrophobicContact CG2-CB 3.84Å; T946-R950 PolarHBondContact O-N 3.05Å; R950-D953 IonicContact NH1-OD2 2.65Å; R950-D953 PolarHBondContact NH1-OD2 3.43Å; R950-D953 VanDerWaalsContact NH1-OD2 3.15Å; R950-D953 PolarHBondContact O-N 3.24Å; R950-C954 WeakPolarHBondContact O-CB 3.48Å; R950-C954 PolarHBondContact O-N 3.46Å; R950-C954 PolarHBondContact O-SG 2.95Å
951	L	92.2	Very high	91.5	Very high	46 Å²	46	57 Å²	57	24%	0.241	28%	0.277	C	S	.	.	H	α-helix	trans	-70	-35.9	175.5	-68	171.3	0	0	0	113.1	V932 A947 R948 R949 N955	V932-L951 HydrophobicContact CB-CD2 4.25Å; V932-L951 HydrophobicContact CG1-CD1 3.91Å; V932-L951 HydrophobicContact CG1-CD2 3.78Å; V932-L951 HydrophobicContact CG2-CD2 3.73Å; A947-L951 VanDerWaalsContact O-CG 3.25Å; A947-L951 WeakPolarHBondContact O-CG 3.46Å; A947-L951 PolarHBondContact O-N 3.18Å; A947-L951 VanDerWaalsContact O-N 3.13Å; R948-L951 PolarHBondContact O-N 3.18Å; R949-L951 VanDerWaalsContact C-N 3.28Å; R949-L951 PolarHBondContact O-N 3.07Å; L951-N955 WeakPolarHBondContact O-CB 3.46Å; L951-N955 PolarHBondContact O-N 3.36Å
952	I	93.3	Very high	91.9	Very high	100 Å²	100	60.5 Å²	60.5	51%	0.513	29%	0.29	S	S	.	.	H	α-helix	trans	-65.9	-42.6	172.1	-68.6	162.8	0	0	0	110.4	R948 R949 N955 T956	R948-I952 VanDerWaalsContact O-CG1 3.31Å; R948-I952 WeakPolarHBondContact O-CG1 3.26Å; R948-I952 PolarHBondContact O-N 3.2Å; R949-I952 WeakPolarHBondContact O-CB 3.43Å; R949-I952 PolarHBondContact O-N 3.4Å; R949-I952 VanDerWaalsContact O-N 3.1Å; I952-N955 PolarHBondContact O-N 3.33Å; I952-T956 WeakPolarHBondContact O-CB 3.41Å; I952-T956 PolarHBondContact O-N 3.21Å; I952-T956 PolarHBondContact O-OG1 3.45Å
953	D	93.6	Very high	92.2	Very high	31 Å²	31	61.4 Å²	61.4	17%	0.166	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-49.4	176.3	-55.4	-30.1	0	0	0	110.1	L806 R949 R950 N955 T956 L957	L806-D953 HydrophobicContact CD1-CB 4.33Å; L806-D953 HydrophobicContact CD2-CB 3.72Å; R949-D953 IonicContact CZ-OD1 3.67Å; R949-D953 IonicContact NE-OD1 2.89Å; R949-D953 PolarHBondContact NE-OD1 3.37Å; R949-D953 IonicContact NH2-OD1 3.23Å; R949-D953 PolarHBondContact O-N 3.07Å; R950-D953 IonicContact NH1-OD2 2.65Å; R950-D953 PolarHBondContact NH1-OD2 3.43Å; R950-D953 VanDerWaalsContact NH1-OD2 3.15Å; R950-D953 PolarHBondContact O-N 3.24Å; D953-N955 PolarHBondContact O-N 2.77Å; D953-T956 PolarHBondContact O-N 2.84Å; D953-L957 PolarHBondContact O-N 2.95Å
954	C	94	Very high	92.5	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-56.3	-46.6	174	-75.1	0	0	0	0	113.4	L925 F929 R950 L957 Y958	L925-C954 HydrophobicContact CD2-CB 4.07Å; F929-C954 HydrophobicContact CE1-CB 3.88Å; F929-C954 HydrophobicContact CZ-CB 4.07Å; R950-C954 WeakPolarHBondContact O-CB 3.48Å; R950-C954 PolarHBondContact O-N 3.46Å; R950-C954 PolarHBondContact O-SG 2.95Å; C954-L957 PolarHBondContact O-N 3.05Å; C954-Y958 PolarHBondContact O-N 3.03Å
955	N	93.4	Very high	92.8	Very high	70 Å²	70	64.3 Å²	64.3	37%	0.374	30%	0.298	S	S	.	.	H	α-helix	trans	-68.5	-35.1	-179.8	-172	64.8	0	0	0	112.4	F929 L951 I952 D953 L957 Y958 H959	F929-N955 HydrophobicContact CZ-CB 4.3Å; L951-N955 WeakPolarHBondContact O-CB 3.46Å; L951-N955 PolarHBondContact O-N 3.36Å; I952-N955 PolarHBondContact O-N 3.33Å; D953-N955 PolarHBondContact O-N 2.77Å; N955-L957 VanDerWaalsContact C-N 3.34Å; N955-Y958 PolarHBondContact O-N 2.96Å; N955-H959 PolarHBondContact ND2-CD2 3.37Å; N955-H959 PolarHBondContact ND2-NE2 2.94Å; N955-H959 VanDerWaalsContact ND2-NE2 3.15Å; N955-H959 PolarHBondContact O-CD2 2.93Å; N955-H959 VanDerWaalsContact O-CD2 3.26Å; N955-H959 PolarHBondContact O-N 3.14Å; N955-H959 VanDerWaalsContact O-N 3.1Å
956	T	95.9	Very high	93.1	Very high	88 Å²	88	66.6 Å²	66.6	54%	0.54	29%	0.294	S	S	.	.	H	α-helix	trans	-63.4	-42.9	173.7	-56.9	0	0	0	0	110.8	I952 D953 R960	I952-T956 WeakPolarHBondContact O-CB 3.41Å; I952-T956 PolarHBondContact O-N 3.21Å; I952-T956 PolarHBondContact O-OG1 3.45Å; D953-T956 PolarHBondContact O-N 2.84Å; T956-R960 PolarHBondContact O-N 3.38Å; T956-R960 VanDerWaalsContact O-N 3.1Å
957	L	95.6	Very high	93.5	Very high	6 Å²	6	69.7 Å²	69.7	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-65.9	-40.9	175.8	-172.3	59.3	0	0	0	112.4	L806 C809 E810 A813 L925 D953 C954 N955 R960 C961	L806-L957 HydrophobicContact CD1-CD2 4.05Å; C809-L957 HydrophobicContact CB-CD2 3.49Å; C809-L957 VanDerWaalsContact CB-CD2 3.49Å; E810-L957 HydrophobicContact CG-CD2 3.83Å; A813-L957 HydrophobicContact CB-CD1 4.18Å; L925-L957 HydrophobicContact CD1-CB 4.3Å; L925-L957 HydrophobicContact CD1-CD2 4.42Å; L925-L957 HydrophobicContact CD1-CG 4.15Å; D953-L957 PolarHBondContact O-N 2.95Å; C954-L957 PolarHBondContact O-N 3.05Å; N955-L957 VanDerWaalsContact C-N 3.34Å; L957-R960 VanDerWaalsContact CD1-NH2 3.28Å; L957-R960 PolarHBondContact O-N 3.39Å; L957-C961 WeakPolarHBondContact O-CB 3.43Å; L957-C961 PolarHBondContact O-N 3.43Å; L957-C961 PolarHBondContact O-SG 3.26Å
958	Y	97.2	Very high	93.6	Very high	47 Å²	47	69.9 Å²	69.9	18%	0.184	31%	0.308	C	S	.	.	H	α-helix	trans	-56.6	-54.2	176.4	-174.2	-98.9	0	0	0	111.3	L922 L925 E926 F929 C954 N955 R960 C961 Y962	L922-Y958 HydrophobicContact CB-CE2 4.08Å; L922-Y958 HydrophobicContact CD2-CD2 3.53Å; L922-Y958 HydrophobicContact CD2-CE2 3.5Å; L922-Y958 HydrophobicContact CD2-CG 4.18Å; L922-Y958 HydrophobicContact CG-CE2 4.32Å; L925-Y958 HydrophobicContact CB-CD2 3.9Å; L925-Y958 HydrophobicContact CD1-CD2 4.15Å; E926-Y958 HydrophobicContact CG-CE2 3.77Å; E926-Y958 VanDerWaalsContact OE1-CE2 3.23Å; E926-Y958 WeakPolarHBondContact OE1-CE2 3.43Å; E926-Y958 PolarHBondContact OE1-OH 3.13Å; F929-Y958 HydrophobicContact CE2-CD2 4.17Å; F929-Y958 HydrophobicContact CE2-CG 4.18Å; C954-Y958 PolarHBondContact O-N 3.03Å; N955-Y958 PolarHBondContact O-N 2.96Å; Y958-R960 PolarHBondContact O-N 3.1Å; Y958-C961 PolarHBondContact O-N 2.96Å; Y958-Y962 VanDerWaalsContact O-CB 3.3Å; Y958-Y962 WeakPolarHBondContact O-CB 3.35Å; Y958-Y962 PolarHBondContact O-N 3.33Å
959	H	94.8	Very high	93.6	Very high	96 Å²	96	66.4 Å²	66.4	44%	0.444	30%	0.304	S	S	.	.	H	α-helix	trans	-62	-39.9	178.3	-67.9	-48.7	0	0	0	112.7	N955 Y962 I963	N955-H959 PolarHBondContact ND2-CD2 3.37Å; N955-H959 PolarHBondContact ND2-NE2 2.94Å; N955-H959 VanDerWaalsContact ND2-NE2 3.15Å; N955-H959 PolarHBondContact O-CD2 2.93Å; N955-H959 VanDerWaalsContact O-CD2 3.26Å; N955-H959 PolarHBondContact O-N 3.14Å; N955-H959 VanDerWaalsContact O-N 3.1Å; H959-Y962 PolarHBondContact O-N 3.42Å; H959-I963 WeakPolarHBondContact O-CB 3.37Å; H959-I963 WeakPolarHBondContact O-CD1 3.45Å; H959-I963 VanDerWaalsContact O-CG1 3.26Å; H959-I963 WeakPolarHBondContact O-CG1 3.28Å; H959-I963 PolarHBondContact O-N 3.4Å
960	R	95.1	Very high	93.5	Very high	106 Å²	106	67.5 Å²	67.5	40%	0.4	31%	0.308	S	S	.	.	H	α-helix	trans	-58.6	-49.5	175.5	-178.9	171.1	69.8	137.9	-13.1	111.3	E817 T956 L957 Y958 R964	E817-R960 IonicContact OE1-CZ 2.7Å; E817-R960 IonicContact OE1-NH1 3.9Å; E817-R960 PolarHBondContact OE1-NH1 3.27Å; E817-R960 IonicContact OE2-NH1 2.69Å; T956-R960 PolarHBondContact O-N 3.38Å; T956-R960 VanDerWaalsContact O-N 3.1Å; L957-R960 VanDerWaalsContact CD1-NH2 3.28Å; L957-R960 PolarHBondContact O-N 3.39Å; Y958-R960 PolarHBondContact O-N 3.1Å; R960-R964 PolarHBondContact O-N 2.86Å
961	C	95.1	Very high	93.4	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-69.5	-38.6	-178.1	-63.7	0	0	0	0	112.3	Y918 V921 L922 L957 Y958 R964 L965	Y918-C961 HydrophobicContact CD1-CB 3.76Å; Y918-C961 HydrophobicContact CE1-CB 4.28Å; V921-C961 HydrophobicContact CG1-CB 4.12Å; L922-C961 HydrophobicContact CD2-CB 3.98Å; L957-C961 WeakPolarHBondContact O-CB 3.43Å; L957-C961 PolarHBondContact O-N 3.43Å; L957-C961 PolarHBondContact O-SG 3.26Å; Y958-C961 PolarHBondContact O-N 2.96Å; C961-R964 PolarHBondContact O-N 3.19Å; C961-L965 WeakPolarHBondContact O-CB 3.36Å; C961-L965 PolarHBondContact O-N 3.15Å
962	Y	95.2	Very high	93.2	Very high	81 Å²	81	67.2 Å²	67.2	32%	0.318	31%	0.31	S	S	.	.	H	α-helix	trans	-64.3	-41.7	177.7	-174.3	-100.2	0	0	0	112.4	L922 Y958 H959 L965 R966	L922-Y962 HydrophobicContact CD1-CD2 3.99Å; Y958-Y962 VanDerWaalsContact O-CB 3.3Å; Y958-Y962 WeakPolarHBondContact O-CB 3.35Å; Y958-Y962 PolarHBondContact O-N 3.33Å; H959-Y962 PolarHBondContact O-N 3.42Å; Y962-L965 PolarHBondContact O-N 3.47Å; Y962-R966 HydrophobicContact CE1-CG 4.37Å; Y962-R966 WeakPolarHBondContact O-CB 3.31Å; Y962-R966 PolarHBondContact O-N 3.09Å; Y962-R966 PolarHBondContact OH-NE 3.45Å; Y962-R966 PolarHBondContact OH-NH2 3.14Å; Y962-R966 VanDerWaalsContact OH-NH2 3.14Å
963	I	93.2	Very high	92.8	Very high	96 Å²	96	69.6 Å²	69.6	49%	0.492	31%	0.313	S	S	.	.	H	α-helix	trans	-64	-42.8	175	-68.8	167	0	0	0	110.7	H959 R966 Q967	H959-I963 WeakPolarHBondContact O-CB 3.37Å; H959-I963 WeakPolarHBondContact O-CD1 3.45Å; H959-I963 VanDerWaalsContact O-CG1 3.26Å; H959-I963 WeakPolarHBondContact O-CG1 3.28Å; H959-I963 PolarHBondContact O-N 3.4Å; I963-R966 PolarHBondContact O-N 2.88Å; I963-Q967 WeakPolarHBondContact O-CG 3.46Å; I963-Q967 PolarHBondContact O-N 2.84Å
964	R	94.1	Very high	92.4	Very high	119 Å²	119	73 Å²	73	45%	0.449	32%	0.323	S	S	.	.	H	α-helix	trans	-63.4	-45.6	175.1	-74.3	-55.2	-160.8	-172.3	7.2	112.6	Y918 R960 C961 R966 Q967 L968	Y918-R964 HydrophobicContact CD2-CB 4.2Å; Y918-R964 HydrophobicContact CE1-CB 4.21Å; Y918-R964 HydrophobicContact CE2-CB 3.77Å; Y918-R964 HydrophobicContact CE2-CG 4.41Å; R960-R964 PolarHBondContact O-N 2.86Å; C961-R964 PolarHBondContact O-N 3.19Å; R964-R966 VanDerWaalsContact C-N 3.33Å; R964-R966 PolarHBondContact O-N 3.06Å; R964-Q967 WeakPolarHBondContact O-CB 3.41Å; R964-Q967 PolarHBondContact O-N 3.38Å; R964-L968 WeakPolarHBondContact O-CG 3.35Å; R964-L968 PolarHBondContact O-N 3.24Å
965	L	94.3	Very high	91.6	Very high	31 Å²	31	81.8 Å²	81.8	16%	0.162	36%	0.364	C	S	.	.	H	α-helix	trans	-59.4	-42.8	176.7	-174.3	62	0	0	0	111.5	I915 L922 C961 Y962 Q967 L968 A969	I915-L965 HydrophobicContact CB-CD1 4.27Å; I915-L965 HydrophobicContact CG1-CD1 4.17Å; I915-L965 HydrophobicContact CG2-CD1 4.07Å; L922-L965 HydrophobicContact CD1-CD2 3.53Å; C961-L965 WeakPolarHBondContact O-CB 3.36Å; C961-L965 PolarHBondContact O-N 3.15Å; Y962-L965 PolarHBondContact O-N 3.47Å; L965-Q967 VanDerWaalsContact C-N 3.29Å; L965-Q967 PolarHBondContact O-N 3.48Å; L965-L968 PolarHBondContact O-N 2.76Å; L965-A969 VanDerWaalsContact O-CB 3.26Å; L965-A969 WeakPolarHBondContact O-CB 3.17Å; L965-A969 PolarHBondContact O-N 3.21Å
966	R	92.3	Very high	91.1	Very high	139 Å²	139	83.1 Å²	83.1	53%	0.525	37%	0.371	S	S	.	.	H	α-helix	trans	-68.7	-18.4	173.8	-84.9	-173.5	159	-176.3	-4.6	114.9	Y962 I963 R964 R970	Y962-R966 HydrophobicContact CE1-CG 4.37Å; Y962-R966 WeakPolarHBondContact O-CB 3.31Å; Y962-R966 PolarHBondContact O-N 3.09Å; Y962-R966 PolarHBondContact OH-NE 3.45Å; Y962-R966 PolarHBondContact OH-NH2 3.14Å; Y962-R966 VanDerWaalsContact OH-NH2 3.14Å; I963-R966 PolarHBondContact O-N 2.88Å; R964-R966 VanDerWaalsContact C-N 3.33Å; R964-R966 PolarHBondContact O-N 3.06Å; R966-R970 WeakPolarHBondContact O-CG 3.26Å; R966-R970 PolarHBondContact O-NH1 2.97Å
967	Q	92.8	Very high	90.6	Very high	78 Å²	78	79.3 Å²	79.3	36%	0.364	35%	0.348	S	S	.	.	H	α-helix	trans	-79.7	-49.4	170.1	-74	170.9	-8.7	0	0	110	I963 R964 L965 A969 R970 Q971	I963-Q967 WeakPolarHBondContact O-CG 3.46Å; I963-Q967 PolarHBondContact O-N 2.84Å; R964-Q967 WeakPolarHBondContact O-CB 3.41Å; R964-Q967 PolarHBondContact O-N 3.38Å; L965-Q967 VanDerWaalsContact C-N 3.29Å; L965-Q967 PolarHBondContact O-N 3.48Å; Q967-A969 PolarHBondContact O-N 2.79Å; Q967-R970 PolarHBondContact O-N 2.73Å; Q967-R970 VanDerWaalsContact O-N 3.15Å; Q967-Q971 WeakPolarHBondContact O-CG 3.44Å; Q967-Q971 PolarHBondContact O-N 3.03Å
968	L	92.4	Very high	89.9	Confident	7 Å²	7	83.5 Å²	83.5	4%	0.037	37%	0.369	C	S	.	.	H	α-helix	trans	-62.1	-43	179.9	-68.9	159.9	0	0	0	112.4	I911 Q914 I915 Y918 R964 L965 R970 Q971 S972	I911-L968 HydrophobicContact CG1-CD2 4.25Å; I911-L968 HydrophobicContact CG2-CD2 4.38Å; Q914-L968 HydrophobicContact CB-CD1 3.55Å; Q914-L968 HydrophobicContact CB-CD2 4.21Å; Q914-L968 HydrophobicContact CG-CD1 4.45Å; I915-L968 HydrophobicContact CD1-CB 4.14Å; I915-L968 HydrophobicContact CG1-CB 3.74Å; I915-L968 HydrophobicContact CG1-CD1 4.46Å; Y918-L968 HydrophobicContact CD2-CD1 3.6Å; Y918-L968 HydrophobicContact CE2-CD1 3.76Å; R964-L968 WeakPolarHBondContact O-CG 3.35Å; R964-L968 PolarHBondContact O-N 3.24Å; L965-L968 PolarHBondContact O-N 2.76Å; L968-R970 PolarHBondContact O-N 3.16Å; L968-Q971 PolarHBondContact O-N 3.5Å; L968-Q971 VanDerWaalsContact O-N 3.09Å; L968-S972 PolarHBondContact O-N 2.93Å; L968-S972 PolarHBondContact O-OG 3.37Å
969	A	88.9	Confident	89.1	Confident	41 Å²	41	86.9 Å²	86.9	34%	0.339	39%	0.387	S	S	.	.	H	α-helix	trans	-66	-15.6	177.5	0	0	0	0	0	114.2	L965 Q967 S972 R973	L965-A969 VanDerWaalsContact O-CB 3.26Å; L965-A969 WeakPolarHBondContact O-CB 3.17Å; L965-A969 PolarHBondContact O-N 3.21Å; Q967-A969 PolarHBondContact O-N 2.79Å; A969-S972 WeakPolarHBondContact CA-OG 3.19Å; A969-S972 PolarHBondContact O-OG 2.81Å; A969-R973 WeakPolarHBondContact O-CG 3.18Å
970	R	89.1	Confident	88.5	Confident	166 Å²	166	84.5 Å²	84.5	63%	0.626	38%	0.38	S	S	*	.	H	α-helix	trans	-87.9	-42.8	167.9	-69.5	-179.2	-179.6	112.5	-14.4	111.3	R966 Q967 L968 S972 R973	R966-R970 WeakPolarHBondContact O-CG 3.26Å; R966-R970 PolarHBondContact O-NH1 2.97Å; Q967-R970 PolarHBondContact O-N 2.73Å; Q967-R970 VanDerWaalsContact O-N 3.15Å; L968-R970 PolarHBondContact O-N 3.16Å; R970-S972 VanDerWaalsContact C-N 3.28Å; R970-S972 PolarHBondContact O-N 2.91Å; R970-R973 PolarHBondContact O-N 2.82Å; R970-R973 VanDerWaalsContact O-N 3.09Å
971	Q	88.5	Confident	87.9	Confident	93 Å²	93	79.9 Å²	79.9	44%	0.435	36%	0.363	S	S	.	.	H	α-helix	trans	-59.7	-39	176.5	-70.3	172.3	-23.2	0	0	111.8	I911 Q967 L968 R973 R974 L977	I911-Q971 HydrophobicContact CD1-CB 4.18Å; Q967-Q971 WeakPolarHBondContact O-CG 3.44Å; Q967-Q971 PolarHBondContact O-N 3.03Å; L968-Q971 PolarHBondContact O-N 3.5Å; L968-Q971 VanDerWaalsContact O-N 3.09Å; Q971-R973 PolarHBondContact O-N 2.77Å; Q971-R974 PolarHBondContact O-N 3.22Å; Q971-L977 WeakPolarHBondContact O-CD1 3.4Å
972	S	88	Confident	87.1	Confident	16 Å²	16	82 Å²	82	11%	0.112	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-13	176.3	63.4	0	0	0	0	115.1	L968 A969 R970	L968-S972 PolarHBondContact O-N 2.93Å; L968-S972 PolarHBondContact O-OG 3.37Å; A969-S972 WeakPolarHBondContact CA-OG 3.19Å; A969-S972 PolarHBondContact O-OG 2.81Å; R970-S972 VanDerWaalsContact C-N 3.28Å; R970-S972 PolarHBondContact O-N 2.91Å
973	R	85	Confident	86.6	Confident	150 Å²	150	85.4 Å²	85.4	57%	0.566	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	7.2	177.9	-72.2	-179.1	175.4	-147.6	-5.2	113.2	A969 R970 Q971	A969-R973 WeakPolarHBondContact O-CG 3.18Å; R970-R973 PolarHBondContact O-N 2.82Å; R970-R973 VanDerWaalsContact O-N 3.09Å; Q971-R973 PolarHBondContact O-N 2.77Å
974	R	85.5	Confident	86.2	Confident	102 Å²	102	82.7 Å²	82.7	39%	0.385	38%	0.384	S	S	.	.	S	Bend	trans	-66.7	140.2	166.7	-73.1	163.9	44.8	-173.8	-6.6	110.3	E907 Q971 D976 L977 I978	E907-R974 IonicContact OE1-CZ 3.79Å; E907-R974 IonicContact OE1-NH1 3.2Å; E907-R974 PolarHBondContact OE1-NH1 3.29Å; E907-R974 IonicContact OE1-NH2 2.68Å; Q971-R974 PolarHBondContact O-N 3.22Å; R974-D976 VanDerWaalsContact CB-OD1 3.23Å; R974-D976 WeakPolarHBondContact CB-OD1 3.15Å; R974-D976 IonicContact CZ-OD1 3.66Å; R974-D976 IonicContact CZ-OD2 3.35Å; R974-D976 IonicContact NE-OD1 3.07Å; R974-D976 PolarHBondContact NE-OD1 2.88Å; R974-D976 IonicContact NE-OD2 2.7Å; R974-D976 IonicContact NH2-OD1 2.65Å; R974-D976 PolarHBondContact NH2-OD1 3Å; R974-D976 IonicContact NH2-OD2 3.17Å; R974-D976 PolarHBondContact NH2-OD2 3.14Å; R974-D976 PolarHBondContact O-N 2.92Å; R974-D976 VanDerWaalsContact O-N 3.17Å; R974-L977 HydrophobicContact CB-CB 4.4Å; R974-L977 HydrophobicContact CB-CD1 4.29Å; R974-L977 HydrophobicContact CB-CG 4.42Å; R974-L977 WeakPolarHBondContact O-CA 3.24Å; R974-L977 PolarHBondContact O-N 3.35Å; R974-I978 WeakPolarHBondContact O-CG1 3.4Å; R974-I978 PolarHBondContact O-N 3.05Å
975	E	76.7	Confident	85.6	Confident	185 Å²	185	80.4 Å²	80.4	86%	0.864	38%	0.38	S	S	*	.	H	α-helix	trans	-53.6	-38.5	-178.2	-61	-179.3	162.8	0	0	113.1	L977	E975-L977 PolarHBondContact O-N 3.45Å
976	D	83.9	Confident	84.7	Confident	98 Å²	98	81.7 Å²	81.7	52%	0.524	40%	0.395	S	S	.	.	H	α-helix	trans	-73.1	-8.5	178.8	72	-53.6	0	0	0	114.4	R974	R974-D976 VanDerWaalsContact CB-OD1 3.23Å; R974-D976 WeakPolarHBondContact CB-OD1 3.15Å; R974-D976 IonicContact CZ-OD1 3.66Å; R974-D976 IonicContact CZ-OD2 3.35Å; R974-D976 IonicContact NE-OD1 3.07Å; R974-D976 PolarHBondContact NE-OD1 2.88Å; R974-D976 IonicContact NE-OD2 2.7Å; R974-D976 IonicContact NH2-OD1 2.65Å; R974-D976 PolarHBondContact NH2-OD1 3Å; R974-D976 IonicContact NH2-OD2 3.17Å; R974-D976 PolarHBondContact NH2-OD2 3.14Å; R974-D976 PolarHBondContact O-N 2.92Å; R974-D976 VanDerWaalsContact O-N 3.17Å
977	L	85.6	Confident	84.2	Confident	9 Å²	9	80.5 Å²	80.5	5%	0.047	40%	0.399	C	S	.	.	H	α-helix	trans	-118.4	-21.9	-176.6	-64.6	177	0	0	0	114.2	E907 A908 I911 Q971 R974 E975 E979 P980 V981	E907-L977 HydrophobicContact CB-CD2 4.37Å; E907-L977 HydrophobicContact CG-CD1 4.46Å; E907-L977 HydrophobicContact CG-CD2 4.45Å; A908-L977 HydrophobicContact CB-CD2 4.04Å; I911-L977 HydrophobicContact CD1-CD1 3.83Å; Q971-L977 WeakPolarHBondContact O-CD1 3.4Å; R974-L977 HydrophobicContact CB-CB 4.4Å; R974-L977 HydrophobicContact CB-CD1 4.29Å; R974-L977 HydrophobicContact CB-CG 4.42Å; R974-L977 WeakPolarHBondContact O-CA 3.24Å; R974-L977 PolarHBondContact O-N 3.35Å; E975-L977 PolarHBondContact O-N 3.45Å; L977-E979 PolarHBondContact O-N 3.45Å; L977-P980 WeakPolarHBondContact O-CD 3.34Å; L977-V981 HydrophobicContact CB-CG2 4.3Å; L977-V981 WeakPolarHBondContact O-CB 3.43Å; L977-V981 WeakPolarHBondContact O-CG2 3.48Å; L977-V981 PolarHBondContact O-N 2.88Å
978	I	79.8	Confident	84	Confident	93 Å²	93	77.6 Å²	77.6	48%	0.477	39%	0.386	S	S	.	.	H	α-helix	trans	-52.8	-56.3	-176.4	-73.2	165.6	0	0	0	112.2	R974 V981 G982	R974-I978 WeakPolarHBondContact O-CG1 3.4Å; R974-I978 PolarHBondContact O-N 3.05Å; I978-V981 PolarHBondContact O-N 2.95Å; I978-G982 PolarHBondContact O-N 2.81Å
979	E	81.2	Confident	83.9	Confident	119 Å²	119	80 Å²	80	56%	0.556	40%	0.401	S	S	*	.	H	α-helix	trans	-70	-43.4	-174	-157.8	-129.3	146.8	0	0	112.6	L977 G982 R983	L977-E979 PolarHBondContact O-N 3.45Å; E979-G982 PolarHBondContact O-N 2.95Å; E979-R983 PolarHBondContact O-N 2.74Å; E979-R983 VanDerWaalsContact O-N 3.16Å; E979-R983 IonicContact OE1-CZ 3.91Å; E979-R983 IonicContact OE1-NE 2.58Å; E979-R983 PolarHBondContact OE1-NE 2.89Å; E979-R983 IonicContact OE1-NH2 3.24Å; E979-R983 PolarHBondContact OE1-NH2 2.7Å; E979-R983 IonicContact OE2-NH2 2.89Å; E979-R983 PolarHBondContact OE2-NH2 3.05Å
980	P	81.8	Confident	84	Confident	46 Å²	46	78.5 Å²	78.5	30%	0.299	39%	0.389	S	S	.	.	H	α-helix	trans	-58.8	-43.2	169.1	-27.1	36.2	0	0	0	114.2	A908 L977 R983 L984	A908-P980 HydrophobicContact CB-CB 3.64Å; L977-P980 WeakPolarHBondContact O-CD 3.34Å; P980-R983 PolarHBondContact O-N 3.08Å; P980-L984 WeakPolarHBondContact O-CB 3.49Å; P980-L984 WeakPolarHBondContact O-CD1 3.43Å; P980-L984 WeakPolarHBondContact O-CG 3.49Å; P980-L984 PolarHBondContact O-N 3.22Å
981	V	82.2	Confident	84.1	Confident	8 Å²	8	72.8 Å²	72.8	5%	0.048	37%	0.37	C	S	.	.	H	α-helix	trans	-63.9	-46	179.4	163.4	0	0	0	0	110.8	A908 V912 L977 I978 R983 L984 L985	A908-V981 HydrophobicContact CB-CG2 3.97Å; V912-V981 HydrophobicContact CG2-CB 4.21Å; V912-V981 HydrophobicContact CG2-CG1 3.81Å; V912-V981 HydrophobicContact CG2-CG2 4.16Å; L977-V981 HydrophobicContact CB-CG2 4.3Å; L977-V981 WeakPolarHBondContact O-CB 3.43Å; L977-V981 WeakPolarHBondContact O-CG2 3.48Å; L977-V981 PolarHBondContact O-N 2.88Å; I978-V981 PolarHBondContact O-N 2.95Å; V981-R983 PolarHBondContact O-N 2.86Å; V981-L984 PolarHBondContact O-N 2.94Å; V981-L984 VanDerWaalsContact O-N 3.14Å; V981-L985 HydrophobicContact CG1-CD1 3.66Å; V981-L985 HydrophobicContact CG1-CG 4.18Å; V981-L985 WeakPolarHBondContact O-CG 3.43Å; V981-L985 PolarHBondContact O-N 3.38Å
982	G	78.9	Confident	84.2	Confident	44 Å²	44	77.1 Å²	77.1	45%	0.454	38%	0.383	S	S	.	.	H	α-helix	trans	-57.3	-47.8	177.3	0	0	0	0	0	112.3	I978 E979 L984 L985	I978-G982 PolarHBondContact O-N 2.81Å; E979-G982 PolarHBondContact O-N 2.95Å; G982-L984 VanDerWaalsContact C-N 3.29Å; G982-L984 PolarHBondContact O-N 3.22Å; G982-L985 PolarHBondContact O-N 3.44Å
983	R	83.7	Confident	84.4	Confident	153 Å²	153	77.2 Å²	77.2	58%	0.577	38%	0.382	S	S	*	.	H	α-helix	trans	-65	-29.2	176.9	-70.1	-163.6	-96.1	135.8	-9.6	113.4	E979 P980 V981 N987	E979-R983 PolarHBondContact O-N 2.74Å; E979-R983 VanDerWaalsContact O-N 3.16Å; E979-R983 IonicContact OE1-CZ 3.91Å; E979-R983 IonicContact OE1-NE 2.58Å; E979-R983 PolarHBondContact OE1-NE 2.89Å; E979-R983 IonicContact OE1-NH2 3.24Å; E979-R983 PolarHBondContact OE1-NH2 2.7Å; E979-R983 IonicContact OE2-NH2 2.89Å; E979-R983 PolarHBondContact OE2-NH2 3.05Å; P980-R983 PolarHBondContact O-N 3.08Å; V981-R983 PolarHBondContact O-N 2.86Å; R983-N987 PolarHBondContact O-ND2 2.91Å
984	L	86	Confident	84.8	Confident	40 Å²	40	70.1 Å²	70.1	21%	0.209	36%	0.355	C	S	.	.	H	α-helix	trans	-84.6	-31.8	179.8	-71.5	166.7	0	0	0	113.5	A908 Q909 V912 P980 V981 G982 A986 N987 I988	A908-L984 HydrophobicContact CB-CD1 3.82Å; Q909-L984 HydrophobicContact CB-CD1 4Å; V912-L984 HydrophobicContact CB-CB 4.38Å; V912-L984 HydrophobicContact CG1-CB 4.34Å; V912-L984 HydrophobicContact CG2-CB 4.01Å; P980-L984 WeakPolarHBondContact O-CB 3.49Å; P980-L984 WeakPolarHBondContact O-CD1 3.43Å; P980-L984 WeakPolarHBondContact O-CG 3.49Å; P980-L984 PolarHBondContact O-N 3.22Å; V981-L984 PolarHBondContact O-N 2.94Å; V981-L984 VanDerWaalsContact O-N 3.14Å; G982-L984 VanDerWaalsContact C-N 3.29Å; G982-L984 PolarHBondContact O-N 3.22Å; L984-A986 PolarHBondContact O-N 3.4Å; L984-N987 PolarHBondContact O-N 2.81Å; L984-I988 HydrophobicContact CB-CD1 4.18Å; L984-I988 HydrophobicContact CD2-CD1 4.12Å; L984-I988 WeakPolarHBondContact O-CG1 3.14Å; L984-I988 PolarHBondContact O-N 3.18Å; L984-I988 VanDerWaalsContact O-N 3.08Å
985	L	81	Confident	85.2	Confident	71 Å²	71	69.1 Å²	69.1	37%	0.372	35%	0.354	S	S	.	.	H	α-helix	trans	-59.6	-33.7	176.6	-81.8	164.4	0	0	0	112.9	V912 V916 V981 G982 N987	V912-L985 HydrophobicContact CG1-CD2 3.97Å; V912-L985 HydrophobicContact CG1-CG 4.19Å; V912-L985 HydrophobicContact CG2-CD2 4.31Å; V912-L985 HydrophobicContact CG2-CG 3.98Å; V916-L985 HydrophobicContact CG1-CD2 4.21Å; V981-L985 HydrophobicContact CG1-CD1 3.66Å; V981-L985 HydrophobicContact CG1-CG 4.18Å; V981-L985 WeakPolarHBondContact O-CG 3.43Å; V981-L985 PolarHBondContact O-N 3.38Å; G982-L985 PolarHBondContact O-N 3.44Å; L985-N987 VanDerWaalsContact C-N 3.29Å; L985-N987 PolarHBondContact O-N 2.96Å
986	A	76	Confident	85.9	Confident	58 Å²	58	64.4 Å²	64.4	48%	0.479	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-23.8	174.8	0	0	0	0	0	113.9	T428 L984	T428-A986 HydrophobicContact CG2-CB 4.36Å; L984-A986 PolarHBondContact O-N 3.4Å
987	N	82	Confident	86.3	Confident	113 Å²	113	59.8 Å²	59.8	60%	0.604	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-14.8	-169.2	-75.2	-80.4	0	0	0	114.2	R983 L984 L985	R983-N987 PolarHBondContact O-ND2 2.91Å; L984-N987 PolarHBondContact O-N 2.81Å; L985-N987 VanDerWaalsContact C-N 3.29Å; L985-N987 PolarHBondContact O-N 2.96Å
988	I	87.5	Confident	86.7	Confident	17 Å²	17	59.4 Å²	59.4	9%	0.087	31%	0.305	C	S	.	.			trans	-113.3	93.9	-171.9	-62	-177.8	0	0	0	109.7	Q909 V912 E913 V916 L984 L993	Q909-I988 HydrophobicContact CG-CD1 3.78Å; V912-I988 HydrophobicContact CB-CD1 4.45Å; V912-I988 HydrophobicContact CG1-CB 3.86Å; V912-I988 HydrophobicContact CG1-CD1 3.97Å; V912-I988 HydrophobicContact CG1-CG1 4.38Å; V912-I988 HydrophobicContact CG1-CG2 4.12Å; E913-I988 HydrophobicContact CG-CD1 4.14Å; E913-I988 HydrophobicContact CG-CG2 3.67Å; V916-I988 HydrophobicContact CG2-CG2 4.26Å; L984-I988 HydrophobicContact CB-CD1 4.18Å; L984-I988 HydrophobicContact CD2-CD1 4.12Å; L984-I988 WeakPolarHBondContact O-CG1 3.14Å; L984-I988 PolarHBondContact O-N 3.18Å; L984-I988 VanDerWaalsContact O-N 3.08Å; I988-L993 HydrophobicContact CG2-CD1 3.94Å; I988-L993 HydrophobicContact CG2-CG 4.42Å
989	T	89.6	Confident	87.2	Confident	59 Å²	59	57.1 Å²	57.1	36%	0.362	29%	0.294	S	S	.	.			trans	-87.9	139.1	177.7	70.2	0	0	0	0	111.7	N991 R992 L993	T989-N991 PolarHBondContact O-N 2.92Å; T989-R992 PolarHBondContact O-N 3.19Å; T989-R992 WeakPolarHBondContact OG1-CB 3.26Å; T989-R992 PolarHBondContact OG1-N 3.22Å; T989-L993 PolarHBondContact O-N 3.04Å
990	A	91.6	Very high	87.5	Confident	9 Å²	9	54.5 Å²	54.5	7%	0.074	28%	0.283	C	S	.	.	H	α-helix	trans	-57.1	-38.9	173.6	0	0	0	0	0	111.6	V916 R920 R992 L993 I994	V916-A990 HydrophobicContact CB-CB 4.27Å; V916-A990 HydrophobicContact CG2-CB 4.26Å; R920-A990 HydrophobicContact CB-CB 4.28Å; A990-R992 VanDerWaalsContact C-N 3.29Å; A990-R992 PolarHBondContact O-N 3.28Å; A990-L993 PolarHBondContact O-N 3.15Å; A990-I994 HydrophobicContact CB-CD1 4.38Å; A990-I994 WeakPolarHBondContact O-CB 3.42Å; A990-I994 WeakPolarHBondContact O-CD1 3.16Å; A990-I994 WeakPolarHBondContact O-CG1 3.21Å; A990-I994 PolarHBondContact O-N 3.17Å
991	N	91.3	Very high	88	Confident	46 Å²	46	52.9 Å²	52.9	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-54.8	-44.1	178.7	-67.3	1.6	0	0	0	111.9	R920 T989 I994 F995 L1031	R920-N991 PolarHBondContact NH1-OD1 2.62Å; R920-N991 VanDerWaalsContact NH1-OD1 3.15Å; R920-N991 PolarHBondContact NH2-OD1 2.89Å; T989-N991 PolarHBondContact O-N 2.92Å; N991-I994 PolarHBondContact O-N 3.24Å; N991-F995 WeakPolarHBondContact O-CB 3.22Å; N991-F995 PolarHBondContact O-N 3.31Å; N991-L1031 HydrophobicContact CB-CD2 4.06Å
992	R	90.1	Very high	88.3	Confident	183 Å²	183	53.4 Å²	53.4	69%	0.691	28%	0.275	S	S	*	.	H	α-helix	trans	-66.4	-43.3	179.2	-174.5	-179.7	179.2	-159.1	0.5	112.4	T989 A990 I994 F995 Q996	T989-R992 PolarHBondContact O-N 3.19Å; T989-R992 WeakPolarHBondContact OG1-CB 3.26Å; T989-R992 PolarHBondContact OG1-N 3.22Å; A990-R992 VanDerWaalsContact C-N 3.29Å; A990-R992 PolarHBondContact O-N 3.28Å; R992-I994 VanDerWaalsContact C-N 3.35Å; R992-F995 PolarHBondContact O-N 2.93Å; R992-Q996 WeakPolarHBondContact O-CB 3.12Å; R992-Q996 PolarHBondContact O-N 3.16Å
993	L	93.1	Very high	88.7	Confident	18 Å²	18	57.9 Å²	57.9	9%	0.094	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-41.8	177.4	-64.3	172.6	0	0	0	111.6	L815 E913 V916 L917 I988 T989 A990 Y997	L815-L993 HydrophobicContact CD2-CB 4.4Å; E913-L993 HydrophobicContact CB-CD1 3.97Å; E913-L993 HydrophobicContact CG-CD1 3.97Å; E913-L993 HydrophobicContact CG-CD2 4.08Å; V916-L993 HydrophobicContact CG2-CD1 3.73Å; L917-L993 HydrophobicContact CD1-CD1 4.08Å; L917-L993 HydrophobicContact CD2-CB 4.13Å; L917-L993 HydrophobicContact CD2-CD1 4.31Å; L917-L993 HydrophobicContact CG-CD1 3.95Å; I988-L993 HydrophobicContact CG2-CD1 3.94Å; I988-L993 HydrophobicContact CG2-CG 4.42Å; T989-L993 PolarHBondContact O-N 3.04Å; A990-L993 PolarHBondContact O-N 3.15Å; L993-Y997 WeakPolarHBondContact O-CB 3.4Å; L993-Y997 PolarHBondContact O-N 3.04Å
994	I	93.6	Very high	88.5	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-67.6	-42.4	179.6	-64.7	171.8	0	0	0	111.1	L812 L917 R920 A990 N991 R992 Y997 A998 L1027 L1031	L812-I994 HydrophobicContact CD1-CD1 4.38Å; L812-I994 HydrophobicContact CD2-CB 4.4Å; L812-I994 HydrophobicContact CD2-CD1 3.49Å; L812-I994 VanDerWaalsContact CD2-CD1 3.49Å; L812-I994 HydrophobicContact CD2-CG1 3.38Å; L812-I994 HydrophobicContact CD2-CG2 4.22Å; L917-I994 HydrophobicContact CD2-CD1 4.47Å; L917-I994 HydrophobicContact CD2-CG1 3.98Å; R920-I994 HydrophobicContact CG-CD1 4.21Å; A990-I994 HydrophobicContact CB-CD1 4.38Å; A990-I994 WeakPolarHBondContact O-CB 3.42Å; A990-I994 WeakPolarHBondContact O-CD1 3.16Å; A990-I994 WeakPolarHBondContact O-CG1 3.21Å; A990-I994 PolarHBondContact O-N 3.17Å; N991-I994 PolarHBondContact O-N 3.24Å; R992-I994 VanDerWaalsContact C-N 3.35Å; I994-Y997 PolarHBondContact O-N 2.93Å; I994-A998 PolarHBondContact O-N 3.18Å; I994-L1027 HydrophobicContact CG2-CB 4.31Å; I994-L1027 HydrophobicContact CG2-CD2 4Å; I994-L1031 HydrophobicContact CB-CD1 4.49Å; I994-L1031 HydrophobicContact CB-CD2 4.1Å; I994-L1031 HydrophobicContact CB-CG 4.39Å; I994-L1031 HydrophobicContact CG2-CD1 3.93Å; I994-L1031 HydrophobicContact CG2-CD2 3.95Å; I994-L1031 HydrophobicContact CG2-CG 3.73Å
995	F	93	Very high	88.6	Confident	82 Å²	82	49.8 Å²	49.8	36%	0.36	25%	0.251	S	S	.	.	H	α-helix	trans	-65.9	-44	177.3	-174.8	-104.7	0	0	0	111.8	N991 R992 Y997 A998 L999 L1031 L1044	N991-F995 WeakPolarHBondContact O-CB 3.22Å; N991-F995 PolarHBondContact O-N 3.31Å; R992-F995 PolarHBondContact O-N 2.93Å; F995-Y997 VanDerWaalsContact C-N 3.28Å; F995-Y997 PolarHBondContact O-N 2.87Å; F995-A998 WeakPolarHBondContact O-CB 3.43Å; F995-A998 PolarHBondContact O-N 3.04Å; F995-L999 HydrophobicContact CD1-CD1 4.12Å; F995-L999 HydrophobicContact CE1-CD1 3.71Å; F995-L999 HydrophobicContact CE1-CG 4.23Å; F995-L999 HydrophobicContact CZ-CD1 4.29Å; F995-L999 HydrophobicContact CZ-CD2 4.45Å; F995-L999 HydrophobicContact CZ-CG 4.44Å; F995-L999 PolarHBondContact O-N 3.3Å; F995-L999 VanDerWaalsContact O-N 3.08Å; F995-L1031 HydrophobicContact CB-CD1 3.76Å; F995-L1031 HydrophobicContact CD2-CD1 3.93Å; F995-L1031 HydrophobicContact CG-CD1 4.36Å; F995-L1044 HydrophobicContact CD2-CD2 4.19Å; F995-L1044 HydrophobicContact CE2-CD2 4.18Å
996	Q	90.9	Very high	88.7	Confident	85 Å²	85	50.7 Å²	50.7	40%	0.397	25%	0.253	S	S	.	.	H	α-helix	trans	-59.6	-41.2	173.3	-174.9	59.4	53.4	0	0	111.2	R992 A998 L999 D1000	R992-Q996 WeakPolarHBondContact O-CB 3.12Å; R992-Q996 PolarHBondContact O-N 3.16Å; Q996-A998 PolarHBondContact O-N 2.81Å; Q996-L999 WeakPolarHBondContact O-CB 3.46Å; Q996-L999 PolarHBondContact O-N 2.85Å; Q996-D1000 PolarHBondContact NE2-OD1 3.26Å; Q996-D1000 PolarHBondContact O-N 2.82Å
997	Y	94.2	Very high	88.7	Confident	2 Å²	2	50 Å²	50	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-67.5	-34.9	178.7	-169.9	-139.3	0	0	0	113.4	L811 E814 L815 R818 L993 I994 F995 D1000 Q1001 L1027	L811-Y997 WeakPolarHBondContact O-CE1 3.49Å; E814-Y997 VanDerWaalsContact CD-OH 3.31Å; E814-Y997 PolarHBondContact OE2-OH 2.92Å; L815-Y997 HydrophobicContact CB-CD1 3.83Å; L815-Y997 HydrophobicContact CB-CE1 3.96Å; L815-Y997 HydrophobicContact CB-CG 4.35Å; L815-Y997 HydrophobicContact CD1-CD1 4.05Å; L815-Y997 HydrophobicContact CD1-CD2 3.82Å; L815-Y997 HydrophobicContact CD1-CE2 4.35Å; L815-Y997 HydrophobicContact CD1-CG 3.66Å; L815-Y997 HydrophobicContact CD2-CD1 3.87Å; L815-Y997 HydrophobicContact CD2-CG 3.91Å; L815-Y997 HydrophobicContact CG-CD1 4.12Å; L815-Y997 HydrophobicContact CG-CG 4.17Å; R818-Y997 PolarHBondContact NH1-OH 2.74Å; R818-Y997 PolarHBondContact NH2-OH 3.48Å; R818-Y997 VanDerWaalsContact NH2-OH 3.12Å; L993-Y997 WeakPolarHBondContact O-CB 3.4Å; L993-Y997 PolarHBondContact O-N 3.04Å; I994-Y997 PolarHBondContact O-N 2.93Å; F995-Y997 VanDerWaalsContact C-N 3.28Å; F995-Y997 PolarHBondContact O-N 2.87Å; Y997-D1000 HydrophobicContact CD2-CB 4.4Å; Y997-D1000 PolarHBondContact O-N 3.48Å; Y997-Q1001 HydrophobicContact CD2-CG 4.32Å; Y997-Q1001 HydrophobicContact CE2-CG 3.98Å; Y997-Q1001 WeakPolarHBondContact O-CG 3.47Å; Y997-Q1001 PolarHBondContact O-N 3.17Å; Y997-Q1001 PolarHBondContact OH-NE2 2.92Å; Y997-L1027 HydrophobicContact CD1-CD1 3.59Å; Y997-L1027 HydrophobicContact CD1-CD2 4.14Å; Y997-L1027 HydrophobicContact CE1-CD1 4.15Å; Y997-L1027 HydrophobicContact CG-CD1 4.17Å
998	A	93	Very high	88.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-44.9	171.9	0	0	0	0	0	111.3	I994 F995 Q996 Q1001 C1002 L1027 I1028	I994-A998 PolarHBondContact O-N 3.18Å; F995-A998 WeakPolarHBondContact O-CB 3.43Å; F995-A998 PolarHBondContact O-N 3.04Å; Q996-A998 PolarHBondContact O-N 2.81Å; A998-Q1001 PolarHBondContact O-N 2.89Å; A998-C1002 PolarHBondContact O-N 2.92Å; A998-C1002 PolarHBondContact O-SG 2.72Å; A998-L1027 HydrophobicContact CB-CB 3.81Å; A998-L1027 HydrophobicContact CB-CD1 4.27Å; A998-I1028 HydrophobicContact CB-CD1 4.32Å; A998-I1028 HydrophobicContact CB-CG1 3.78Å
999	L	89.5	Confident	88.3	Confident	46 Å²	46	46.6 Å²	46.6	24%	0.241	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-46.5	174.3	-66.2	178.2	0	0	0	111.8	F995 Q996 Q1001 C1002 Y1003	F995-L999 HydrophobicContact CD1-CD1 4.12Å; F995-L999 HydrophobicContact CE1-CD1 3.71Å; F995-L999 HydrophobicContact CE1-CG 4.23Å; F995-L999 HydrophobicContact CZ-CD1 4.29Å; F995-L999 HydrophobicContact CZ-CD2 4.45Å; F995-L999 HydrophobicContact CZ-CG 4.44Å; F995-L999 PolarHBondContact O-N 3.3Å; F995-L999 VanDerWaalsContact O-N 3.08Å; Q996-L999 WeakPolarHBondContact O-CB 3.46Å; Q996-L999 PolarHBondContact O-N 2.85Å; L999-Q1001 VanDerWaalsContact C-N 3.27Å; L999-Q1001 PolarHBondContact O-N 3.27Å; L999-C1002 PolarHBondContact O-N 2.91Å; L999-Y1003 HydrophobicContact CB-CD2 4.37Å; L999-Y1003 HydrophobicContact CB-CE2 4.07Å; L999-Y1003 WeakPolarHBondContact O-CD2 3.21Å; L999-Y1003 PolarHBondContact O-N 3.03Å
1000	D	88.3	Confident	87.5	Confident	64 Å²	64	47.6 Å²	47.6	34%	0.342	22%	0.219	S	C	.	.	H	α-helix	trans	-58.7	-38.4	179.2	-67.2	-13.9	0	0	0	112	Q996 Y997 A1004	Q996-D1000 PolarHBondContact NE2-OD1 3.26Å; Q996-D1000 PolarHBondContact O-N 2.82Å; Y997-D1000 HydrophobicContact CD2-CB 4.4Å; Y997-D1000 PolarHBondContact O-N 3.48Å; D1000-A1004 VanDerWaalsContact O-CB 3.3Å; D1000-A1004 WeakPolarHBondContact O-CB 3.5Å; D1000-A1004 PolarHBondContact O-N 3.15Å; D1000-A1004 VanDerWaalsContact O-N 3.1Å
1001	Q	91.5	Very high	86.5	Confident	11 Å²	11	50.1 Å²	50.1	5%	0.051	23%	0.231	C	C	.	.	H	α-helix	trans	-70.6	-39.2	173.7	-69.5	-71.9	16.5	0	0	112.1	Y997 A998 L999 A1004 A1005 R1020	Y997-Q1001 HydrophobicContact CD2-CG 4.32Å; Y997-Q1001 HydrophobicContact CE2-CG 3.98Å; Y997-Q1001 WeakPolarHBondContact O-CG 3.47Å; Y997-Q1001 PolarHBondContact O-N 3.17Å; Y997-Q1001 PolarHBondContact OH-NE2 2.92Å; A998-Q1001 PolarHBondContact O-N 2.89Å; L999-Q1001 VanDerWaalsContact C-N 3.27Å; L999-Q1001 PolarHBondContact O-N 3.27Å; Q1001-A1004 CarbonylContact O-C 3.6Å; Q1001-A1004 PolarHBondContact O-N 3.35Å; Q1001-A1005 WeakPolarHBondContact O-CB 3.22Å; Q1001-A1005 PolarHBondContact O-N 3.17Å; Q1001-R1020 VanDerWaalsContact OE1-NH1 3.11Å
1002	C	89.9	Confident	85.8	Confident	19 Å²	19	50.4 Å²	50.4	13%	0.128	24%	0.244	C	C	.	.	H	α-helix	trans	-66.3	-42.9	177.4	-65	0	0	0	0	112.5	A998 L999 A1004 A1005 E1006 L1051	A998-C1002 PolarHBondContact O-N 2.92Å; A998-C1002 PolarHBondContact O-SG 2.72Å; L999-C1002 PolarHBondContact O-N 2.91Å; C1002-A1004 VanDerWaalsContact C-N 3.33Å; C1002-A1004 PolarHBondContact O-N 2.86Å; C1002-A1005 WeakPolarHBondContact O-CB 3.43Å; C1002-A1005 PolarHBondContact O-N 3.47Å; C1002-A1005 VanDerWaalsContact O-N 3.15Å; C1002-E1006 PolarHBondContact O-N 3.01Å; C1002-L1051 HydrophobicContact CB-CD2 4.34Å; C1002-L1051 VanDerWaalsContact SG-CD1 3.52Å; C1002-L1051 VanDerWaalsContact SG-CD2 3.52Å
1003	Y	86.1	Confident	85.4	Confident	138 Å²	138	46.1 Å²	46.1	54%	0.541	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-41.5	172.9	-70.5	-57.5	0	0	0	111.5	L999 A1005 E1006 M1007	L999-Y1003 HydrophobicContact CB-CD2 4.37Å; L999-Y1003 HydrophobicContact CB-CE2 4.07Å; L999-Y1003 WeakPolarHBondContact O-CD2 3.21Å; L999-Y1003 PolarHBondContact O-N 3.03Å; Y1003-A1005 VanDerWaalsContact C-N 3.29Å; Y1003-A1005 PolarHBondContact O-N 3.34Å; Y1003-E1006 PolarHBondContact O-N 3.03Å; Y1003-M1007 VanDerWaalsContact O-CG 3.31Å; Y1003-M1007 WeakPolarHBondContact O-CG 3.2Å; Y1003-M1007 PolarHBondContact O-N 2.94Å
1004	A	81.2	Confident	85.1	Confident	23 Å²	23	48 Å²	48	19%	0.19	24%	0.241	C	C	.	.	H	α-helix	trans	-68.4	-28	175.1	0	0	0	0	0	112.5	D1000 Q1001 C1002 M1007 D1008	D1000-A1004 VanDerWaalsContact O-CB 3.3Å; D1000-A1004 WeakPolarHBondContact O-CB 3.5Å; D1000-A1004 PolarHBondContact O-N 3.15Å; D1000-A1004 VanDerWaalsContact O-N 3.1Å; Q1001-A1004 CarbonylContact O-C 3.6Å; Q1001-A1004 PolarHBondContact O-N 3.35Å; C1002-A1004 VanDerWaalsContact C-N 3.33Å; C1002-A1004 PolarHBondContact O-N 2.86Å; A1004-M1007 PolarHBondContact O-N 2.94Å; A1004-D1008 WeakPolarHBondContact O-CB 3.32Å; A1004-D1008 VanDerWaalsContact O-CG 3.31Å; A1004-D1008 PolarHBondContact O-N 2.92Å
1005	A	86.2	Confident	84.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.3	-43.8	173.9	0	0	0	0	0	111.8	Q1001 C1002 Y1003 M1007 D1008 E1009 S1017 R1020 Y1021	Q1001-A1005 WeakPolarHBondContact O-CB 3.22Å; Q1001-A1005 PolarHBondContact O-N 3.17Å; C1002-A1005 WeakPolarHBondContact O-CB 3.43Å; C1002-A1005 PolarHBondContact O-N 3.47Å; C1002-A1005 VanDerWaalsContact O-N 3.15Å; Y1003-A1005 VanDerWaalsContact C-N 3.29Å; Y1003-A1005 PolarHBondContact O-N 3.34Å; A1005-M1007 VanDerWaalsContact C-N 3.32Å; A1005-D1008 PolarHBondContact O-N 2.96Å; A1005-E1009 WeakPolarHBondContact O-CB 3.49Å; A1005-E1009 PolarHBondContact O-N 3.24Å; A1005-S1017 VanDerWaalsContact O-CB 3.29Å; A1005-S1017 WeakPolarHBondContact O-CB 3.17Å; A1005-S1017 PolarHBondContact O-OG 2.81Å; A1005-R1020 HydrophobicContact CB-CB 3.61Å; A1005-Y1021 HydrophobicContact CB-CD1 3.86Å; A1005-Y1021 HydrophobicContact CB-CD2 3.62Å; A1005-Y1021 HydrophobicContact CB-CE1 3.84Å; A1005-Y1021 HydrophobicContact CB-CE2 3.62Å; A1005-Y1021 HydrophobicContact CB-CG 3.74Å
1006	E	83.3	Confident	84.2	Confident	90 Å²	90	47.7 Å²	47.7	42%	0.421	25%	0.249	S	C	.	.	H	α-helix	trans	-62.6	-39.2	173.5	-172	-171.3	-176.6	0	0	111.4	C1002 Y1003 Y1010	C1002-E1006 PolarHBondContact O-N 3.01Å; Y1003-E1006 PolarHBondContact O-N 3.03Å; E1006-Y1010 WeakPolarHBondContact O-CB 3.45Å; E1006-Y1010 PolarHBondContact O-N 3.38Å
1007	M	76.1	Confident	84	Confident	45 Å²	45	43.6 Å²	43.6	22%	0.222	23%	0.23	C	C	.	.	H	α-helix	trans	-69.1	-40.4	176.4	-67	-55.1	94.2	0	0	112.6	T179 Y1003 A1004 A1005 Y1010 I1011	T179-M1007 HydrophobicContact CG2-SD 4.19Å; T179-M1007 PolarHBondContact OG1-SD 3.47Å; Y1003-M1007 VanDerWaalsContact O-CG 3.31Å; Y1003-M1007 WeakPolarHBondContact O-CG 3.2Å; Y1003-M1007 PolarHBondContact O-N 2.94Å; A1004-M1007 PolarHBondContact O-N 2.94Å; A1005-M1007 VanDerWaalsContact C-N 3.32Å; M1007-Y1010 PolarHBondContact O-N 3.33Å; M1007-I1011 WeakPolarHBondContact O-CD1 3.49Å; M1007-I1011 WeakPolarHBondContact O-CG1 3.49Å; M1007-I1011 PolarHBondContact O-N 3.04Å
1008	D	81.4	Confident	83.8	Confident	11 Å²	11	44.2 Å²	44.2	6%	0.059	23%	0.233	C	C	.	.	H	α-helix	trans	-70.1	-36.3	177.4	-71.2	-7.5	0	0	0	110.8	A1004 A1005 I1011 G1012 E1013 L1016 R1020	A1004-D1008 WeakPolarHBondContact O-CB 3.32Å; A1004-D1008 VanDerWaalsContact O-CG 3.31Å; A1004-D1008 PolarHBondContact O-N 2.92Å; A1005-D1008 PolarHBondContact O-N 2.96Å; D1008-I1011 PolarHBondContact O-N 3.42Å; D1008-G1012 PolarHBondContact O-N 2.88Å; D1008-E1013 HydrophobicContact CB-CB 4.16Å; D1008-E1013 PolarHBondContact O-N 2.68Å; D1008-L1016 HydrophobicContact CB-CB 4.17Å; D1008-R1020 IonicContact OD2-CZ 2.82Å; D1008-R1020 VanDerWaalsContact OD2-CZ 3.23Å; D1008-R1020 IonicContact OD2-NE 2.67Å; D1008-R1020 PolarHBondContact OD2-NE 3.39Å; D1008-R1020 IonicContact OD2-NH2 3.26Å; D1008-R1020 PolarHBondContact OD2-NH2 3.23Å
1009	E	80.3	Confident	83.8	Confident	47 Å²	47	49 Å²	49	22%	0.22	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-46.6	170.3	-166.7	-172	160.1	0	0	111.4	A1005 I1011 G1012 R1054 L1058	A1005-E1009 WeakPolarHBondContact O-CB 3.49Å; A1005-E1009 PolarHBondContact O-N 3.24Å; E1009-I1011 PolarHBondContact O-N 3.27Å; E1009-G1012 PolarHBondContact O-N 3.17Å; E1009-R1054 IonicContact OE1-CZ 2.64Å; E1009-R1054 VanDerWaalsContact OE1-CZ 3.23Å; E1009-R1054 IonicContact OE1-NE 2.71Å; E1009-R1054 IonicContact OE1-NH1 3.1Å; E1009-R1054 IonicContact OE1-NH2 2.72Å; E1009-R1054 PolarHBondContact OE1-NH2 2.7Å; E1009-R1054 IonicContact OE2-CZ 3.58Å; E1009-R1054 IonicContact OE2-NE 2.76Å; E1009-R1054 PolarHBondContact OE2-NE 3.47Å; E1009-R1054 IonicContact OE2-NH2 2.78Å; E1009-R1054 PolarHBondContact OE2-NH2 3.44Å; E1009-L1058 HydrophobicContact CG-CD1 3.91Å
1010	Y	72.1	Confident	83.9	Confident	80 Å²	80	48.9 Å²	48.9	31%	0.314	25%	0.252	S	S	.	.	H	α-helix	trans	-60.1	-26.4	177	-178.9	-85.5	0	0	0	113	R169 F170 M175 E1006 M1007	R169-Y1010 VanDerWaalsContact CZ-OH 3.28Å; R169-Y1010 PolarHBondContact NE-OH 3.25Å; R169-Y1010 PolarHBondContact NH2-OH 3.09Å; F170-Y1010 PolarHBondContact O-OH 2.69Å; M175-Y1010 HydrophobicContact CE-CE2 3.83Å; M175-Y1010 HydrophobicContact SD-CE2 4.01Å; E1006-Y1010 WeakPolarHBondContact O-CB 3.45Å; E1006-Y1010 PolarHBondContact O-N 3.38Å; M1007-Y1010 PolarHBondContact O-N 3.33Å
1011	I	72.1	Confident	84.2	Confident	62 Å²	62	46.6 Å²	46.6	32%	0.318	24%	0.239	S	C	.	.	H	α-helix	trans	-84.5	-13.8	177.6	-62.7	157.9	0	0	0	111.6	T52 M1007 D1008 E1009 E1013	T52-I1011 HydrophobicContact CG2-CD1 3.92Å; M1007-I1011 WeakPolarHBondContact O-CD1 3.49Å; M1007-I1011 WeakPolarHBondContact O-CG1 3.49Å; M1007-I1011 PolarHBondContact O-N 3.04Å; D1008-I1011 PolarHBondContact O-N 3.42Å; E1009-I1011 PolarHBondContact O-N 3.27Å; I1011-E1013 HydrophobicContact CB-CG 4.48Å; I1011-E1013 HydrophobicContact CG2-CG 4.01Å
1012	G	75.8	Confident	84.3	Confident	51 Å²	51	48.2 Å²	48.2	53%	0.526	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	4.4	-172.3	0	0	0	0	0	114	D1008 E1009 I1014	D1008-G1012 PolarHBondContact O-N 2.88Å; E1009-G1012 PolarHBondContact O-N 3.17Å; G1012-I1014 PolarHBondContact O-N 3.19Å
1013	E	82	Confident	84.6	Confident	94 Å²	94	47.8 Å²	47.8	44%	0.439	24%	0.243	S	C	.	.			trans	-81.6	60.3	179.4	-70.2	-70.4	176.8	0	0	111	D1008 I1011 A1015 L1016 S1017	D1008-E1013 HydrophobicContact CB-CB 4.16Å; D1008-E1013 PolarHBondContact O-N 2.68Å; I1011-E1013 HydrophobicContact CB-CG 4.48Å; I1011-E1013 HydrophobicContact CG2-CG 4.01Å; E1013-A1015 PolarHBondContact O-N 3.1Å; E1013-L1016 HydrophobicContact CB-CB 4.26Å; E1013-L1016 HydrophobicContact CB-CD1 4.14Å; E1013-L1016 HydrophobicContact CB-CG 4.42Å; E1013-L1016 HydrophobicContact CG-CD1 4.37Å; E1013-L1016 PolarHBondContact O-N 2.88Å; E1013-S1017 PolarHBondContact O-N 2.86Å
1014	I	86.5	Confident	84.9	Confident	56 Å²	56	41.2 Å²	41.2	29%	0.287	22%	0.217	S	C	.	.	H	α-helix	trans	-54.1	-39.6	-172.6	-65.5	172.8	0	0	0	111.8	G1012 S1017 L1018 L1058 A1062	G1012-I1014 PolarHBondContact O-N 3.19Å; I1014-S1017 PolarHBondContact O-N 3.09Å; I1014-L1018 HydrophobicContact CG2-CD1 3.89Å; I1014-L1018 HydrophobicContact CG2-CG 4.4Å; I1014-L1018 WeakPolarHBondContact O-CB 3.42Å; I1014-L1018 VanDerWaalsContact O-CG 3.28Å; I1014-L1018 WeakPolarHBondContact O-CG 3.49Å; I1014-L1018 PolarHBondContact O-N 2.8Å; I1014-L1058 HydrophobicContact CG1-CD1 4.27Å; I1014-L1058 HydrophobicContact CG2-CD1 3.88Å; I1014-L1058 HydrophobicContact CG2-CG 4.04Å; I1014-A1062 HydrophobicContact CG2-CB 3.75Å
1015	A	83.2	Confident	85.6	Confident	40 Å²	40	40.2 Å²	40.2	33%	0.331	21%	0.209	S	C	.	.	H	α-helix	trans	-64.7	-41.3	178.8	0	0	0	0	0	113.1	E1013 Q1019	E1013-A1015 PolarHBondContact O-N 3.1Å; A1015-Q1019 PolarHBondContact O-N 2.9Å; A1015-Q1019 VanDerWaalsContact O-N 3.08Å
1016	L	84.2	Confident	86	Confident	37 Å²	37	40.3 Å²	40.3	19%	0.194	21%	0.209	C	C	.	.	H	α-helix	trans	-70.1	-40.8	176.2	-65	179.1	0	0	0	111	D1008 E1013 L1018 Q1019 R1020	D1008-L1016 HydrophobicContact CB-CB 4.17Å; E1013-L1016 HydrophobicContact CB-CB 4.26Å; E1013-L1016 HydrophobicContact CB-CD1 4.14Å; E1013-L1016 HydrophobicContact CB-CG 4.42Å; E1013-L1016 HydrophobicContact CG-CD1 4.37Å; E1013-L1016 PolarHBondContact O-N 2.88Å; L1016-L1018 PolarHBondContact O-N 2.76Å; L1016-Q1019 PolarHBondContact O-N 2.81Å; L1016-R1020 WeakPolarHBondContact O-CG 3.46Å; L1016-R1020 PolarHBondContact O-N 3.05Å
1017	S	87.7	Confident	86.5	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.3	-46.6	175.4	-178.3	0	0	0	0	112.2	A1005 E1013 I1014 Q1019 R1020 Y1021 L1058	A1005-S1017 VanDerWaalsContact O-CB 3.29Å; A1005-S1017 WeakPolarHBondContact O-CB 3.17Å; A1005-S1017 PolarHBondContact O-OG 2.81Å; E1013-S1017 PolarHBondContact O-N 2.86Å; I1014-S1017 PolarHBondContact O-N 3.09Å; S1017-Q1019 PolarHBondContact O-N 2.9Å; S1017-R1020 PolarHBondContact O-N 3.43Å; S1017-Y1021 WeakPolarHBondContact O-CD2 3.45Å; S1017-Y1021 PolarHBondContact O-N 2.93Å; S1017-Y1021 WeakPolarHBondContact OG-CE2 3.27Å; S1017-L1058 VanDerWaalsContact OG-CD2 3.26Å; S1017-L1058 WeakPolarHBondContact OG-CD2 3.01Å
1018	L	90.5	Very high	87.4	Confident	14 Å²	14	34 Å²	34	7%	0.073	18%	0.179	C	C	.	.	H	α-helix	trans	-57.9	-47	173.1	-74	165.6	0	0	0	112	I1014 L1016 R1020 Y1021 K1022 Y1055 L1058 W1059 A1062	I1014-L1018 HydrophobicContact CG2-CD1 3.89Å; I1014-L1018 HydrophobicContact CG2-CG 4.4Å; I1014-L1018 WeakPolarHBondContact O-CB 3.42Å; I1014-L1018 VanDerWaalsContact O-CG 3.28Å; I1014-L1018 WeakPolarHBondContact O-CG 3.49Å; I1014-L1018 PolarHBondContact O-N 2.8Å; L1016-L1018 PolarHBondContact O-N 2.76Å; L1018-R1020 VanDerWaalsContact C-N 3.28Å; L1018-R1020 PolarHBondContact O-N 3.39Å; L1018-Y1021 PolarHBondContact O-N 3.31Å; L1018-K1022 WeakPolarHBondContact O-CB 3.15Å; L1018-K1022 PolarHBondContact O-N 2.85Å; L1018-Y1055 HydrophobicContact CB-CE2 4.04Å; L1018-Y1055 HydrophobicContact CD2-CD2 3.73Å; L1018-Y1055 HydrophobicContact CD2-CE2 3.62Å; L1018-Y1055 HydrophobicContact CD2-CG 4.27Å; L1018-Y1055 HydrophobicContact CG-CE2 4.46Å; L1018-Y1055 WeakPolarHBondContact O-CE2 3.18Å; L1018-L1058 HydrophobicContact CD2-CB 4.05Å; L1018-L1058 HydrophobicContact CD2-CD2 3.91Å; L1018-L1058 HydrophobicContact CD2-CG 3.91Å; L1018-L1058 HydrophobicContact CG-CD2 3.84Å; L1018-L1058 HydrophobicContact CG-CG 4.03Å; L1018-W1059 HydrophobicContact CD1-CE3 3.77Å; L1018-W1059 HydrophobicContact CD1-CZ3 4.22Å; L1018-W1059 HydrophobicContact CD2-CB 4.14Å; L1018-W1059 HydrophobicContact CD2-CE3 4.13Å; L1018-A1062 HydrophobicContact CD1-CB 4.22Å
1019	Q	92.2	Very high	87.8	Confident	100 Å²	100	35.4 Å²	35.4	47%	0.467	19%	0.185	S	C	.	.	H	α-helix	trans	-58	-40.1	177.8	-172.5	-177.7	6.4	0	0	112	A1015 L1016 S1017 A1023	A1015-Q1019 PolarHBondContact O-N 2.9Å; A1015-Q1019 VanDerWaalsContact O-N 3.08Å; L1016-Q1019 PolarHBondContact O-N 2.81Å; S1017-Q1019 PolarHBondContact O-N 2.9Å; Q1019-A1023 PolarHBondContact O-N 3.34Å
1020	R	92.3	Very high	88.3	Confident	45 Å²	45	33.2 Å²	33.2	17%	0.17	18%	0.175	C	C	.	.	H	α-helix	trans	-75.6	-39.7	178.8	-68.3	-173.1	-161.9	-74.4	-2	114	Q1001 A1005 D1008 L1016 S1017 L1018 K1022 A1023 G1024	Q1001-R1020 VanDerWaalsContact OE1-NH1 3.11Å; A1005-R1020 HydrophobicContact CB-CB 3.61Å; D1008-R1020 IonicContact OD2-CZ 2.82Å; D1008-R1020 VanDerWaalsContact OD2-CZ 3.23Å; D1008-R1020 IonicContact OD2-NE 2.67Å; D1008-R1020 PolarHBondContact OD2-NE 3.39Å; D1008-R1020 IonicContact OD2-NH2 3.26Å; D1008-R1020 PolarHBondContact OD2-NH2 3.23Å; L1016-R1020 WeakPolarHBondContact O-CG 3.46Å; L1016-R1020 PolarHBondContact O-N 3.05Å; S1017-R1020 PolarHBondContact O-N 3.43Å; L1018-R1020 VanDerWaalsContact C-N 3.28Å; L1018-R1020 PolarHBondContact O-N 3.39Å; R1020-K1022 VanDerWaalsContact C-N 3.29Å; R1020-K1022 PolarHBondContact O-N 3.41Å; R1020-A1023 WeakPolarHBondContact O-CB 3.48Å; R1020-A1023 PolarHBondContact O-N 3.38Å; R1020-G1024 PolarHBondContact O-N 3.05Å
1021	Y	94	Very high	89.3	Confident	15 Å²	15	29.9 Å²	29.9	6%	0.059	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-40.7	172.8	-82.6	-54.9	0	0	0	110.7	A1005 S1017 L1018 G1024 I1025 L1051 R1054 L1058	A1005-Y1021 HydrophobicContact CB-CD1 3.86Å; A1005-Y1021 HydrophobicContact CB-CD2 3.62Å; A1005-Y1021 HydrophobicContact CB-CE1 3.84Å; A1005-Y1021 HydrophobicContact CB-CE2 3.62Å; A1005-Y1021 HydrophobicContact CB-CG 3.74Å; S1017-Y1021 WeakPolarHBondContact O-CD2 3.45Å; S1017-Y1021 PolarHBondContact O-N 2.93Å; S1017-Y1021 WeakPolarHBondContact OG-CE2 3.27Å; L1018-Y1021 PolarHBondContact O-N 3.31Å; Y1021-G1024 PolarHBondContact O-N 3.37Å; Y1021-I1025 WeakPolarHBondContact O-CD1 3.33Å; Y1021-I1025 VanDerWaalsContact O-CG1 3.26Å; Y1021-I1025 WeakPolarHBondContact O-CG1 3.3Å; Y1021-I1025 PolarHBondContact O-N 2.82Å; Y1021-L1051 HydrophobicContact CD1-CD2 4.11Å; Y1021-L1051 HydrophobicContact CE1-CD2 4.16Å; Y1021-R1054 HydrophobicContact CD2-CG 4.48Å; Y1021-R1054 HydrophobicContact CE1-CG 3.95Å; Y1021-R1054 HydrophobicContact CE2-CG 3.81Å; Y1021-L1058 HydrophobicContact CD2-CD2 4.11Å; Y1021-L1058 HydrophobicContact CE2-CD2 4.26Å
1022	K	93.8	Very high	90.1	Very high	46 Å²	46	28.2 Å²	28.2	20%	0.2	16%	0.156	C	C	.	.	H	α-helix	trans	-56.4	-50.4	170.4	-170.7	-168.8	-178	-150.9	0	111.3	L779 W780 E807 L1018 R1020 G1024 I1025 T1026 Y1055	L779-K1022 HydrophobicContact CD1-CG 4.35Å; W780-K1022 HydrophobicContact CH2-CG 4.39Å; E807-K1022 IonicContact OE1-NZ 3.17Å; E807-K1022 PolarHBondContact OE1-NZ 2.83Å; E807-K1022 WeakPolarHBondContact OE2-CE 3.43Å; E807-K1022 IonicContact OE2-NZ 3.78Å; E807-K1022 PolarHBondContact OE2-NZ 3.29Å; L1018-K1022 WeakPolarHBondContact O-CB 3.15Å; L1018-K1022 PolarHBondContact O-N 2.85Å; R1020-K1022 VanDerWaalsContact C-N 3.29Å; R1020-K1022 PolarHBondContact O-N 3.41Å; K1022-G1024 PolarHBondContact O-N 2.89Å; K1022-I1025 PolarHBondContact O-N 3.26Å; K1022-T1026 PolarHBondContact O-N 2.83Å; K1022-T1026 PolarHBondContact O-OG1 3.43Å; K1022-T1026 VanDerWaalsContact O-OG1 3.05Å; K1022-Y1055 HydrophobicContact CB-CE2 4.15Å
1023	A	94.8	Very high	90.5	Very high	9 Å²	9	31.8 Å²	31.8	7%	0.074	16%	0.159	C	C	.	.	H	α-helix	trans	-59.2	-42	177.7	0	0	0	0	0	113.2	L811 Q1019 R1020 T1026 L1027	L811-A1023 HydrophobicContact CD1-CB 3.84Å; L811-A1023 HydrophobicContact CD2-CB 3.78Å; L811-A1023 HydrophobicContact CG-CB 4.5Å; Q1019-A1023 PolarHBondContact O-N 3.34Å; R1020-A1023 WeakPolarHBondContact O-CB 3.48Å; R1020-A1023 PolarHBondContact O-N 3.38Å; A1023-T1026 PolarHBondContact O-N 2.88Å; A1023-L1027 WeakPolarHBondContact O-CD1 3.49Å; A1023-L1027 VanDerWaalsContact O-CG 3.32Å; A1023-L1027 WeakPolarHBondContact O-CG 3.41Å; A1023-L1027 PolarHBondContact O-N 2.84Å
1024	G	94.3	Very high	90.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.8	-44.7	174.5	0	0	0	0	0	112.7	R1020 Y1021 K1022 T1026 L1027 I1028	R1020-G1024 PolarHBondContact O-N 3.05Å; Y1021-G1024 PolarHBondContact O-N 3.37Å; K1022-G1024 PolarHBondContact O-N 2.89Å; G1024-T1026 PolarHBondContact O-N 2.91Å; G1024-L1027 PolarHBondContact O-N 3.24Å; G1024-I1028 WeakPolarHBondContact O-CG1 3.44Å; G1024-I1028 PolarHBondContact O-N 2.8Å
1025	I	94.2	Very high	90.2	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.015	14%	0.141	C	C	.	.	H	α-helix	trans	-60.5	-44.7	175.3	-66	160.1	0	0	0	110.8	L779 Y1021 K1022 I1028 H1029 M1048 L1051 R1052 Y1055	L779-I1025 HydrophobicContact CD2-CB 4.45Å; L779-I1025 HydrophobicContact CD2-CD1 4.4Å; L779-I1025 HydrophobicContact CD2-CG2 3.69Å; Y1021-I1025 WeakPolarHBondContact O-CD1 3.33Å; Y1021-I1025 VanDerWaalsContact O-CG1 3.26Å; Y1021-I1025 WeakPolarHBondContact O-CG1 3.3Å; Y1021-I1025 PolarHBondContact O-N 2.82Å; K1022-I1025 PolarHBondContact O-N 3.26Å; I1025-I1028 PolarHBondContact O-N 3.35Å; I1025-H1029 VanDerWaalsContact O-CB 3.32Å; I1025-H1029 WeakPolarHBondContact O-CB 3.45Å; I1025-H1029 PolarHBondContact O-N 3.42Å; I1025-M1048 HydrophobicContact CG2-CG 4.01Å; I1025-L1051 HydrophobicContact CD1-CB 4.22Å; I1025-L1051 HydrophobicContact CG1-CB 3.59Å; I1025-L1051 HydrophobicContact CG1-CD1 4.28Å; I1025-R1052 HydrophobicContact CD1-CG 3.93Å; I1025-R1052 HydrophobicContact CG1-CG 4.29Å; I1025-R1052 HydrophobicContact CG2-CG 4.25Å; I1025-Y1055 HydrophobicContact CD1-CG 4.45Å
1026	T	94.3	Very high	90.4	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-60.1	-46.2	177.9	-55.9	0	0	0	0	112.1	W780 L808 L811 K1022 A1023 G1024 H1029 G1030	W780-T1026 WeakPolarHBondContact CH2-OG1 3.47Å; L808-T1026 HydrophobicContact CB-CG2 3.72Å; L808-T1026 HydrophobicContact CD1-CG2 4.21Å; L811-T1026 HydrophobicContact CD1-CG2 4.07Å; K1022-T1026 PolarHBondContact O-N 2.83Å; K1022-T1026 PolarHBondContact O-OG1 3.43Å; K1022-T1026 VanDerWaalsContact O-OG1 3.05Å; A1023-T1026 PolarHBondContact O-N 2.88Å; G1024-T1026 PolarHBondContact O-N 2.91Å; T1026-H1029 PolarHBondContact O-N 3.14Å; T1026-G1030 PolarHBondContact O-N 2.93Å
1027	L	95	Very high	90.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.2	-44.1	179.8	-69.7	162.4	0	0	0	112.1	L808 L811 L812 I994 Y997 A998 A1023 G1024 G1030 L1031	L808-L1027 HydrophobicContact CD1-CD2 4.16Å; L811-L1027 HydrophobicContact CB-CD2 4.12Å; L811-L1027 HydrophobicContact CD1-CG 4.28Å; L812-L1027 HydrophobicContact CD2-CD2 3.99Å; I994-L1027 HydrophobicContact CG2-CB 4.31Å; I994-L1027 HydrophobicContact CG2-CD2 4Å; Y997-L1027 HydrophobicContact CD1-CD1 3.59Å; Y997-L1027 HydrophobicContact CD1-CD2 4.14Å; Y997-L1027 HydrophobicContact CE1-CD1 4.15Å; Y997-L1027 HydrophobicContact CG-CD1 4.17Å; A998-L1027 HydrophobicContact CB-CB 3.81Å; A998-L1027 HydrophobicContact CB-CD1 4.27Å; A1023-L1027 WeakPolarHBondContact O-CD1 3.49Å; A1023-L1027 VanDerWaalsContact O-CG 3.32Å; A1023-L1027 WeakPolarHBondContact O-CG 3.41Å; A1023-L1027 PolarHBondContact O-N 2.84Å; G1024-L1027 PolarHBondContact O-N 3.24Å; L1027-G1030 PolarHBondContact O-N 3.09Å; L1027-L1031 PolarHBondContact O-N 2.9Å; L1027-L1031 VanDerWaalsContact O-N 3.14Å
1028	I	94.1	Very high	90.6	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-67.9	-35.3	176.5	-65.1	-174	0	0	0	111.4	A998 G1024 I1025 L1031 C1032 L1044 C1047 M1048 L1051	A998-I1028 HydrophobicContact CB-CD1 4.32Å; A998-I1028 HydrophobicContact CB-CG1 3.78Å; G1024-I1028 WeakPolarHBondContact O-CG1 3.44Å; G1024-I1028 PolarHBondContact O-N 2.8Å; I1025-I1028 PolarHBondContact O-N 3.35Å; I1028-L1031 PolarHBondContact O-N 3.15Å; I1028-C1032 WeakPolarHBondContact O-CB 3.48Å; I1028-C1032 PolarHBondContact O-N 2.99Å; I1028-L1044 HydrophobicContact CG2-CB 4.19Å; I1028-L1044 HydrophobicContact CG2-CD2 4.05Å; I1028-L1044 WeakPolarHBondContact CG2-O 3.03Å; I1028-C1047 HydrophobicContact CD1-CB 4.23Å; I1028-C1047 VanDerWaalsContact CD1-SG 3.54Å; I1028-M1048 HydrophobicContact CG2-CB 3.97Å; I1028-M1048 HydrophobicContact CG2-CE 4.3Å; I1028-M1048 HydrophobicContact CG2-CG 4.47Å; I1028-L1051 HydrophobicContact CD1-CD1 3.74Å
1029	H	91.3	Very high	90.6	Very high	41 Å²	41	47.3 Å²	47.3	19%	0.19	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-43.4	173.7	-174.6	-103.9	0	0	0	112	M804 I1025 T1026 L1031 C1032 Q1033 M1048	M804-H1029 PolarHBondContact SD-CE1 2.71Å; M804-H1029 PolarHBondContact SD-ND1 3.47Å; I1025-H1029 VanDerWaalsContact O-CB 3.32Å; I1025-H1029 WeakPolarHBondContact O-CB 3.45Å; I1025-H1029 PolarHBondContact O-N 3.42Å; T1026-H1029 PolarHBondContact O-N 3.14Å; H1029-L1031 VanDerWaalsContact C-N 3.33Å; H1029-L1031 PolarHBondContact O-N 3.14Å; H1029-C1032 PolarHBondContact O-N 3.28Å; H1029-C1032 VanDerWaalsContact O-N 3.16Å; H1029-Q1033 PolarHBondContact CE1-NE2 3.4Å; H1029-Q1033 PolarHBondContact NE2-NE2 3.21Å; H1029-Q1033 VanDerWaalsContact NE2-NE2 3.1Å; H1029-Q1033 WeakPolarHBondContact O-CG 3.41Å; H1029-Q1033 PolarHBondContact O-N 2.84Å; H1029-M1048 HydrophobicContact CB-CE 3.98Å; H1029-M1048 HydrophobicContact CB-SD 3.97Å
1030	G	90.6	Very high	90.3	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-56.3	-44.4	173.1	0	0	0	0	0	113.2	Y924 T1026 L1027 Q1033 H1034	Y924-G1030 VanDerWaalsContact OH-C 3.24Å; Y924-G1030 WeakPolarHBondContact OH-CA 3.49Å; Y924-G1030 PolarHBondContact OH-O 3.08Å; T1026-G1030 PolarHBondContact O-N 2.93Å; L1027-G1030 PolarHBondContact O-N 3.09Å; G1030-Q1033 PolarHBondContact O-N 2.82Å; G1030-H1034 PolarHBondContact O-ND1 3.47Å
1031	L	91.9	Very high	90.2	Very high	11 Å²	11	48 Å²	48	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-43.1	174.1	-71.5	169.1	0	0	0	112.6	N991 I994 F995 L1027 I1028 H1029 Q1033 H1034 A1035 L1044	N991-L1031 HydrophobicContact CB-CD2 4.06Å; I994-L1031 HydrophobicContact CB-CD1 4.49Å; I994-L1031 HydrophobicContact CB-CD2 4.1Å; I994-L1031 HydrophobicContact CB-CG 4.39Å; I994-L1031 HydrophobicContact CG2-CD1 3.93Å; I994-L1031 HydrophobicContact CG2-CD2 3.95Å; I994-L1031 HydrophobicContact CG2-CG 3.73Å; F995-L1031 HydrophobicContact CB-CD1 3.76Å; F995-L1031 HydrophobicContact CD2-CD1 3.93Å; F995-L1031 HydrophobicContact CG-CD1 4.36Å; L1027-L1031 PolarHBondContact O-N 2.9Å; L1027-L1031 VanDerWaalsContact O-N 3.14Å; I1028-L1031 PolarHBondContact O-N 3.15Å; H1029-L1031 VanDerWaalsContact C-N 3.33Å; H1029-L1031 PolarHBondContact O-N 3.14Å; L1031-Q1033 VanDerWaalsContact C-N 3.26Å; L1031-Q1033 PolarHBondContact O-N 3.39Å; L1031-H1034 CarbonylContact O-C 3.6Å; L1031-H1034 WeakPolarHBondContact O-CA 3.43Å; L1031-H1034 PolarHBondContact O-N 3.12Å; L1031-A1035 PolarHBondContact O-N 3.27Å; L1031-L1044 HydrophobicContact CB-CD1 3.97Å; L1031-L1044 HydrophobicContact CB-CD2 4.22Å; L1031-L1044 HydrophobicContact CD1-CD2 4.37Å
1032	C	89.7	Confident	90	Very high	26 Å²	26	50.5 Å²	50.5	18%	0.176	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-32.6	-178	-167.4	0	0	0	0	112.7	I1028 H1029 H1034 L1044 M1048	I1028-C1032 WeakPolarHBondContact O-CB 3.48Å; I1028-C1032 PolarHBondContact O-N 2.99Å; H1029-C1032 PolarHBondContact O-N 3.28Å; H1029-C1032 VanDerWaalsContact O-N 3.16Å; C1032-H1034 PolarHBondContact O-N 2.69Å; C1032-L1044 HydrophobicContact CB-CB 4.17Å; C1032-M1048 HydrophobicContact CB-CE 3.92Å
1033	Q	83.3	Confident	89.8	Confident	126 Å²	126	53.2 Å²	53.2	59%	0.589	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-17.8	173.7	-60.6	-62.8	-20.5	0	0	113.2	H1029 G1030 L1031	H1029-Q1033 PolarHBondContact CE1-NE2 3.4Å; H1029-Q1033 PolarHBondContact NE2-NE2 3.21Å; H1029-Q1033 VanDerWaalsContact NE2-NE2 3.1Å; H1029-Q1033 WeakPolarHBondContact O-CG 3.41Å; H1029-Q1033 PolarHBondContact O-N 2.84Å; G1030-Q1033 PolarHBondContact O-N 2.82Å; L1031-Q1033 VanDerWaalsContact C-N 3.26Å; L1031-Q1033 PolarHBondContact O-N 3.39Å
1034	H	78.8	Confident	89.6	Confident	49 Å²	49	53.9 Å²	53.9	23%	0.227	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-6.3	-176.1	-74.3	81.9	0	0	0	114.7	R920 Y923 Y924 G1030 L1031 C1032 K1036	R920-H1034 PolarHBondContact NH1-CD2 2.91Å; Y923-H1034 AromaticContact CD1-NE2 3.82Å; Y923-H1034 AromaticContact CE1-CE1 3.99Å; Y923-H1034 AromaticContact CE1-NE2 3.21Å; Y923-H1034 WeakPolarHBondContact CE1-NE2 3.39Å; Y924-H1034 AromaticContact CE1-CE1 3.29Å; Y924-H1034 WeakPolarHBondContact CE1-CE1 3.5Å; Y924-H1034 AromaticContact CE1-ND1 3.89Å; Y924-H1034 AromaticContact CZ-CE1 3.49Å; Y924-H1034 VanDerWaalsContact CZ-CE1 3.49Å; Y924-H1034 AromaticContact CZ-ND1 3.8Å; Y924-H1034 PolarHBondContact OH-CE1 2.82Å; Y924-H1034 PolarHBondContact OH-ND1 2.93Å; G1030-H1034 PolarHBondContact O-ND1 3.47Å; L1031-H1034 CarbonylContact O-C 3.6Å; L1031-H1034 WeakPolarHBondContact O-CA 3.43Å; L1031-H1034 PolarHBondContact O-N 3.12Å; C1032-H1034 PolarHBondContact O-N 2.69Å; H1034-K1036 PolarHBondContact O-N 3.34Å
1035	A	85	Confident	89.4	Confident	13 Å²	13	57 Å²	57	11%	0.107	28%	0.283	C	S	.	.			trans	-65.8	118.3	177.1	0	0	0	0	0	110.6	L1031 D1040 K1041 L1044	L1031-A1035 PolarHBondContact O-N 3.27Å; A1035-D1040 HydrophobicContact CB-CB 3.91Å; A1035-K1041 HydrophobicContact CB-CG 3.68Å; A1035-K1041 WeakPolarHBondContact O-CE 3.4Å; A1035-L1044 HydrophobicContact CB-CD1 4.16Å
1036	K	85.4	Confident	89.1	Confident	148 Å²	148	60.5 Å²	60.5	64%	0.643	30%	0.302	S	S	*	.			trans	-70.8	-46.1	171.3	-72.8	-175.6	177.7	174.9	0	110.8	E426 H1034	E426-K1036 IonicContact OE2-NZ 3.96Å; E426-K1036 PolarHBondContact OE2-NZ 2.77Å; H1034-K1036 PolarHBondContact O-N 3.34Å
1037	S	89.9	Confident	88.9	Confident	47 Å²	47	62 Å²	62	33%	0.329	31%	0.312	S	S	.	.	S	Bend	trans	-73.4	136.8	-177.8	172.8	0	0	0	0	113	R1039 D1040 K1041	S1037-R1039 VanDerWaalsContact C-N 3.26Å; S1037-R1039 PolarHBondContact O-N 3.11Å; S1037-R1039 WeakPolarHBondContact OG-CB 3.49Å; S1037-R1039 PolarHBondContact OG-N 2.99Å; S1037-D1040 WeakPolarHBondContact CB-OD2 3.48Å; S1037-D1040 PolarHBondContact O-N 3.02Å; S1037-K1041 PolarHBondContact O-N 3.2Å; S1037-K1041 VanDerWaalsContact O-N 3.08Å
1038	Q	87.8	Confident	88.7	Confident	128 Å²	128	62.6 Å²	62.6	60%	0.598	32%	0.315	S	S	*	.	H	α-helix	trans	-67.5	-27	173.1	-173.3	61.6	15.8	0	0	112.4	T1042	Q1038-T1042 PolarHBondContact O-N 3.41Å; Q1038-T1042 PolarHBondContact O-OG1 2.73Å
1039	R	89.1	Confident	88.5	Confident	183 Å²	183	67.5 Å²	67.5	69%	0.691	33%	0.334	S	S	*	.	H	α-helix	trans	-65.3	-41.5	172.3	-174.2	-175.8	177.3	108.6	-1	110.8	S1037 T1042 L1043	S1037-R1039 VanDerWaalsContact C-N 3.26Å; S1037-R1039 PolarHBondContact O-N 3.11Å; S1037-R1039 WeakPolarHBondContact OG-CB 3.49Å; S1037-R1039 PolarHBondContact OG-N 2.99Å; R1039-T1042 WeakPolarHBondContact CA-OG1 3.47Å; R1039-T1042 PolarHBondContact O-N 3.29Å; R1039-T1042 PolarHBondContact O-OG1 2.93Å; R1039-L1043 HydrophobicContact CG-CD1 4.04Å; R1039-L1043 WeakPolarHBondContact O-CB 3.15Å; R1039-L1043 VanDerWaalsContact O-CG 3.29Å; R1039-L1043 WeakPolarHBondContact O-CG 3.18Å; R1039-L1043 PolarHBondContact O-N 3.44Å
1040	D	87.3	Confident	88.4	Confident	76 Å²	76	67.8 Å²	67.8	41%	0.406	34%	0.336	S	S	.	.	H	α-helix	trans	-72.6	-39.4	-179.2	-57.1	-8.8	0	0	0	110.6	A1035 S1037 T1042 L1043 L1044	A1035-D1040 HydrophobicContact CB-CB 3.91Å; S1037-D1040 WeakPolarHBondContact CB-OD2 3.48Å; S1037-D1040 PolarHBondContact O-N 3.02Å; D1040-T1042 VanDerWaalsContact C-N 3.34Å; D1040-T1042 PolarHBondContact O-N 3.33Å; D1040-L1043 PolarHBondContact O-N 2.92Å; D1040-L1044 VanDerWaalsContact O-CB 3.27Å; D1040-L1044 WeakPolarHBondContact O-CB 3.42Å; D1040-L1044 WeakPolarHBondContact O-CD1 3.29Å; D1040-L1044 WeakPolarHBondContact O-CG 3.44Å; D1040-L1044 PolarHBondContact O-N 3.47Å
1041	K	88.5	Confident	88.5	Confident	84 Å²	84	68.5 Å²	68.5	37%	0.365	34%	0.339	S	S	.	.	H	α-helix	trans	-57.6	-44.7	172.1	-71.1	-179.7	-171.5	179.2	0	112.3	A1035 S1037 S1045	A1035-K1041 HydrophobicContact CB-CG 3.68Å; A1035-K1041 WeakPolarHBondContact O-CE 3.4Å; S1037-K1041 PolarHBondContact O-N 3.2Å; S1037-K1041 VanDerWaalsContact O-N 3.08Å; K1041-S1045 WeakPolarHBondContact O-CB 3.47Å; K1041-S1045 PolarHBondContact O-N 2.85Å
1042	T	90.8	Very high	88.5	Confident	67 Å²	67	72.6 Å²	72.6	41%	0.411	35%	0.354	S	S	.	.	H	α-helix	trans	-67.4	-47.6	178.7	41.1	0	0	0	0	111.6	Q1038 R1039 D1040 L1044 S1045 D1046	Q1038-T1042 PolarHBondContact O-N 3.41Å; Q1038-T1042 PolarHBondContact O-OG1 2.73Å; R1039-T1042 WeakPolarHBondContact CA-OG1 3.47Å; R1039-T1042 PolarHBondContact O-N 3.29Å; R1039-T1042 PolarHBondContact O-OG1 2.93Å; D1040-T1042 VanDerWaalsContact C-N 3.34Å; D1040-T1042 PolarHBondContact O-N 3.33Å; T1042-L1044 PolarHBondContact O-N 3.34Å; T1042-S1045 WeakPolarHBondContact O-CB 3.49Å; T1042-S1045 PolarHBondContact O-N 3.16Å; T1042-D1046 PolarHBondContact O-N 3.18Å
1043	L	90.2	Very high	88.4	Confident	103 Å²	103	76 Å²	76	54%	0.539	37%	0.368	S	S	.	.	H	α-helix	trans	-61.1	-41.7	176.7	-70.1	170.2	0	0	0	113.4	R1039 D1040 C1047	R1039-L1043 HydrophobicContact CG-CD1 4.04Å; R1039-L1043 WeakPolarHBondContact O-CB 3.15Å; R1039-L1043 VanDerWaalsContact O-CG 3.29Å; R1039-L1043 WeakPolarHBondContact O-CG 3.18Å; R1039-L1043 PolarHBondContact O-N 3.44Å; D1040-L1043 PolarHBondContact O-N 2.92Å; L1043-C1047 WeakPolarHBondContact O-CB 3.24Å; L1043-C1047 PolarHBondContact O-N 3.32Å
1044	L	90.8	Very high	88.8	Confident	22 Å²	22	74.5 Å²	74.5	12%	0.115	36%	0.356	C	S	.	.	H	α-helix	trans	-69.6	-36.2	176.2	-68.7	167	0	0	0	111.8	F995 I1028 L1031 C1032 A1035 D1040 T1042 M1048	F995-L1044 HydrophobicContact CD2-CD2 4.19Å; F995-L1044 HydrophobicContact CE2-CD2 4.18Å; I1028-L1044 HydrophobicContact CG2-CB 4.19Å; I1028-L1044 HydrophobicContact CG2-CD2 4.05Å; I1028-L1044 WeakPolarHBondContact CG2-O 3.03Å; L1031-L1044 HydrophobicContact CB-CD1 3.97Å; L1031-L1044 HydrophobicContact CB-CD2 4.22Å; L1031-L1044 HydrophobicContact CD1-CD2 4.37Å; C1032-L1044 HydrophobicContact CB-CB 4.17Å; A1035-L1044 HydrophobicContact CB-CD1 4.16Å; D1040-L1044 VanDerWaalsContact O-CB 3.27Å; D1040-L1044 WeakPolarHBondContact O-CB 3.42Å; D1040-L1044 WeakPolarHBondContact O-CD1 3.29Å; D1040-L1044 WeakPolarHBondContact O-CG 3.44Å; D1040-L1044 PolarHBondContact O-N 3.47Å; T1042-L1044 PolarHBondContact O-N 3.34Å; L1044-M1048 VanDerWaalsContact O-CB 3.27Å; L1044-M1048 WeakPolarHBondContact O-CB 3.1Å; L1044-M1048 PolarHBondContact O-N 2.97Å
1045	S	88.8	Confident	89.4	Confident	66 Å²	66	74.2 Å²	74.2	46%	0.462	35%	0.354	S	S	.	.	H	α-helix	trans	-63.1	-47.5	173.6	-173.3	0	0	0	0	111.7	K1041 T1042 C1047 M1048 R1049	K1041-S1045 WeakPolarHBondContact O-CB 3.47Å; K1041-S1045 PolarHBondContact O-N 2.85Å; T1042-S1045 WeakPolarHBondContact O-CB 3.49Å; T1042-S1045 PolarHBondContact O-N 3.16Å; S1045-C1047 PolarHBondContact O-N 2.83Å; S1045-M1048 WeakPolarHBondContact O-CB 3.31Å; S1045-M1048 PolarHBondContact O-N 3.43Å; S1045-R1049 WeakPolarHBondContact O-CB 3.46Å; S1045-R1049 PolarHBondContact O-N 3.04Å
1046	D	88.5	Confident	89.6	Confident	76 Å²	76	76.2 Å²	76.2	41%	0.406	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-41.9	176.9	-94.1	-51.4	0	0	0	112.6	T1042 M1048 R1049 L1050	T1042-D1046 PolarHBondContact O-N 3.18Å; D1046-M1048 VanDerWaalsContact C-N 3.35Å; D1046-M1048 PolarHBondContact O-N 3.27Å; D1046-R1049 WeakPolarHBondContact O-CB 3.23Å; D1046-R1049 PolarHBondContact O-N 3.43Å; D1046-R1049 IonicContact OD1-CZ 3.11Å; D1046-R1049 IonicContact OD1-NE 2.76Å; D1046-R1049 PolarHBondContact OD1-NE 2.72Å; D1046-R1049 VanDerWaalsContact OD1-NE 3.12Å; D1046-R1049 IonicContact OD1-NH2 3.52Å; D1046-R1049 PolarHBondContact OD1-NH2 3.04Å; D1046-L1050 WeakPolarHBondContact O-CG 2.97Å; D1046-L1050 PolarHBondContact O-N 2.82Å
1047	C	89.6	Confident	89.7	Confident	33 Å²	33	72.1 Å²	72.1	22%	0.223	36%	0.36	C	S	.	.	H	α-helix	trans	-61.8	-44	174.3	-164.7	0	0	0	0	111.2	I1028 L1043 S1045 R1049 L1050 L1051	I1028-C1047 HydrophobicContact CD1-CB 4.23Å; I1028-C1047 VanDerWaalsContact CD1-SG 3.54Å; L1043-C1047 WeakPolarHBondContact O-CB 3.24Å; L1043-C1047 PolarHBondContact O-N 3.32Å; S1045-C1047 PolarHBondContact O-N 2.83Å; C1047-R1049 VanDerWaalsContact C-N 3.34Å; C1047-R1049 PolarHBondContact O-N 2.78Å; C1047-L1050 PolarHBondContact O-N 3.48Å; C1047-L1051 WeakPolarHBondContact O-CG 3.43Å; C1047-L1051 PolarHBondContact O-N 2.97Å
1048	M	90.9	Very high	89.5	Confident	12 Å²	12	70.1 Å²	70.1	6%	0.059	35%	0.345	C	S	.	.	H	α-helix	trans	-63.9	-36.9	176.2	-161.5	-168.8	-39.2	0	0	112.6	I1025 I1028 H1029 C1032 L1044 S1045 D1046 L1051 R1052	I1025-M1048 HydrophobicContact CG2-CG 4.01Å; I1028-M1048 HydrophobicContact CG2-CB 3.97Å; I1028-M1048 HydrophobicContact CG2-CE 4.3Å; I1028-M1048 HydrophobicContact CG2-CG 4.47Å; H1029-M1048 HydrophobicContact CB-CE 3.98Å; H1029-M1048 HydrophobicContact CB-SD 3.97Å; C1032-M1048 HydrophobicContact CB-CE 3.92Å; L1044-M1048 VanDerWaalsContact O-CB 3.27Å; L1044-M1048 WeakPolarHBondContact O-CB 3.1Å; L1044-M1048 PolarHBondContact O-N 2.97Å; S1045-M1048 WeakPolarHBondContact O-CB 3.31Å; S1045-M1048 PolarHBondContact O-N 3.43Å; D1046-M1048 VanDerWaalsContact C-N 3.35Å; D1046-M1048 PolarHBondContact O-N 3.27Å; M1048-L1051 PolarHBondContact O-N 3.11Å; M1048-R1052 WeakPolarHBondContact O-CB 3.15Å; M1048-R1052 VanDerWaalsContact O-CG 3.25Å; M1048-R1052 WeakPolarHBondContact O-CG 3.45Å; M1048-R1052 PolarHBondContact O-N 3.33Å; M1048-R1052 PolarHBondContact SD-NH2 3.02Å
1049	R	90.3	Very high	89.5	Confident	106 Å²	106	69.9 Å²	69.9	40%	0.4	34%	0.339	S	S	.	.	H	α-helix	trans	-61.9	-50.5	174.3	179.6	-175.5	57.6	69.4	3.1	110.8	S1045 D1046 C1047 L1051 R1052 E1053	S1045-R1049 WeakPolarHBondContact O-CB 3.46Å; S1045-R1049 PolarHBondContact O-N 3.04Å; D1046-R1049 WeakPolarHBondContact O-CB 3.23Å; D1046-R1049 PolarHBondContact O-N 3.43Å; D1046-R1049 IonicContact OD1-CZ 3.11Å; D1046-R1049 IonicContact OD1-NE 2.76Å; D1046-R1049 PolarHBondContact OD1-NE 2.72Å; D1046-R1049 VanDerWaalsContact OD1-NE 3.12Å; D1046-R1049 IonicContact OD1-NH2 3.52Å; D1046-R1049 PolarHBondContact OD1-NH2 3.04Å; C1047-R1049 VanDerWaalsContact C-N 3.34Å; C1047-R1049 PolarHBondContact O-N 2.78Å; R1049-L1051 VanDerWaalsContact C-N 3.31Å; R1049-L1051 PolarHBondContact O-N 3.5Å; R1049-R1052 PolarHBondContact O-N 3.15Å; R1049-R1052 VanDerWaalsContact O-N 3.12Å; R1049-E1053 WeakPolarHBondContact CD-OE1 3Å; R1049-E1053 HydrophobicContact CG-CG 4.47Å; R1049-E1053 WeakPolarHBondContact CG-OE1 3.43Å; R1049-E1053 IonicContact CZ-OE1 2.75Å; R1049-E1053 VanDerWaalsContact NH1-CD 3.29Å; R1049-E1053 IonicContact NH1-OE1 2.69Å; R1049-E1053 PolarHBondContact NH1-OE1 3.02Å; R1049-E1053 IonicContact NH1-OE2 3.58Å; R1049-E1053 PolarHBondContact NH1-OE2 3.26Å; R1049-E1053 VanDerWaalsContact NH1-OE2 3.11Å; R1049-E1053 WeakPolarHBondContact O-CG 3.45Å; R1049-E1053 PolarHBondContact O-N 2.87Å
1050	L	90	Very high	89.2	Confident	47 Å²	47	63.4 Å²	63.4	25%	0.246	32%	0.322	C	S	.	.	H	α-helix	trans	-58.8	-40.6	177.6	-69	169.2	0	0	0	112.3	D1046 C1047 R1054 L1138	D1046-L1050 WeakPolarHBondContact O-CG 2.97Å; D1046-L1050 PolarHBondContact O-N 2.82Å; C1047-L1050 PolarHBondContact O-N 3.48Å; L1050-R1054 WeakPolarHBondContact O-CB 3.25Å; L1050-R1054 PolarHBondContact O-N 3.35Å; L1050-L1138 HydrophobicContact CD1-CD2 3.96Å; L1050-L1138 HydrophobicContact CD1-CG 4.26Å
1051	L	91.4	Very high	88.9	Confident	15 Å²	15	63.6 Å²	63.6	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-67.5	-38.6	175.1	-64.4	-175.1	0	0	0	112.8	C1002 Y1021 I1025 I1028 C1047 M1048 R1049 R1054 Y1055	C1002-L1051 HydrophobicContact CB-CD2 4.34Å; C1002-L1051 VanDerWaalsContact SG-CD1 3.52Å; C1002-L1051 VanDerWaalsContact SG-CD2 3.52Å; Y1021-L1051 HydrophobicContact CD1-CD2 4.11Å; Y1021-L1051 HydrophobicContact CE1-CD2 4.16Å; I1025-L1051 HydrophobicContact CD1-CB 4.22Å; I1025-L1051 HydrophobicContact CG1-CB 3.59Å; I1025-L1051 HydrophobicContact CG1-CD1 4.28Å; I1028-L1051 HydrophobicContact CD1-CD1 3.74Å; C1047-L1051 WeakPolarHBondContact O-CG 3.43Å; C1047-L1051 PolarHBondContact O-N 2.97Å; M1048-L1051 PolarHBondContact O-N 3.11Å; R1049-L1051 VanDerWaalsContact C-N 3.31Å; R1049-L1051 PolarHBondContact O-N 3.5Å; L1051-R1054 PolarHBondContact O-N 2.84Å; L1051-Y1055 VanDerWaalsContact O-CB 3.32Å; L1051-Y1055 WeakPolarHBondContact O-CB 3.38Å; L1051-Y1055 PolarHBondContact O-N 3.13Å
1052	R	91.4	Very high	88.3	Confident	98 Å²	98	61.9 Å²	61.9	37%	0.37	33%	0.328	S	S	.	.	H	α-helix	trans	-66	-43	175.4	-74.5	171.6	-178.7	-160.3	2.5	111.9	I1025 M1048 R1049 R1054 Y1055 A1056	I1025-R1052 HydrophobicContact CD1-CG 3.93Å; I1025-R1052 HydrophobicContact CG1-CG 4.29Å; I1025-R1052 HydrophobicContact CG2-CG 4.25Å; M1048-R1052 WeakPolarHBondContact O-CB 3.15Å; M1048-R1052 VanDerWaalsContact O-CG 3.25Å; M1048-R1052 WeakPolarHBondContact O-CG 3.45Å; M1048-R1052 PolarHBondContact O-N 3.33Å; M1048-R1052 PolarHBondContact SD-NH2 3.02Å; R1049-R1052 PolarHBondContact O-N 3.15Å; R1049-R1052 VanDerWaalsContact O-N 3.12Å; R1052-R1054 VanDerWaalsContact C-N 3.34Å; R1052-R1054 PolarHBondContact O-N 2.81Å; R1052-Y1055 PolarHBondContact O-N 2.68Å; R1052-A1056 WeakPolarHBondContact O-CB 3.31Å; R1052-A1056 PolarHBondContact O-N 3.2Å
1053	E	89.3	Confident	87.5	Confident	98 Å²	98	62.4 Å²	62.4	46%	0.458	33%	0.331	S	S	.	.	H	α-helix	trans	-58.6	-45.3	173.7	-73.6	166	-173.4	0	0	111	R1049 A1056 C1057	R1049-E1053 WeakPolarHBondContact CD-OE1 3Å; R1049-E1053 HydrophobicContact CG-CG 4.47Å; R1049-E1053 WeakPolarHBondContact CG-OE1 3.43Å; R1049-E1053 IonicContact CZ-OE1 2.75Å; R1049-E1053 VanDerWaalsContact NH1-CD 3.29Å; R1049-E1053 IonicContact NH1-OE1 2.69Å; R1049-E1053 PolarHBondContact NH1-OE1 3.02Å; R1049-E1053 IonicContact NH1-OE2 3.58Å; R1049-E1053 PolarHBondContact NH1-OE2 3.26Å; R1049-E1053 VanDerWaalsContact NH1-OE2 3.11Å; R1049-E1053 WeakPolarHBondContact O-CG 3.45Å; R1049-E1053 PolarHBondContact O-N 2.87Å; E1053-A1056 PolarHBondContact O-N 3.47Å; E1053-C1057 WeakPolarHBondContact O-CB 3.49Å; E1053-C1057 PolarHBondContact O-N 3.39Å
1054	R	90	Very high	86.5	Confident	93 Å²	93	64.3 Å²	64.3	35%	0.351	34%	0.335	S	S	.	.	H	α-helix	trans	-65.8	-44.6	177	-173.9	52.2	168.3	177.9	-6.2	112.7	E1009 Y1021 L1050 L1051 R1052 C1057 L1058	E1009-R1054 IonicContact OE1-CZ 2.64Å; E1009-R1054 VanDerWaalsContact OE1-CZ 3.23Å; E1009-R1054 IonicContact OE1-NE 2.71Å; E1009-R1054 IonicContact OE1-NH1 3.1Å; E1009-R1054 IonicContact OE1-NH2 2.72Å; E1009-R1054 PolarHBondContact OE1-NH2 2.7Å; E1009-R1054 IonicContact OE2-CZ 3.58Å; E1009-R1054 IonicContact OE2-NE 2.76Å; E1009-R1054 PolarHBondContact OE2-NE 3.47Å; E1009-R1054 IonicContact OE2-NH2 2.78Å; E1009-R1054 PolarHBondContact OE2-NH2 3.44Å; Y1021-R1054 HydrophobicContact CD2-CG 4.48Å; Y1021-R1054 HydrophobicContact CE1-CG 3.95Å; Y1021-R1054 HydrophobicContact CE2-CG 3.81Å; L1050-R1054 WeakPolarHBondContact O-CB 3.25Å; L1050-R1054 PolarHBondContact O-N 3.35Å; L1051-R1054 PolarHBondContact O-N 2.84Å; R1052-R1054 VanDerWaalsContact C-N 3.34Å; R1052-R1054 PolarHBondContact O-N 2.81Å; R1054-C1057 PolarHBondContact O-N 2.7Å; R1054-L1058 WeakPolarHBondContact O-CB 3.17Å; R1054-L1058 PolarHBondContact O-N 3.42Å
1055	Y	91.7	Very high	83.9	Confident	43 Å²	43	67.1 Å²	67.1	17%	0.169	35%	0.354	C	S	.	.	H	α-helix	trans	-58.8	-47	175.5	179.9	-87.4	0	0	0	111.5	L779 L1018 K1022 I1025 L1051 R1052 L1058 W1059	L779-Y1055 HydrophobicContact CD1-CD1 4.15Å; L779-Y1055 HydrophobicContact CD1-CE1 3.77Å; L779-Y1055 HydrophobicContact CD1-CE2 4.5Å; L1018-Y1055 HydrophobicContact CB-CE2 4.04Å; L1018-Y1055 HydrophobicContact CD2-CD2 3.73Å; L1018-Y1055 HydrophobicContact CD2-CE2 3.62Å; L1018-Y1055 HydrophobicContact CD2-CG 4.27Å; L1018-Y1055 HydrophobicContact CG-CE2 4.46Å; L1018-Y1055 WeakPolarHBondContact O-CE2 3.18Å; K1022-Y1055 HydrophobicContact CB-CE2 4.15Å; I1025-Y1055 HydrophobicContact CD1-CG 4.45Å; L1051-Y1055 VanDerWaalsContact O-CB 3.32Å; L1051-Y1055 WeakPolarHBondContact O-CB 3.38Å; L1051-Y1055 PolarHBondContact O-N 3.13Å; R1052-Y1055 PolarHBondContact O-N 2.68Å; Y1055-L1058 PolarHBondContact O-N 3.13Å; Y1055-W1059 VanDerWaalsContact O-CB 3.31Å; Y1055-W1059 WeakPolarHBondContact O-CB 3.41Å; Y1055-W1059 PolarHBondContact O-N 3Å
1056	A	89.4	Confident	81.2	Confident	55 Å²	55	70.6 Å²	70.6	46%	0.455	37%	0.368	S	S	.	.	H	α-helix	trans	-64.4	-41.3	178.8	0	0	0	0	0	112.4	R1052 E1053 W1059 S1060	R1052-A1056 WeakPolarHBondContact O-CB 3.31Å; R1052-A1056 PolarHBondContact O-N 3.2Å; E1053-A1056 PolarHBondContact O-N 3.47Å; A1056-W1059 PolarHBondContact O-N 3.37Å; A1056-S1060 WeakPolarHBondContact O-CB 3.16Å; A1056-S1060 PolarHBondContact O-N 3.2Å
1057	C	88.3	Confident	78.6	Confident	63 Å²	63	75.2 Å²	75.2	43%	0.426	39%	0.391	S	S	.	.	H	α-helix	trans	-58.8	-48.4	173.9	-179	0	0	0	0	111.5	E1053 R1054 S1060 T1061	E1053-C1057 WeakPolarHBondContact O-CB 3.49Å; E1053-C1057 PolarHBondContact O-N 3.39Å; R1054-C1057 PolarHBondContact O-N 2.7Å; C1057-S1060 PolarHBondContact O-N 2.79Å; C1057-S1060 PolarHBondContact O-OG 3.16Å; C1057-T1061 PolarHBondContact O-N 2.86Å; C1057-T1061 PolarHBondContact O-OG1 2.84Å
1058	L	85.9	Confident	75.8	Confident	5 Å²	5	81.6 Å²	81.6	3%	0.026	42%	0.418	C	S	.	.	H	α-helix	trans	-65.7	-42.1	178.5	-174.6	60.9	0	0	0	112.1	E1009 I1014 S1017 L1018 Y1021 R1054 Y1055 S1060 T1061 A1062	E1009-L1058 HydrophobicContact CG-CD1 3.91Å; I1014-L1058 HydrophobicContact CG1-CD1 4.27Å; I1014-L1058 HydrophobicContact CG2-CD1 3.88Å; I1014-L1058 HydrophobicContact CG2-CG 4.04Å; S1017-L1058 VanDerWaalsContact OG-CD2 3.26Å; S1017-L1058 WeakPolarHBondContact OG-CD2 3.01Å; L1018-L1058 HydrophobicContact CD2-CB 4.05Å; L1018-L1058 HydrophobicContact CD2-CD2 3.91Å; L1018-L1058 HydrophobicContact CD2-CG 3.91Å; L1018-L1058 HydrophobicContact CG-CD2 3.84Å; L1018-L1058 HydrophobicContact CG-CG 4.03Å; Y1021-L1058 HydrophobicContact CD2-CD2 4.11Å; Y1021-L1058 HydrophobicContact CE2-CD2 4.26Å; R1054-L1058 WeakPolarHBondContact O-CB 3.17Å; R1054-L1058 PolarHBondContact O-N 3.42Å; Y1055-L1058 PolarHBondContact O-N 3.13Å; L1058-S1060 PolarHBondContact O-N 3.36Å; L1058-T1061 WeakPolarHBondContact O-CA 3.5Å; L1058-T1061 WeakPolarHBondContact O-CB 3.48Å; L1058-T1061 PolarHBondContact O-N 2.67Å; L1058-A1062 PolarHBondContact O-N 2.87Å
1059	W	87.9	Confident	72.8	Confident	122 Å²	122	86.5 Å²	86.5	46%	0.462	45%	0.449	S	S	.	.	H	α-helix	trans	-61.1	-42	175.1	-174.2	-96.3	0	0	0	111.9	L1018 Y1055 A1056 T1061 A1062 T1063	L1018-W1059 HydrophobicContact CD1-CE3 3.77Å; L1018-W1059 HydrophobicContact CD1-CZ3 4.22Å; L1018-W1059 HydrophobicContact CD2-CB 4.14Å; L1018-W1059 HydrophobicContact CD2-CE3 4.13Å; Y1055-W1059 VanDerWaalsContact O-CB 3.31Å; Y1055-W1059 WeakPolarHBondContact O-CB 3.41Å; Y1055-W1059 PolarHBondContact O-N 3Å; A1056-W1059 PolarHBondContact O-N 3.37Å; W1059-T1061 PolarHBondContact O-N 2.85Å; W1059-A1062 PolarHBondContact O-N 3.4Å; W1059-T1063 HydrophobicContact CD2-CG2 4.24Å; W1059-T1063 HydrophobicContact CG-CG2 4.43Å; W1059-T1063 HydrophobicContact CZ2-CG2 4.11Å; W1059-T1063 WeakPolarHBondContact O-CB 3.42Å; W1059-T1063 WeakPolarHBondContact O-CG2 3.4Å; W1059-T1063 PolarHBondContact O-N 3.36Å; W1059-T1063 PolarHBondContact O-OG1 3.12Å
1060	S	83.2	Confident	69.8	Low	48 Å²	48	89 Å²	89	34%	0.336	47%	0.467	S	S	.	.	H	α-helix	trans	-66.8	-15.7	174.7	83.1	0	0	0	0	113.9	A1056 C1057 L1058 K1064	A1056-S1060 WeakPolarHBondContact O-CB 3.16Å; A1056-S1060 PolarHBondContact O-N 3.2Å; C1057-S1060 PolarHBondContact O-N 2.79Å; C1057-S1060 PolarHBondContact O-OG 3.16Å; L1058-S1060 PolarHBondContact O-N 3.36Å; S1060-K1064 VanDerWaalsContact O-CD 3.24Å; S1060-K1064 WeakPolarHBondContact O-CD 3.25Å; S1060-K1064 WeakPolarHBondContact O-CE 3.26Å; S1060-K1064 VanDerWaalsContact O-CG 3.31Å; S1060-K1064 WeakPolarHBondContact O-CG 3.26Å
1061	T	79.7	Confident	66.8	Low	80 Å²	80	94.2 Å²	94.2	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-88.4	-41	173.1	-53.6	0	0	0	0	110.1	C1057 L1058 W1059 T1063	C1057-T1061 PolarHBondContact O-N 2.86Å; C1057-T1061 PolarHBondContact O-OG1 2.84Å; L1058-T1061 WeakPolarHBondContact O-CA 3.5Å; L1058-T1061 WeakPolarHBondContact O-CB 3.48Å; L1058-T1061 PolarHBondContact O-N 2.67Å; W1059-T1061 PolarHBondContact O-N 2.85Å; T1061-T1063 VanDerWaalsContact C-N 3.34Å; T1061-T1063 PolarHBondContact O-N 2.98Å
1062	A	76.8	Confident	63.7	Low	48 Å²	48	103.2 Å²	103.2	40%	0.397	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-30.5	176.5	0	0	0	0	0	114.4	I1014 L1018 L1058 W1059	I1014-A1062 HydrophobicContact CG2-CB 3.75Å; L1018-A1062 HydrophobicContact CD1-CB 4.22Å; L1058-A1062 PolarHBondContact O-N 2.87Å; W1059-A1062 PolarHBondContact O-N 3.4Å
1063	T	74.5	Confident	60.7	Low	78 Å²	78	105.9 Å²	105.9	48%	0.479	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-1.1	-170.2	51.2	0	0	0	0	115.1	W1059 T1061 P1065	W1059-T1063 HydrophobicContact CD2-CG2 4.24Å; W1059-T1063 HydrophobicContact CG-CG2 4.43Å; W1059-T1063 HydrophobicContact CZ2-CG2 4.11Å; W1059-T1063 WeakPolarHBondContact O-CB 3.42Å; W1059-T1063 WeakPolarHBondContact O-CG2 3.4Å; W1059-T1063 PolarHBondContact O-N 3.36Å; W1059-T1063 PolarHBondContact O-OG1 3.12Å; T1061-T1063 VanDerWaalsContact C-N 3.34Å; T1061-T1063 PolarHBondContact O-N 2.98Å; T1063-P1065 WeakPolarHBondContact O-CD 3.41Å
1064	K	68.1	Low	57.8	Low	143 Å²	143	106.6 Å²	106.6	62%	0.622	55%	0.554	S	S	*	*			trans	-75.4	123	174.4	-82.1	166.1	-174.3	162.9	0	110.5	S1060	S1060-K1064 VanDerWaalsContact O-CD 3.24Å; S1060-K1064 WeakPolarHBondContact O-CD 3.25Å; S1060-K1064 WeakPolarHBondContact O-CE 3.26Å; S1060-K1064 VanDerWaalsContact O-CG 3.31Å; S1060-K1064 WeakPolarHBondContact O-CG 3.26Å
1065	P	37.2	Very low	54.8	Low	81 Å²	81	109.5 Å²	109.5	53%	0.526	58%	0.576	S	S	.	*	S	Bend	trans	-67	144	169.5	28.3	-32.4	0	0	0	110.3	Y761 T1063	Y761-P1065 WeakPolarHBondContact OH-CB 3.43Å; T1063-P1065 WeakPolarHBondContact O-CD 3.41Å
1066	N	31.7	Very low	51.8	Low	139 Å²	139	113.4 Å²	113.4	74%	0.743	61%	0.605	S	S	*	*			trans	63.6	69.3	173.2	-54.2	-33.3	0	0	0	116.4
1067	L	33.2	Very low	49	Very low	172 Å²	172	117.2 Å²	117.2	90%	0.901	62%	0.622	S	S	*	*				-103.7	110.5	121.2	-106.4	83.2	0	0	0	108.2
1068	Q	30.6	Very low	46.3	Very low	167 Å²	167	122.9 Å²	122.9	78%	0.78	65%	0.645	S	S	*	*			trans	-74.8	156.9	169.8	-76	176.8	-34	0	0	110.6	M1070	Q1068-M1070 PolarHBondContact O-N 3.17Å
1069	T	29.2	Very low	43.6	Very low	115 Å²	115	127.6 Å²	127.6	71%	0.706	68%	0.676	S	S	*	*			trans	-25.7	119.6	164.8	-31.4	0	0	0	0	113.8	H1071	T1069-H1071 PolarHBondContact O-N 3.3Å
1070	M	26.8	Very low	40.8	Very low	159 Å²	159	128.1 Å²	128.1	78%	0.783	69%	0.693	S	S	*	*			trans	-69.9	75.6	166.8	-84.4	-70.3	-68.3	0	0	110.2	Q1068 Y1072	Q1068-M1070 PolarHBondContact O-N 3.17Å; M1070-Y1072 HydrophobicContact CE-CD2 4.45Å; M1070-Y1072 HydrophobicContact CE-CE2 4.12Å; M1070-Y1072 PolarHBondContact O-N 3.09Å; M1070-Y1072 VanDerWaalsContact O-N 3.08Å
1071	H	27.6	Very low	38.4	Very low	157 Å²	157	132.2 Å²	132.2	73%	0.727	72%	0.716	S	S	*	*			trans	-72.3	96.1	171.7	-107.8	-64.2	0	0	0	109.7	T1069 Q1073	T1069-H1071 PolarHBondContact O-N 3.3Å; H1071-Q1073 PolarHBondContact O-N 2.86Å
1072	Y	26.3	Very low	36	Very low	203 Å²	203	134.9 Å²	134.9	80%	0.796	73%	0.732	S	S	*	*			trans	-68.3	107.1	160.6	-104.6	-91.9	0	0	0	108.9	M1070	M1070-Y1072 HydrophobicContact CE-CD2 4.45Å; M1070-Y1072 HydrophobicContact CE-CE2 4.12Å; M1070-Y1072 PolarHBondContact O-N 3.09Å; M1070-Y1072 VanDerWaalsContact O-N 3.08Å
1073	Q	27.1	Very low	33.9	Very low	154 Å²	154	139.3 Å²	139.3	72%	0.72	76%	0.755	S	S	*	*			trans	-87.4	141.4	155.6	-75.2	-161.9	-60.4	0	0	109.4	H1071 D1075	H1071-Q1073 PolarHBondContact O-N 2.86Å; Q1073-D1075 VanDerWaalsContact C-N 3.34Å; Q1073-D1075 PolarHBondContact O-N 2.88Å; Q1073-D1075 VanDerWaalsContact O-N 3.08Å
1074	P	28.5	Very low	31.8	Very low	114 Å²	114	139.7 Å²	139.7	74%	0.74	77%	0.766	S	S	*	*			trans	-86.3	69.9	-177.2	35.6	-35.8	0	0	0	111.5	T1076	P1074-T1076 PolarHBondContact O-N 3.15Å; P1074-T1076 VanDerWaalsContact O-N 3.08Å; P1074-T1076 PolarHBondContact O-OG1 3.49Å
1075	D	27.9	Very low	30.1	Very low	153 Å²	153	138.7 Å²	138.7	82%	0.818	77%	0.772	S	S	*	*			trans	-67.6	111.8	176.8	-99.5	-25.4	0	0	0	111.1	Q1073	Q1073-D1075 VanDerWaalsContact C-N 3.34Å; Q1073-D1075 PolarHBondContact O-N 2.88Å; Q1073-D1075 VanDerWaalsContact O-N 3.08Å
1076	T	28	Very low	29.8	Very low	125 Å²	125	140.7 Å²	140.7	77%	0.767	78%	0.782	S	S	*	*			trans	-95.7	108.8	-172.3	-54.1	0	0	0	0	109.5	P1074	P1074-T1076 PolarHBondContact O-N 3.15Å; P1074-T1076 VanDerWaalsContact O-N 3.08Å; P1074-T1076 PolarHBondContact O-OG1 3.49Å
1077	T	31	Very low	29.9	Very low	135 Å²	135	139 Å²	139	83%	0.828	78%	0.777	S	S	*	*			trans	-161.7	102.4	159.1	3.4	0	0	0	0	112.5
1078	M	30.3	Very low	29.8	Very low	183 Å²	183	139.1 Å²	139.1	90%	0.901	77%	0.773	S	S	*	*			trans	-88.2	129.1	163.6	-77.3	-74.2	-163.9	0	0	109.5
1079	P	30.6	Very low	29.8	Very low	104 Å²	104	136.1 Å²	136.1	68%	0.675	77%	0.77	S	S	*	*			trans	-89.2	167.1	167.5	35.3	-33.1	0	0	0	112.1
1080	T	29.3	Very low	29.9	Very low	133 Å²	133	135.2 Å²	135.2	82%	0.816	77%	0.768	S	S	*	*			trans	70.5	137.7	-170.8	79.4	0	0	0	0	113.2
1081	T	32	Very low	30.2	Very low	134 Å²	134	134.8 Å²	134.8	82%	0.822	77%	0.769	S	S	*	*			cis	-128.2	162	21.2	35.8	0	0	0	0	113.9
1082	T	28.6	Very low	30.6	Very low	135 Å²	135	134.4 Å²	134.4	83%	0.828	77%	0.772	S	S	*	*			trans	-98.7	129.2	-176.3	-45.3	0	0	0	0	112.1
1083	T	34.2	Very low	30.8	Very low	142 Å²	142	131.4 Å²	131.4	87%	0.871	77%	0.77	S	S	*	*			trans	-157.8	148.3	149.5	6.1	0	0	0	0	111.1
1084	A	30.2	Very low	31.6	Very low	86 Å²	86	128.6 Å²	128.6	71%	0.711	77%	0.765	S	S	*	*			trans	-81.5	174.5	-178.8	0	0	0	0	0	111.5
1085	T	31.8	Very low	31.9	Very low	121 Å²	121	129 Å²	129	74%	0.742	77%	0.766	S	S	*	*			cis	-167.3	166	38.2	-38.9	0	0	0	0	111.7
1086	T	31.7	Very low	32.1	Very low	123 Å²	123	128.2 Å²	128.2	76%	0.755	76%	0.762	S	S	*	*			trans	71.5	139.8	164.1	13	0	0	0	0	115.9
1087	T	33.1	Very low	32.4	Very low	103 Å²	103	129 Å²	129	63%	0.632	76%	0.76	S	S	*	*			cis	-155.6	145.5	6	-31.5	0	0	0	0	110.7
1088	Q	30.6	Very low	32.2	Very low	176 Å²	176	129.8 Å²	129.8	82%	0.822	76%	0.758	S	S	*	*			trans	50.8	139.8	151.7	-76	167.5	10	0	0	119.9
1089	C	30.4	Very low	32.7	Very low	104 Å²	104	125.9 Å²	125.9	70%	0.703	75%	0.746	S	S	*	*			cis	-149.6	163.1	21.7	-109.4	0	0	0	0	112.2
1090	S	32.1	Very low	32.7	Very low	96 Å²	96	126 Å²	126	67%	0.671	75%	0.749	S	S	*	*			trans	27.7	131	147.8	-47.7	0	0	0	0	120.5
1091	N	33.1	Very low	32.8	Very low	150 Å²	150	126.9 Å²	126.9	80%	0.802	75%	0.749	S	S	*	*			cis	-163.2	178.4	3.4	-94.7	-24	0	0	0	106.9
1092	N	35.5	Very low	32.9	Very low	148 Å²	148	125 Å²	125	79%	0.791	74%	0.741	S	S	*	*			cis	-141.7	-160.4	11.3	-159.9	-1.1	0	0	0	110.3
1093	N	30.7	Very low	32.8	Very low	140 Å²	140	126 Å²	126	75%	0.749	74%	0.741	S	S	*	*			trans	-140.3	-171	-172.1	-138.9	12.4	0	0	0	113.4
1094	P	45.1	Very low	33.3	Very low	95 Å²	95	124.8 Å²	124.8	62%	0.617	74%	0.735	S	S	*	*				-136.2	-126.2	-110.9	47.1	-27	0	0	0	114.6
1095	T	34.1	Very low	33.4	Very low	123 Å²	123	128.2 Å²	128.2	76%	0.755	74%	0.742	S	S	*	*			trans	88.4	142.6	177.5	73.9	0	0	0	0	114.9
1096	N	32.8	Very low	33.9	Very low	137 Å²	137	127.2 Å²	127.2	73%	0.733	74%	0.737	S	S	*	*			cis	-160.5	172.7	1.3	-128.5	-7.2	0	0	0	109.2
1097	I	33.9	Very low	33.9	Very low	142 Å²	142	126.4 Å²	126.4	73%	0.728	74%	0.737	S	S	*	*			cis	-155.9	-166	-0.8	-156.7	164.8	0	0	0	109.8
1098	L	25.5	Very low	33.9	Very low	151 Å²	151	129 Å²	129	79%	0.791	75%	0.746	S	S	*	*			trans	-135.7	-170.9	-177.5	-106.7	82.8	0	0	0	109.9
1099	P	42.1	Very low	34	Very low	100 Å²	100	127.5 Å²	127.5	65%	0.649	74%	0.743	S	S	*	*			cis	-143.7	-165.1	-46	42.5	-24	0	0	0	115.4
1100	S	30.6	Very low	34.1	Very low	107 Å²	107	129.9 Å²	129.9	75%	0.748	75%	0.749	S	S	*	*			trans	72.3	153.8	149.2	70.6	0	0	0	0	119.9
1101	D	31.3	Very low	34.5	Very low	152 Å²	152	130 Å²	130	81%	0.813	75%	0.748	S	S	*	*			cis	-142.6	-162.7	4.6	-148.6	45.9	0	0	0	109.9
1102	S	33.6	Very low	34.3	Very low	94 Å²	94	128.4 Å²	128.4	66%	0.657	75%	0.748	S	S	*	*			cis	-156.3	-168.8	10.7	77.8	0	0	0	0	114.7
1103	L	27.4	Very low	34.1	Very low	157 Å²	157	126.4 Å²	126.4	82%	0.822	75%	0.746	S	S	*	*			trans	-120.5	-164.3	174.9	-65.5	157.3	0	0	0	110.4
1104	P	43.4	Very low	34	Very low	115 Å²	115	128.8 Å²	128.8	75%	0.747	75%	0.752	S	S	*	*			cis	-141.1	144.5	-12	26.5	-1.5	0	0	0	119.4
1105	N	32.9	Very low	33.4	Very low	158 Å²	158	129.4 Å²	129.4	85%	0.845	76%	0.755	S	S	*	*			trans	70.1	-179.6	131	-124.3	14.2	0	0	0	122
1106	P	42.4	Very low	33.2	Very low	101 Å²	101	130.2 Å²	130.2	66%	0.656	75%	0.754	S	S	*	*				-141	176.4	-118	45.4	-25.6	0	0	0	119.4
1107	S	31.1	Very low	33.1	Very low	106 Å²	106	129.3 Å²	129.3	74%	0.741	75%	0.749	S	S	*	*			trans	172.2	135.4	131.7	62.4	0	0	0	0	118
1108	L	32.6	Very low	33	Very low	158 Å²	158	130.7 Å²	130.7	83%	0.827	75%	0.75	S	S	*	*			trans	72.8	142.4	142.5	-73.8	164.5	0	0	0	125.1
1109	N	33.9	Very low	33.2	Very low	143 Å²	143	132.3 Å²	132.3	77%	0.765	75%	0.751	S	S	*	*			trans	81.2	84.2	156.9	-61.8	-2.3	0	0	0	122.5
1110	D	32.2	Very low	32.6	Very low	155 Å²	155	131.3 Å²	131.3	83%	0.829	75%	0.751	S	S	*	*				45.4	156.5	108.3	-123.1	30.6	0	0	0	122.8
1111	P	40.3	Very low	32.7	Very low	98 Å²	98	132.1 Å²	132.1	64%	0.636	75%	0.751	S	S	*	*				-136.4	162.1	-81.4	41.5	-25.9	0	0	0	116
1112	S	29.4	Very low	32.5	Very low	116 Å²	116	130.4 Å²	130.4	81%	0.811	75%	0.746	S	S	*	*			trans	164.9	148.2	136.9	45.4	0	0	0	0	116.4
1113	S	31.2	Very low	32.4	Very low	107 Å²	107	132.8 Å²	132.8	75%	0.748	76%	0.756	S	S	*	*			trans	45.1	94.7	157.7	60.2	0	0	0	0	122.7
1114	E	28.9	Very low	32.5	Very low	189 Å²	189	128.5 Å²	128.5	88%	0.883	75%	0.75	S	S	*	*				73.7	127.3	111.3	-123.2	172.5	-145.3	0	0	124.2
1115	V	31.8	Very low	31.7	Very low	109 Å²	109	127.4 Å²	127.4	66%	0.661	75%	0.751	S	S	*	*			trans	116.8	106.5	144.1	-174.4	0	0	0	0	119.1
1116	N	30.1	Very low	31.4	Very low	139 Å²	139	128.1 Å²	128.1	74%	0.743	75%	0.754	S	S	*	*			trans	67.7	149.1	155.7	-69.4	-24.6	0	0	0	118.8
1117	N	31	Very low	30.9	Very low	118 Å²	118	128.4 Å²	128.4	63%	0.631	76%	0.756	S	S	*	*			cis	-161.2	150.7	5.4	-137.1	-34.4	0	0	0	113.6
1118	K	31.3	Very low	30.7	Very low	171 Å²	171	132.6 Å²	132.6	74%	0.743	77%	0.766	S	S	*	*			trans	68.6	147.5	154.6	-57.5	-153.5	-177.5	179	0	121
1119	F	29	Very low	30.5	Very low	186 Å²	186	130.4 Å²	130.4	82%	0.816	76%	0.759	S	S	*	*			cis	-163.5	142.7	-17.7	-137.1	-111.8	0	0	0	112.1
1120	A	31	Very low	30.1	Very low	78 Å²	78	130.9 Å²	130.9	65%	0.645	76%	0.762	S	S	*	*			trans	58.3	161.2	154.8	0	0	0	0	0	119.8
1121	V	31.2	Very low	29.8	Very low	125 Å²	125	130 Å²	130	76%	0.758	77%	0.766	S	S	*	*			cis	-132.3	123.8	14.5	-176.8	0	0	0	0	111.4
1122	T	29	Very low	29.2	Very low	115 Å²	115	129.3 Å²	129.3	71%	0.706	77%	0.769	S	S	*	*				28.5	143.6	116.8	-15.1	0	0	0	0	118.2
1123	V	31.4	Very low	29.3	Very low	144 Å²	144	129.9 Å²	129.9	87%	0.873	77%	0.77	S	S	*	*			cis	-147.2	148.7	37.1	-175.7	0	0	0	0	109.4
1124	G	29.1	Very low	29.2	Very low	67 Å²	67	131 Å²	131	69%	0.691	77%	0.772	S	S	*	*			cis	-172.6	165.1	-2.8	0	0	0	0	0	110.1
1125	A	26	Very low	29.2	Very low	92 Å²	92	128.4 Å²	128.4	76%	0.76	77%	0.769	S	S	*	*			trans	-140.1	148.1	-167.2	0	0	0	0	0	113.7
1126	L	27.3	Very low	29.1	Very low	174 Å²	174	128.5 Å²	128.5	91%	0.911	78%	0.775	S	S	*	*			trans	-151.3	100	155.9	-88.9	-176.1	0	0	0	110.6
1127	P	30.2	Very low	28.8	Very low	107 Å²	107	127.5 Å²	127.5	70%	0.695	78%	0.776	S	S	*	*			trans	-101.5	117.9	163.8	33.1	-24.5	0	0	0	110.5
1128	M	28	Very low	28.6	Very low	193 Å²	193	128 Å²	128	95%	0.951	78%	0.778	S	S	*	*			trans	-88.9	113.7	165.5	-89.2	-73	-179.8	0	0	109.4
1129	T	27.3	Very low	28.5	Very low	112 Å²	112	134.8 Å²	134.8	69%	0.687	80%	0.799	S	S	*	*			trans	-128.8	149.1	173.7	50.7	0	0	0	0	110.7
1130	N	26.6	Very low	28.5	Very low	154 Å²	154	132.2 Å²	132.2	82%	0.824	80%	0.798	S	S	*	*			trans	79.6	64.3	170.5	-54.7	-13.7	0	0	0	117.9
1131	C	26.4	Very low	28.4	Very low	135 Å²	135	135.1 Å²	135.1	91%	0.912	81%	0.806	S	S	*	*			trans	-115.7	101.1	131.4	-76.2	0	0	0	0	108.7
1132	A	26.5	Very low	28.2	Very low	85 Å²	85	135.6 Å²	135.6	70%	0.702	81%	0.809	S	S	*	*			trans	-80.9	134.8	173.1	0	0	0	0	0	109.9	T1134	A1132-T1134 PolarHBondContact O-N 3.01Å; A1132-T1134 VanDerWaalsContact O-N 3.08Å
1133	P	31.3	Very low	28.2	Very low	128 Å²	128	136.8 Å²	136.8	83%	0.831	82%	0.815	S	S	*	*			trans	-75.6	98.9	175.6	30.2	-32.9	0	0	0	109.8
1134	T	29.8	Very low	28	Very low	130 Å²	130	136.4 Å²	136.4	80%	0.798	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-60.9	137	169.8	43.6	0	0	0	0	110.3	A1132 S1136	A1132-T1134 PolarHBondContact O-N 3.01Å; A1132-T1134 VanDerWaalsContact O-N 3.08Å; T1134-S1136 PolarHBondContact O-N 3.45Å
1135	T	28.7	Very low	27.9	Very low	134 Å²	134	141 Å²	141	82%	0.822	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-58.7	125.1	-175.8	46.5	0	0	0	0	112.2	P1137	T1135-P1137 VanDerWaalsContact O-CD 3.28Å; T1135-P1137 WeakPolarHBondContact O-CD 3.04Å
1136	S	29	Very low	28.1	Very low	112 Å²	112	144.5 Å²	144.5	78%	0.783	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-61.4	117	178.3	-45.8	0	0	0	0	111.9	T1134 L1138	T1134-S1136 PolarHBondContact O-N 3.45Å; S1136-L1138 PolarHBondContact O-N 3.1Å
1137	P	25.4	Very low	28.1	Very low	118 Å²	118	142.2 Å²	142.2	77%	0.766	82%	0.817	S	S	*	*			trans	-95	60.7	-178.3	37.9	-32.7	0	0	0	111.4	T1135	T1135-P1137 VanDerWaalsContact O-CD 3.28Å; T1135-P1137 WeakPolarHBondContact O-CD 3.04Å
1138	L	27.1	Very low	27.9	Very low	127 Å²	127	145.2 Å²	145.2	67%	0.665	83%	0.827	S	S	*	*			trans	-137	105.6	169.2	-88.5	170.9	0	0	0	108.5	L1050 S1136	L1050-L1138 HydrophobicContact CD1-CD2 3.96Å; L1050-L1138 HydrophobicContact CD1-CG 4.26Å; S1136-L1138 PolarHBondContact O-N 3.1Å
1139	R	29.2	Very low	27.9	Very low	314 Å²	314	140.8 Å²	140.8	100%	1.185	82%	0.816	S	S	*	*			trans	-156.6	0	-178.5	-163.4	178	-165.5	-134.4	-0.6	111.7

Retrieved 1,139 of 1,139 residues in 840.7 ms (Link to these results)

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