A0A077Z2X2_TRITR Loading...

RNA cytidine acetyltransferase

RNA cytidine acetyltransferase with specificity toward both 18S rRNA and tRNAs. Catalyzes the formation of N(4)-acetylcytidine (ac4C) in 18S rRNA. Required for early nucleolar cleavages of precursor rRNA at sites A0, A1 and A2 during 18S rRNA synthesis. Catalyzes the formation of ac4C in serine and leucine tRNAs. Requires a tRNA-binding adapter protein for full tRNA acetyltransferase activity but not for 18S rRNA acetylation.

AlphaFold DB , UniProt , Accession A0A077Z2X2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,005 aa.

						>A0A077Z2X2_TRITR|A0A077Z2X2
MHRKKLDNRIRVLIENGLACNHRSMFVIVGDKGRDHVVVLHHILTKASLRPRPSVLWCYKKELGFTTHRKKRMRMLQKKMRAGKAGLDDEKPFDLFVASTQIRYCYYSETHKILGNTYGMCILQATLTPNLLARTIETIEGGGLVIILLRSLTSLRQLYTLAMDVHARYRTEAHSDIVGRFNERFLLSLASCQACCVLDDDLNILPISSHMNNLKAVTPKEKEQVSSNDLAFKQLLESLSDSPQLRSLLKLCKTLDQANVVLKLLNIVAENSLRHTVSLTAARGRGKSAALGLATAGAIGSGFSNIFVTSPSPENLKTYFQFVCRGFDALNFKEHMDYEVVQSANPEFNKAIVRISVIRSHRQTVQYIHPTDAAKLGQAELVIIDEAAAIPLVHVKHLLGPYLVFMASNINGYEGTGRSLSLKLLHQLRQETACITGTHTKSAAGSSKETEITATSGRVLSELVLEESIRYGAGDPVESWLNQLLCLDVNLAPKVSSGCPAPNDCDLYPFSADTLFCFHKVSEVFLQRLMSIYVAAHYKNSPNDLQMISDAPAHHLFVLLGPVDVNQKNIPEILCVIQVCLEGDISKASVDDQMSRGKRPSGDLIPWTLAQQFQDSDFPGLSGARIVRIATHPDYQNMGYGSRAVELLQQYYEGAFPALDEVQTDLQPLEVNGQESGGGLLEEKIAPRKDLPPLLAKLSERRAERLDWLGVCYGLTPELQKFWARKNFVPVYIRQTANELTGEFSCIKIKCLRNEEQSQEWLTAYWKDFQRRFISLLGFQFAIFPITLALGILARQPLLALDNGTGIDRAELRIFFSDYDLKRLEMYSQNLVDHHLITDLLPFLARMFFTRKIKVDLSTLQAGILMALGLQHKTVDDIVKELNLPSSQILALFNRIVRKCLSYLNQVCENAIESHLGIDQRHKVTAKEISRPLEEELNEYASEVQRKAQGDLRGLISESDLAKYRIRADEDETEFLNDKLASSKKSKKRLKKMHGGGGGGKKRRR
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.3	Very low	75.4	Confident	234 Å²	234	128.5 Å²	128.5	100%	1.153	57%	0.572	S	S	*	*				0	113	0	-91.5	-177.1	165.5	0	0	108.7	R3	M1-R3 PolarHBondContact O-N 3.36Å
2	H	54.2	Low	76.5	Confident	195 Å²	195	119.2 Å²	119.2	90%	0.903	53%	0.533	S	S	*	.			trans	-63.2	117.1	165.5	-79.6	-68.1	0	0	0	108.1	K4	H2-K4 PolarHBondContact O-N 3.06Å
3	R	63.4	Low	77.6	Confident	253 Å²	253	110.7 Å²	110.7	96%	0.955	50%	0.495	S	S	*	.			trans	-72.1	81.8	172.9	-76	-175.3	176	178.5	0.1	108.5	M1	M1-R3 PolarHBondContact O-N 3.36Å
4	K	70	Confident	78.5	Confident	131 Å²	131	103 Å²	103	57%	0.57	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-76.7	128.3	173.2	-153.9	177.5	-172.1	-175.3	0	108.3	H2 L6 N203	H2-K4 PolarHBondContact O-N 3.06Å; K4-L6 PolarHBondContact O-N 3.31Å; K4-N203 PolarHBondContact NZ-ND2 3.36Å; K4-N203 PolarHBondContact NZ-OD1 3.39Å
5	K	78.2	Confident	79.3	Confident	202 Å²	202	100.5 Å²	100.5	88%	0.878	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-67.1	122.9	175.7	-172.8	178	179.4	-178.5	0	108
6	L	81.9	Confident	79.9	Confident	61 Å²	61	95.6 Å²	95.6	32%	0.319	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-61.3	138.1	174.8	-168.7	85.1	0	0	0	109.5	K4 N8 I10 I43 L202	K4-L6 PolarHBondContact O-N 3.31Å; L6-N8 PolarHBondContact O-N 3.3Å; L6-I10 HydrophobicContact CD1-CD1 4.04Å; L6-I10 HydrophobicContact CD2-CB 4.42Å; L6-I10 HydrophobicContact CD2-CG2 4.47Å; L6-I10 HydrophobicContact CG-CD1 4.22Å; L6-I43 HydrophobicContact CD2-CD1 3.59Å; L6-L202 HydrophobicContact CD1-CB 3.95Å; L6-L202 HydrophobicContact CD1-CD1 3.62Å; L6-L202 HydrophobicContact CD1-CG 4.37Å
7	D	84.2	Confident	80.4	Confident	52 Å²	52	90.4 Å²	90.4	28%	0.278	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-61.1	126.8	173.1	-164.5	-41	0	0	0	110.4	R9 I10 I204	D7-R9 PolarHBondContact O-N 2.93Å; D7-R9 WeakPolarHBondContact OD1-CB 3.27Å; D7-R9 VanDerWaalsContact OD1-CG 3.31Å; D7-R9 WeakPolarHBondContact OD1-CG 3.07Å; D7-R9 PolarHBondContact OD1-N 3.37Å; D7-R9 IonicContact OD1-NE 3.01Å; D7-R9 PolarHBondContact OD1-NE 2.92Å; D7-R9 VanDerWaalsContact OD1-NE 3.14Å; D7-R9 IonicContact OD2-CZ 3.14Å; D7-R9 VanDerWaalsContact OD2-CZ 3.24Å; D7-R9 IonicContact OD2-NE 2.61Å; D7-R9 PolarHBondContact OD2-NE 3.01Å; D7-R9 IonicContact OD2-NH2 3.12Å; D7-R9 PolarHBondContact OD2-NH2 3.15Å; D7-I10 PolarHBondContact O-N 3.45Å; D7-I204 HydrophobicContact CB-CD1 4.08Å
8	N	86.8	Confident	80.8	Confident	101 Å²	101	88.2 Å²	88.2	54%	0.54	40%	0.4	S	S	.	.	H	α-helix	trans	-64.2	-23.2	-176.1	-164	38	0	0	0	112.2	L6 I10 R11 V12	L6-N8 PolarHBondContact O-N 3.3Å; N8-I10 VanDerWaalsContact C-N 3.27Å; N8-I10 PolarHBondContact O-N 3.32Å; N8-R11 WeakPolarHBondContact O-CB 3.32Å; N8-R11 PolarHBondContact O-N 3.25Å; N8-R11 VanDerWaalsContact O-N 3.1Å; N8-V12 WeakPolarHBondContact O-CG2 3.29Å; N8-V12 PolarHBondContact O-N 3.42Å
9	R	87.4	Confident	81	Confident	68 Å²	68	85.7 Å²	85.7	26%	0.257	40%	0.397	S	S	.	.	H	α-helix	trans	-59.4	-36	179	-67.3	179.5	-73.2	171.8	1.1	112.9	D7 R11 V12 L13 I204 M211 N212	D7-R9 PolarHBondContact O-N 2.93Å; D7-R9 WeakPolarHBondContact OD1-CB 3.27Å; D7-R9 VanDerWaalsContact OD1-CG 3.31Å; D7-R9 WeakPolarHBondContact OD1-CG 3.07Å; D7-R9 PolarHBondContact OD1-N 3.37Å; D7-R9 IonicContact OD1-NE 3.01Å; D7-R9 PolarHBondContact OD1-NE 2.92Å; D7-R9 VanDerWaalsContact OD1-NE 3.14Å; D7-R9 IonicContact OD2-CZ 3.14Å; D7-R9 VanDerWaalsContact OD2-CZ 3.24Å; D7-R9 IonicContact OD2-NE 2.61Å; D7-R9 PolarHBondContact OD2-NE 3.01Å; D7-R9 IonicContact OD2-NH2 3.12Å; D7-R9 PolarHBondContact OD2-NH2 3.15Å; R9-R11 VanDerWaalsContact C-N 3.31Å; R9-R11 PolarHBondContact O-N 3.37Å; R9-V12 PolarHBondContact O-N 2.8Å; R9-L13 WeakPolarHBondContact O-CB 3.13Å; R9-L13 PolarHBondContact O-N 3.34Å; R9-I204 HydrophobicContact CB-CD1 3.64Å; R9-I204 HydrophobicContact CG-CD1 4.44Å; R9-M211 HydrophobicContact CB-CE 4.16Å; R9-M211 WeakPolarHBondContact CD-O 3.05Å; R9-N212 PolarHBondContact NH1-OD1 3.31Å
10	I	89.3	Confident	81.2	Confident	0 Å²	0	84.1 Å²	84.1	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-60.5	-45.5	176.4	-62.1	175.4	0	0	0	109.9	L6 D7 N8 I14 F26 L40 L198 L202 I204	L6-I10 HydrophobicContact CD1-CD1 4.04Å; L6-I10 HydrophobicContact CD2-CB 4.42Å; L6-I10 HydrophobicContact CD2-CG2 4.47Å; L6-I10 HydrophobicContact CG-CD1 4.22Å; D7-I10 PolarHBondContact O-N 3.45Å; N8-I10 VanDerWaalsContact C-N 3.27Å; N8-I10 PolarHBondContact O-N 3.32Å; I10-I14 HydrophobicContact CG2-CD1 4.43Å; I10-I14 WeakPolarHBondContact O-CG1 3.38Å; I10-I14 PolarHBondContact O-N 3.06Å; I10-F26 HydrophobicContact CB-CE1 4.47Å; I10-F26 HydrophobicContact CG1-CE1 4.48Å; I10-F26 HydrophobicContact CG2-CE1 3.8Å; I10-F26 HydrophobicContact CG2-CZ 3.88Å; I10-L40 HydrophobicContact CG2-CD2 3.72Å; I10-L198 HydrophobicContact CD1-CD1 4.24Å; I10-L198 HydrophobicContact CD1-CD2 3.67Å; I10-L198 HydrophobicContact CG1-CD2 4.14Å; I10-L202 HydrophobicContact CD1-CB 4.47Å; I10-I204 HydrophobicContact CG1-CD1 4.12Å; I10-I204 HydrophobicContact CG1-CG1 4.29Å
11	R	89.3	Confident	81.6	Confident	117 Å²	117	83.2 Å²	83.2	44%	0.442	39%	0.393	S	S	.	.	H	α-helix	trans	-67.8	-45.3	179.6	-178	178.6	173.6	-168	-8.4	111.7	N8 R9 L13 I14 E15 I43	N8-R11 WeakPolarHBondContact O-CB 3.32Å; N8-R11 PolarHBondContact O-N 3.25Å; N8-R11 VanDerWaalsContact O-N 3.1Å; R9-R11 VanDerWaalsContact C-N 3.31Å; R9-R11 PolarHBondContact O-N 3.37Å; R11-L13 VanDerWaalsContact C-N 3.3Å; R11-L13 PolarHBondContact O-N 2.8Å; R11-I14 PolarHBondContact O-N 3.39Å; R11-E15 HydrophobicContact CG-CG 4.38Å; R11-E15 IonicContact CZ-OE1 3.23Å; R11-E15 VanDerWaalsContact CZ-OE1 3.25Å; R11-E15 IonicContact NE-OE1 3.19Å; R11-E15 PolarHBondContact NE-OE1 2.87Å; R11-E15 IonicContact NH2-OE1 3.25Å; R11-E15 PolarHBondContact NH2-OE1 2.83Å; R11-E15 WeakPolarHBondContact O-CG 3.43Å; R11-E15 PolarHBondContact O-N 3.45Å; R11-I43 HydrophobicContact CG-CG2 4.4Å
12	V	89.5	Confident	83.8	Confident	16 Å²	16	74 Å²	74	10%	0.097	35%	0.347	C	S	.	.	H	α-helix	trans	-60.6	-40.3	178.8	173	0	0	0	0	111.2	N8 R9 I14 E15 N16 A216	N8-V12 WeakPolarHBondContact O-CG2 3.29Å; N8-V12 PolarHBondContact O-N 3.42Å; R9-V12 PolarHBondContact O-N 2.8Å; V12-I14 PolarHBondContact O-N 2.86Å; V12-E15 PolarHBondContact O-N 3.41Å; V12-N16 VanDerWaalsContact O-CB 3.28Å; V12-N16 WeakPolarHBondContact O-CB 3.31Å; V12-N16 PolarHBondContact O-N 3.47Å; V12-N16 PolarHBondContact O-OD1 2.8Å; V12-A216 HydrophobicContact CG1-CB 4.14Å
13	L	90.2	Very high	85.8	Confident	9 Å²	9	64.8 Å²	64.8	5%	0.047	31%	0.305	C	S	.	.	H	α-helix	trans	-59.9	-45.4	176.9	-178	62.1	0	0	0	111.8	R9 R11 N16 G17 F26 C196 L214	R9-L13 WeakPolarHBondContact O-CB 3.13Å; R9-L13 PolarHBondContact O-N 3.34Å; R11-L13 VanDerWaalsContact C-N 3.3Å; R11-L13 PolarHBondContact O-N 2.8Å; L13-N16 PolarHBondContact O-N 2.78Å; L13-G17 PolarHBondContact O-N 2.77Å; L13-F26 HydrophobicContact CD2-CE1 4.2Å; L13-F26 HydrophobicContact CD2-CE2 4.37Å; L13-F26 HydrophobicContact CD2-CZ 3.83Å; L13-F26 HydrophobicContact CG-CZ 4.49Å; L13-C196 HydrophobicContact CD2-CB 3.85Å; L13-L214 HydrophobicContact CB-CD1 4.37Å; L13-L214 HydrophobicContact CD1-CD1 4.19Å
14	I	91	Very high	87.2	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-44.5	178.6	-62.4	171.9	0	0	0	111	I10 R11 V12 G17 L18 F26 L40 I43 L44 A47 L144	I10-I14 HydrophobicContact CG2-CD1 4.43Å; I10-I14 WeakPolarHBondContact O-CG1 3.38Å; I10-I14 PolarHBondContact O-N 3.06Å; R11-I14 PolarHBondContact O-N 3.39Å; V12-I14 PolarHBondContact O-N 2.86Å; I14-G17 PolarHBondContact O-N 3.47Å; I14-L18 HydrophobicContact CG2-CD1 4.24Å; I14-L18 PolarHBondContact O-N 2.87Å; I14-F26 HydrophobicContact CD1-CE2 4.08Å; I14-F26 HydrophobicContact CD1-CZ 4.16Å; I14-F26 HydrophobicContact CG1-CE2 3.84Å; I14-F26 HydrophobicContact CG1-CZ 3.97Å; I14-L40 HydrophobicContact CD1-CD2 4.25Å; I14-I43 HydrophobicContact CD1-CB 4.2Å; I14-I43 HydrophobicContact CD1-CG2 3.66Å; I14-L44 HydrophobicContact CG2-CB 4.48Å; I14-L44 HydrophobicContact CG2-CD1 3.86Å; I14-A47 HydrophobicContact CG2-CB 4.48Å; I14-L144 HydrophobicContact CD1-CD1 4.28Å; I14-L144 HydrophobicContact CD1-CD2 4.41Å; I14-L144 HydrophobicContact CG1-CD2 4.04Å
15	E	89.9	Confident	88.3	Confident	66 Å²	66	46.7 Å²	46.7	31%	0.308	23%	0.233	S	C	.	.	H	α-helix	trans	-64.8	-38.4	178.7	-72.7	177.7	175	0	0	112	R11 V12 L18 A19 A47	R11-E15 HydrophobicContact CG-CG 4.38Å; R11-E15 IonicContact CZ-OE1 3.23Å; R11-E15 VanDerWaalsContact CZ-OE1 3.25Å; R11-E15 IonicContact NE-OE1 3.19Å; R11-E15 PolarHBondContact NE-OE1 2.87Å; R11-E15 IonicContact NH2-OE1 3.25Å; R11-E15 PolarHBondContact NH2-OE1 2.83Å; R11-E15 WeakPolarHBondContact O-CG 3.43Å; R11-E15 PolarHBondContact O-N 3.45Å; V12-E15 PolarHBondContact O-N 3.41Å; E15-L18 PolarHBondContact O-N 3.31Å; E15-A19 WeakPolarHBondContact O-CB 3.46Å; E15-A19 PolarHBondContact O-N 3.32Å; E15-A47 HydrophobicContact CG-CB 4.12Å
16	N	88.6	Confident	89	Confident	22 Å²	22	37 Å²	37	12%	0.118	19%	0.191	C	C	.	.	H	α-helix	trans	-65	-45.1	173.8	-73.9	-6.9	0	0	0	111.3	V12 L13 L18 A19 C20 K215 V217	V12-N16 VanDerWaalsContact O-CB 3.28Å; V12-N16 WeakPolarHBondContact O-CB 3.31Å; V12-N16 PolarHBondContact O-N 3.47Å; V12-N16 PolarHBondContact O-OD1 2.8Å; L13-N16 PolarHBondContact O-N 2.78Å; N16-L18 VanDerWaalsContact C-N 3.31Å; N16-L18 PolarHBondContact O-N 2.87Å; N16-A19 PolarHBondContact O-N 3.42Å; N16-A19 VanDerWaalsContact O-N 3.16Å; N16-C20 PolarHBondContact O-N 2.89Å; N16-K215 PolarHBondContact ND2-O 3.37Å; N16-V217 HydrophobicContact CB-CG2 4.1Å; N16-V217 WeakPolarHBondContact OD1-CG2 3.45Å; N16-V217 PolarHBondContact OD1-N 3.2Å
17	G	88.4	Confident	89.4	Confident	6 Å²	6	34.2 Å²	34.2	6%	0.062	18%	0.176	C	C	.	.	H	α-helix	trans	-58.3	-42.1	176	0	0	0	0	0	112.5	L13 I14 N21 H22	L13-G17 PolarHBondContact O-N 2.77Å; I14-G17 PolarHBondContact O-N 3.47Å; G17-N21 CarbonylContact O-C 3.58Å; G17-N21 WeakPolarHBondContact O-CA 3.43Å; G17-N21 PolarHBondContact O-N 2.8Å; G17-H22 CarbonylContact C-O 3.37Å; G17-H22 WeakPolarHBondContact CA-O 3.48Å; G17-H22 PolarHBondContact O-N 3.23Å; G17-H22 VanDerWaalsContact O-O 3.11Å
18	L	88	Confident	89.7	Confident	51 Å²	51	31.7 Å²	31.7	27%	0.267	16%	0.163	S	C	.	.	H	α-helix	trans	-65.6	-40.8	174.5	-76.1	164.2	0	0	0	112.7	I14 E15 N16 N21 L44 A47	I14-L18 HydrophobicContact CG2-CD1 4.24Å; I14-L18 PolarHBondContact O-N 2.87Å; E15-L18 PolarHBondContact O-N 3.31Å; N16-L18 VanDerWaalsContact C-N 3.31Å; N16-L18 PolarHBondContact O-N 2.87Å; L18-N21 PolarHBondContact O-N 2.69Å; L18-L44 HydrophobicContact CD1-CD1 4.2Å; L18-L44 HydrophobicContact CD2-CD1 4.33Å; L18-L44 HydrophobicContact CG-CD1 4.4Å; L18-A47 HydrophobicContact CD1-CB 3.44Å; L18-A47 VanDerWaalsContact CD1-CB 3.44Å
19	A	85.5	Confident	89.6	Confident	41 Å²	41	27 Å²	27	34%	0.339	14%	0.138	S	C	.	.	H	α-helix	trans	-67.2	-43.4	-179.3	0	0	0	0	0	112.5	E15 N16 N21 K222	E15-A19 WeakPolarHBondContact O-CB 3.46Å; E15-A19 PolarHBondContact O-N 3.32Å; N16-A19 PolarHBondContact O-N 3.42Å; N16-A19 VanDerWaalsContact O-N 3.16Å; A19-N21 VanDerWaalsContact C-N 3.31Å; A19-K222 HydrophobicContact CB-CD 4.45Å; A19-K222 HydrophobicContact CB-CG 4.44Å
20	C	84.8	Confident	89.4	Confident	53 Å²	53	24 Å²	24	36%	0.358	13%	0.129	S	C	.	.	H	α-helix	trans	-86.6	-1.4	179.2	-60.8	0	0	0	0	113.3	N16 H22	N16-C20 PolarHBondContact O-N 2.89Å; C20-H22 HydrophobicContact CB-CB 4.43Å; C20-H22 PolarHBondContact O-CD2 3.49Å; C20-H22 VanDerWaalsContact O-CD2 3.29Å; C20-H22 PolarHBondContact O-N 2.93Å
21	N	88.5	Confident	89	Confident	66 Å²	66	28.9 Å²	28.9	35%	0.353	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	36.5	-172	-161.7	32.5	0	0	0	112.9	G17 L18 A19 G141 G472	G17-N21 CarbonylContact O-C 3.58Å; G17-N21 WeakPolarHBondContact O-CA 3.43Å; G17-N21 PolarHBondContact O-N 2.8Å; L18-N21 PolarHBondContact O-N 2.69Å; A19-N21 VanDerWaalsContact C-N 3.31Å; N21-G141 WeakPolarHBondContact O-CA 3.35Å; N21-G141 VanDerWaalsContact OD1-C 3.22Å; N21-G141 VanDerWaalsContact OD1-CA 3.28Å; N21-G141 WeakPolarHBondContact OD1-CA 3.35Å; N21-G141 PolarHBondContact OD1-O 2.97Å; N21-G472 PolarHBondContact ND2-N 3.48Å; N21-G472 PolarHBondContact O-N 3.45Å
22	H	91.7	Very high	88.6	Confident	41 Å²	41	29 Å²	29	19%	0.19	16%	0.159	C	C	.	.			trans	-104.4	154.5	178.8	-65.7	165.2	0	0	0	111.2	G17 C20 G142 A473	G17-H22 CarbonylContact C-O 3.37Å; G17-H22 WeakPolarHBondContact CA-O 3.48Å; G17-H22 PolarHBondContact O-N 3.23Å; G17-H22 VanDerWaalsContact O-O 3.11Å; C20-H22 HydrophobicContact CB-CB 4.43Å; C20-H22 PolarHBondContact O-CD2 3.49Å; C20-H22 VanDerWaalsContact O-CD2 3.29Å; C20-H22 PolarHBondContact O-N 2.93Å; H22-G142 WeakPolarHBondContact O-CA 3.35Å; H22-G142 PolarHBondContact O-N 3.47Å; H22-A473 PolarHBondContact NE2-O 3.48Å
23	R	94.3	Very high	88.2	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.008	16%	0.155	C	C	.	.			trans	-79.3	151.7	176.5	-70.7	172.5	-67.3	-167.1	-10.3	110.4	I136 I139 E140 Y471 D475 V477 E478	R23-I136 PolarHBondContact NH1-O 3.38Å; R23-I139 HydrophobicContact CG-CG2 4.12Å; R23-E140 WeakPolarHBondContact CG-O 3.25Å; R23-Y471 VanDerWaalsContact CZ-CE1 3.44Å; R23-D475 IonicContact CZ-OD2 2.64Å; R23-D475 PolarHBondContact N-OD1 3.49Å; R23-D475 PolarHBondContact N-OD2 2.86Å; R23-D475 IonicContact NE-OD2 3.32Å; R23-D475 PolarHBondContact NE-OD2 2.92Å; R23-D475 IonicContact NH2-OD2 3.24Å; R23-D475 PolarHBondContact NH2-OD2 2.82Å; R23-V477 HydrophobicContact CB-CB 4.14Å; R23-V477 HydrophobicContact CB-CG1 4.46Å; R23-V477 HydrophobicContact CB-CG2 4.11Å; R23-V477 VanDerWaalsContact O-CG2 3.3Å; R23-V477 WeakPolarHBondContact O-CG2 3.35Å; R23-E478 VanDerWaalsContact NH2-CB 3.27Å
24	S	94	Very high	87.9	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.021	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	140.4	173.2	-65.3	0	0	0	0	110.7	G143 L144 V145	S24-G143 PolarHBondContact N-O 3.02Å; S24-L144 WeakPolarHBondContact O-CA 3.46Å; S24-V145 PolarHBondContact O-N 3Å
25	M	93.5	Very high	87.6	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.6	-178.4	-175.7	178.3	-64.7	0	0	111.7	I136 V145 I147 L189 A194 C195 C196 V477 W480	M25-I136 HydrophobicContact CE-CD1 3.96Å; M25-V145 CarbonylContact C-O 3.57Å; M25-V145 WeakPolarHBondContact CA-O 3.43Å; M25-V145 HydrophobicContact CB-CB 4.37Å; M25-V145 HydrophobicContact CE-CB 4.47Å; M25-V145 HydrophobicContact CE-CG1 4.23Å; M25-V145 HydrophobicContact CG-CB 4.22Å; M25-V145 HydrophobicContact CG-CG1 4.35Å; M25-I147 HydrophobicContact SD-CD1 4.21Å; M25-L189 HydrophobicContact SD-CD2 3.78Å; M25-A194 PolarHBondContact N-O 3.42Å; M25-C195 HydrophobicContact CB-CB 4.32Å; M25-C195 WeakPolarHBondContact O-CA 3.38Å; M25-C196 PolarHBondContact O-N 3.1Å; M25-V477 HydrophobicContact CE-CG1 3.96Å; M25-W480 HydrophobicContact CE-CE3 3.92Å; M25-W480 HydrophobicContact CE-CH2 3.64Å; M25-W480 HydrophobicContact CE-CZ3 3.21Å; M25-W480 HydrophobicContact SD-CH2 3.98Å; M25-W480 HydrophobicContact SD-CZ3 4.11Å
26	F	93	Very high	87.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	130.4	173.1	-71.6	-83.9	0	0	0	110.8	I10 L13 I14 L40 L144 V145 I146 I147 C196 L198	I10-F26 HydrophobicContact CB-CE1 4.47Å; I10-F26 HydrophobicContact CG1-CE1 4.48Å; I10-F26 HydrophobicContact CG2-CE1 3.8Å; I10-F26 HydrophobicContact CG2-CZ 3.88Å; L13-F26 HydrophobicContact CD2-CE1 4.2Å; L13-F26 HydrophobicContact CD2-CE2 4.37Å; L13-F26 HydrophobicContact CD2-CZ 3.83Å; L13-F26 HydrophobicContact CG-CZ 4.49Å; I14-F26 HydrophobicContact CD1-CE2 4.08Å; I14-F26 HydrophobicContact CD1-CZ 4.16Å; I14-F26 HydrophobicContact CG1-CE2 3.84Å; I14-F26 HydrophobicContact CG1-CZ 3.97Å; F26-L40 HydrophobicContact CB-CD1 4.28Å; F26-L40 HydrophobicContact CE1-CD2 4.44Å; F26-L40 HydrophobicContact CE2-CD2 4.46Å; F26-L40 HydrophobicContact CG-CD1 4.23Å; F26-L40 HydrophobicContact CZ-CD2 4.38Å; F26-L144 HydrophobicContact CD2-CD2 3.64Å; F26-L144 HydrophobicContact CE2-CD2 3.45Å; F26-L144 VanDerWaalsContact CE2-CD2 3.45Å; F26-V145 PolarHBondContact N-O 3.33Å; F26-I146 HydrophobicContact CB-CG1 4.45Å; F26-I146 CarbonylContact O-C 3.52Å; F26-I146 WeakPolarHBondContact O-CA 3.27Å; F26-I147 PolarHBondContact O-N 3.44Å; F26-C196 CarbonylContact C-O 3.36Å; F26-C196 WeakPolarHBondContact CA-O 3.46Å; F26-C196 HydrophobicContact CD1-CB 3.6Å; F26-C196 HydrophobicContact CE1-CB 3.55Å; F26-C196 HydrophobicContact CZ-CB 4.47Å; F26-L198 HydrophobicContact CD1-CD1 3.55Å; F26-L198 HydrophobicContact CD1-CG 4.22Å; F26-L198 HydrophobicContact CE1-CD1 4.13Å; F26-L198 HydrophobicContact CG-CD1 4.45Å
27	V	90.2	Very high	87.6	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	114.1	174.2	-177.6	0	0	0	0	107.6	I147 L149 L189 C196 V197 L198	V27-I147 WeakPolarHBondContact CA-O 3.5Å; V27-I147 HydrophobicContact CG1-CB 4.48Å; V27-I147 HydrophobicContact CG2-CB 4.25Å; V27-I147 HydrophobicContact CG2-CD1 4.35Å; V27-L149 HydrophobicContact CG1-CD1 3.51Å; V27-L149 HydrophobicContact CG1-CG 4.16Å; V27-L189 HydrophobicContact CG2-CD1 3.95Å; V27-L189 HydrophobicContact CG2-CD2 4.21Å; V27-C196 PolarHBondContact N-O 3.18Å; V27-V197 HydrophobicContact CB-CG1 4.15Å; V27-V197 HydrophobicContact CB-CG2 4.44Å; V27-V197 HydrophobicContact CG1-CG1 4.27Å; V27-V197 CarbonylContact O-C 3.59Å; V27-V197 WeakPolarHBondContact O-CA 3.36Å; V27-L198 PolarHBondContact O-N 3.23Å
28	I	89.6	Confident	87.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.5	-176.5	-50.7	176.6	0	0	0	108.6	H36 L40 I146 I147 L148 L149 L198	I28-H36 HydrophobicContact CD1-CB 3.91Å; I28-L40 HydrophobicContact CD1-CD1 3.9Å; I28-I146 HydrophobicContact CD1-CG2 3.85Å; I28-I146 HydrophobicContact CG1-CG2 4.27Å; I28-I147 PolarHBondContact N-O 2.88Å; I28-L148 HydrophobicContact CB-CD2 4.09Å; I28-L148 HydrophobicContact CD1-CD2 4.01Å; I28-L148 HydrophobicContact CG1-CD2 4.41Å; I28-L149 PolarHBondContact O-N 3.43Å; I28-L198 WeakPolarHBondContact CA-O 3.38Å; I28-L198 HydrophobicContact CG1-CB 4.49Å; I28-L198 HydrophobicContact CG1-CD1 4.49Å
29	V	85.7	Confident	87.8	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116.2	-178.9	-172.7	0	0	0	0	108.9	L149 L152 L155 V197 L198 D199 D200 L205 L680	V29-L149 HydrophobicContact CG2-CD1 4.28Å; V29-L152 HydrophobicContact CG1-CB 4.27Å; V29-L155 HydrophobicContact CG1-CD2 4.33Å; V29-L155 HydrophobicContact CG2-CD2 3.7Å; V29-L155 HydrophobicContact CG2-CG 4.47Å; V29-V197 HydrophobicContact CG2-CG1 4.07Å; V29-L198 PolarHBondContact N-O 3.44Å; V29-D199 CarbonylContact O-C 3.55Å; V29-D200 PolarHBondContact O-N 2.89Å; V29-L205 HydrophobicContact CG2-CD1 4.27Å; V29-L680 HydrophobicContact CG1-CD1 4.29Å; V29-L680 HydrophobicContact CG1-CD2 4.32Å
30	G	82.3	Confident	88	Confident	7 Å²	7	30.6 Å²	30.6	7%	0.072	16%	0.16	C	C	.	.	S	Bend	trans	133.1	-176.3	172	0	0	0	0	0	114.5	L149 D200	G30-L149 PolarHBondContact N-O 3.18Å; G30-D200 WeakPolarHBondContact CA-OD1 3.25Å; G30-D200 WeakPolarHBondContact CA-OD2 3.46Å
31	D	80.3	Confident	88.4	Confident	102 Å²	102	28.6 Å²	28.6	55%	0.545	15%	0.145	S	C	.	.	S	Bend	trans	-86.7	-24.5	-167.7	-69.3	-27.2	0	0	0	112.9	G33 S151 D200	D31-G33 VanDerWaalsContact C-N 3.3Å; D31-S151 WeakPolarHBondContact OD1-CA 3.12Å; D31-S151 PolarHBondContact OD1-N 3.39Å; D31-D200 VanDerWaalsContact N-CG 3.33Å; D31-D200 PolarHBondContact N-OD1 2.91Å; D31-D200 PolarHBondContact N-OD2 2.95Å
32	K	81.3	Confident	88.4	Confident	120 Å²	120	31.1 Å²	31.1	52%	0.522	16%	0.155	S	C	.	.			trans	-88	4.5	178.7	-66.2	-179.9	-173.3	163.7	0	113.4	R34 D35 H36 D200	K32-R34 PolarHBondContact O-N 3.05Å; K32-D35 PolarHBondContact O-N 3.32Å; K32-H36 PolarHBondContact O-CD2 3.18Å; K32-H36 VanDerWaalsContact O-CD2 3.28Å; K32-D200 PolarHBondContact N-OD1 3.45Å; K32-D200 PolarHBondContact N-OD2 3.44Å
33	G	81.7	Confident	88.4	Confident	2 Å²	2	30.3 Å²	30.3	2%	0.021	15%	0.152	C	C	.	.	H	α-helix	trans	-44.5	-32.2	177.6	0	0	0	0	0	116.1	D31 D35 H36 V37 D200	D31-G33 VanDerWaalsContact C-N 3.3Å; G33-D35 PolarHBondContact O-N 3.06Å; G33-H36 PolarHBondContact O-N 3.45Å; G33-V37 WeakPolarHBondContact O-CG2 3.38Å; G33-V37 PolarHBondContact O-N 2.83Å; G33-D200 PolarHBondContact N-OD1 3.33Å
34	R	83.7	Confident	88.2	Confident	57 Å²	57	30.4 Å²	30.4	22%	0.215	15%	0.152	C	C	.	.	H	α-helix	trans	-63.4	-39.6	177.4	-71.3	-177.4	175.7	140.7	6	113.6	K32 H36 V37 L63 F93 R150	K32-R34 PolarHBondContact O-N 3.05Å; R34-H36 VanDerWaalsContact C-N 3.31Å; R34-V37 WeakPolarHBondContact O-CB 3.31Å; R34-V37 PolarHBondContact O-N 3.09Å; R34-L63 VanDerWaalsContact NH2-C 3.26Å; R34-L63 PolarHBondContact NH2-O 3.02Å; R34-F93 HydrophobicContact CB-CD2 4.37Å; R34-F93 HydrophobicContact CB-CE2 4.08Å; R34-F93 HydrophobicContact CB-CZ 4.46Å; R34-F93 WeakPolarHBondContact O-CD2 3.22Å; R34-R150 VanDerWaalsContact CZ-CZ 3.46Å; R34-R150 VanDerWaalsContact CZ-NH2 3.28Å; R34-R150 VanDerWaalsContact NH2-CZ 3.26Å
35	D	85.4	Confident	88	Confident	84 Å²	84	31.9 Å²	31.9	45%	0.449	16%	0.161	S	C	.	.	H	α-helix	trans	-73.2	-32.4	-176.1	-66.3	-23.3	0	0	0	110.2	K32 G33 V37 V38	K32-D35 PolarHBondContact O-N 3.32Å; G33-D35 PolarHBondContact O-N 3.06Å; D35-V37 VanDerWaalsContact C-N 3.35Å; D35-V37 PolarHBondContact O-N 2.89Å; D35-V38 WeakPolarHBondContact O-CB 3.41Å; D35-V38 PolarHBondContact O-N 2.68Å
36	H	88	Confident	87.7	Confident	22 Å²	22	39.5 Å²	39.5	10%	0.102	19%	0.194	C	C	.	.	H	α-helix	trans	-68.4	-29.1	176.5	-61	-47.1	0	0	0	114.2	I28 K32 G33 R34 V38 V39 L40 D200 L202	I28-H36 HydrophobicContact CD1-CB 3.91Å; K32-H36 PolarHBondContact O-CD2 3.18Å; K32-H36 VanDerWaalsContact O-CD2 3.28Å; G33-H36 PolarHBondContact O-N 3.45Å; R34-H36 VanDerWaalsContact C-N 3.31Å; H36-V38 PolarHBondContact O-N 3.21Å; H36-V39 WeakPolarHBondContact O-CB 3.37Å; H36-V39 PolarHBondContact O-N 3.18Å; H36-V39 VanDerWaalsContact O-N 3.1Å; H36-L40 PolarHBondContact O-N 3.25Å; H36-D200 PolarHBondContact CE1-O 3.1Å; H36-D200 PolarHBondContact NE2-O 2.97Å; H36-L202 HydrophobicContact CB-CD2 3.89Å; H36-L202 HydrophobicContact CB-CG 4.45Å; H36-L202 WeakPolarHBondContact ND1-CG 3.43Å
37	V	89.8	Confident	87.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-53.8	-40.2	172.3	170.6	0	0	0	0	110.9	G33 R34 D35 V39 L40 H41 W57 F96 M120 I122 I146 L148	G33-V37 WeakPolarHBondContact O-CG2 3.38Å; G33-V37 PolarHBondContact O-N 2.83Å; R34-V37 WeakPolarHBondContact O-CB 3.31Å; R34-V37 PolarHBondContact O-N 3.09Å; D35-V37 VanDerWaalsContact C-N 3.35Å; D35-V37 PolarHBondContact O-N 2.89Å; V37-V39 VanDerWaalsContact C-N 3.35Å; V37-L40 PolarHBondContact O-N 3.35Å; V37-H41 WeakPolarHBondContact O-CB 3.5Å; V37-H41 PolarHBondContact O-N 2.99Å; V37-W57 HydrophobicContact CG1-CZ3 4.32Å; V37-F96 HydrophobicContact CG1-CE1 4.24Å; V37-F96 HydrophobicContact CG1-CZ 4.18Å; V37-M120 HydrophobicContact CG1-CE 3.82Å; V37-I122 HydrophobicContact CG1-CD1 3.37Å; V37-I122 HydrophobicContact CG1-CG1 4.07Å; V37-I122 HydrophobicContact CG2-CD1 4.48Å; V37-I122 HydrophobicContact CG2-CG2 4.38Å; V37-I146 HydrophobicContact CG2-CD1 4.28Å; V37-I146 HydrophobicContact CG2-CG2 4.35Å; V37-L148 HydrophobicContact CG2-CD1 4.25Å; V37-L148 HydrophobicContact CG2-CD2 4.07Å
38	V	89.4	Confident	86.8	Confident	22 Å²	22	42.3 Å²	42.3	13%	0.133	22%	0.216	C	C	.	.	H	α-helix	trans	-64.6	-42.9	-179.5	-174.6	0	0	0	0	110.9	D35 H36 H41 H42 P92 F93 F96	D35-V38 WeakPolarHBondContact O-CB 3.41Å; D35-V38 PolarHBondContact O-N 2.68Å; H36-V38 PolarHBondContact O-N 3.21Å; V38-H41 PolarHBondContact O-N 3.1Å; V38-H42 WeakPolarHBondContact O-CB 3.3Å; V38-H42 PolarHBondContact O-N 3.36Å; V38-P92 HydrophobicContact CG1-CB 4.12Å; V38-F93 HydrophobicContact CG2-CB 4.11Å; V38-F93 HydrophobicContact CG2-CD2 3.76Å; V38-F93 HydrophobicContact CG2-CG 4.43Å; V38-F96 HydrophobicContact CB-CB 4.42Å; V38-F96 HydrophobicContact CG1-CB 3.93Å; V38-F96 HydrophobicContact CG1-CG 4.44Å; V38-F96 HydrophobicContact CG2-CB 3.81Å; V38-F96 HydrophobicContact CG2-CD1 4.26Å; V38-F96 HydrophobicContact CG2-CG 4.01Å
39	V	90.3	Very high	86	Confident	59 Å²	59	51.4 Å²	51.4	36%	0.358	26%	0.264	S	S	.	.	H	α-helix	trans	-63.2	-48.5	179.6	-178.8	0	0	0	0	110	H36 V37 H41 H42 I43 L202	H36-V39 WeakPolarHBondContact O-CB 3.37Å; H36-V39 PolarHBondContact O-N 3.18Å; H36-V39 VanDerWaalsContact O-N 3.1Å; V37-V39 VanDerWaalsContact C-N 3.35Å; V39-H41 PolarHBondContact O-N 3.44Å; V39-H42 WeakPolarHBondContact O-CB 3.48Å; V39-H42 PolarHBondContact O-N 3.23Å; V39-I43 HydrophobicContact CG1-CD1 4Å; V39-I43 VanDerWaalsContact O-CG1 3.31Å; V39-I43 WeakPolarHBondContact O-CG1 3.43Å; V39-I43 PolarHBondContact O-N 3.17Å; V39-L202 HydrophobicContact CG1-CD1 4.21Å
40	L	91.5	Very high	85.4	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-41.3	178.6	-69.2	171	0	0	0	112.2	I10 I14 F26 I28 H36 V37 H42 I43 L44 I146	I10-L40 HydrophobicContact CG2-CD2 3.72Å; I14-L40 HydrophobicContact CD1-CD2 4.25Å; F26-L40 HydrophobicContact CB-CD1 4.28Å; F26-L40 HydrophobicContact CE1-CD2 4.44Å; F26-L40 HydrophobicContact CE2-CD2 4.46Å; F26-L40 HydrophobicContact CG-CD1 4.23Å; F26-L40 HydrophobicContact CZ-CD2 4.38Å; I28-L40 HydrophobicContact CD1-CD1 3.9Å; H36-L40 PolarHBondContact O-N 3.25Å; V37-L40 PolarHBondContact O-N 3.35Å; L40-H42 VanDerWaalsContact C-N 3.31Å; L40-H42 PolarHBondContact O-N 3.48Å; L40-I43 PolarHBondContact O-N 2.99Å; L40-L44 PolarHBondContact O-N 3.4Å; L40-I146 HydrophobicContact CB-CD1 4.06Å; L40-I146 HydrophobicContact CD1-CD1 3.53Å; L40-I146 HydrophobicContact CD1-CG1 4.37Å; L40-I146 HydrophobicContact CG-CD1 4.45Å
41	H	91.9	Very high	84.8	Confident	10 Å²	10	64.9 Å²	64.9	5%	0.046	33%	0.328	C	S	.	.	H	α-helix	trans	-61.6	-40.2	174.1	178.2	-87.3	0	0	0	111.9	V37 V38 V39 L44 T45 F96 M120	V37-H41 WeakPolarHBondContact O-CB 3.5Å; V37-H41 PolarHBondContact O-N 2.99Å; V38-H41 PolarHBondContact O-N 3.1Å; V39-H41 PolarHBondContact O-N 3.44Å; H41-L44 PolarHBondContact O-N 2.93Å; H41-T45 PolarHBondContact CE1-OG1 3.42Å; H41-T45 WeakPolarHBondContact O-CB 3.35Å; H41-T45 PolarHBondContact O-N 3.06Å; H41-T45 PolarHBondContact O-OG1 2.81Å; H41-F96 HydrophobicContact CB-CD2 4.38Å; H41-F96 HydrophobicContact CB-CE2 3.82Å; H41-F96 AromaticContact CD2-CE2 3.73Å; H41-F96 AromaticContact CG-CE2 3.49Å; H41-F96 VanDerWaalsContact CG-CE2 3.49Å; H41-F96 AromaticContact ND1-CE2 3.78Å; H41-M120 HydrophobicContact CB-CE 4.12Å; H41-M120 HydrophobicContact CB-SD 3.79Å
42	H	89.7	Confident	84.8	Confident	120 Å²	120	67.7 Å²	67.7	56%	0.556	33%	0.331	S	S	*	.	H	α-helix	trans	-65.2	-42.4	176.4	-176.1	73.6	0	0	0	111.8	V38 V39 L40 T45 K46	V38-H42 WeakPolarHBondContact O-CB 3.3Å; V38-H42 PolarHBondContact O-N 3.36Å; V39-H42 WeakPolarHBondContact O-CB 3.48Å; V39-H42 PolarHBondContact O-N 3.23Å; L40-H42 VanDerWaalsContact C-N 3.31Å; L40-H42 PolarHBondContact O-N 3.48Å; H42-T45 PolarHBondContact O-N 3.21Å; H42-K46 WeakPolarHBondContact O-CB 3.45Å; H42-K46 PolarHBondContact O-N 2.73Å
43	I	90.1	Very high	85	Confident	24 Å²	24	62.8 Å²	62.8	12%	0.123	31%	0.311	C	S	.	.	H	α-helix	trans	-61	-46.9	175.5	-64.6	163.5	0	0	0	110.5	L6 R11 I14 V39 L40 T45 K46 A47	L6-I43 HydrophobicContact CD2-CD1 3.59Å; R11-I43 HydrophobicContact CG-CG2 4.4Å; I14-I43 HydrophobicContact CD1-CB 4.2Å; I14-I43 HydrophobicContact CD1-CG2 3.66Å; V39-I43 HydrophobicContact CG1-CD1 4Å; V39-I43 VanDerWaalsContact O-CG1 3.31Å; V39-I43 WeakPolarHBondContact O-CG1 3.43Å; V39-I43 PolarHBondContact O-N 3.17Å; L40-I43 PolarHBondContact O-N 2.99Å; I43-T45 PolarHBondContact O-N 3.46Å; I43-K46 PolarHBondContact O-N 3.16Å; I43-A47 WeakPolarHBondContact O-CB 3.4Å; I43-A47 PolarHBondContact O-N 3.48Å
44	L	90.4	Very high	85.4	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-59.9	-46.4	176.7	-179.7	64.2	0	0	0	112	I14 L18 L40 H41 K46 A47 S48 P53 G142 L144	I14-L44 HydrophobicContact CG2-CB 4.48Å; I14-L44 HydrophobicContact CG2-CD1 3.86Å; L18-L44 HydrophobicContact CD1-CD1 4.2Å; L18-L44 HydrophobicContact CD2-CD1 4.33Å; L18-L44 HydrophobicContact CG-CD1 4.4Å; L40-L44 PolarHBondContact O-N 3.4Å; H41-L44 PolarHBondContact O-N 2.93Å; L44-K46 VanDerWaalsContact C-N 3.26Å; L44-K46 PolarHBondContact O-N 3.44Å; L44-A47 PolarHBondContact O-N 2.83Å; L44-S48 VanDerWaalsContact O-CB 3.3Å; L44-S48 WeakPolarHBondContact O-CB 3.46Å; L44-S48 PolarHBondContact O-N 2.96Å; L44-P53 HydrophobicContact CD2-CB 4.24Å; L44-P53 HydrophobicContact CD2-CG 3.75Å; L44-P53 HydrophobicContact CG-CG 4.27Å; L44-G142 VanDerWaalsContact CD1-O 3.32Å; L44-G142 WeakPolarHBondContact CD1-O 3.4Å; L44-L144 HydrophobicContact CB-CD1 3.65Å; L44-L144 HydrophobicContact CD1-CD1 4.21Å; L44-L144 HydrophobicContact CD1-CG 4.36Å; L44-L144 HydrophobicContact CD2-CB 4.42Å; L44-L144 HydrophobicContact CD2-CD1 3.71Å; L44-L144 HydrophobicContact CD2-CG 4.02Å; L44-L144 HydrophobicContact CG-CD1 4.04Å
45	T	89.6	Confident	85.9	Confident	33 Å²	33	61.6 Å²	61.6	20%	0.202	31%	0.311	C	S	.	.	H	α-helix	trans	-62.2	-36.3	178.8	-56.7	0	0	0	0	111.5	H41 H42 I43 R52	H41-T45 PolarHBondContact CE1-OG1 3.42Å; H41-T45 WeakPolarHBondContact O-CB 3.35Å; H41-T45 PolarHBondContact O-N 3.06Å; H41-T45 PolarHBondContact O-OG1 2.81Å; H42-T45 PolarHBondContact O-N 3.21Å; I43-T45 PolarHBondContact O-N 3.46Å; T45-R52 HydrophobicContact CG2-CG 3.89Å
46	K	88.3	Confident	86.3	Confident	161 Å²	161	57.6 Å²	57.6	70%	0.7	29%	0.29	S	S	*	.	H	α-helix	trans	-75.2	-33.9	179.1	-172.8	176	179.6	177.2	0	112.5	H42 I43 L44	H42-K46 WeakPolarHBondContact O-CB 3.45Å; H42-K46 PolarHBondContact O-N 2.73Å; I43-K46 PolarHBondContact O-N 3.16Å; L44-K46 VanDerWaalsContact C-N 3.26Å; L44-K46 PolarHBondContact O-N 3.44Å
47	A	85.4	Confident	86.6	Confident	33 Å²	33	56.5 Å²	56.5	27%	0.273	29%	0.285	S	S	.	.	H	α-helix	trans	-77	-30.8	177.8	0	0	0	0	0	112.4	I14 E15 L18 I43 L44	I14-A47 HydrophobicContact CG2-CB 4.48Å; E15-A47 HydrophobicContact CG-CB 4.12Å; L18-A47 HydrophobicContact CD1-CB 3.44Å; L18-A47 VanDerWaalsContact CD1-CB 3.44Å; I43-A47 WeakPolarHBondContact O-CB 3.4Å; I43-A47 PolarHBondContact O-N 3.48Å; L44-A47 PolarHBondContact O-N 2.83Å
48	S	79.2	Confident	86.6	Confident	27 Å²	27	56.5 Å²	56.5	19%	0.189	29%	0.285	C	S	.	.			trans	-85.7	126.8	177.9	-173.4	0	0	0	0	111.5	L44 R50	L44-S48 VanDerWaalsContact O-CB 3.3Å; L44-S48 WeakPolarHBondContact O-CB 3.46Å; L44-S48 PolarHBondContact O-N 2.96Å; S48-R50 PolarHBondContact O-N 3.1Å; S48-R50 WeakPolarHBondContact OG-CB 3.46Å; S48-R50 PolarHBondContact OG-N 3.31Å
49	L	72.9	Confident	86.6	Confident	191 Å²	191	56.1 Å²	56.1	100%	1	28%	0.281	S	S	*	.	S	Bend	trans	-75.4	0.5	171.4	-68.1	166.4	0	0	0	112.9
50	R	72	Confident	86.2	Confident	171 Å²	171	56.6 Å²	56.6	65%	0.645	28%	0.278	S	S	*	.	S	Bend	trans	-93.5	164.5	-174.7	-70	-174.9	-177.7	167.3	5	112.2	S48	S48-R50 PolarHBondContact O-N 3.1Å; S48-R50 WeakPolarHBondContact OG-CB 3.46Å; S48-R50 PolarHBondContact OG-N 3.31Å
51	P	70.3	Confident	85.6	Confident	120 Å²	120	64.2 Å²	64.2	78%	0.779	31%	0.312	S	S	*	.	S	Bend	trans	-49.5	150.4	170.1	19.1	-33.8	0	0	0	112.5
52	R	79.8	Confident	84.9	Confident	160 Å²	160	71.1 Å²	71.1	60%	0.604	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-48.8	128.3	-177	-73.6	-174.1	178.5	-173.9	0.2	110.9	T45	T45-R52 HydrophobicContact CG2-CG 3.89Å
53	P	84.8	Confident	84	Confident	17 Å²	17	65.9 Å²	65.9	11%	0.11	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-65	142.9	-174.6	24.4	-31.8	0	0	0	111.8	L44	L44-P53 HydrophobicContact CD2-CB 4.24Å; L44-P53 HydrophobicContact CD2-CG 3.75Å; L44-P53 HydrophobicContact CG-CG 4.27Å
54	S	91.4	Very high	83.1	Confident	34 Å²	34	67.7 Å²	67.7	24%	0.238	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-70.5	139.6	171.4	48.6	0	0	0	0	110.6	Y118 G119 M120	S54-Y118 WeakPolarHBondContact OG-CA 3.3Å; S54-G119 PolarHBondContact O-N 3.24Å; S54-G119 PolarHBondContact OG-N 3.31Å; S54-M120 PolarHBondContact O-N 3.25Å
55	V	94	Very high	82.6	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.6	-177.4	-175.4	0	0	0	0	110.1	F96 Q101 I102 R103 M120 I122	V55-F96 HydrophobicContact CG1-CZ 4.39Å; V55-F96 HydrophobicContact CG2-CE2 4.39Å; V55-F96 HydrophobicContact CG2-CZ 4.12Å; V55-Q101 PolarHBondContact N-O 2.81Å; V55-Q101 VanDerWaalsContact N-O 3.07Å; V55-I102 HydrophobicContact CB-CG1 4.16Å; V55-I102 HydrophobicContact CB-CG2 4.44Å; V55-I102 HydrophobicContact CG1-CG2 4.34Å; V55-I102 CarbonylContact O-C 3.5Å; V55-I102 WeakPolarHBondContact O-CA 3.33Å; V55-R103 PolarHBondContact O-N 3.39Å; V55-M120 CarbonylContact C-O 3.56Å; V55-M120 WeakPolarHBondContact CA-O 3.47Å; V55-M120 HydrophobicContact CG1-CB 4.49Å; V55-M120 HydrophobicContact CG1-CG 4.46Å; V55-M120 HydrophobicContact CG2-CB 4.2Å; V55-M120 HydrophobicContact CG2-SD 4.22Å; V55-I122 HydrophobicContact CG1-CD1 3.53Å; V55-I122 HydrophobicContact CG1-CG1 4.29Å
56	L	94	Very high	82	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	119.2	168.7	175	64.5	0	0	0	109.2	R103 C105 I113 Y118 M120 C121 I122	L56-R103 HydrophobicContact CD1-CB 4.43Å; L56-R103 HydrophobicContact CD1-CG 4.28Å; L56-C105 HydrophobicContact CD1-CB 4.04Å; L56-I113 HydrophobicContact CD1-CD1 4.44Å; L56-I113 HydrophobicContact CD1-CG2 4.03Å; L56-I113 HydrophobicContact CD2-CD1 3.58Å; L56-Y118 HydrophobicContact CB-CD1 3.84Å; L56-Y118 HydrophobicContact CB-CD2 3.93Å; L56-Y118 HydrophobicContact CB-CE1 4.19Å; L56-Y118 HydrophobicContact CB-CE2 4.29Å; L56-Y118 HydrophobicContact CB-CG 3.71Å; L56-Y118 HydrophobicContact CD1-CE2 4.25Å; L56-Y118 HydrophobicContact CD2-CD2 3.99Å; L56-Y118 HydrophobicContact CD2-CE2 4.09Å; L56-Y118 HydrophobicContact CG-CD2 4.42Å; L56-Y118 HydrophobicContact CG-CE2 4.45Å; L56-M120 PolarHBondContact N-O 2.93Å; L56-C121 CarbonylContact O-C 3.58Å; L56-C121 WeakPolarHBondContact O-CA 3.46Å; L56-I122 PolarHBondContact O-N 3.44Å
57	W	93.1	Very high	81.5	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	109.1	176.8	-161.1	-53.3	0	0	0	110.4	V37 L63 F65 F93 F96 I102 R103 Y104 C105 I122 L148	V37-W57 HydrophobicContact CG1-CZ3 4.32Å; W57-L63 VanDerWaalsContact CD1-CD2 3.45Å; W57-L63 HydrophobicContact CD2-CD2 4.27Å; W57-L63 HydrophobicContact CG-CD2 4.08Å; W57-L63 VanDerWaalsContact NE1-CD2 3.25Å; W57-F65 HydrophobicContact CD2-CZ 4.34Å; W57-F65 HydrophobicContact CE3-CZ 4.4Å; W57-F65 HydrophobicContact CH2-CE1 4.22Å; W57-F65 HydrophobicContact CH2-CZ 4.19Å; W57-F65 HydrophobicContact CZ2-CE1 4Å; W57-F65 HydrophobicContact CZ2-CZ 4.09Å; W57-F65 HydrophobicContact CZ3-CZ 4.33Å; W57-F93 AromaticContact CH2-CE2 3.72Å; W57-F93 HydrophobicContact CH2-CE2 3.72Å; W57-F93 AromaticContact CH2-CZ 3.81Å; W57-F93 HydrophobicContact CH2-CZ 3.81Å; W57-F93 HydrophobicContact CZ3-CE2 4.02Å; W57-F93 HydrophobicContact CZ3-CZ 4.18Å; W57-F96 HydrophobicContact CZ3-CE1 4.06Å; W57-I102 HydrophobicContact CB-CG2 3.76Å; W57-R103 PolarHBondContact N-O 3.17Å; W57-Y104 HydrophobicContact CB-CD1 3.93Å; W57-Y104 HydrophobicContact CB-CE1 4.19Å; W57-Y104 HydrophobicContact CG-CD1 4.3Å; W57-Y104 HydrophobicContact CG-CE1 4.36Å; W57-C105 PolarHBondContact O-N 2.81Å; W57-I122 HydrophobicContact CD2-CB 4.22Å; W57-I122 HydrophobicContact CD2-CD1 3.97Å; W57-I122 HydrophobicContact CD2-CG2 4.13Å; W57-I122 HydrophobicContact CE3-CB 4.42Å; W57-I122 HydrophobicContact CE3-CD1 3.32Å; W57-I122 HydrophobicContact CE3-CG1 4.48Å; W57-I122 HydrophobicContact CE3-CG2 4.43Å; W57-I122 HydrophobicContact CG-CB 4.43Å; W57-I122 HydrophobicContact CH2-CD1 4.26Å; W57-I122 HydrophobicContact CH2-CG2 4.31Å; W57-I122 HydrophobicContact CZ2-CG2 4.03Å; W57-I122 HydrophobicContact CZ3-CD1 3.49Å; W57-I122 VanDerWaalsContact CZ3-CD1 3.49Å; W57-L148 HydrophobicContact CZ2-CD1 4.43Å
58	C	91.3	Very high	81.1	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.2	-178.8	-68.9	0	0	0	0	111	C105 Y107 I122 L123 Q124	C58-C105 WeakPolarHBondContact CA-O 3.42Å; C58-Y107 HydrophobicContact CB-CD1 4.07Å; C58-Y107 HydrophobicContact CB-CE1 3.71Å; C58-Y107 WeakPolarHBondContact O-CE1 3.46Å; C58-I122 PolarHBondContact N-O 2.99Å; C58-L123 HydrophobicContact CB-CD2 3.62Å; C58-Q124 PolarHBondContact O-N 3.24Å
59	Y	89.1	Confident	80.8	Confident	13 Å²	13	73.7 Å²	73.7	5%	0.051	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	162	-176.3	67.9	-72.2	0	0	0	112.3	L63 C105 Y106 Y107	Y59-L63 HydrophobicContact CD1-CD1 3.69Å; Y59-L63 HydrophobicContact CD1-CD2 4.13Å; Y59-L63 HydrophobicContact CD1-CG 3.91Å; Y59-L63 HydrophobicContact CD2-CD1 3.72Å; Y59-L63 HydrophobicContact CD2-CG 3.59Å; Y59-L63 HydrophobicContact CE1-CD1 3.43Å; Y59-L63 VanDerWaalsContact CE1-CD1 3.43Å; Y59-L63 HydrophobicContact CE1-CG 4.17Å; Y59-L63 HydrophobicContact CE2-CD1 3.4Å; Y59-L63 HydrophobicContact CE2-CG 3.8Å; Y59-L63 HydrophobicContact CG-CD1 3.84Å; Y59-L63 HydrophobicContact CG-CD2 4.09Å; Y59-L63 HydrophobicContact CG-CG 3.63Å; Y59-C105 WeakPolarHBondContact CD1-O 3.34Å; Y59-C105 PolarHBondContact N-O 3.4Å; Y59-C105 VanDerWaalsContact N-O 3.1Å; Y59-Y106 HydrophobicContact CD2-CD1 4.21Å; Y59-Y106 HydrophobicContact CD2-CE1 4.12Å; Y59-Y106 HydrophobicContact CE1-CD1 4.38Å; Y59-Y106 HydrophobicContact CE1-CE1 4.47Å; Y59-Y106 AromaticContact CE2-CD1 3.65Å; Y59-Y106 HydrophobicContact CE2-CD1 3.65Å; Y59-Y106 AromaticContact CE2-CE1 3.22Å; Y59-Y106 HydrophobicContact CE2-CE1 3.22Å; Y59-Y106 AromaticContact CE2-CZ 3.88Å; Y59-Y106 AromaticContact CZ-CD1 3.74Å; Y59-Y106 AromaticContact CZ-CE1 3.44Å; Y59-Y106 VanDerWaalsContact CZ-CE1 3.44Å; Y59-Y106 AromaticContact CZ-CZ 3.71Å; Y59-Y106 CarbonylContact O-C 3.51Å; Y59-Y106 WeakPolarHBondContact O-CA 3.41Å; Y59-Y106 WeakPolarHBondContact OH-CE1 3.48Å; Y59-Y106 WeakPolarHBondContact OH-CE2 3.44Å; Y59-Y106 PolarHBondContact OH-OH 3.09Å; Y59-Y107 VanDerWaalsContact N-CE1 3.34Å; Y59-Y107 WeakPolarHBondContact O-CD1 3.37Å; Y59-Y107 PolarHBondContact O-N 2.96Å
60	K	82.3	Confident	80.9	Confident	70 Å²	70	72.9 Å²	72.9	30%	0.304	35%	0.35	S	S	.	.	S	Bend	trans	-88.8	-64.3	-175.6	-171	177.9	171.9	-171.6	0	114.1	Y107 D164	K60-Y107 HydrophobicContact CB-CD2 3.67Å; K60-Y107 HydrophobicContact CB-CE2 3.78Å; K60-Y107 HydrophobicContact CG-CD2 4.12Å; K60-D164 VanDerWaalsContact CE-CG 3.47Å; K60-D164 WeakPolarHBondContact CE-OD2 3.47Å; K60-D164 IonicContact NZ-OD1 2.74Å; K60-D164 PolarHBondContact NZ-OD1 2.91Å; K60-D164 IonicContact NZ-OD2 2.73Å; K60-D164 PolarHBondContact NZ-OD2 3.22Å
61	K	79.1	Confident	81.3	Confident	161 Å²	161	70.9 Å²	70.9	70%	0.7	35%	0.346	S	S	*	.	S	Bend	trans	-129.2	-55.7	-179.9	-73.6	-178.4	-179.7	177.8	0	111.4
62	E	76.7	Confident	81.3	Confident	155 Å²	155	66.4 Å²	66.4	72%	0.724	31%	0.314	S	S	*	.			trans	-117.1	127.8	-171.5	-63.4	-170.7	178.3	0	0	113.6	Q124	E62-Q124 PolarHBondContact O-NE2 3.29Å
63	L	69.9	Low	81	Confident	10 Å²	10	64.6 Å²	64.6	5%	0.052	31%	0.314	C	S	.	.			trans	-86.8	-11.8	173	-86.8	149.8	0	0	0	113.1	R34 W57 Y59 F65 T67 Y104	R34-L63 VanDerWaalsContact NH2-C 3.26Å; R34-L63 PolarHBondContact NH2-O 3.02Å; W57-L63 VanDerWaalsContact CD1-CD2 3.45Å; W57-L63 HydrophobicContact CD2-CD2 4.27Å; W57-L63 HydrophobicContact CG-CD2 4.08Å; W57-L63 VanDerWaalsContact NE1-CD2 3.25Å; Y59-L63 HydrophobicContact CD1-CD1 3.69Å; Y59-L63 HydrophobicContact CD1-CD2 4.13Å; Y59-L63 HydrophobicContact CD1-CG 3.91Å; Y59-L63 HydrophobicContact CD2-CD1 3.72Å; Y59-L63 HydrophobicContact CD2-CG 3.59Å; Y59-L63 HydrophobicContact CE1-CD1 3.43Å; Y59-L63 VanDerWaalsContact CE1-CD1 3.43Å; Y59-L63 HydrophobicContact CE1-CG 4.17Å; Y59-L63 HydrophobicContact CE2-CD1 3.4Å; Y59-L63 HydrophobicContact CE2-CG 3.8Å; Y59-L63 HydrophobicContact CG-CD1 3.84Å; Y59-L63 HydrophobicContact CG-CD2 4.09Å; Y59-L63 HydrophobicContact CG-CG 3.63Å; L63-F65 HydrophobicContact CB-CD1 4.27Å; L63-F65 HydrophobicContact CB-CE1 4.17Å; L63-F65 HydrophobicContact CB-CG 4.47Å; L63-F65 HydrophobicContact CB-CZ 4.33Å; L63-F65 HydrophobicContact CD2-CE1 3.82Å; L63-F65 HydrophobicContact CD2-CE2 4.11Å; L63-F65 HydrophobicContact CD2-CZ 3.49Å; L63-F65 VanDerWaalsContact CD2-CZ 3.49Å; L63-F65 HydrophobicContact CG-CZ 4.46Å; L63-F65 WeakPolarHBondContact O-CD1 3.45Å; L63-F65 VanDerWaalsContact O-CE1 3.29Å; L63-F65 WeakPolarHBondContact O-CE1 3.22Å; L63-F65 PolarHBondContact O-N 3.34Å; L63-T67 HydrophobicContact CD1-CG2 3.47Å; L63-T67 VanDerWaalsContact CD1-CG2 3.47Å; L63-Y104 HydrophobicContact CD1-CD1 3.98Å; L63-Y104 HydrophobicContact CD1-CE1 4.45Å; L63-Y104 HydrophobicContact CD2-CD1 4.31Å; L63-Y104 HydrophobicContact CD2-CE1 4.37Å
64	G	72.2	Confident	80.7	Confident	61 Å²	61	72.7 Å²	72.7	63%	0.629	34%	0.342	S	S	*	.	S	Bend	trans	61.9	4.4	-171.1	0	0	0	0	0	114.5
65	F	78.3	Confident	80	Confident	35 Å²	35	75.6 Å²	75.6	15%	0.154	35%	0.353	C	S	.	.	S	Bend	trans	-148.9	160.2	171.7	60.5	-92.1	0	0	0	110	W57 L63 F93 V97 Y104	W57-F65 HydrophobicContact CD2-CZ 4.34Å; W57-F65 HydrophobicContact CE3-CZ 4.4Å; W57-F65 HydrophobicContact CH2-CE1 4.22Å; W57-F65 HydrophobicContact CH2-CZ 4.19Å; W57-F65 HydrophobicContact CZ2-CE1 4Å; W57-F65 HydrophobicContact CZ2-CZ 4.09Å; W57-F65 HydrophobicContact CZ3-CZ 4.33Å; L63-F65 HydrophobicContact CB-CD1 4.27Å; L63-F65 HydrophobicContact CB-CE1 4.17Å; L63-F65 HydrophobicContact CB-CG 4.47Å; L63-F65 HydrophobicContact CB-CZ 4.33Å; L63-F65 HydrophobicContact CD2-CE1 3.82Å; L63-F65 HydrophobicContact CD2-CE2 4.11Å; L63-F65 HydrophobicContact CD2-CZ 3.49Å; L63-F65 VanDerWaalsContact CD2-CZ 3.49Å; L63-F65 HydrophobicContact CG-CZ 4.46Å; L63-F65 WeakPolarHBondContact O-CD1 3.45Å; L63-F65 VanDerWaalsContact O-CE1 3.29Å; L63-F65 WeakPolarHBondContact O-CE1 3.22Å; L63-F65 PolarHBondContact O-N 3.34Å; F65-F93 AromaticContact CD1-CE1 3.69Å; F65-F93 HydrophobicContact CD1-CE1 3.69Å; F65-F93 AromaticContact CD1-CZ 3.87Å; F65-F93 HydrophobicContact CD1-CZ 3.87Å; F65-F93 AromaticContact CE1-CE1 3.81Å; F65-F93 HydrophobicContact CE1-CE1 3.81Å; F65-F93 AromaticContact CE1-CZ 3.47Å; F65-F93 HydrophobicContact CE1-CZ 3.47Å; F65-F93 VanDerWaalsContact CE1-CZ 3.47Å; F65-F93 HydrophobicContact CG-CE1 4.12Å; F65-F93 HydrophobicContact CZ-CE1 4.29Å; F65-F93 AromaticContact CZ-CZ 3.84Å; F65-F93 HydrophobicContact CZ-CZ 3.84Å; F65-V97 HydrophobicContact CE2-CG1 4.49Å; F65-V97 HydrophobicContact CE2-CG2 4.28Å; F65-Y104 AromaticContact CE2-CE1 3.83Å; F65-Y104 HydrophobicContact CE2-CE1 3.83Å; F65-Y104 HydrophobicContact CZ-CE1 4.2Å
66	T	77.8	Confident	79	Confident	26 Å²	26	77.5 Å²	77.5	16%	0.16	36%	0.363	C	S	.	.			trans	-82.9	133.8	178.8	171.2	0	0	0	0	111.3	H68 R72 M75	T66-H68 PolarHBondContact OG1-N 3.39Å; T66-R72 HydrophobicContact CG2-CB 3.68Å; T66-R72 HydrophobicContact CG2-CG 3.98Å; T66-M75 HydrophobicContact CG2-CE 3.89Å
67	T	77.2	Confident	78.2	Confident	49 Å²	49	82 Å²	82	30%	0.301	38%	0.384	S	S	.	.	S	Bend	trans	-73	-29.7	174	54.3	0	0	0	0	112.4	L63 R69 Y104	L63-T67 HydrophobicContact CD1-CG2 3.47Å; L63-T67 VanDerWaalsContact CD1-CG2 3.47Å; T67-R69 PolarHBondContact O-N 2.78Å; T67-R69 VanDerWaalsContact O-N 3.14Å; T67-Y104 HydrophobicContact CG2-CD1 3.66Å; T67-Y104 HydrophobicContact CG2-CD2 3.73Å; T67-Y104 HydrophobicContact CG2-CE1 3.94Å; T67-Y104 HydrophobicContact CG2-CE2 4.01Å; T67-Y104 HydrophobicContact CG2-CG 3.55Å
68	H	77.3	Confident	77.6	Confident	132 Å²	132	89.7 Å²	89.7	61%	0.611	42%	0.417	S	S	*	.			trans	-71.4	107.6	178.9	-80.2	-72.3	0	0	0	112.1	T66 K70 K71 R72	T66-H68 PolarHBondContact OG1-N 3.39Å; H68-K70 VanDerWaalsContact C-N 3.31Å; H68-K70 PolarHBondContact O-N 3.42Å; H68-K71 HydrophobicContact CB-CB 3.87Å; H68-K71 PolarHBondContact O-N 3.45Å; H68-K71 VanDerWaalsContact O-N 3.09Å; H68-R72 PolarHBondContact O-N 3.23Å
69	R	73.9	Confident	76.8	Confident	142 Å²	142	96 Å²	96	54%	0.536	45%	0.445	S	S	.	.	H	α-helix	trans	-48.5	-47.7	176.5	-76.9	-174.6	175.5	177.1	-0.8	113	T67 K71 R72 M73 A98 T100	T67-R69 PolarHBondContact O-N 2.78Å; T67-R69 VanDerWaalsContact O-N 3.14Å; R69-K71 PolarHBondContact O-N 3.08Å; R69-R72 PolarHBondContact O-N 2.99Å; R69-M73 PolarHBondContact O-N 3.08Å; R69-A98 PolarHBondContact NE-O 3.36Å; R69-A98 PolarHBondContact NH2-O 3.27Å; R69-T100 PolarHBondContact NH2-O 3.35Å
70	K	75.3	Confident	76	Confident	174 Å²	174	98.4 Å²	98.4	76%	0.757	46%	0.458	S	S	*	.	H	α-helix	trans	-62.5	-42.7	179.2	-73.4	-175.1	178.5	179.5	0	113	H68 R72 R74	H68-K70 VanDerWaalsContact C-N 3.31Å; H68-K70 PolarHBondContact O-N 3.42Å; K70-R72 VanDerWaalsContact C-N 3.32Å; K70-R74 WeakPolarHBondContact O-CG 3.45Å; K70-R74 PolarHBondContact O-N 3.49Å; K70-R74 VanDerWaalsContact O-N 3.12Å
71	K	78.6	Confident	75.8	Confident	129 Å²	129	105.6 Å²	105.6	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-66.9	-36.5	178.7	-167.4	175.7	-178.1	177.9	0	110.9	H68 R69 M75	H68-K71 HydrophobicContact CB-CB 3.87Å; H68-K71 PolarHBondContact O-N 3.45Å; H68-K71 VanDerWaalsContact O-N 3.09Å; R69-K71 PolarHBondContact O-N 3.08Å; K71-M75 PolarHBondContact O-N 3.06Å
72	R	71.8	Confident	75.8	Confident	27 Å²	27	101.1 Å²	101.1	10%	0.102	48%	0.476	C	S	.	.	H	α-helix	trans	-66.6	-49.5	175.7	-157.8	175.8	-175.2	150.1	-7.7	112	T66 H68 R69 K70 R74 M75 L76 D94	T66-R72 HydrophobicContact CG2-CB 3.68Å; T66-R72 HydrophobicContact CG2-CG 3.98Å; H68-R72 PolarHBondContact O-N 3.23Å; R69-R72 PolarHBondContact O-N 2.99Å; K70-R72 VanDerWaalsContact C-N 3.32Å; R72-R74 VanDerWaalsContact C-N 3.26Å; R72-R74 PolarHBondContact O-N 2.71Å; R72-M75 CarbonylContact O-C 3.41Å; R72-M75 WeakPolarHBondContact O-CA 3.48Å; R72-M75 PolarHBondContact O-N 3.23Å; R72-L76 HydrophobicContact CG-CD1 4.43Å; R72-L76 PolarHBondContact O-N 3.31Å; R72-D94 IonicContact CZ-OD1 2.88Å; R72-D94 IonicContact NE-OD1 2.92Å; R72-D94 PolarHBondContact NE-OD1 3.46Å; R72-D94 IonicContact NH2-OD1 2.73Å; R72-D94 PolarHBondContact NH2-OD1 3.34Å
73	M	72.7	Confident	75.4	Confident	122 Å²	122	97 Å²	97	60%	0.601	48%	0.475	S	S	*	.	H	α-helix	trans	-53	-44.5	175.1	-85.2	-86.8	-85	0	0	111.5	R69 L76 Q77	R69-M73 PolarHBondContact O-N 3.08Å; M73-L76 PolarHBondContact O-N 3.21Å; M73-Q77 WeakPolarHBondContact O-CB 3.34Å; M73-Q77 VanDerWaalsContact O-CG 3.29Å; M73-Q77 WeakPolarHBondContact O-CG 3.45Å; M73-Q77 PolarHBondContact O-N 3.25Å
74	R	79.8	Confident	75.2	Confident	186 Å²	186	105.4 Å²	105.4	70%	0.702	51%	0.511	S	S	*	.	H	α-helix	trans	-63.6	-41.3	174.8	-72.5	179.2	-179.3	177.6	-0.6	113.1	K70 R72 K78	K70-R74 WeakPolarHBondContact O-CG 3.45Å; K70-R74 PolarHBondContact O-N 3.49Å; K70-R74 VanDerWaalsContact O-N 3.12Å; R72-R74 VanDerWaalsContact C-N 3.26Å; R72-R74 PolarHBondContact O-N 2.71Å; R74-K78 WeakPolarHBondContact O-CB 3.39Å; R74-K78 PolarHBondContact O-N 3.1Å
75	M	76.2	Confident	74.4	Confident	95 Å²	95	104.1 Å²	104.1	47%	0.468	49%	0.494	S	S	.	.	H	α-helix	trans	-66.4	-39.7	176.1	-79	-149.6	-112.9	0	0	112.4	T66 K71 R72 K78 K79	T66-M75 HydrophobicContact CG2-CE 3.89Å; K71-M75 PolarHBondContact O-N 3.06Å; R72-M75 CarbonylContact O-C 3.41Å; R72-M75 WeakPolarHBondContact O-CA 3.48Å; R72-M75 PolarHBondContact O-N 3.23Å; M75-K78 PolarHBondContact O-N 3.05Å; M75-K79 WeakPolarHBondContact O-CG 2.89Å; M75-K79 PolarHBondContact O-N 3.41Å
76	L	73.5	Confident	73.4	Confident	41 Å²	41	104.2 Å²	104.2	22%	0.215	51%	0.505	C	S	.	.	H	α-helix	trans	-63.9	-49.3	175.7	-119.2	130.9	0	0	0	110.3	R72 M73 K78 K79 M80 D94	R72-L76 HydrophobicContact CG-CD1 4.43Å; R72-L76 PolarHBondContact O-N 3.31Å; M73-L76 PolarHBondContact O-N 3.21Å; L76-K78 VanDerWaalsContact C-N 3.27Å; L76-K78 PolarHBondContact O-N 2.79Å; L76-K79 WeakPolarHBondContact O-CA 3.25Å; L76-K79 WeakPolarHBondContact O-CB 3.5Å; L76-K79 PolarHBondContact O-N 3.28Å; L76-M80 WeakPolarHBondContact O-CG 3.32Å; L76-M80 PolarHBondContact O-N 3.41Å; L76-D94 HydrophobicContact CD1-CB 4.24Å
77	Q	76.9	Confident	72.2	Confident	94 Å²	94	110 Å²	110	44%	0.439	53%	0.534	S	S	.	.	H	α-helix	trans	-57.1	-39.1	173.1	-74.6	176.7	-3.8	0	0	112.3	M73 M80 R81	M73-Q77 WeakPolarHBondContact O-CB 3.34Å; M73-Q77 VanDerWaalsContact O-CG 3.29Å; M73-Q77 WeakPolarHBondContact O-CG 3.45Å; M73-Q77 PolarHBondContact O-N 3.25Å; Q77-M80 PolarHBondContact O-N 3.47Å; Q77-R81 WeakPolarHBondContact O-CB 3.35Å; Q77-R81 VanDerWaalsContact O-CG 3.32Å; Q77-R81 WeakPolarHBondContact O-CG 3.28Å; Q77-R81 PolarHBondContact O-N 2.95Å
78	K	79.5	Confident	71.1	Confident	161 Å²	161	115.2 Å²	115.2	70%	0.7	56%	0.56	S	S	*	*	H	α-helix	trans	-65.9	-38.7	175.7	-168.1	175.6	-178	179.4	0	111.9	R74 M75 L76 A82	R74-K78 WeakPolarHBondContact O-CB 3.39Å; R74-K78 PolarHBondContact O-N 3.1Å; M75-K78 PolarHBondContact O-N 3.05Å; L76-K78 VanDerWaalsContact C-N 3.27Å; L76-K78 PolarHBondContact O-N 2.79Å; K78-A82 WeakPolarHBondContact O-CB 3.29Å; K78-A82 PolarHBondContact O-N 3.04Å
79	K	74.1	Confident	70	Confident	133 Å²	133	114.4 Å²	114.4	58%	0.578	56%	0.561	S	S	*	*	H	α-helix	trans	-67.7	-38.9	174.7	-76.3	-177.4	177	-177	0	112.4	M75 L76 A82 G83 K84	M75-K79 WeakPolarHBondContact O-CG 2.89Å; M75-K79 PolarHBondContact O-N 3.41Å; L76-K79 WeakPolarHBondContact O-CA 3.25Å; L76-K79 WeakPolarHBondContact O-CB 3.5Å; L76-K79 PolarHBondContact O-N 3.28Å; K79-A82 PolarHBondContact O-N 3.45Å; K79-G83 PolarHBondContact O-N 2.6Å; K79-K84 PolarHBondContact O-N 3.2Å
80	M	72.8	Confident	69.2	Low	64 Å²	64	112.7 Å²	112.7	32%	0.315	56%	0.559	S	S	.	*	H	α-helix	trans	-63.7	-46.5	173.9	-66.2	176.1	97.9	0	0	111	L76 Q77 A82 G83 L87	L76-M80 WeakPolarHBondContact O-CG 3.32Å; L76-M80 PolarHBondContact O-N 3.41Å; Q77-M80 PolarHBondContact O-N 3.47Å; M80-A82 PolarHBondContact O-N 3.44Å; M80-G83 PolarHBondContact O-N 2.88Å; M80-L87 HydrophobicContact CE-CB 4.42Å; M80-L87 HydrophobicContact CE-CD2 3.54Å; M80-L87 HydrophobicContact CE-CG 3.87Å
81	R	79	Confident	69	Low	220 Å²	220	111.1 Å²	111.1	83%	0.83	55%	0.552	S	S	*	*	H	α-helix	trans	-61.5	-30.2	174.7	-73.7	179.6	-175.7	-168.5	0.6	113.2	Q77 G83	Q77-R81 WeakPolarHBondContact O-CB 3.35Å; Q77-R81 VanDerWaalsContact O-CG 3.32Å; Q77-R81 WeakPolarHBondContact O-CG 3.28Å; Q77-R81 PolarHBondContact O-N 2.95Å; R81-G83 PolarHBondContact O-N 3.18Å
82	A	78.4	Confident	69.1	Low	67 Å²	67	109 Å²	109	55%	0.554	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	3.9	176	0	0	0	0	0	113.7	K78 K79 M80 K84	K78-A82 WeakPolarHBondContact O-CB 3.29Å; K78-A82 PolarHBondContact O-N 3.04Å; K79-A82 PolarHBondContact O-N 3.45Å; M80-A82 PolarHBondContact O-N 3.44Å; A82-K84 PolarHBondContact O-N 2.94Å
83	G	68.2	Low	69.7	Low	69 Å²	69	108.5 Å²	108.5	71%	0.711	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	11.5	177.6	0	0	0	0	0	115.2	K79 M80 R81	K79-G83 PolarHBondContact O-N 2.6Å; M80-G83 PolarHBondContact O-N 2.88Å; R81-G83 PolarHBondContact O-N 3.18Å
84	K	64.9	Low	70.1	Confident	187 Å²	187	104.4 Å²	104.4	81%	0.813	53%	0.53	S	S	*	.	S	Bend	trans	-91.5	-1.6	-176.3	-73.3	-172.3	177.1	-175.6	0	114.4	K79 A82	K79-K84 PolarHBondContact O-N 3.2Å; A82-K84 PolarHBondContact O-N 2.94Å
85	A	56.4	Low	70.2	Confident	33 Å²	33	100.2 Å²	100.2	27%	0.273	52%	0.522	S	S	.	.	S	Bend	trans	-146.7	127.6	178.4	0	0	0	0	0	109.6
86	G	57.2	Low	70.7	Confident	37 Å²	37	96 Å²	96	38%	0.381	50%	0.5	S	S	.	.			trans	-67.2	159	171.6	0	0	0	0	0	111.9	D88 D89	G86-D88 PolarHBondContact O-N 2.84Å; G86-D89 PolarHBondContact N-OD2 3.2Å; G86-D89 PolarHBondContact O-N 3.07Å; G86-D89 VanDerWaalsContact O-N 3.16Å
87	L	52.7	Low	71.2	Confident	147 Å²	147	94.3 Å²	94.3	77%	0.77	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-26	176	-87.4	147.9	0	0	0	113	M80	M80-L87 HydrophobicContact CE-CB 4.42Å; M80-L87 HydrophobicContact CE-CD2 3.54Å; M80-L87 HydrophobicContact CE-CG 3.87Å
88	D	54.2	Low	71.4	Confident	159 Å²	159	92.7 Å²	92.7	85%	0.85	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-2.4	-179.9	-66.2	-36.4	0	0	0	114.2	G86 E90	G86-D88 PolarHBondContact O-N 2.84Å; D88-E90 PolarHBondContact O-N 3.3Å; D88-E90 VanDerWaalsContact O-N 3.15Å
89	D	54.4	Low	71.6	Confident	116 Å²	116	87.7 Å²	87.7	62%	0.62	48%	0.48	S	S	*	.			trans	-87.2	35.6	179.5	-73.1	-35.4	0	0	0	112.3	G86 K91	G86-D89 PolarHBondContact N-OD2 3.2Å; G86-D89 PolarHBondContact O-N 3.07Å; G86-D89 VanDerWaalsContact O-N 3.16Å; D89-K91 PolarHBondContact O-N 3.13Å
90	E	57.3	Low	72.2	Confident	105 Å²	105	81.6 Å²	81.6	49%	0.491	45%	0.454	S	S	.	.			trans	-67.3	103.3	168.1	-73.1	-158.2	164.9	0	0	108.6	D88	D88-E90 PolarHBondContact O-N 3.3Å; D88-E90 VanDerWaalsContact O-N 3.15Å
91	K	70.9	Confident	73	Confident	141 Å²	141	86 Å²	86	61%	0.613	47%	0.474	S	S	*	.			trans	-53.4	131.9	174.9	-67.5	-173.5	177.3	-170.3	0	108.1	D89 F93 D94 L95	D89-K91 PolarHBondContact O-N 3.13Å; K91-F93 PolarHBondContact O-N 3.17Å; K91-D94 WeakPolarHBondContact O-CB 3.34Å; K91-D94 PolarHBondContact O-N 3.44Å; K91-L95 PolarHBondContact O-N 3.37Å
92	P	81.1	Confident	73.5	Confident	86 Å²	86	76.7 Å²	76.7	56%	0.558	44%	0.44	S	S	*	.	H	α-helix	trans	-49.5	-30.5	-178.4	-30.5	34.5	0	0	0	114	V38 F96	V38-P92 HydrophobicContact CG1-CB 4.12Å; P92-F96 WeakPolarHBondContact O-CB 3.39Å; P92-F96 PolarHBondContact O-N 3.15Å
93	F	84.2	Confident	74.1	Confident	15 Å²	15	77.9 Å²	77.9	7%	0.066	43%	0.43	C	S	.	.	H	α-helix	trans	-64.4	-39.1	174.3	-171.2	-101.8	0	0	0	114.7	R34 V38 W57 F65 K91 F96 V97	R34-F93 HydrophobicContact CB-CD2 4.37Å; R34-F93 HydrophobicContact CB-CE2 4.08Å; R34-F93 HydrophobicContact CB-CZ 4.46Å; R34-F93 WeakPolarHBondContact O-CD2 3.22Å; V38-F93 HydrophobicContact CG2-CB 4.11Å; V38-F93 HydrophobicContact CG2-CD2 3.76Å; V38-F93 HydrophobicContact CG2-CG 4.43Å; W57-F93 AromaticContact CH2-CE2 3.72Å; W57-F93 HydrophobicContact CH2-CE2 3.72Å; W57-F93 AromaticContact CH2-CZ 3.81Å; W57-F93 HydrophobicContact CH2-CZ 3.81Å; W57-F93 HydrophobicContact CZ3-CE2 4.02Å; W57-F93 HydrophobicContact CZ3-CZ 4.18Å; F65-F93 AromaticContact CD1-CE1 3.69Å; F65-F93 HydrophobicContact CD1-CE1 3.69Å; F65-F93 AromaticContact CD1-CZ 3.87Å; F65-F93 HydrophobicContact CD1-CZ 3.87Å; F65-F93 AromaticContact CE1-CE1 3.81Å; F65-F93 HydrophobicContact CE1-CE1 3.81Å; F65-F93 AromaticContact CE1-CZ 3.47Å; F65-F93 HydrophobicContact CE1-CZ 3.47Å; F65-F93 VanDerWaalsContact CE1-CZ 3.47Å; F65-F93 HydrophobicContact CG-CE1 4.12Å; F65-F93 HydrophobicContact CZ-CE1 4.29Å; F65-F93 AromaticContact CZ-CZ 3.84Å; F65-F93 HydrophobicContact CZ-CZ 3.84Å; K91-F93 PolarHBondContact O-N 3.17Å; F93-F96 HydrophobicContact CE2-CD1 4.44Å; F93-F96 PolarHBondContact O-N 3.26Å; F93-V97 HydrophobicContact CD1-CG2 4.44Å; F93-V97 HydrophobicContact CE1-CG2 3.96Å; F93-V97 HydrophobicContact CE2-CG2 4.36Å; F93-V97 HydrophobicContact CZ-CG2 3.9Å; F93-V97 WeakPolarHBondContact O-CG2 3.45Å; F93-V97 PolarHBondContact O-N 3.33Å; F93-V97 VanDerWaalsContact O-N 3.08Å
94	D	80.1	Confident	75.1	Confident	36 Å²	36	77.2 Å²	77.2	19%	0.193	41%	0.407	C	S	.	.	H	α-helix	trans	-65.3	-45	176.8	-74.7	-52.3	0	0	0	110.8	R72 L76 K91 F96 V97 A98	R72-D94 IonicContact CZ-OD1 2.88Å; R72-D94 IonicContact NE-OD1 2.92Å; R72-D94 PolarHBondContact NE-OD1 3.46Å; R72-D94 IonicContact NH2-OD1 2.73Å; R72-D94 PolarHBondContact NH2-OD1 3.34Å; L76-D94 HydrophobicContact CD1-CB 4.24Å; K91-D94 WeakPolarHBondContact O-CB 3.34Å; K91-D94 PolarHBondContact O-N 3.44Å; D94-F96 PolarHBondContact O-N 2.98Å; D94-V97 PolarHBondContact O-N 3.49Å; D94-A98 WeakPolarHBondContact O-CB 3.45Å; D94-A98 PolarHBondContact O-N 2.82Å
95	L	82.6	Confident	76.3	Confident	98 Å²	98	68.5 Å²	68.5	51%	0.513	37%	0.37	S	S	.	.	H	α-helix	trans	-63.4	-40.4	176	-170	113.5	0	0	0	112	K91 A98 S99	K91-L95 PolarHBondContact O-N 3.37Å; L95-A98 PolarHBondContact O-N 3.38Å; L95-S99 VanDerWaalsContact O-CB 3.3Å; L95-S99 WeakPolarHBondContact O-CB 3.43Å; L95-S99 PolarHBondContact O-N 3.17Å; L95-S99 PolarHBondContact O-OG 3.2Å
96	F	86.6	Confident	77.9	Confident	6 Å²	6	71.7 Å²	71.7	3%	0.026	38%	0.375	C	S	.	.	H	α-helix	trans	-57.4	-52.5	174.3	168.9	-103	0	0	0	111.4	V37 V38 H41 V55 W57 P92 F93 D94 A98 S99 T100 I102	V37-F96 HydrophobicContact CG1-CE1 4.24Å; V37-F96 HydrophobicContact CG1-CZ 4.18Å; V38-F96 HydrophobicContact CB-CB 4.42Å; V38-F96 HydrophobicContact CG1-CB 3.93Å; V38-F96 HydrophobicContact CG1-CG 4.44Å; V38-F96 HydrophobicContact CG2-CB 3.81Å; V38-F96 HydrophobicContact CG2-CD1 4.26Å; V38-F96 HydrophobicContact CG2-CG 4.01Å; H41-F96 HydrophobicContact CB-CD2 4.38Å; H41-F96 HydrophobicContact CB-CE2 3.82Å; H41-F96 AromaticContact CD2-CE2 3.73Å; H41-F96 AromaticContact CG-CE2 3.49Å; H41-F96 VanDerWaalsContact CG-CE2 3.49Å; H41-F96 AromaticContact ND1-CE2 3.78Å; V55-F96 HydrophobicContact CG1-CZ 4.39Å; V55-F96 HydrophobicContact CG2-CE2 4.39Å; V55-F96 HydrophobicContact CG2-CZ 4.12Å; W57-F96 HydrophobicContact CZ3-CE1 4.06Å; P92-F96 WeakPolarHBondContact O-CB 3.39Å; P92-F96 PolarHBondContact O-N 3.15Å; F93-F96 HydrophobicContact CE2-CD1 4.44Å; F93-F96 PolarHBondContact O-N 3.26Å; D94-F96 PolarHBondContact O-N 2.98Å; F96-A98 VanDerWaalsContact C-N 3.31Å; F96-A98 PolarHBondContact O-N 3.26Å; F96-S99 PolarHBondContact O-N 2.79Å; F96-T100 HydrophobicContact CD2-CG2 3.61Å; F96-T100 HydrophobicContact CE2-CG2 3.7Å; F96-T100 HydrophobicContact CG-CG2 4.49Å; F96-T100 WeakPolarHBondContact O-CB 3.24Å; F96-T100 WeakPolarHBondContact O-CG2 3.46Å; F96-T100 PolarHBondContact O-N 3.11Å; F96-T100 PolarHBondContact O-OG1 3.11Å; F96-I102 HydrophobicContact CD1-CD1 4.22Å; F96-I102 HydrophobicContact CE1-CD1 3.63Å; F96-I102 HydrophobicContact CZ-CD1 4.09Å
97	V	84.4	Confident	79.3	Confident	6 Å²	6	71.6 Å²	71.6	4%	0.036	36%	0.363	C	S	.	.	H	α-helix	trans	-66.6	-33.6	-178.2	175.1	0	0	0	0	112.5	F65 F93 D94 I102 Y104	F65-V97 HydrophobicContact CE2-CG1 4.49Å; F65-V97 HydrophobicContact CE2-CG2 4.28Å; F93-V97 HydrophobicContact CD1-CG2 4.44Å; F93-V97 HydrophobicContact CE1-CG2 3.96Å; F93-V97 HydrophobicContact CE2-CG2 4.36Å; F93-V97 HydrophobicContact CZ-CG2 3.9Å; F93-V97 WeakPolarHBondContact O-CG2 3.45Å; F93-V97 PolarHBondContact O-N 3.33Å; F93-V97 VanDerWaalsContact O-N 3.08Å; D94-V97 PolarHBondContact O-N 3.49Å; V97-I102 HydrophobicContact CB-CD1 4.33Å; V97-I102 HydrophobicContact CG1-CD1 4.37Å; V97-I102 HydrophobicContact CG2-CD1 4.08Å; V97-Y104 WeakPolarHBondContact CG1-OH 3.39Å
98	A	80.8	Confident	80.8	Confident	60 Å²	60	69 Å²	69	50%	0.496	36%	0.358	S	S	.	.	H	α-helix	trans	-72.5	-40.9	178.4	0	0	0	0	0	112.7	R69 D94 L95 F96	R69-A98 PolarHBondContact NE-O 3.36Å; R69-A98 PolarHBondContact NH2-O 3.27Å; D94-A98 WeakPolarHBondContact O-CB 3.45Å; D94-A98 PolarHBondContact O-N 2.82Å; L95-A98 PolarHBondContact O-N 3.38Å; F96-A98 VanDerWaalsContact C-N 3.31Å; F96-A98 PolarHBondContact O-N 3.26Å
99	S	83.9	Confident	82.3	Confident	56 Å²	56	64.3 Å²	64.3	39%	0.392	33%	0.331	S	S	.	.	H	α-helix	trans	-90.5	-29.1	-172	65.4	0	0	0	0	114.4	L95 F96	L95-S99 VanDerWaalsContact O-CB 3.3Å; L95-S99 WeakPolarHBondContact O-CB 3.43Å; L95-S99 PolarHBondContact O-N 3.17Å; L95-S99 PolarHBondContact O-OG 3.2Å; F96-S99 PolarHBondContact O-N 2.79Å
100	T	86	Confident	83.7	Confident	5 Å²	5	59 Å²	59	3%	0.031	30%	0.303	C	S	.	.	S	Bend	trans	-89	151.5	-175.9	61.9	0	0	0	0	112.6	R69 F96 I102	R69-T100 PolarHBondContact NH2-O 3.35Å; F96-T100 HydrophobicContact CD2-CG2 3.61Å; F96-T100 HydrophobicContact CE2-CG2 3.7Å; F96-T100 HydrophobicContact CG-CG2 4.49Å; F96-T100 WeakPolarHBondContact O-CB 3.24Å; F96-T100 WeakPolarHBondContact O-CG2 3.46Å; F96-T100 PolarHBondContact O-N 3.11Å; F96-T100 PolarHBondContact O-OG1 3.11Å; T100-I102 PolarHBondContact O-N 3.4Å; T100-I102 WeakPolarHBondContact OG1-CD1 3.48Å; T100-I102 VanDerWaalsContact OG1-CG1 3.24Å; T100-I102 WeakPolarHBondContact OG1-CG1 3.3Å
101	Q	89	Confident	84.6	Confident	158 Å²	158	58.4 Å²	58.4	74%	0.738	30%	0.3	S	S	*	.			trans	-83.4	95.3	174.2	-172.7	-179.3	4.9	0	0	109.3	V55	V55-Q101 PolarHBondContact N-O 2.81Å; V55-Q101 VanDerWaalsContact N-O 3.07Å
102	I	90.4	Very high	84.9	Confident	23 Å²	23	56.4 Å²	56.4	12%	0.118	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.3	179.8	-49.4	-178.4	0	0	0	109.8	V55 W57 F96 V97 T100 Y104	V55-I102 HydrophobicContact CB-CG1 4.16Å; V55-I102 HydrophobicContact CB-CG2 4.44Å; V55-I102 HydrophobicContact CG1-CG2 4.34Å; V55-I102 CarbonylContact O-C 3.5Å; V55-I102 WeakPolarHBondContact O-CA 3.33Å; W57-I102 HydrophobicContact CB-CG2 3.76Å; F96-I102 HydrophobicContact CD1-CD1 4.22Å; F96-I102 HydrophobicContact CE1-CD1 3.63Å; F96-I102 HydrophobicContact CZ-CD1 4.09Å; V97-I102 HydrophobicContact CB-CD1 4.33Å; V97-I102 HydrophobicContact CG1-CD1 4.37Å; V97-I102 HydrophobicContact CG2-CD1 4.08Å; T100-I102 PolarHBondContact O-N 3.4Å; T100-I102 WeakPolarHBondContact OG1-CD1 3.48Å; T100-I102 VanDerWaalsContact OG1-CG1 3.24Å; T100-I102 WeakPolarHBondContact OG1-CG1 3.3Å; I102-Y104 HydrophobicContact CB-CE2 4.12Å; I102-Y104 HydrophobicContact CG2-CD1 4.16Å; I102-Y104 HydrophobicContact CG2-CD2 4.46Å; I102-Y104 HydrophobicContact CG2-CE1 3.74Å; I102-Y104 HydrophobicContact CG2-CE2 4.07Å
103	R	90.6	Very high	85	Confident	92 Å²	92	52.4 Å²	52.4	35%	0.347	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	117.1	165.6	177.7	130.2	169.4	-146.4	1.1	108.9	V55 L56 W57 K112 N116 Y118	V55-R103 PolarHBondContact O-N 3.39Å; L56-R103 HydrophobicContact CD1-CB 4.43Å; L56-R103 HydrophobicContact CD1-CG 4.28Å; W57-R103 PolarHBondContact N-O 3.17Å; R103-K112 PolarHBondContact NH2-O 3Å; R103-K112 VanDerWaalsContact NH2-O 3.07Å; R103-N116 PolarHBondContact NH1-ND2 2.91Å; R103-Y118 HydrophobicContact CB-CE1 3.81Å; R103-Y118 WeakPolarHBondContact CD-OH 3.38Å; R103-Y118 HydrophobicContact CG-CE1 4.39Å; R103-Y118 PolarHBondContact NH1-OH 3.48Å
104	Y	90.2	Very high	84.3	Confident	55 Å²	55	52.9 Å²	52.9	22%	0.216	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131.4	174.3	-60.9	-78.6	0	0	0	109.9	W57 L63 F65 T67 V97 I102	W57-Y104 HydrophobicContact CB-CD1 3.93Å; W57-Y104 HydrophobicContact CB-CE1 4.19Å; W57-Y104 HydrophobicContact CG-CD1 4.3Å; W57-Y104 HydrophobicContact CG-CE1 4.36Å; L63-Y104 HydrophobicContact CD1-CD1 3.98Å; L63-Y104 HydrophobicContact CD1-CE1 4.45Å; L63-Y104 HydrophobicContact CD2-CD1 4.31Å; L63-Y104 HydrophobicContact CD2-CE1 4.37Å; F65-Y104 AromaticContact CE2-CE1 3.83Å; F65-Y104 HydrophobicContact CE2-CE1 3.83Å; F65-Y104 HydrophobicContact CZ-CE1 4.2Å; T67-Y104 HydrophobicContact CG2-CD1 3.66Å; T67-Y104 HydrophobicContact CG2-CD2 3.73Å; T67-Y104 HydrophobicContact CG2-CE1 3.94Å; T67-Y104 HydrophobicContact CG2-CE2 4.01Å; T67-Y104 HydrophobicContact CG2-CG 3.55Å; V97-Y104 WeakPolarHBondContact CG1-OH 3.39Å; I102-Y104 HydrophobicContact CB-CE2 4.12Å; I102-Y104 HydrophobicContact CG2-CD1 4.16Å; I102-Y104 HydrophobicContact CG2-CD2 4.46Å; I102-Y104 HydrophobicContact CG2-CE1 3.74Å; I102-Y104 HydrophobicContact CG2-CE2 4.07Å
105	C	89.5	Confident	83.8	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.034	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	130	-179.7	-172.2	0	0	0	0	110.4	L56 W57 C58 Y59 E109 I113	L56-C105 HydrophobicContact CD1-CB 4.04Å; W57-C105 PolarHBondContact O-N 2.81Å; C58-C105 WeakPolarHBondContact CA-O 3.42Å; Y59-C105 WeakPolarHBondContact CD1-O 3.34Å; Y59-C105 PolarHBondContact N-O 3.4Å; Y59-C105 VanDerWaalsContact N-O 3.1Å; C105-E109 VanDerWaalsContact SG-C 3.59Å; C105-I113 HydrophobicContact CB-CG2 4.41Å
106	Y	89.8	Confident	83.8	Confident	100 Å²	100	51 Å²	51	39%	0.392	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	150.4	168.6	-69.8	-77	0	0	0	110.3	Y59 S108 E109 T110	Y59-Y106 HydrophobicContact CD2-CD1 4.21Å; Y59-Y106 HydrophobicContact CD2-CE1 4.12Å; Y59-Y106 HydrophobicContact CE1-CD1 4.38Å; Y59-Y106 HydrophobicContact CE1-CE1 4.47Å; Y59-Y106 AromaticContact CE2-CD1 3.65Å; Y59-Y106 HydrophobicContact CE2-CD1 3.65Å; Y59-Y106 AromaticContact CE2-CE1 3.22Å; Y59-Y106 HydrophobicContact CE2-CE1 3.22Å; Y59-Y106 AromaticContact CE2-CZ 3.88Å; Y59-Y106 AromaticContact CZ-CD1 3.74Å; Y59-Y106 AromaticContact CZ-CE1 3.44Å; Y59-Y106 VanDerWaalsContact CZ-CE1 3.44Å; Y59-Y106 AromaticContact CZ-CZ 3.71Å; Y59-Y106 CarbonylContact O-C 3.51Å; Y59-Y106 WeakPolarHBondContact O-CA 3.41Å; Y59-Y106 WeakPolarHBondContact OH-CE1 3.48Å; Y59-Y106 WeakPolarHBondContact OH-CE2 3.44Å; Y59-Y106 PolarHBondContact OH-OH 3.09Å; Y106-S108 PolarHBondContact O-N 3.43Å; Y106-E109 WeakPolarHBondContact O-CA 3.28Å; Y106-E109 PolarHBondContact O-N 3.23Å; Y106-T110 PolarHBondContact O-N 3.2Å
107	Y	87.6	Confident	83.8	Confident	34 Å²	34	53.6 Å²	53.6	13%	0.133	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-56.3	-34.7	176.5	-69.1	-14.1	0	0	0	113.7	C58 Y59 K60 E109 T110 Q124 A125 L131	C58-Y107 HydrophobicContact CB-CD1 4.07Å; C58-Y107 HydrophobicContact CB-CE1 3.71Å; C58-Y107 WeakPolarHBondContact O-CE1 3.46Å; Y59-Y107 VanDerWaalsContact N-CE1 3.34Å; Y59-Y107 WeakPolarHBondContact O-CD1 3.37Å; Y59-Y107 PolarHBondContact O-N 2.96Å; K60-Y107 HydrophobicContact CB-CD2 3.67Å; K60-Y107 HydrophobicContact CB-CE2 3.78Å; K60-Y107 HydrophobicContact CG-CD2 4.12Å; Y107-E109 VanDerWaalsContact C-N 3.27Å; Y107-E109 PolarHBondContact O-N 3.39Å; Y107-T110 VanDerWaalsContact O-CG2 3.3Å; Y107-T110 WeakPolarHBondContact O-CG2 3.34Å; Y107-T110 PolarHBondContact O-OG1 3.43Å; Y107-Q124 PolarHBondContact OH-N 2.65Å; Y107-Q124 PolarHBondContact OH-O 3.36Å; Y107-A125 WeakPolarHBondContact CE2-O 3.43Å; Y107-A125 PolarHBondContact OH-O 2.93Å; Y107-L131 HydrophobicContact CD1-CD1 3.78Å; Y107-L131 HydrophobicContact CD1-CD2 3.68Å; Y107-L131 HydrophobicContact CD1-CG 4.41Å; Y107-L131 HydrophobicContact CD2-CD2 4.02Å; Y107-L131 HydrophobicContact CE1-CD1 4.22Å; Y107-L131 HydrophobicContact CE1-CD2 3.58Å; Y107-L131 HydrophobicContact CE2-CD2 3.95Å; Y107-L131 HydrophobicContact CG-CD1 4.31Å; Y107-L131 HydrophobicContact CG-CD2 3.89Å
108	S	84.1	Confident	84.1	Confident	93 Å²	93	53.9 Å²	53.9	65%	0.65	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-65.8	-27.4	173.8	49.4	0	0	0	0	113.4	Y106 H111	Y106-S108 PolarHBondContact O-N 3.43Å; S108-H111 PolarHBondContact O-CE1 3.01Å; S108-H111 VanDerWaalsContact O-CE1 3.3Å; S108-H111 PolarHBondContact O-ND1 2.86Å
109	E	84.9	Confident	84.7	Confident	61 Å²	61	51.1 Å²	51.1	29%	0.285	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-97.2	7.3	-173.8	-62.9	-166.9	129.1	0	0	114	C105 Y106 Y107 H111 K112	C105-E109 VanDerWaalsContact SG-C 3.59Å; Y106-E109 WeakPolarHBondContact O-CA 3.28Å; Y106-E109 PolarHBondContact O-N 3.23Å; Y107-E109 VanDerWaalsContact C-N 3.27Å; Y107-E109 PolarHBondContact O-N 3.39Å; E109-H111 PolarHBondContact O-N 2.91Å; E109-K112 HydrophobicContact CB-CD 4.33Å; E109-K112 WeakPolarHBondContact O-CB 3.47Å; E109-K112 PolarHBondContact O-N 2.86Å; E109-K112 IonicContact OE1-NZ 2.98Å; E109-K112 PolarHBondContact OE1-NZ 3.41Å
110	T	83.3	Confident	85.2	Confident	4 Å²	4	48.4 Å²	48.4	3%	0.025	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-61.7	-10.6	-179.1	52.9	0	0	0	0	114.4	Y106 Y107 K112 I113 L131 R134 T135	Y106-T110 PolarHBondContact O-N 3.2Å; Y107-T110 VanDerWaalsContact O-CG2 3.3Å; Y107-T110 WeakPolarHBondContact O-CG2 3.34Å; Y107-T110 PolarHBondContact O-OG1 3.43Å; T110-K112 VanDerWaalsContact C-N 3.32Å; T110-I113 WeakPolarHBondContact O-CG1 3.5Å; T110-L131 HydrophobicContact CG2-CD1 3.32Å; T110-R134 PolarHBondContact OG1-NH1 3.45Å; T110-T135 HydrophobicContact CG2-CG2 4.45Å
111	H	77.6	Confident	85.6	Confident	93 Å²	93	48.2 Å²	48.2	43%	0.431	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-73.5	-21	170.4	60.7	-84.2	0	0	0	113	S108 E109 L114	S108-H111 PolarHBondContact O-CE1 3.01Å; S108-H111 VanDerWaalsContact O-CE1 3.3Å; S108-H111 PolarHBondContact O-ND1 2.86Å; E109-H111 PolarHBondContact O-N 2.91Å; H111-L114 HydrophobicContact CB-CD1 4.25Å; H111-L114 VanDerWaalsContact O-CB 3.28Å; H111-L114 WeakPolarHBondContact O-CB 3.45Å; H111-L114 WeakPolarHBondContact O-CD1 3.47Å; H111-L114 WeakPolarHBondContact O-CG 3.39Å
112	K	77	Confident	85.8	Confident	99 Å²	99	40.7 Å²	40.7	43%	0.43	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-83.2	-11.8	-178.6	-59.3	-179	-179.2	170.9	0	114.3	R103 E109 T110 L114	R103-K112 PolarHBondContact NH2-O 3Å; R103-K112 VanDerWaalsContact NH2-O 3.07Å; E109-K112 HydrophobicContact CB-CD 4.33Å; E109-K112 WeakPolarHBondContact O-CB 3.47Å; E109-K112 PolarHBondContact O-N 2.86Å; E109-K112 IonicContact OE1-NZ 2.98Å; E109-K112 PolarHBondContact OE1-NZ 3.41Å; T110-K112 VanDerWaalsContact C-N 3.32Å; K112-L114 VanDerWaalsContact C-N 3.34Å
113	I	81.6	Confident	85.9	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-90.9	-7.6	178.3	55.4	167	0	0	0	112.1	L56 C105 T110 G115 N116 Y118 T135 T138	L56-I113 HydrophobicContact CD1-CD1 4.44Å; L56-I113 HydrophobicContact CD1-CG2 4.03Å; L56-I113 HydrophobicContact CD2-CD1 3.58Å; C105-I113 HydrophobicContact CB-CG2 4.41Å; T110-I113 WeakPolarHBondContact O-CG1 3.5Å; I113-G115 PolarHBondContact O-N 3.19Å; I113-N116 PolarHBondContact O-N 3.17Å; I113-Y118 HydrophobicContact CB-CE2 4.37Å; I113-T135 HydrophobicContact CD1-CG2 4.31Å; I113-T138 HydrophobicContact CD1-CG2 4.31Å; I113-T138 HydrophobicContact CG1-CG2 4.49Å
114	L	69.5	Low	85.6	Confident	26 Å²	26	36.3 Å²	36.3	14%	0.136	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	97.5	-177.5	-65.7	-172.3	0	0	0	111.4	H111 K112 R134 Y413 E414	H111-L114 HydrophobicContact CB-CD1 4.25Å; H111-L114 VanDerWaalsContact O-CB 3.28Å; H111-L114 WeakPolarHBondContact O-CB 3.45Å; H111-L114 WeakPolarHBondContact O-CD1 3.47Å; H111-L114 WeakPolarHBondContact O-CG 3.39Å; K112-L114 VanDerWaalsContact C-N 3.34Å; L114-R134 HydrophobicContact CD2-CB 4.36Å; L114-R134 HydrophobicContact CD2-CG 4.22Å; L114-Y413 WeakPolarHBondContact CD1-OH 3.23Å; L114-Y413 WeakPolarHBondContact CD2-OH 3.42Å; L114-E414 WeakPolarHBondContact CD1-OE1 3.46Å
115	G	71.2	Confident	84.7	Confident	34 Å²	34	35.1 Å²	35.1	35%	0.351	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	127.4	-18.8	-176	0	0	0	0	0	113	I113	I113-G115 PolarHBondContact O-N 3.19Å
116	N	81.8	Confident	83.7	Confident	59 Å²	59	36.9 Å²	36.9	32%	0.316	20%	0.2	S	C	.	.			trans	-86.2	156	170.3	-57.8	-64.5	0	0	0	110.3	R103 I113 Y118	R103-N116 PolarHBondContact NH1-ND2 2.91Å; I113-N116 PolarHBondContact O-N 3.17Å; N116-Y118 HydrophobicContact CB-CE2 3.72Å
117	T	86.5	Confident	83.1	Confident	61 Å²	61	32.7 Å²	32.7	37%	0.374	18%	0.184	S	C	.	.			trans	-124.4	138.3	175.3	-49.6	0	0	0	0	108.8	T138 E140 R470	T117-T138 CarbonylContact C-O 3.49Å; T117-T138 VanDerWaalsContact CA-O 3.26Å; T117-T138 WeakPolarHBondContact CA-O 3.27Å; T117-E140 HydrophobicContact CG2-CB 3.76Å; T117-R470 HydrophobicContact CG2-CG 4.26Å; T117-R470 PolarHBondContact OG1-NE 3.33Å
118	Y	91.7	Very high	82.9	Confident	13 Å²	13	32.4 Å²	32.4	5%	0.051	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	148.4	-177	-59.6	-88.1	0	0	0	110.8	S54 L56 R103 I113 N116 T138 I139 E140	S54-Y118 WeakPolarHBondContact OG-CA 3.3Å; L56-Y118 HydrophobicContact CB-CD1 3.84Å; L56-Y118 HydrophobicContact CB-CD2 3.93Å; L56-Y118 HydrophobicContact CB-CE1 4.19Å; L56-Y118 HydrophobicContact CB-CE2 4.29Å; L56-Y118 HydrophobicContact CB-CG 3.71Å; L56-Y118 HydrophobicContact CD1-CE2 4.25Å; L56-Y118 HydrophobicContact CD2-CD2 3.99Å; L56-Y118 HydrophobicContact CD2-CE2 4.09Å; L56-Y118 HydrophobicContact CG-CD2 4.42Å; L56-Y118 HydrophobicContact CG-CE2 4.45Å; R103-Y118 HydrophobicContact CB-CE1 3.81Å; R103-Y118 WeakPolarHBondContact CD-OH 3.38Å; R103-Y118 HydrophobicContact CG-CE1 4.39Å; R103-Y118 PolarHBondContact NH1-OH 3.48Å; I113-Y118 HydrophobicContact CB-CE2 4.37Å; N116-Y118 HydrophobicContact CB-CE2 3.72Å; Y118-T138 PolarHBondContact N-O 3.35Å; Y118-I139 VanDerWaalsContact O-CA 3.32Å; Y118-I139 WeakPolarHBondContact O-CA 3.44Å; Y118-E140 PolarHBondContact O-N 3.3Å; Y118-E140 VanDerWaalsContact O-N 3.08Å
119	G	92.1	Very high	83.1	Confident	1 Å²	1	28 Å²	28	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	-21.1	173.6	0	0	0	0	0	113.5	S54 G143 L144	S54-G119 PolarHBondContact O-N 3.24Å; S54-G119 PolarHBondContact OG-N 3.31Å; G119-G143 CarbonylContact O-C 3.59Å; G119-G143 WeakPolarHBondContact O-CA 3.35Å; G119-L144 PolarHBondContact O-N 2.99Å
120	M	94.5	Very high	83.1	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	135.9	-178.7	-174.3	176.8	-169.9	0	0	111.2	V37 H41 S54 V55 L56 I122 L144 I146	V37-M120 HydrophobicContact CG1-CE 3.82Å; H41-M120 HydrophobicContact CB-CE 4.12Å; H41-M120 HydrophobicContact CB-SD 3.79Å; S54-M120 PolarHBondContact O-N 3.25Å; V55-M120 CarbonylContact C-O 3.56Å; V55-M120 WeakPolarHBondContact CA-O 3.47Å; V55-M120 HydrophobicContact CG1-CB 4.49Å; V55-M120 HydrophobicContact CG1-CG 4.46Å; V55-M120 HydrophobicContact CG2-CB 4.2Å; V55-M120 HydrophobicContact CG2-SD 4.22Å; L56-M120 PolarHBondContact N-O 2.93Å; M120-I122 HydrophobicContact CE-CG1 4.39Å; M120-L144 CarbonylContact C-O 3.59Å; M120-L144 WeakPolarHBondContact CA-O 3.39Å; M120-L144 HydrophobicContact CG-CB 4.22Å; M120-I146 HydrophobicContact CE-CD1 3.16Å; M120-I146 HydrophobicContact CE-CG1 3.99Å
121	C	94.8	Very high	83.4	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.4	174.2	-173.4	0	0	0	0	111	L56 I139 L144 I146	L56-C121 CarbonylContact O-C 3.58Å; L56-C121 WeakPolarHBondContact O-CA 3.46Å; C121-I139 HydrophobicContact CB-CD1 3.31Å; C121-I139 HydrophobicContact CB-CG1 3.74Å; C121-L144 PolarHBondContact N-O 3.41Å; C121-I146 PolarHBondContact O-N 2.94Å
122	I	94	Very high	84	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	121.6	179.1	-56.7	158.4	0	0	0	108.4	V37 V55 L56 W57 C58 M120 I146 L148	V37-I122 HydrophobicContact CG1-CD1 3.37Å; V37-I122 HydrophobicContact CG1-CG1 4.07Å; V37-I122 HydrophobicContact CG2-CD1 4.48Å; V37-I122 HydrophobicContact CG2-CG2 4.38Å; V55-I122 HydrophobicContact CG1-CD1 3.53Å; V55-I122 HydrophobicContact CG1-CG1 4.29Å; L56-I122 PolarHBondContact O-N 3.44Å; W57-I122 HydrophobicContact CD2-CB 4.22Å; W57-I122 HydrophobicContact CD2-CD1 3.97Å; W57-I122 HydrophobicContact CD2-CG2 4.13Å; W57-I122 HydrophobicContact CE3-CB 4.42Å; W57-I122 HydrophobicContact CE3-CD1 3.32Å; W57-I122 HydrophobicContact CE3-CG1 4.48Å; W57-I122 HydrophobicContact CE3-CG2 4.43Å; W57-I122 HydrophobicContact CG-CB 4.43Å; W57-I122 HydrophobicContact CH2-CD1 4.26Å; W57-I122 HydrophobicContact CH2-CG2 4.31Å; W57-I122 HydrophobicContact CZ2-CG2 4.03Å; W57-I122 HydrophobicContact CZ3-CD1 3.49Å; W57-I122 VanDerWaalsContact CZ3-CD1 3.49Å; C58-I122 PolarHBondContact N-O 2.99Å; M120-I122 HydrophobicContact CE-CG1 4.39Å; I122-I146 CarbonylContact C-O 3.55Å; I122-I146 WeakPolarHBondContact CA-O 3.29Å; I122-I146 HydrophobicContact CG1-CB 4.49Å; I122-L148 HydrophobicContact CG2-CD1 3.75Å; I122-L148 HydrophobicContact CG2-CG 4.19Å
123	L	91.6	Very high	84.5	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.7	179.7	-64.1	167.1	0	0	0	109.7	C58 L127 L131 L132 T135 I146 I147 L148	C58-L123 HydrophobicContact CB-CD2 3.62Å; L123-L127 HydrophobicContact CB-CD2 4.01Å; L123-L127 HydrophobicContact CD1-CD2 3.98Å; L123-L127 HydrophobicContact CG-CD2 4.46Å; L123-L131 HydrophobicContact CD2-CD2 4.46Å; L123-L131 HydrophobicContact CD2-CG 4.4Å; L123-L132 HydrophobicContact CD1-CD2 4.1Å; L123-T135 HydrophobicContact CD2-CG2 3.8Å; L123-I146 PolarHBondContact N-O 3.02Å; L123-I147 HydrophobicContact CD1-CG1 4.24Å; L123-L148 PolarHBondContact O-N 3.01Å
124	Q	84.7	Confident	84.7	Confident	24 Å²	24	18.8 Å²	18.8	11%	0.112	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	91.4	-179.9	-171.9	-175.5	-55.4	0	0	113.3	C58 E62 Y107	C58-Q124 PolarHBondContact O-N 3.24Å; E62-Q124 PolarHBondContact O-NE2 3.29Å; Y107-Q124 PolarHBondContact OH-N 2.65Å; Y107-Q124 PolarHBondContact OH-O 3.36Å
125	A	71.9	Confident	85.7	Confident	30 Å²	30	17.6 Å²	17.6	25%	0.248	11%	0.107	C	C	.	.	S	Bend	trans	52.4	153.9	171.1	0	0	0	0	0	118.5	Y107 L148	Y107-A125 WeakPolarHBondContact CE2-O 3.43Å; Y107-A125 PolarHBondContact OH-O 2.93Å; A125-L148 PolarHBondContact N-O 3.03Å; A125-L148 VanDerWaalsContact N-O 3.08Å
126	T	67.1	Low	86.7	Confident	42 Å²	42	16 Å²	16	26%	0.258	9%	0.09	S	C	.	.			trans	55.1	91.5	-174	53.5	0	0	0	0	114.3	M163	T126-M163 HydrophobicContact CG2-CG 4.25Å
127	L	77.2	Confident	86.9	Confident	11 Å²	11	14.1 Å²	14.1	6%	0.058	8%	0.08	C	C	.	.			trans	-100	122.1	-172.9	-62.9	163.4	0	0	0	110.2	L123 L131 L132 I147 M163 F185	L123-L127 HydrophobicContact CB-CD2 4.01Å; L123-L127 HydrophobicContact CD1-CD2 3.98Å; L123-L127 HydrophobicContact CG-CD2 4.46Å; L127-L131 HydrophobicContact CD2-CD2 4.41Å; L127-L132 HydrophobicContact CB-CD1 4.09Å; L127-L132 HydrophobicContact CB-CD2 4.36Å; L127-L132 HydrophobicContact CB-CG 4.09Å; L127-L132 HydrophobicContact CD1-CD2 4.08Å; L127-L132 HydrophobicContact CD2-CD2 3.83Å; L127-L132 HydrophobicContact CD2-CG 4.32Å; L127-L132 HydrophobicContact CG-CD2 4.3Å; L127-I147 HydrophobicContact CD1-CD1 4.05Å; L127-I147 HydrophobicContact CD1-CG2 3.81Å; L127-M163 WeakPolarHBondContact O-CE 3.25Å; L127-F185 HydrophobicContact CD1-CE1 3.87Å; L127-F185 HydrophobicContact CD1-CE2 4.4Å; L127-F185 HydrophobicContact CD1-CZ 3.69Å
128	T	83.5	Confident	87	Confident	28 Å²	28	11.3 Å²	11.3	17%	0.172	6%	0.062	C	C	.	.			trans	-90.4	147.5	165.9	52.9	0	0	0	0	109.5	N130 L131 L132 M163 V165	T128-N130 VanDerWaalsContact C-N 3.25Å; T128-N130 PolarHBondContact O-N 3.5Å; T128-L131 WeakPolarHBondContact O-CB 3.42Å; T128-L131 PolarHBondContact O-N 3.2Å; T128-L131 WeakPolarHBondContact OG1-CB 3.32Å; T128-L131 PolarHBondContact OG1-N 3.47Å; T128-L132 PolarHBondContact O-N 2.96Å; T128-M163 HydrophobicContact CG2-CE 3.64Å; T128-V165 HydrophobicContact CG2-CG2 3.75Å
129	P	88.1	Confident	87.1	Confident	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-49.4	-45.4	176.4	-28.9	32.7	0	0	0	113.4	L131 L132 A133 F181 L485 P542 Q546	P129-L131 PolarHBondContact O-N 3.35Å; P129-L132 PolarHBondContact O-N 3.12Å; P129-A133 PolarHBondContact O-N 2.69Å; P129-F181 HydrophobicContact CB-CZ 4.22Å; P129-F181 HydrophobicContact CG-CD1 4.43Å; P129-F181 HydrophobicContact CG-CD2 4.43Å; P129-F181 HydrophobicContact CG-CE1 3.91Å; P129-F181 HydrophobicContact CG-CE2 3.91Å; P129-F181 HydrophobicContact CG-CZ 3.64Å; P129-L485 HydrophobicContact CB-CD2 3.63Å; P129-P542 HydrophobicContact CB-CB 3.74Å; P129-P542 WeakPolarHBondContact CB-O 3.45Å; P129-Q546 HydrophobicContact CG-CB 3.8Å
130	N	86.2	Confident	87	Confident	18 Å²	18	13.9 Å²	13.9	10%	0.096	8%	0.075	C	C	.	.	H	α-helix	trans	-67.9	-35	-179.7	-171.9	24	0	0	0	112.5	T128 R134 Y413 N543	T128-N130 VanDerWaalsContact C-N 3.25Å; T128-N130 PolarHBondContact O-N 3.5Å; N130-R134 PolarHBondContact ND2-NH2 3.25Å; N130-R134 WeakPolarHBondContact O-CB 3.32Å; N130-R134 VanDerWaalsContact O-CG 3.24Å; N130-R134 WeakPolarHBondContact O-CG 3.38Å; N130-R134 PolarHBondContact O-N 3.26Å; N130-R134 PolarHBondContact OD1-NE 2.92Å; N130-Y413 WeakPolarHBondContact OD1-CD2 3.37Å; N130-N543 WeakPolarHBondContact CB-OD1 3.3Å; N130-N543 PolarHBondContact N-OD1 3.19Å
131	L	88.4	Confident	86.8	Confident	4 Å²	4	14.2 Å²	14.2	2%	0.021	8%	0.078	C	C	.	.	H	α-helix	trans	-64.5	-46.1	173.8	173.9	70	0	0	0	111	Y107 T110 L123 L127 T128 P129 A133 R134 T135	Y107-L131 HydrophobicContact CD1-CD1 3.78Å; Y107-L131 HydrophobicContact CD1-CD2 3.68Å; Y107-L131 HydrophobicContact CD1-CG 4.41Å; Y107-L131 HydrophobicContact CD2-CD2 4.02Å; Y107-L131 HydrophobicContact CE1-CD1 4.22Å; Y107-L131 HydrophobicContact CE1-CD2 3.58Å; Y107-L131 HydrophobicContact CE2-CD2 3.95Å; Y107-L131 HydrophobicContact CG-CD1 4.31Å; Y107-L131 HydrophobicContact CG-CD2 3.89Å; T110-L131 HydrophobicContact CG2-CD1 3.32Å; L123-L131 HydrophobicContact CD2-CD2 4.46Å; L123-L131 HydrophobicContact CD2-CG 4.4Å; L127-L131 HydrophobicContact CD2-CD2 4.41Å; T128-L131 WeakPolarHBondContact O-CB 3.42Å; T128-L131 PolarHBondContact O-N 3.2Å; T128-L131 WeakPolarHBondContact OG1-CB 3.32Å; T128-L131 PolarHBondContact OG1-N 3.47Å; P129-L131 PolarHBondContact O-N 3.35Å; L131-A133 VanDerWaalsContact C-N 3.32Å; L131-A133 PolarHBondContact O-N 3.25Å; L131-R134 PolarHBondContact O-N 2.95Å; L131-T135 HydrophobicContact CD1-CG2 3.78Å; L131-T135 HydrophobicContact CG-CG2 4.4Å; L131-T135 WeakPolarHBondContact O-CB 3.36Å; L131-T135 WeakPolarHBondContact O-CG2 3.42Å; L131-T135 PolarHBondContact O-N 3.48Å; L131-T135 PolarHBondContact O-OG1 3.49Å
132	L	89.8	Confident	86.5	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-57.3	-48.9	177.4	-77.3	171.3	0	0	0	110.6	L123 L127 T128 P129 R134 T135 I136 I147 F185 L481	L123-L132 HydrophobicContact CD1-CD2 4.1Å; L127-L132 HydrophobicContact CB-CD1 4.09Å; L127-L132 HydrophobicContact CB-CD2 4.36Å; L127-L132 HydrophobicContact CB-CG 4.09Å; L127-L132 HydrophobicContact CD1-CD2 4.08Å; L127-L132 HydrophobicContact CD2-CD2 3.83Å; L127-L132 HydrophobicContact CD2-CG 4.32Å; L127-L132 HydrophobicContact CG-CD2 4.3Å; T128-L132 PolarHBondContact O-N 2.96Å; P129-L132 PolarHBondContact O-N 3.12Å; L132-R134 PolarHBondContact O-N 3.26Å; L132-T135 PolarHBondContact O-N 3.45Å; L132-T135 PolarHBondContact O-OG1 2.89Å; L132-I136 HydrophobicContact CB-CD1 4.27Å; L132-I136 HydrophobicContact CD2-CD1 3.97Å; L132-I136 VanDerWaalsContact O-CB 3.29Å; L132-I136 WeakPolarHBondContact O-CB 3.26Å; L132-I136 VanDerWaalsContact O-CG1 3.26Å; L132-I136 WeakPolarHBondContact O-CG1 3.32Å; L132-I136 PolarHBondContact O-N 3.49Å; L132-I147 HydrophobicContact CD2-CD1 4.39Å; L132-F185 HydrophobicContact CD1-CD2 4.17Å; L132-F185 HydrophobicContact CD1-CE2 3.87Å; L132-L481 HydrophobicContact CB-CD1 4.42Å
133	A	88.5	Confident	86.5	Confident	3 Å²	3	14.6 Å²	14.6	3%	0.025	8%	0.082	C	C	.	.	H	α-helix	trans	-58.5	-51.1	178.9	0	0	0	0	0	112.4	P129 L131 T135 E137 Y413 L485	P129-A133 PolarHBondContact O-N 2.69Å; L131-A133 VanDerWaalsContact C-N 3.32Å; L131-A133 PolarHBondContact O-N 3.25Å; A133-T135 VanDerWaalsContact C-N 3.34Å; A133-T135 PolarHBondContact O-N 3.24Å; A133-E137 VanDerWaalsContact O-CB 3.24Å; A133-E137 WeakPolarHBondContact O-CB 3.48Å; A133-E137 PolarHBondContact O-N 3.09Å; A133-Y413 VanDerWaalsContact CB-CB 3.47Å; A133-Y413 HydrophobicContact CB-CD1 3.61Å; A133-Y413 HydrophobicContact CB-CG 3.77Å; A133-L485 HydrophobicContact CB-CD1 3.73Å
134	R	86	Confident	86.6	Confident	41 Å²	41	14.6 Å²	14.6	16%	0.155	8%	0.082	C	C	.	.	H	α-helix	trans	-60.6	-41.8	-179	-73.1	171.9	-177.4	-163.1	-7.3	113.2	T110 L114 N130 L131 L132 T138 Y413	T110-R134 PolarHBondContact OG1-NH1 3.45Å; L114-R134 HydrophobicContact CD2-CB 4.36Å; L114-R134 HydrophobicContact CD2-CG 4.22Å; N130-R134 PolarHBondContact ND2-NH2 3.25Å; N130-R134 WeakPolarHBondContact O-CB 3.32Å; N130-R134 VanDerWaalsContact O-CG 3.24Å; N130-R134 WeakPolarHBondContact O-CG 3.38Å; N130-R134 PolarHBondContact O-N 3.26Å; N130-R134 PolarHBondContact OD1-NE 2.92Å; L131-R134 PolarHBondContact O-N 2.95Å; L132-R134 PolarHBondContact O-N 3.26Å; R134-T138 VanDerWaalsContact O-CG2 3.25Å; R134-T138 WeakPolarHBondContact O-CG2 3.5Å; R134-Y413 HydrophobicContact CB-CE1 4.49Å; R134-Y413 HydrophobicContact CG-CD1 4.19Å; R134-Y413 HydrophobicContact CG-CD2 3.79Å; R134-Y413 HydrophobicContact CG-CE1 3.79Å; R134-Y413 HydrophobicContact CG-CE2 3.37Å; R134-Y413 HydrophobicContact CG-CG 4.2Å; R134-Y413 VanDerWaalsContact NE-CE2 3.33Å
135	T	90.3	Very high	87.1	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-81.1	-46.3	-171.8	52.7	0	0	0	0	111.7	T110 I113 L123 L131 L132 A133 E137 T138	T110-T135 HydrophobicContact CG2-CG2 4.45Å; I113-T135 HydrophobicContact CD1-CG2 4.31Å; L123-T135 HydrophobicContact CD2-CG2 3.8Å; L131-T135 HydrophobicContact CD1-CG2 3.78Å; L131-T135 HydrophobicContact CG-CG2 4.4Å; L131-T135 WeakPolarHBondContact O-CB 3.36Å; L131-T135 WeakPolarHBondContact O-CG2 3.42Å; L131-T135 PolarHBondContact O-N 3.48Å; L131-T135 PolarHBondContact O-OG1 3.49Å; L132-T135 PolarHBondContact O-N 3.45Å; L132-T135 PolarHBondContact O-OG1 2.89Å; A133-T135 VanDerWaalsContact C-N 3.34Å; A133-T135 PolarHBondContact O-N 3.24Å; T135-E137 VanDerWaalsContact C-N 3.28Å; T135-E137 PolarHBondContact O-N 3.45Å; T135-T138 PolarHBondContact O-N 2.91Å; T135-T138 PolarHBondContact O-OG1 2.88Å
136	I	91.1	Very high	88.2	Confident	0 Å²	0	12 Å²	12	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-63.7	-36.5	-179.5	-65.2	170.5	0	0	0	111.1	R23 M25 L132 T138 I139 V145 V477 W480 L481	R23-I136 PolarHBondContact NH1-O 3.38Å; M25-I136 HydrophobicContact CE-CD1 3.96Å; L132-I136 HydrophobicContact CB-CD1 4.27Å; L132-I136 HydrophobicContact CD2-CD1 3.97Å; L132-I136 VanDerWaalsContact O-CB 3.29Å; L132-I136 WeakPolarHBondContact O-CB 3.26Å; L132-I136 VanDerWaalsContact O-CG1 3.26Å; L132-I136 WeakPolarHBondContact O-CG1 3.32Å; L132-I136 PolarHBondContact O-N 3.49Å; I136-T138 VanDerWaalsContact C-N 3.3Å; I136-T138 PolarHBondContact O-N 3.07Å; I136-I139 PolarHBondContact O-N 3.46Å; I136-V145 HydrophobicContact CG1-CG1 4.14Å; I136-V145 HydrophobicContact CG1-CG2 4.27Å; I136-V145 HydrophobicContact CG2-CG2 4.33Å; I136-V477 HydrophobicContact CG2-CG1 3.83Å; I136-W480 HydrophobicContact CD1-CZ3 4.03Å; I136-L481 HydrophobicContact CB-CD2 4.03Å; I136-L481 HydrophobicContact CD1-CD1 3.98Å; I136-L481 HydrophobicContact CD1-CD2 4.42Å; I136-L481 HydrophobicContact CG2-CD2 3.92Å
137	E	87.3	Confident	89.3	Confident	21 Å²	21	10 Å²	10	10%	0.098	5%	0.052	C	C	.	.	H	α-helix	trans	-69.3	-26.1	-179.9	-154.7	-156.2	120.4	0	0	113.3	A133 T135 I139 R283 G284 R470	A133-E137 VanDerWaalsContact O-CB 3.24Å; A133-E137 WeakPolarHBondContact O-CB 3.48Å; A133-E137 PolarHBondContact O-N 3.09Å; T135-E137 VanDerWaalsContact C-N 3.28Å; T135-E137 PolarHBondContact O-N 3.45Å; E137-I139 PolarHBondContact O-N 2.92Å; E137-R283 WeakPolarHBondContact OE1-CB 3.49Å; E137-R283 WeakPolarHBondContact OE1-CD 3.44Å; E137-R283 WeakPolarHBondContact OE1-CG 3.31Å; E137-R283 WeakPolarHBondContact OE2-CB 3.43Å; E137-R283 VanDerWaalsContact OE2-CD 3.23Å; E137-R283 WeakPolarHBondContact OE2-CD 3.41Å; E137-G284 PolarHBondContact OE1-N 2.92Å; E137-R470 VanDerWaalsContact O-CD 3.29Å; E137-R470 WeakPolarHBondContact O-CD 3.38Å; E137-R470 PolarHBondContact O-NH1 3.34Å; E137-R470 IonicContact OE1-NH1 2.87Å; E137-R470 PolarHBondContact OE1-NH1 3.4Å
138	T	89	Confident	89.9	Confident	1 Å²	1	9.6 Å²	9.6	1%	0.006	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-1.2	178.6	60.9	0	0	0	0	114.1	I113 T117 Y118 R134 T135 I136	I113-T138 HydrophobicContact CD1-CG2 4.31Å; I113-T138 HydrophobicContact CG1-CG2 4.49Å; T117-T138 CarbonylContact C-O 3.49Å; T117-T138 VanDerWaalsContact CA-O 3.26Å; T117-T138 WeakPolarHBondContact CA-O 3.27Å; Y118-T138 PolarHBondContact N-O 3.35Å; R134-T138 VanDerWaalsContact O-CG2 3.25Å; R134-T138 WeakPolarHBondContact O-CG2 3.5Å; T135-T138 PolarHBondContact O-N 2.91Å; T135-T138 PolarHBondContact O-OG1 2.88Å; I136-T138 VanDerWaalsContact C-N 3.3Å; I136-T138 PolarHBondContact O-N 3.07Å
139	I	92.5	Very high	89.9	Confident	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	136.5	-175.9	-57.8	162.8	0	0	0	109.6	R23 Y118 C121 I136 E137 V145	R23-I139 HydrophobicContact CG-CG2 4.12Å; Y118-I139 VanDerWaalsContact O-CA 3.32Å; Y118-I139 WeakPolarHBondContact O-CA 3.44Å; C121-I139 HydrophobicContact CB-CD1 3.31Å; C121-I139 HydrophobicContact CB-CG1 3.74Å; I136-I139 PolarHBondContact O-N 3.46Å; E137-I139 PolarHBondContact O-N 2.92Å; I139-V145 HydrophobicContact CD1-CB 4.13Å; I139-V145 HydrophobicContact CD1-CG2 3.22Å
140	E	91.5	Very high	89.4	Confident	69 Å²	69	11.4 Å²	11.4	32%	0.322	5%	0.054	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	162.6	174.6	63.2	-176	178.7	0	0	113	R23 T117 Y118 G143 R470	R23-E140 WeakPolarHBondContact CG-O 3.25Å; T117-E140 HydrophobicContact CG2-CB 3.76Å; Y118-E140 PolarHBondContact O-N 3.3Å; Y118-E140 VanDerWaalsContact O-N 3.08Å; E140-G143 WeakPolarHBondContact O-CA 3.21Å; E140-G143 PolarHBondContact O-N 2.96Å; E140-R470 CarbonylContact C-O 3.51Å; E140-R470 WeakPolarHBondContact CA-O 3.4Å
141	G	89.8	Confident	88.6	Confident	6 Å²	6	15 Å²	15	6%	0.062	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	140.2	171.4	0	0	0	0	0	111.3	N21 G143 R470	N21-G141 WeakPolarHBondContact O-CA 3.35Å; N21-G141 VanDerWaalsContact OD1-C 3.22Å; N21-G141 VanDerWaalsContact OD1-CA 3.28Å; N21-G141 WeakPolarHBondContact OD1-CA 3.35Å; N21-G141 PolarHBondContact OD1-O 2.97Å; G141-G143 PolarHBondContact O-N 3.24Å; G141-R470 PolarHBondContact N-O 3.01Å
142	G	89.2	Confident	87.5	Confident	7 Å²	7	15.6 Å²	15.6	7%	0.072	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	75.5	-1	-167.5	0	0	0	0	0	114.3	H22 L44	H22-G142 WeakPolarHBondContact O-CA 3.35Å; H22-G142 PolarHBondContact O-N 3.47Å; L44-G142 VanDerWaalsContact CD1-O 3.32Å; L44-G142 WeakPolarHBondContact CD1-O 3.4Å
143	G	92.5	Very high	86.1	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.01	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	169.6	176.8	0	0	0	0	0	114.2	S24 G119 E140 G141	S24-G143 PolarHBondContact N-O 3.02Å; G119-G143 CarbonylContact O-C 3.59Å; G119-G143 WeakPolarHBondContact O-CA 3.35Å; E140-G143 WeakPolarHBondContact O-CA 3.21Å; E140-G143 PolarHBondContact O-N 2.96Å; G141-G143 PolarHBondContact O-N 3.24Å
144	L	94.4	Very high	85	Confident	1 Å²	1	22 Å²	22	1%	0.005	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	130.2	-176.3	-74	171.5	0	0	0	113.3	I14 S24 F26 L44 G119 M120 C121	I14-L144 HydrophobicContact CD1-CD1 4.28Å; I14-L144 HydrophobicContact CD1-CD2 4.41Å; I14-L144 HydrophobicContact CG1-CD2 4.04Å; S24-L144 WeakPolarHBondContact O-CA 3.46Å; F26-L144 HydrophobicContact CD2-CD2 3.64Å; F26-L144 HydrophobicContact CE2-CD2 3.45Å; F26-L144 VanDerWaalsContact CE2-CD2 3.45Å; L44-L144 HydrophobicContact CB-CD1 3.65Å; L44-L144 HydrophobicContact CD1-CD1 4.21Å; L44-L144 HydrophobicContact CD1-CG 4.36Å; L44-L144 HydrophobicContact CD2-CB 4.42Å; L44-L144 HydrophobicContact CD2-CD1 3.71Å; L44-L144 HydrophobicContact CD2-CG 4.02Å; L44-L144 HydrophobicContact CG-CD1 4.04Å; G119-L144 PolarHBondContact O-N 2.99Å; M120-L144 CarbonylContact C-O 3.59Å; M120-L144 WeakPolarHBondContact CA-O 3.39Å; M120-L144 HydrophobicContact CG-CB 4.22Å; C121-L144 PolarHBondContact N-O 3.41Å
145	V	95.2	Very high	84.2	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	122.3	165.6	-175	0	0	0	0	108.3	S24 M25 F26 I136 I139 I147	S24-V145 PolarHBondContact O-N 3Å; M25-V145 CarbonylContact C-O 3.57Å; M25-V145 WeakPolarHBondContact CA-O 3.43Å; M25-V145 HydrophobicContact CB-CB 4.37Å; M25-V145 HydrophobicContact CE-CB 4.47Å; M25-V145 HydrophobicContact CE-CG1 4.23Å; M25-V145 HydrophobicContact CG-CB 4.22Å; M25-V145 HydrophobicContact CG-CG1 4.35Å; F26-V145 PolarHBondContact N-O 3.33Å; I136-V145 HydrophobicContact CG1-CG1 4.14Å; I136-V145 HydrophobicContact CG1-CG2 4.27Å; I136-V145 HydrophobicContact CG2-CG2 4.33Å; I139-V145 HydrophobicContact CD1-CB 4.13Å; I139-V145 HydrophobicContact CD1-CG2 3.22Å; V145-I147 HydrophobicContact CG1-CG1 4.43Å
146	I	93.9	Very high	83.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.5	173.3	-57.3	-169.8	0	0	0	110.2	F26 I28 V37 L40 M120 C121 I122 L123 L148	F26-I146 HydrophobicContact CB-CG1 4.45Å; F26-I146 CarbonylContact O-C 3.52Å; F26-I146 WeakPolarHBondContact O-CA 3.27Å; I28-I146 HydrophobicContact CD1-CG2 3.85Å; I28-I146 HydrophobicContact CG1-CG2 4.27Å; V37-I146 HydrophobicContact CG2-CD1 4.28Å; V37-I146 HydrophobicContact CG2-CG2 4.35Å; L40-I146 HydrophobicContact CB-CD1 4.06Å; L40-I146 HydrophobicContact CD1-CD1 3.53Å; L40-I146 HydrophobicContact CD1-CG1 4.37Å; L40-I146 HydrophobicContact CG-CD1 4.45Å; M120-I146 HydrophobicContact CE-CD1 3.16Å; M120-I146 HydrophobicContact CE-CG1 3.99Å; C121-I146 PolarHBondContact O-N 2.94Å; I122-I146 CarbonylContact C-O 3.55Å; I122-I146 WeakPolarHBondContact CA-O 3.29Å; I122-I146 HydrophobicContact CG1-CB 4.49Å; L123-I146 PolarHBondContact N-O 3.02Å; I146-L148 HydrophobicContact CG2-CD2 3.71Å; I146-L148 HydrophobicContact CG2-CG 4.22Å
147	I	91.4	Very high	82.1	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119.8	172.4	-58.7	178.2	0	0	0	108.1	M25 F26 V27 I28 L123 L127 L132 V145 L149 F185	M25-I147 HydrophobicContact SD-CD1 4.21Å; F26-I147 PolarHBondContact O-N 3.44Å; V27-I147 WeakPolarHBondContact CA-O 3.5Å; V27-I147 HydrophobicContact CG1-CB 4.48Å; V27-I147 HydrophobicContact CG2-CB 4.25Å; V27-I147 HydrophobicContact CG2-CD1 4.35Å; I28-I147 PolarHBondContact N-O 2.88Å; L123-I147 HydrophobicContact CD1-CG1 4.24Å; L127-I147 HydrophobicContact CD1-CD1 4.05Å; L127-I147 HydrophobicContact CD1-CG2 3.81Å; L132-I147 HydrophobicContact CD2-CD1 4.39Å; V145-I147 HydrophobicContact CG1-CG1 4.43Å; I147-L149 HydrophobicContact CG2-CD2 4.15Å; I147-L149 HydrophobicContact CG2-CG 4.26Å; I147-F185 HydrophobicContact CD1-CZ 3.83Å
148	L	89.1	Confident	81.1	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	117.3	177.5	-58	178.4	0	0	0	109.5	I28 V37 W57 I122 L123 A125 I146	I28-L148 HydrophobicContact CB-CD2 4.09Å; I28-L148 HydrophobicContact CD1-CD2 4.01Å; I28-L148 HydrophobicContact CG1-CD2 4.41Å; V37-L148 HydrophobicContact CG2-CD1 4.25Å; V37-L148 HydrophobicContact CG2-CD2 4.07Å; W57-L148 HydrophobicContact CZ2-CD1 4.43Å; I122-L148 HydrophobicContact CG2-CD1 3.75Å; I122-L148 HydrophobicContact CG2-CG 4.19Å; L123-L148 PolarHBondContact O-N 3.01Å; A125-L148 PolarHBondContact N-O 3.03Å; A125-L148 VanDerWaalsContact N-O 3.08Å; I146-L148 HydrophobicContact CG2-CD2 3.71Å; I146-L148 HydrophobicContact CG2-CG 4.22Å
149	L	83.7	Confident	80	Confident	11 Å²	11	27.7 Å²	27.7	6%	0.058	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	102.1	174.8	-60.5	174	0	0	0	108.3	V27 I28 V29 G30 I147 L152 L158	V27-L149 HydrophobicContact CG1-CD1 3.51Å; V27-L149 HydrophobicContact CG1-CG 4.16Å; I28-L149 PolarHBondContact O-N 3.43Å; V29-L149 HydrophobicContact CG2-CD1 4.28Å; G30-L149 PolarHBondContact N-O 3.18Å; I147-L149 HydrophobicContact CG2-CD2 4.15Å; I147-L149 HydrophobicContact CG2-CG 4.26Å; L149-L152 HydrophobicContact CB-CD1 4.04Å; L149-L152 HydrophobicContact CD1-CD1 4.48Å; L149-L158 HydrophobicContact CD1-CD1 3.51Å; L149-L158 HydrophobicContact CD2-CD1 4.06Å; L149-L158 HydrophobicContact CG-CD1 4.39Å
150	R	77.3	Confident	78.7	Confident	55 Å²	55	32.1 Å²	32.1	21%	0.208	18%	0.176	C	C	.	.			trans	-87.7	158.8	179.5	-68	-159.4	-170.7	118.9	21.8	112	R34 L152	R34-R150 VanDerWaalsContact CZ-CZ 3.46Å; R34-R150 VanDerWaalsContact CZ-NH2 3.28Å; R34-R150 VanDerWaalsContact NH2-CZ 3.26Å; R150-L152 PolarHBondContact O-N 2.67Å
151	S	69	Low	77.2	Confident	94 Å²	94	32.2 Å²	32.2	66%	0.657	18%	0.178	S	C	*	.	S	Bend	trans	55.2	31.4	168	58.2	0	0	0	0	115.2	D31	D31-S151 WeakPolarHBondContact OD1-CA 3.12Å; D31-S151 PolarHBondContact OD1-N 3.39Å
152	L	66.7	Low	75.6	Confident	16 Å²	16	34.7 Å²	34.7	8%	0.084	20%	0.198	C	C	.	.			trans	-106.1	123.9	171.6	-64.7	176.9	0	0	0	108.8	V29 L149 R150 Q157 L158 L161	V29-L152 HydrophobicContact CG1-CB 4.27Å; L149-L152 HydrophobicContact CB-CD1 4.04Å; L149-L152 HydrophobicContact CD1-CD1 4.48Å; R150-L152 PolarHBondContact O-N 2.67Å; L152-Q157 HydrophobicContact CD2-CB 3.69Å; L152-L158 HydrophobicContact CD1-CB 4.13Å; L152-L158 HydrophobicContact CD1-CD1 3.98Å; L152-L158 HydrophobicContact CD1-CG 3.97Å; L152-L161 HydrophobicContact CD2-CD1 4.19Å
153	T	60.1	Low	74.1	Confident	110 Å²	110	34.9 Å²	34.9	68%	0.675	20%	0.197	S	C	*	.	S	Bend	trans	-90.8	-25.5	173.4	42.5	0	0	0	0	111.7	Q157	T153-Q157 PolarHBondContact OG1-NE2 2.85Å; T153-Q157 PolarHBondContact OG1-OE1 3.02Å; T153-Q157 VanDerWaalsContact OG1-OE1 3.09Å
154	S	65	Low	72.4	Confident	28 Å²	28	39.2 Å²	39.2	20%	0.196	22%	0.22	C	C	.	.	S	Bend	trans	-133.8	147.3	171	150.5	0	0	0	0	109.4	R156 Q157 E683	S154-R156 PolarHBondContact O-N 3.33Å; S154-R156 WeakPolarHBondContact OG-CB 3.39Å; S154-R156 PolarHBondContact OG-N 3.01Å; S154-Q157 WeakPolarHBondContact O-CB 3.43Å; S154-Q157 PolarHBondContact O-N 2.98Å; S154-E683 PolarHBondContact OG-OE1 3.1Å
155	L	70.1	Confident	70.4	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-68.8	-23.1	176	-80.6	169	0	0	0	112.9	V29 Q157 L158 L186 L205 I207 L680 E683 I685	V29-L155 HydrophobicContact CG1-CD2 4.33Å; V29-L155 HydrophobicContact CG2-CD2 3.7Å; V29-L155 HydrophobicContact CG2-CG 4.47Å; L155-Q157 VanDerWaalsContact C-N 3.26Å; L155-Q157 PolarHBondContact O-N 3.24Å; L155-L158 WeakPolarHBondContact O-CB 3.32Å; L155-L158 PolarHBondContact O-N 3.22Å; L155-L158 VanDerWaalsContact O-N 3.13Å; L155-L186 HydrophobicContact CB-CD2 4.25Å; L155-L186 HydrophobicContact CD2-CD1 4.19Å; L155-L205 HydrophobicContact CD1-CD1 4.28Å; L155-I207 HydrophobicContact CD1-CD1 3.21Å; L155-I207 HydrophobicContact CD1-CG1 4.48Å; L155-L680 HydrophobicContact CG-CD2 4.26Å; L155-E683 PolarHBondContact N-OE2 3.05Å; L155-I685 HydrophobicContact CB-CD1 4.22Å; L155-I685 HydrophobicContact CD1-CD1 3.95Å
156	R	69.2	Low	69	Low	87 Å²	87	40.8 Å²	40.8	33%	0.328	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-66.1	-26	173.7	-69.7	177.2	-179.6	-178.4	5.8	113	S154 L158 Y159 S676 E683	S154-R156 PolarHBondContact O-N 3.33Å; S154-R156 WeakPolarHBondContact OG-CB 3.39Å; S154-R156 PolarHBondContact OG-N 3.01Å; R156-L158 PolarHBondContact O-N 3.43Å; R156-L158 VanDerWaalsContact O-N 3.12Å; R156-Y159 HydrophobicContact CB-CD2 4.23Å; R156-Y159 HydrophobicContact CB-CE2 4.4Å; R156-Y159 HydrophobicContact CG-CD2 4.37Å; R156-Y159 HydrophobicContact CG-CE2 4.06Å; R156-Y159 VanDerWaalsContact O-CB 3.23Å; R156-Y159 WeakPolarHBondContact O-CB 3.29Å; R156-Y159 PolarHBondContact O-N 2.55Å; R156-S676 PolarHBondContact NH1-OG 2.97Å; R156-E683 WeakPolarHBondContact CG-OE1 3.36Å; R156-E683 IonicContact NE-OE1 3.89Å
157	Q	67.1	Low	67.4	Low	67 Å²	67	43.9 Å²	43.9	31%	0.313	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-60.8	-21.6	173.2	-71.2	171.9	-10	0	0	112.3	L152 T153 S154 L155 Y159 T160 L161	L152-Q157 HydrophobicContact CD2-CB 3.69Å; T153-Q157 PolarHBondContact OG1-NE2 2.85Å; T153-Q157 PolarHBondContact OG1-OE1 3.02Å; T153-Q157 VanDerWaalsContact OG1-OE1 3.09Å; S154-Q157 WeakPolarHBondContact O-CB 3.43Å; S154-Q157 PolarHBondContact O-N 2.98Å; L155-Q157 VanDerWaalsContact C-N 3.26Å; L155-Q157 PolarHBondContact O-N 3.24Å; Q157-Y159 PolarHBondContact O-N 3.02Å; Q157-T160 PolarHBondContact O-N 3.09Å; Q157-T160 PolarHBondContact O-OG1 3.18Å; Q157-L161 PolarHBondContact O-N 2.84Å
158	L	67.3	Low	65.9	Low	9 Å²	9	52 Å²	52	5%	0.047	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-66.5	-27.6	174.5	-143.5	168	0	0	0	111.8	L149 L152 L155 R156 T160 L161 N182	L149-L158 HydrophobicContact CD1-CD1 3.51Å; L149-L158 HydrophobicContact CD2-CD1 4.06Å; L149-L158 HydrophobicContact CG-CD1 4.39Å; L152-L158 HydrophobicContact CD1-CB 4.13Å; L152-L158 HydrophobicContact CD1-CD1 3.98Å; L152-L158 HydrophobicContact CD1-CG 3.97Å; L155-L158 WeakPolarHBondContact O-CB 3.32Å; L155-L158 PolarHBondContact O-N 3.22Å; L155-L158 VanDerWaalsContact O-N 3.13Å; R156-L158 PolarHBondContact O-N 3.43Å; R156-L158 VanDerWaalsContact O-N 3.12Å; L158-T160 VanDerWaalsContact C-N 3.28Å; L158-T160 PolarHBondContact O-N 3.16Å; L158-L161 HydrophobicContact CD2-CD1 4.33Å; L158-L161 HydrophobicContact CG-CD1 4.05Å; L158-L161 PolarHBondContact O-N 3.48Å; L158-N182 HydrophobicContact CD2-CB 3.92Å; L158-N182 WeakPolarHBondContact O-CB 3.33Å; L158-N182 PolarHBondContact O-ND2 2.91Å
159	Y	66.1	Low	64.9	Low	18 Å²	18	53.4 Å²	53.4	7%	0.071	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-34.6	176	-59.6	-21.4	0	0	0	112.4	R156 Q157 G179 E183 L186 I685	R156-Y159 HydrophobicContact CB-CD2 4.23Å; R156-Y159 HydrophobicContact CB-CE2 4.4Å; R156-Y159 HydrophobicContact CG-CD2 4.37Å; R156-Y159 HydrophobicContact CG-CE2 4.06Å; R156-Y159 VanDerWaalsContact O-CB 3.23Å; R156-Y159 WeakPolarHBondContact O-CB 3.29Å; R156-Y159 PolarHBondContact O-N 2.55Å; Q157-Y159 PolarHBondContact O-N 3.02Å; Y159-G179 WeakPolarHBondContact O-CA 3.23Å; Y159-E183 HydrophobicContact CD1-CB 3.74Å; Y159-E183 HydrophobicContact CD1-CG 4.05Å; Y159-E183 HydrophobicContact CE1-CB 3.85Å; Y159-E183 HydrophobicContact CE1-CG 3.75Å; Y159-E183 HydrophobicContact CE2-CG 4.44Å; Y159-E183 HydrophobicContact CG-CB 4.33Å; Y159-L186 HydrophobicContact CD1-CD2 4.34Å; Y159-L186 HydrophobicContact CE1-CB 4.11Å; Y159-L186 HydrophobicContact CE1-CD2 3.47Å; Y159-L186 VanDerWaalsContact CE1-CD2 3.47Å; Y159-L186 HydrophobicContact CE1-CG 4.4Å; Y159-I685 WeakPolarHBondContact OH-CG2 3.34Å
160	T	63.9	Low	64.3	Low	94 Å²	94	58.3 Å²	58.3	58%	0.577	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-0.1	-176.8	53	0	0	0	0	113.2	Q157 L158 A162 V671	Q157-T160 PolarHBondContact O-N 3.09Å; Q157-T160 PolarHBondContact O-OG1 3.18Å; L158-T160 VanDerWaalsContact C-N 3.28Å; L158-T160 PolarHBondContact O-N 3.16Å; T160-A162 PolarHBondContact O-N 3.49Å; T160-V671 HydrophobicContact CG2-CG1 4.38Å
161	L	60.2	Low	63.8	Low	70 Å²	70	56.4 Å²	56.4	37%	0.366	30%	0.303	S	S	.	.			trans	-66.6	106.3	180	-84.6	176.1	0	0	0	111.2	L152 Q157 L158 N182	L152-L161 HydrophobicContact CD2-CD1 4.19Å; Q157-L161 PolarHBondContact O-N 2.84Å; L158-L161 HydrophobicContact CD2-CD1 4.33Å; L158-L161 HydrophobicContact CG-CD1 4.05Å; L158-L161 PolarHBondContact O-N 3.48Å; L161-N182 PolarHBondContact O-ND2 3.45Å
162	A	55.4	Low	63.9	Low	59 Å²	59	56.4 Å²	56.4	49%	0.488	29%	0.293	S	S	.	.			trans	-69.4	127.7	168.5	0	0	0	0	0	110.6	T160 H166	T160-A162 PolarHBondContact O-N 3.49Å; A162-H166 WeakPolarHBondContact CA-ND1 3.22Å
163	M	58.5	Low	64	Low	11 Å²	11	58 Å²	58	5%	0.054	31%	0.309	C	S	.	.			trans	-96.3	156.5	176.1	-64.9	-177.2	61.1	0	0	111	T126 L127 T128 V165 H166 Q546	T126-M163 HydrophobicContact CG2-CG 4.25Å; L127-M163 WeakPolarHBondContact O-CE 3.25Å; T128-M163 HydrophobicContact CG2-CE 3.64Å; M163-V165 PolarHBondContact O-N 2.56Å; M163-V165 VanDerWaalsContact O-N 3.09Å; M163-H166 PolarHBondContact N-ND1 2.64Å; M163-H166 WeakPolarHBondContact O-CA 3.47Å; M163-H166 WeakPolarHBondContact O-CB 3.4Å; M163-H166 PolarHBondContact O-N 2.8Å; M163-Q546 PolarHBondContact SD-NE2 3.44Å
164	D	56.3	Low	64.7	Low	92 Å²	92	55.8 Å²	55.8	49%	0.492	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-58.4	-28.4	174.7	-68.7	17.5	0	0	0	113.2	K60 H166 A167	K60-D164 VanDerWaalsContact CE-CG 3.47Å; K60-D164 WeakPolarHBondContact CE-OD2 3.47Å; K60-D164 IonicContact NZ-OD1 2.74Å; K60-D164 PolarHBondContact NZ-OD1 2.91Å; K60-D164 IonicContact NZ-OD2 2.73Å; K60-D164 PolarHBondContact NZ-OD2 3.22Å; D164-H166 PolarHBondContact O-N 2.85Å; D164-A167 WeakPolarHBondContact O-CB 3.37Å; D164-A167 PolarHBondContact O-N 3.02Å
165	V	54	Low	65	Low	32 Å²	32	57.5 Å²	57.5	19%	0.194	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-63.4	-31.6	176.6	-170.7	0	0	0	0	110.6	T128 M163 A167 R168 Y169	T128-V165 HydrophobicContact CG2-CG2 3.75Å; M163-V165 PolarHBondContact O-N 2.56Å; M163-V165 VanDerWaalsContact O-N 3.09Å; V165-A167 PolarHBondContact O-N 3.4Å; V165-R168 WeakPolarHBondContact O-CB 3.17Å; V165-R168 PolarHBondContact O-N 3.26Å; V165-Y169 HydrophobicContact CB-CE2 4.49Å; V165-Y169 HydrophobicContact CG1-CE1 4.23Å; V165-Y169 HydrophobicContact CG1-CE2 3.74Å; V165-Y169 VanDerWaalsContact CG1-OH 3.32Å; V165-Y169 WeakPolarHBondContact CG1-OH 3.48Å
166	H	64.8	Low	65.2	Low	2 Å²	2	62.9 Å²	62.9	1%	0.009	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-62.4	-29.3	177.4	-61.9	170.4	0	0	0	112.2	A162 M163 D164 R168 Y169 R170 I177 D550	A162-H166 WeakPolarHBondContact CA-ND1 3.22Å; M163-H166 PolarHBondContact N-ND1 2.64Å; M163-H166 WeakPolarHBondContact O-CA 3.47Å; M163-H166 WeakPolarHBondContact O-CB 3.4Å; M163-H166 PolarHBondContact O-N 2.8Å; D164-H166 PolarHBondContact O-N 2.85Å; H166-R168 PolarHBondContact O-N 3.5Å; H166-R168 VanDerWaalsContact O-N 3.12Å; H166-Y169 AromaticContact CD2-CD2 3.86Å; H166-Y169 PolarHBondContact O-N 3.46Å; H166-R170 PolarHBondContact O-N 2.91Å; H166-I177 HydrophobicContact CB-CD1 3.5Å; H166-I177 VanDerWaalsContact CB-CD1 3.5Å; H166-I177 HydrophobicContact CB-CG2 4.06Å; H166-I177 WeakPolarHBondContact O-CD1 3.33Å; H166-D550 IonicContact CD2-OD2 2.8Å; H166-D550 IonicContact CE1-OD2 3.73Å; H166-D550 IonicContact NE2-OD2 2.89Å; H166-D550 PolarHBondContact NE2-OD2 3.49Å
167	A	59.9	Low	65.4	Low	64 Å²	64	60.5 Å²	60.5	53%	0.529	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-60.8	-22.7	173.1	0	0	0	0	0	113.2	D164 V165	D164-A167 WeakPolarHBondContact O-CB 3.37Å; D164-A167 PolarHBondContact O-N 3.02Å; V165-A167 PolarHBondContact O-N 3.4Å
168	R	60	Low	65.9	Low	171 Å²	171	59.3 Å²	59.3	65%	0.645	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-85.7	-15.2	174.6	-57	-178.9	-179.3	-173.2	-2	113.7	V165 H166	V165-R168 WeakPolarHBondContact O-CB 3.17Å; V165-R168 PolarHBondContact O-N 3.26Å; H166-R168 PolarHBondContact O-N 3.5Å; H166-R168 VanDerWaalsContact O-N 3.12Å
169	Y	68.9	Low	66.4	Low	31 Å²	31	59.1 Å²	59.1	12%	0.122	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-14.8	-178.8	-58.3	-30.8	0	0	0	112.5	V165 H166 Q546 M547 D550 A551	V165-Y169 HydrophobicContact CB-CE2 4.49Å; V165-Y169 HydrophobicContact CG1-CE1 4.23Å; V165-Y169 HydrophobicContact CG1-CE2 3.74Å; V165-Y169 VanDerWaalsContact CG1-OH 3.32Å; V165-Y169 WeakPolarHBondContact CG1-OH 3.48Å; H166-Y169 AromaticContact CD2-CD2 3.86Å; H166-Y169 PolarHBondContact O-N 3.46Å; Y169-Q546 HydrophobicContact CE2-CG 4.35Å; Y169-M547 HydrophobicContact CD1-CG 4.21Å; Y169-M547 HydrophobicContact CE1-CB 3.82Å; Y169-M547 HydrophobicContact CE1-CG 3.68Å; Y169-M547 HydrophobicContact CE1-SD 4.49Å; Y169-D550 HydrophobicContact CD2-CB 4.39Å; Y169-A551 HydrophobicContact CD1-CB 4.24Å; Y169-A551 HydrophobicContact CD2-CB 4.36Å; Y169-A551 HydrophobicContact CG-CB 3.9Å
170	R	70.7	Confident	67.3	Low	114 Å²	114	59.9 Å²	59.9	43%	0.43	33%	0.325	S	S	.	.			trans	-74.3	127.8	173	-62.7	-173.3	179.3	152.8	2.9	109.5	H166 S175 I177	H166-R170 PolarHBondContact O-N 2.91Å; R170-S175 WeakPolarHBondContact CD-O 3.48Å; R170-S175 PolarHBondContact NE-O 2.63Å; R170-I177 HydrophobicContact CB-CD1 4.5Å; R170-I177 HydrophobicContact CG-CD1 3.3Å; R170-I177 HydrophobicContact CG-CG1 4.03Å
171	T	66.2	Low	68.4	Low	14 Å²	14	55.5 Å²	55.5	9%	0.086	30%	0.298	C	S	.	.			trans	-102.1	167.8	160.5	59.3	0	0	0	0	108.4	A173 H174 D603	T171-A173 PolarHBondContact O-N 3.3Å; T171-H174 PolarHBondContact N-O 3.48Å; T171-H174 CarbonylContact O-C 3.48Å; T171-H174 PolarHBondContact O-N 2.82Å; T171-H174 WeakPolarHBondContact OG1-CB 3.4Å; T171-H174 PolarHBondContact OG1-N 3.43Å; T171-D603 WeakPolarHBondContact CG2-OD1 3.26Å; T171-D603 WeakPolarHBondContact CG2-OD2 3.36Å
172	E	71.2	Confident	69.5	Low	95 Å²	95	52.6 Å²	52.6	44%	0.444	28%	0.282	S	S	.	.	S	Bend	trans	-62.2	-37.2	178.3	-162.3	168.7	147.5	0	0	111.2	I585 S586 S589	E172-I585 WeakPolarHBondContact OE2-CG2 3.37Å; E172-S586 VanDerWaalsContact OE1-CB 3.24Å; E172-S586 WeakPolarHBondContact OE1-CB 3.12Å; E172-S586 PolarHBondContact OE1-N 3.48Å; E172-S586 PolarHBondContact OE1-OG 2.75Å; E172-S589 WeakPolarHBondContact OE2-CB 3.5Å; E172-S589 PolarHBondContact OE2-OG 3.04Å
173	A	70.2	Confident	70.8	Confident	50 Å²	50	50.2 Å²	50.2	41%	0.413	26%	0.261	S	S	.	.	S	Bend	trans	-76	-26.9	176	0	0	0	0	0	114.1	T171 D584	T171-A173 PolarHBondContact O-N 3.3Å; A173-D584 HydrophobicContact CB-CB 4.25Å
174	H	74.1	Confident	72.2	Confident	62 Å²	62	49.7 Å²	49.7	29%	0.287	26%	0.259	S	S	.	.			trans	-130.6	88.4	-174.9	-58.6	74.5	0	0	0	111.6	T171 P552 A553	T171-H174 PolarHBondContact N-O 3.48Å; T171-H174 CarbonylContact O-C 3.48Å; T171-H174 PolarHBondContact O-N 2.82Å; T171-H174 WeakPolarHBondContact OG1-CB 3.4Å; T171-H174 PolarHBondContact OG1-N 3.43Å; H174-P552 HydrophobicContact CB-CB 4.17Å; H174-P552 HydrophobicContact CB-CG 3.84Å; H174-A553 HydrophobicContact CB-CB 4.4Å
175	S	71.5	Confident	73.7	Confident	64 Å²	64	45.5 Å²	45.5	45%	0.448	24%	0.236	S	C	.	.			trans	-86.2	-26.4	-178.6	53.4	0	0	0	0	114.9	R170 I177	R170-S175 WeakPolarHBondContact CD-O 3.48Å; R170-S175 PolarHBondContact NE-O 2.63Å; S175-I177 PolarHBondContact O-N 2.85Å
176	D	73.2	Confident	75.1	Confident	115 Å²	115	44.1 Å²	44.1	62%	0.615	23%	0.228	S	C	*	.			trans	-84.1	112.7	-163.2	-67.9	-2	0	0	0	110.9	P552	D176-P552 WeakPolarHBondContact O-CB 3.09Å; D176-P552 WeakPolarHBondContact O-CG 3.34Å
177	I	74.7	Confident	76.1	Confident	36 Å²	36	44.9 Å²	44.9	19%	0.185	23%	0.232	C	C	.	.			trans	-108.4	124.5	-175.2	-65.7	-178.5	0	0	0	109.5	H166 R170 S175 D550 P552	H166-I177 HydrophobicContact CB-CD1 3.5Å; H166-I177 VanDerWaalsContact CB-CD1 3.5Å; H166-I177 HydrophobicContact CB-CG2 4.06Å; H166-I177 WeakPolarHBondContact O-CD1 3.33Å; R170-I177 HydrophobicContact CB-CD1 4.5Å; R170-I177 HydrophobicContact CG-CD1 3.3Å; R170-I177 HydrophobicContact CG-CG1 4.03Å; S175-I177 PolarHBondContact O-N 2.85Å; I177-D550 HydrophobicContact CG2-CB 4.32Å; I177-P552 HydrophobicContact CG1-CG 4.42Å
178	V	76.2	Confident	77.5	Confident	42 Å²	42	41.9 Å²	41.9	26%	0.255	21%	0.207	S	C	.	.			trans	-100.9	120.9	175	-174	0	0	0	0	108.1	R180	V178-R180 HydrophobicContact CB-CG 4.23Å; V178-R180 HydrophobicContact CG1-CG 3.85Å; V178-R180 PolarHBondContact O-N 2.75Å
179	G	78.4	Confident	78.7	Confident	5 Å²	5	33.8 Å²	33.8	5%	0.052	18%	0.176	C	C	.	.			trans	-74.4	57.6	-179	0	0	0	0	0	114.1	Y159 F181 N182 E183	Y159-G179 WeakPolarHBondContact O-CA 3.23Å; G179-F181 VanDerWaalsContact C-N 3.31Å; G179-F181 PolarHBondContact O-N 2.99Å; G179-N182 PolarHBondContact O-N 2.96Å; G179-N182 VanDerWaalsContact O-N 3.17Å; G179-E183 PolarHBondContact O-N 2.95Å; G179-E183 VanDerWaalsContact O-N 3.16Å
180	R	84.8	Confident	79.4	Confident	35 Å²	35	33.7 Å²	33.7	13%	0.132	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-36.7	-176.5	-60.5	-171	-174.6	95.9	-2.3	112.3	V178 E183 R184 D513 F516 S549 D550	V178-R180 HydrophobicContact CB-CG 4.23Å; V178-R180 HydrophobicContact CG1-CG 3.85Å; V178-R180 PolarHBondContact O-N 2.75Å; R180-E183 PolarHBondContact O-N 3.32Å; R180-R184 PolarHBondContact O-N 2.82Å; R180-D513 IonicContact CZ-OD1 2.73Å; R180-D513 IonicContact CZ-OD2 2.71Å; R180-D513 VanDerWaalsContact NE-CG 3.32Å; R180-D513 IonicContact NE-OD1 2.77Å; R180-D513 PolarHBondContact NE-OD1 2.79Å; R180-D513 IonicContact NE-OD2 3.18Å; R180-D513 IonicContact NH2-OD1 2.8Å; R180-D513 PolarHBondContact NH2-OD1 2.93Å; R180-D513 IonicContact NH2-OD2 3.81Å; R180-D513 PolarHBondContact NH2-OD2 3.1Å; R180-F516 HydrophobicContact CB-CB 4.1Å; R180-F516 HydrophobicContact CB-CG 4.49Å; R180-S549 WeakPolarHBondContact CD-O 3.24Å; R180-S549 PolarHBondContact NH1-O 2.77Å; R180-D550 PolarHBondContact N-OD1 3.26Å
181	F	87.9	Confident	80	Confident	1 Å²	1	30.6 Å²	30.6	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-64.1	-40.4	176	-177.7	-99.8	0	0	0	112.4	P129 G179 E183 R184 F185 L484 L485 L545 Q546 S549 D550	P129-F181 HydrophobicContact CB-CZ 4.22Å; P129-F181 HydrophobicContact CG-CD1 4.43Å; P129-F181 HydrophobicContact CG-CD2 4.43Å; P129-F181 HydrophobicContact CG-CE1 3.91Å; P129-F181 HydrophobicContact CG-CE2 3.91Å; P129-F181 HydrophobicContact CG-CZ 3.64Å; G179-F181 VanDerWaalsContact C-N 3.31Å; G179-F181 PolarHBondContact O-N 2.99Å; F181-E183 VanDerWaalsContact C-N 3.31Å; F181-E183 PolarHBondContact O-N 3.15Å; F181-R184 PolarHBondContact O-N 2.81Å; F181-F185 HydrophobicContact CE1-CB 4.47Å; F181-F185 VanDerWaalsContact O-CB 3.28Å; F181-F185 WeakPolarHBondContact O-CB 3.48Å; F181-F185 PolarHBondContact O-N 3.43Å; F181-L484 HydrophobicContact CE2-CD1 4.46Å; F181-L485 HydrophobicContact CZ-CD2 4.41Å; F181-L545 HydrophobicContact CE2-CD2 4.5Å; F181-Q546 HydrophobicContact CB-CG 4.32Å; F181-S549 WeakPolarHBondContact CB-OG 3.49Å; F181-D550 PolarHBondContact N-OD1 3.13Å
182	N	83.4	Confident	81	Confident	9 Å²	9	30 Å²	30	5%	0.048	17%	0.174	C	C	.	.	H	α-helix	trans	-66.4	-37.5	178.9	-70.8	-17.5	0	0	0	111.3	L158 L161 G179 F185 L186	L158-N182 HydrophobicContact CD2-CB 3.92Å; L158-N182 WeakPolarHBondContact O-CB 3.33Å; L158-N182 PolarHBondContact O-ND2 2.91Å; L161-N182 PolarHBondContact O-ND2 3.45Å; G179-N182 PolarHBondContact O-N 2.96Å; G179-N182 VanDerWaalsContact O-N 3.17Å; N182-F185 PolarHBondContact O-N 3.44Å; N182-L186 PolarHBondContact O-N 3.41Å
183	E	82.3	Confident	81.6	Confident	10 Å²	10	31.6 Å²	31.6	5%	0.047	18%	0.182	C	C	.	.	H	α-helix	trans	-61.3	-51.6	172.9	-178.1	173.3	171.8	0	0	111.6	Y159 G179 R180 F181 F185 L186 L187 R688	Y159-E183 HydrophobicContact CD1-CB 3.74Å; Y159-E183 HydrophobicContact CD1-CG 4.05Å; Y159-E183 HydrophobicContact CE1-CB 3.85Å; Y159-E183 HydrophobicContact CE1-CG 3.75Å; Y159-E183 HydrophobicContact CE2-CG 4.44Å; Y159-E183 HydrophobicContact CG-CB 4.33Å; G179-E183 PolarHBondContact O-N 2.95Å; G179-E183 VanDerWaalsContact O-N 3.16Å; R180-E183 PolarHBondContact O-N 3.32Å; F181-E183 VanDerWaalsContact C-N 3.31Å; F181-E183 PolarHBondContact O-N 3.15Å; E183-F185 VanDerWaalsContact C-N 3.31Å; E183-F185 PolarHBondContact O-N 3.36Å; E183-L186 PolarHBondContact O-N 3.44Å; E183-L187 HydrophobicContact CG-CD1 4.12Å; E183-L187 WeakPolarHBondContact O-CG 3.47Å; E183-L187 PolarHBondContact O-N 3.33Å; E183-R688 WeakPolarHBondContact OE1-CG 3.38Å; E183-R688 IonicContact OE1-NE 2.65Å; E183-R688 PolarHBondContact OE1-NE 3.24Å; E183-R688 IonicContact OE2-CZ 2.71Å; E183-R688 IonicContact OE2-NE 3.62Å; E183-R688 PolarHBondContact OE2-NE 3.27Å; E183-R688 IonicContact OE2-NH2 3.68Å; E183-R688 PolarHBondContact OE2-NH2 2.93Å
184	R	88.3	Confident	82.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-58.5	-42.5	175.1	-176.9	163.8	171.1	-109.2	-2.1	112.3	R180 F181 L187 S188 Q483 L484 C486 F518 E523	R180-R184 PolarHBondContact O-N 2.82Å; F181-R184 PolarHBondContact O-N 2.81Å; R184-L187 PolarHBondContact O-N 3.4Å; R184-S188 VanDerWaalsContact O-CB 3.28Å; R184-S188 WeakPolarHBondContact O-CB 3.46Å; R184-S188 PolarHBondContact O-N 3.32Å; R184-Q483 PolarHBondContact NH2-O 3.47Å; R184-L484 HydrophobicContact CG-CD1 4.29Å; R184-L484 VanDerWaalsContact CZ-O 3.22Å; R184-L484 PolarHBondContact NH1-O 3.33Å; R184-L484 PolarHBondContact NH2-O 3.46Å; R184-C486 PolarHBondContact NH2-SG 3.37Å; R184-F518 HydrophobicContact CG-CB 4.38Å; R184-F518 HydrophobicContact CG-CD2 3.87Å; R184-E523 IonicContact CZ-OE1 3.96Å; R184-E523 IonicContact CZ-OE2 2.76Å; R184-E523 IonicContact NE-OE2 3.99Å; R184-E523 PolarHBondContact NE-OE2 2.94Å; R184-E523 VanDerWaalsContact NH2-CD 3.25Å; R184-E523 IonicContact NH2-OE1 3.56Å; R184-E523 PolarHBondContact NH2-OE1 3.48Å; R184-E523 IonicContact NH2-OE2 2.69Å; R184-E523 PolarHBondContact NH2-OE2 3.12Å
185	F	88.1	Confident	83.3	Confident	4 Å²	4	26.8 Å²	26.8	2%	0.018	15%	0.153	C	C	.	.	H	α-helix	trans	-57.8	-50.5	177.5	172.9	-105.6	0	0	0	111	L127 L132 I147 F181 N182 E183 L187 S188 L189 W480 L484	L127-F185 HydrophobicContact CD1-CE1 3.87Å; L127-F185 HydrophobicContact CD1-CE2 4.4Å; L127-F185 HydrophobicContact CD1-CZ 3.69Å; L132-F185 HydrophobicContact CD1-CD2 4.17Å; L132-F185 HydrophobicContact CD1-CE2 3.87Å; I147-F185 HydrophobicContact CD1-CZ 3.83Å; F181-F185 HydrophobicContact CE1-CB 4.47Å; F181-F185 VanDerWaalsContact O-CB 3.28Å; F181-F185 WeakPolarHBondContact O-CB 3.48Å; F181-F185 PolarHBondContact O-N 3.43Å; N182-F185 PolarHBondContact O-N 3.44Å; E183-F185 VanDerWaalsContact C-N 3.31Å; E183-F185 PolarHBondContact O-N 3.36Å; F185-L187 PolarHBondContact O-N 2.92Å; F185-S188 PolarHBondContact O-N 3.17Å; F185-S188 PolarHBondContact O-OG 3.21Å; F185-L189 HydrophobicContact CD1-CD1 4.31Å; F185-L189 HydrophobicContact CE1-CD1 3.77Å; F185-L189 HydrophobicContact CE1-CG 4.39Å; F185-L189 HydrophobicContact CE2-CD2 4.26Å; F185-L189 HydrophobicContact CZ-CD1 3.98Å; F185-L189 HydrophobicContact CZ-CD2 4.07Å; F185-L189 HydrophobicContact CZ-CG 4.26Å; F185-L189 WeakPolarHBondContact O-CG 3.26Å; F185-L189 PolarHBondContact O-N 2.81Å; F185-L189 VanDerWaalsContact O-N 3.11Å; F185-W480 HydrophobicContact CD2-CZ2 4.25Å; F185-W480 AromaticContact CE2-CH2 3.86Å; F185-W480 HydrophobicContact CE2-CH2 3.86Å; F185-W480 AromaticContact CE2-CZ2 3.88Å; F185-W480 HydrophobicContact CE2-CZ2 3.88Å; F185-L484 HydrophobicContact CD2-CD2 3.75Å; F185-L484 HydrophobicContact CE2-CD2 4.31Å
186	L	83.5	Confident	84.2	Confident	3 Å²	3	23.8 Å²	23.8	2%	0.016	13%	0.131	C	C	.	.	H	α-helix	trans	-62.5	-44.7	-179.9	-173.4	66.4	0	0	0	112.1	L155 Y159 N182 E183 S188 L189 I685	L155-L186 HydrophobicContact CB-CD2 4.25Å; L155-L186 HydrophobicContact CD2-CD1 4.19Å; Y159-L186 HydrophobicContact CD1-CD2 4.34Å; Y159-L186 HydrophobicContact CE1-CB 4.11Å; Y159-L186 HydrophobicContact CE1-CD2 3.47Å; Y159-L186 VanDerWaalsContact CE1-CD2 3.47Å; Y159-L186 HydrophobicContact CE1-CG 4.4Å; N182-L186 PolarHBondContact O-N 3.41Å; E183-L186 PolarHBondContact O-N 3.44Å; L186-S188 VanDerWaalsContact C-N 3.28Å; L186-S188 PolarHBondContact O-N 2.86Å; L186-L189 HydrophobicContact CD1-CD1 4.35Å; L186-L189 WeakPolarHBondContact O-CB 3.41Å; L186-L189 PolarHBondContact O-N 3.43Å; L186-I685 HydrophobicContact CD1-CD1 4.2Å; L186-I685 HydrophobicContact CD2-CD1 3.71Å; L186-I685 HydrophobicContact CD2-CG1 4.43Å; L186-I685 HydrophobicContact CD2-CG2 4.22Å; L186-I685 HydrophobicContact CG-CD1 3.92Å
187	L	84.5	Confident	84.9	Confident	18 Å²	18	18.4 Å²	18.4	9%	0.094	10%	0.103	C	C	.	.	H	α-helix	trans	-63.3	-37.1	176.5	-67.4	171.9	0	0	0	111.6	E183 R184 F185 L189 A190 C517 F518 I685	E183-L187 HydrophobicContact CG-CD1 4.12Å; E183-L187 WeakPolarHBondContact O-CG 3.47Å; E183-L187 PolarHBondContact O-N 3.33Å; R184-L187 PolarHBondContact O-N 3.4Å; F185-L187 PolarHBondContact O-N 2.92Å; L187-L189 VanDerWaalsContact C-N 3.31Å; L187-L189 PolarHBondContact O-N 2.86Å; L187-A190 WeakPolarHBondContact O-CB 3.22Å; L187-A190 PolarHBondContact O-N 3.08Å; L187-C517 WeakPolarHBondContact CD1-O 3.36Å; L187-F518 HydrophobicContact CB-CB 3.77Å; L187-F518 HydrophobicContact CB-CD1 3.75Å; L187-F518 HydrophobicContact CB-CG 3.94Å; L187-F518 HydrophobicContact CD1-CB 3.85Å; L187-F518 HydrophobicContact CG-CB 4.48Å; L187-I685 HydrophobicContact CD2-CG2 3.67Å
188	S	89.2	Confident	85.6	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66	-31.5	177.2	81.4	0	0	0	0	113	R184 F185 L186 A190 S191 C192 W480 F518	R184-S188 VanDerWaalsContact O-CB 3.28Å; R184-S188 WeakPolarHBondContact O-CB 3.46Å; R184-S188 PolarHBondContact O-N 3.32Å; F185-S188 PolarHBondContact O-N 3.17Å; F185-S188 PolarHBondContact O-OG 3.21Å; L186-S188 VanDerWaalsContact C-N 3.28Å; L186-S188 PolarHBondContact O-N 2.86Å; S188-A190 PolarHBondContact O-N 3Å; S188-S191 PolarHBondContact O-N 3.43Å; S188-S191 PolarHBondContact O-OG 2.92Å; S188-C192 PolarHBondContact O-N 3.19Å; S188-W480 PolarHBondContact O-NE1 3.37Å; S188-W480 VanDerWaalsContact O-NE1 3.12Å; S188-W480 PolarHBondContact OG-NE1 2.92Å; S188-F518 VanDerWaalsContact CA-CZ 3.48Å
189	L	86.3	Confident	86.1	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-62.1	-33.2	178.1	-68.5	171.5	0	0	0	111.7	M25 V27 F185 L186 L187 S191 C192 W480	M25-L189 HydrophobicContact SD-CD2 3.78Å; V27-L189 HydrophobicContact CG2-CD1 3.95Å; V27-L189 HydrophobicContact CG2-CD2 4.21Å; F185-L189 HydrophobicContact CD1-CD1 4.31Å; F185-L189 HydrophobicContact CE1-CD1 3.77Å; F185-L189 HydrophobicContact CE1-CG 4.39Å; F185-L189 HydrophobicContact CE2-CD2 4.26Å; F185-L189 HydrophobicContact CZ-CD1 3.98Å; F185-L189 HydrophobicContact CZ-CD2 4.07Å; F185-L189 HydrophobicContact CZ-CG 4.26Å; F185-L189 WeakPolarHBondContact O-CG 3.26Å; F185-L189 PolarHBondContact O-N 2.81Å; F185-L189 VanDerWaalsContact O-N 3.11Å; L186-L189 HydrophobicContact CD1-CD1 4.35Å; L186-L189 WeakPolarHBondContact O-CB 3.41Å; L186-L189 PolarHBondContact O-N 3.43Å; L187-L189 VanDerWaalsContact C-N 3.31Å; L187-L189 PolarHBondContact O-N 2.86Å; L189-S191 VanDerWaalsContact C-N 3.25Å; L189-S191 PolarHBondContact O-N 3.26Å; L189-C192 PolarHBondContact O-N 3.48Å; L189-W480 HydrophobicContact CD2-CH2 4.14Å; L189-W480 HydrophobicContact CD2-CZ2 3.6Å; L189-W480 HydrophobicContact CG-CZ2 4.43Å
190	A	82.3	Confident	86.3	Confident	29 Å²	29	17 Å²	17	24%	0.24	9%	0.093	C	C	.	.	H	α-helix	trans	-64.5	-30.7	176.1	0	0	0	0	0	112.6	L187 S188 I207	L187-A190 WeakPolarHBondContact O-CB 3.22Å; L187-A190 PolarHBondContact O-N 3.08Å; S188-A190 PolarHBondContact O-N 3Å; A190-I207 HydrophobicContact CB-CG2 3.97Å
191	S	84	Confident	86.3	Confident	49 Å²	49	20.1 Å²	20.1	34%	0.343	11%	0.112	S	C	.	.	H	α-helix	trans	-79.7	-17.2	177.8	72.4	0	0	0	0	114	S188 L189 Q193	S188-S191 PolarHBondContact O-N 3.43Å; S188-S191 PolarHBondContact O-OG 2.92Å; L189-S191 VanDerWaalsContact C-N 3.25Å; L189-S191 PolarHBondContact O-N 3.26Å; S191-Q193 PolarHBondContact O-N 3.46Å
192	C	87	Confident	86.1	Confident	3 Å²	3	21 Å²	21	2%	0.02	12%	0.117	C	C	.	.			trans	-79.6	114.1	-177.3	-174.6	0	0	0	0	111	S188 L189 A194 C195 W480	S188-C192 PolarHBondContact O-N 3.19Å; L189-C192 PolarHBondContact O-N 3.48Å; C192-A194 PolarHBondContact O-N 3.01Å; C192-C195 HydrophobicContact CB-CB 3.66Å; C192-C195 PolarHBondContact O-N 3.32Å; C192-W480 HydrophobicContact CB-CB 4.13Å; C192-W480 HydrophobicContact CB-CD2 4.28Å; C192-W480 HydrophobicContact CB-CG 3.74Å
193	Q	84.6	Confident	86.2	Confident	128 Å²	128	22.3 Å²	22.3	60%	0.598	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.1	-177.1	-63.8	-179.6	1.8	0	0	113.4	S191	S191-Q193 PolarHBondContact O-N 3.46Å
194	A	89.1	Confident	86.3	Confident	10 Å²	10	22.6 Å²	22.6	8%	0.083	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	19.4	-179	0	0	0	0	0	113.3	M25 C192 P476 V477	M25-A194 PolarHBondContact N-O 3.42Å; C192-A194 PolarHBondContact O-N 3.01Å; A194-P476 HydrophobicContact CB-CB 4.06Å; A194-P476 HydrophobicContact CB-CG 4.41Å; A194-V477 HydrophobicContact CB-CG2 3.87Å
195	C	90.6	Very high	86	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.007	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	134.3	179.5	-170	0	0	0	0	112.4	M25 C192 S208	M25-C195 HydrophobicContact CB-CB 4.32Å; M25-C195 WeakPolarHBondContact O-CA 3.38Å; C192-C195 HydrophobicContact CB-CB 3.66Å; C192-C195 PolarHBondContact O-N 3.32Å; C195-S208 PolarHBondContact O-OG 3.4Å
196	C	90.1	Very high	85.2	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126.5	175.5	175.7	0	0	0	0	110.4	L13 M25 F26 V27 L198 M211	L13-C196 HydrophobicContact CD2-CB 3.85Å; M25-C196 PolarHBondContact O-N 3.1Å; F26-C196 CarbonylContact C-O 3.36Å; F26-C196 WeakPolarHBondContact CA-O 3.46Å; F26-C196 HydrophobicContact CD1-CB 3.6Å; F26-C196 HydrophobicContact CE1-CB 3.55Å; F26-C196 HydrophobicContact CZ-CB 4.47Å; V27-C196 PolarHBondContact N-O 3.18Å; C196-L198 WeakPolarHBondContact SG-CD2 3.49Å; C196-M211 HydrophobicContact CB-CE 3.76Å; C196-M211 HydrophobicContact CB-SD 3.42Å; C196-M211 WeakPolarHBondContact CB-SD 3.48Å; C196-M211 WeakPolarHBondContact SG-CE 3.31Å; C196-M211 PolarHBondContact SG-SD 3.49Å
197	V	88.2	Confident	84.5	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.012	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.4	174.5	-162.3	0	0	0	0	108.9	V27 V29 L205 I207	V27-V197 HydrophobicContact CB-CG1 4.15Å; V27-V197 HydrophobicContact CB-CG2 4.44Å; V27-V197 HydrophobicContact CG1-CG1 4.27Å; V27-V197 CarbonylContact O-C 3.59Å; V27-V197 WeakPolarHBondContact O-CA 3.36Å; V29-V197 HydrophobicContact CG2-CG1 4.07Å; V197-L205 HydrophobicContact CB-CB 4.33Å; V197-L205 HydrophobicContact CB-CD1 4.35Å; V197-L205 HydrophobicContact CG1-CD1 3.7Å; V197-L205 PolarHBondContact O-N 3.15Å; V197-I207 HydrophobicContact CB-CD1 4.24Å; V197-I207 HydrophobicContact CG1-CD1 4.13Å; V197-I207 HydrophobicContact CG2-CD1 4.36Å
198	L	88.6	Confident	83.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	147.7	-172.8	-62.4	173.7	0	0	0	110.8	I10 F26 V27 I28 V29 C196 L202 N203 I204	I10-L198 HydrophobicContact CD1-CD1 4.24Å; I10-L198 HydrophobicContact CD1-CD2 3.67Å; I10-L198 HydrophobicContact CG1-CD2 4.14Å; F26-L198 HydrophobicContact CD1-CD1 3.55Å; F26-L198 HydrophobicContact CD1-CG 4.22Å; F26-L198 HydrophobicContact CE1-CD1 4.13Å; F26-L198 HydrophobicContact CG-CD1 4.45Å; V27-L198 PolarHBondContact O-N 3.23Å; I28-L198 WeakPolarHBondContact CA-O 3.38Å; I28-L198 HydrophobicContact CG1-CB 4.49Å; I28-L198 HydrophobicContact CG1-CD1 4.49Å; V29-L198 PolarHBondContact N-O 3.44Å; C196-L198 WeakPolarHBondContact SG-CD2 3.49Å; L198-L202 HydrophobicContact CD1-CD2 3.84Å; L198-N203 WeakPolarHBondContact CA-O 3.38Å; L198-I204 HydrophobicContact CD2-CG1 3.75Å
199	D	86.4	Confident	82.5	Confident	15 Å²	15	30.1 Å²	30.1	8%	0.08	18%	0.176	C	C	.	.			trans	-88.6	-178.8	167.8	71.9	7.8	0	0	0	112.7	V29 D201 L202 N203	V29-D199 CarbonylContact O-C 3.55Å; D199-D201 PolarHBondContact O-N 2.96Å; D199-D201 VanDerWaalsContact O-N 3.14Å; D199-D201 VanDerWaalsContact OD1-C 3.29Å; D199-D201 WeakPolarHBondContact OD1-CA 3.28Å; D199-D201 PolarHBondContact OD1-N 3.23Å; D199-L202 PolarHBondContact O-N 3.36Å; D199-L202 VanDerWaalsContact O-N 3.11Å; D199-L202 PolarHBondContact OD1-N 3.31Å; D199-N203 PolarHBondContact N-O 2.9Å; D199-N203 VanDerWaalsContact N-O 3.09Å; D199-N203 WeakPolarHBondContact OD1-CB 3.23Å; D199-N203 PolarHBondContact OD1-N 3.02Å; D199-N203 PolarHBondContact OD1-ND2 2.87Å; D199-N203 WeakPolarHBondContact OD2-CB 3.24Å; D199-N203 PolarHBondContact OD2-ND2 2.94Å
200	D	83.7	Confident	81.9	Confident	40 Å²	40	33.9 Å²	33.9	21%	0.214	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-6.5	176	-99.4	-9.5	0	0	0	114.9	V29 G30 D31 K32 G33 H36	V29-D200 PolarHBondContact O-N 2.89Å; G30-D200 WeakPolarHBondContact CA-OD1 3.25Å; G30-D200 WeakPolarHBondContact CA-OD2 3.46Å; D31-D200 VanDerWaalsContact N-CG 3.33Å; D31-D200 PolarHBondContact N-OD1 2.91Å; D31-D200 PolarHBondContact N-OD2 2.95Å; K32-D200 PolarHBondContact N-OD1 3.45Å; K32-D200 PolarHBondContact N-OD2 3.44Å; G33-D200 PolarHBondContact N-OD1 3.33Å; H36-D200 PolarHBondContact CE1-O 3.1Å; H36-D200 PolarHBondContact NE2-O 2.97Å
201	D	83.6	Confident	81.3	Confident	99 Å²	99	32.6 Å²	32.6	53%	0.529	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	11.9	176.2	-77.1	-29.6	0	0	0	111.8	D199 N203	D199-D201 PolarHBondContact O-N 2.96Å; D199-D201 VanDerWaalsContact O-N 3.14Å; D199-D201 VanDerWaalsContact OD1-C 3.29Å; D199-D201 WeakPolarHBondContact OD1-CA 3.28Å; D199-D201 PolarHBondContact OD1-N 3.23Å; D201-N203 WeakPolarHBondContact CB-ND2 3.4Å; D201-N203 PolarHBondContact O-N 2.86Å
202	L	84.9	Confident	80.6	Confident	19 Å²	19	35.5 Å²	35.5	10%	0.099	20%	0.195	C	C	.	.			trans	60.9	26.5	-175.4	-63.6	169.4	0	0	0	114.3	L6 I10 H36 V39 L198 D199	L6-L202 HydrophobicContact CD1-CB 3.95Å; L6-L202 HydrophobicContact CD1-CD1 3.62Å; L6-L202 HydrophobicContact CD1-CG 4.37Å; I10-L202 HydrophobicContact CD1-CB 4.47Å; H36-L202 HydrophobicContact CB-CD2 3.89Å; H36-L202 HydrophobicContact CB-CG 4.45Å; H36-L202 WeakPolarHBondContact ND1-CG 3.43Å; V39-L202 HydrophobicContact CG1-CD1 4.21Å; L198-L202 HydrophobicContact CD1-CD2 3.84Å; D199-L202 PolarHBondContact O-N 3.36Å; D199-L202 VanDerWaalsContact O-N 3.11Å; D199-L202 PolarHBondContact OD1-N 3.31Å
203	N	85.5	Confident	79.9	Confident	37 Å²	37	41.9 Å²	41.9	20%	0.198	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-80.7	142.3	168.8	-45.1	-54.7	0	0	0	109.4	K4 L198 D199 D201 L681	K4-N203 PolarHBondContact NZ-ND2 3.36Å; K4-N203 PolarHBondContact NZ-OD1 3.39Å; L198-N203 WeakPolarHBondContact CA-O 3.38Å; D199-N203 PolarHBondContact N-O 2.9Å; D199-N203 VanDerWaalsContact N-O 3.09Å; D199-N203 WeakPolarHBondContact OD1-CB 3.23Å; D199-N203 PolarHBondContact OD1-N 3.02Å; D199-N203 PolarHBondContact OD1-ND2 2.87Å; D199-N203 WeakPolarHBondContact OD2-CB 3.24Å; D199-N203 PolarHBondContact OD2-ND2 2.94Å; D201-N203 WeakPolarHBondContact CB-ND2 3.4Å; D201-N203 PolarHBondContact O-N 2.86Å; N203-L681 HydrophobicContact CB-CD2 4.26Å
204	I	84.7	Confident	79.6	Confident	17 Å²	17	38.1 Å²	38.1	9%	0.087	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-80.9	124.6	178.9	-64.7	167.6	0	0	0	109.1	D7 R9 I10 L198 M211	D7-I204 HydrophobicContact CB-CD1 4.08Å; R9-I204 HydrophobicContact CB-CD1 3.64Å; R9-I204 HydrophobicContact CG-CD1 4.44Å; I10-I204 HydrophobicContact CG1-CD1 4.12Å; I10-I204 HydrophobicContact CG1-CG1 4.29Å; L198-I204 HydrophobicContact CD2-CG1 3.75Å; I204-M211 HydrophobicContact CD1-CE 3.74Å; I204-M211 HydrophobicContact CD1-SD 4.41Å; I204-M211 HydrophobicContact CG1-CE 4.39Å; I204-M211 HydrophobicContact CG2-CB 4.41Å; I204-M211 HydrophobicContact CG2-CE 4.35Å; I204-M211 HydrophobicContact CG2-SD 3.62Å
205	L	80.5	Confident	79	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-78.8	141.3	176	-65.5	166.1	0	0	0	110.4	V29 L155 V197 I207 L680 L681	V29-L205 HydrophobicContact CG2-CD1 4.27Å; L155-L205 HydrophobicContact CD1-CD1 4.28Å; V197-L205 HydrophobicContact CB-CB 4.33Å; V197-L205 HydrophobicContact CB-CD1 4.35Å; V197-L205 HydrophobicContact CG1-CD1 3.7Å; V197-L205 PolarHBondContact O-N 3.15Å; L205-I207 HydrophobicContact CB-CD1 3.89Å; L205-I207 HydrophobicContact CB-CG1 4.29Å; L205-I207 HydrophobicContact CD1-CD1 4.41Å; L205-I207 PolarHBondContact O-N 3.11Å; L205-L680 HydrophobicContact CD2-CB 3.78Å; L205-L680 VanDerWaalsContact CD2-O 3.29Å; L205-L680 WeakPolarHBondContact CD2-O 3.43Å; L205-L681 HydrophobicContact CD2-CD2 4.05Å; L205-L681 HydrophobicContact CD2-CG 4.5Å
206	P	71.3	Confident	78.4	Confident	77 Å²	77	49.1 Å²	49.1	50%	0.5	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	32.1	-171.8	33.4	-37.5	0	0	0	114.6	L681	P206-L681 VanDerWaalsContact CG-O 3.3Å; P206-L681 WeakPolarHBondContact CG-O 3.36Å
207	I	69.9	Low	77.7	Confident	25 Å²	25	50.7 Å²	50.7	13%	0.128	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-41.5	-175.2	-58.1	159.3	0	0	0	110.4	L155 A190 V197 L205 S209 I685	L155-I207 HydrophobicContact CD1-CD1 3.21Å; L155-I207 HydrophobicContact CD1-CG1 4.48Å; A190-I207 HydrophobicContact CB-CG2 3.97Å; V197-I207 HydrophobicContact CB-CD1 4.24Å; V197-I207 HydrophobicContact CG1-CD1 4.13Å; V197-I207 HydrophobicContact CG2-CD1 4.36Å; L205-I207 HydrophobicContact CB-CD1 3.89Å; L205-I207 HydrophobicContact CB-CG1 4.29Å; L205-I207 HydrophobicContact CD1-CD1 4.41Å; L205-I207 PolarHBondContact O-N 3.11Å; I207-S209 PolarHBondContact O-N 2.96Å; I207-I685 HydrophobicContact CD1-CD1 3.69Å; I207-I685 HydrophobicContact CG1-CD1 3.84Å; I207-I685 HydrophobicContact CG2-CD1 3.93Å
208	S	66	Low	76.8	Confident	3 Å²	3	53.9 Å²	53.9	2%	0.021	30%	0.299	C	S	.	.			trans	-92.6	92.9	176.8	23.9	0	0	0	0	110.3	C195 H210 M211	C195-S208 PolarHBondContact O-OG 3.4Å; S208-H210 PolarHBondContact O-N 3.2Å; S208-H210 VanDerWaalsContact O-N 3.1Å; S208-M211 WeakPolarHBondContact O-CB 3.35Å; S208-M211 PolarHBondContact O-N 3.13Å
209	S	65.6	Low	75.4	Confident	77 Å²	77	58.3 Å²	58.3	54%	0.538	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-54.2	-30	179	57.2	0	0	0	0	113.3	I207 M211 N212	I207-S209 PolarHBondContact O-N 2.96Å; S209-M211 PolarHBondContact O-N 3.23Å; S209-N212 PolarHBondContact O-N 2.95Å
210	H	73.5	Confident	73.7	Confident	80 Å²	80	65.8 Å²	65.8	37%	0.37	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-58.9	-29.9	175.8	-60.1	-66.5	0	0	0	113.5	S208 N212 N213	S208-H210 PolarHBondContact O-N 3.2Å; S208-H210 VanDerWaalsContact O-N 3.1Å; H210-N212 PolarHBondContact O-N 2.86Å; H210-N213 PolarHBondContact O-N 2.88Å; H210-N213 VanDerWaalsContact O-N 3.12Å
211	M	70.4	Confident	72.3	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.015	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-66.8	-20.4	-179.2	-69.3	-149	74.9	0	0	113.7	R9 C196 I204 S208 S209 N213 L214	R9-M211 HydrophobicContact CB-CE 4.16Å; R9-M211 WeakPolarHBondContact CD-O 3.05Å; C196-M211 HydrophobicContact CB-CE 3.76Å; C196-M211 HydrophobicContact CB-SD 3.42Å; C196-M211 WeakPolarHBondContact CB-SD 3.48Å; C196-M211 WeakPolarHBondContact SG-CE 3.31Å; C196-M211 PolarHBondContact SG-SD 3.49Å; I204-M211 HydrophobicContact CD1-CE 3.74Å; I204-M211 HydrophobicContact CD1-SD 4.41Å; I204-M211 HydrophobicContact CG1-CE 4.39Å; I204-M211 HydrophobicContact CG2-CB 4.41Å; I204-M211 HydrophobicContact CG2-CE 4.35Å; I204-M211 HydrophobicContact CG2-SD 3.62Å; S208-M211 WeakPolarHBondContact O-CB 3.35Å; S208-M211 PolarHBondContact O-N 3.13Å; S209-M211 PolarHBondContact O-N 3.23Å; M211-N213 VanDerWaalsContact C-N 3.28Å; M211-N213 PolarHBondContact O-N 2.89Å; M211-L214 HydrophobicContact CE-CD1 4.03Å; M211-L214 HydrophobicContact CG-CD1 4.43Å
212	N	69.4	Low	70.8	Confident	110 Å²	110	70.8 Å²	70.8	59%	0.588	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-73.7	-23.1	176.9	-66.7	-19.6	0	0	0	112.3	R9 S209 H210	R9-N212 PolarHBondContact NH1-OD1 3.31Å; S209-N212 PolarHBondContact O-N 2.95Å; H210-N212 PolarHBondContact O-N 2.86Å
213	N	71.7	Confident	68.9	Low	137 Å²	137	77.2 Å²	77.2	73%	0.733	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-109.9	11.8	-175.8	-70.4	-17.4	0	0	0	113.8	H210 M211 K215	H210-N213 PolarHBondContact O-N 2.88Å; H210-N213 VanDerWaalsContact O-N 3.12Å; M211-N213 VanDerWaalsContact C-N 3.28Å; M211-N213 PolarHBondContact O-N 2.89Å; N213-K215 PolarHBondContact O-N 3.31Å; N213-K215 VanDerWaalsContact O-N 3.08Å
214	L	77.4	Confident	67.2	Low	48 Å²	48	83.1 Å²	83.1	25%	0.251	43%	0.432	S	S	.	.			trans	-64.8	109.8	-177.2	-110.2	164.5	0	0	0	111.1	L13 M211	L13-L214 HydrophobicContact CB-CD1 4.37Å; L13-L214 HydrophobicContact CD1-CD1 4.19Å; M211-L214 HydrophobicContact CE-CD1 4.03Å; M211-L214 HydrophobicContact CG-CD1 4.43Å
215	K	77.4	Confident	65.6	Low	179 Å²	179	86.1 Å²	86.1	78%	0.778	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-99.8	147.9	170.7	-66.6	-177.3	-178.3	178.4	0	109.9	N16 N213	N16-K215 PolarHBondContact ND2-O 3.37Å; N213-K215 PolarHBondContact O-N 3.31Å; N213-K215 VanDerWaalsContact O-N 3.08Å
216	A	78.7	Confident	64.6	Low	63 Å²	63	88.4 Å²	88.4	52%	0.521	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-70	135.5	173.6	0	0	0	0	0	110	V12 T218	V12-A216 HydrophobicContact CG1-CB 4.14Å; A216-T218 PolarHBondContact O-N 3.39Å
217	V	75	Confident	64.4	Low	34 Å²	34	89 Å²	89	21%	0.206	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-61.8	130.3	177.5	173.7	0	0	0	0	109.7	N16 E221 K222	N16-V217 HydrophobicContact CB-CG2 4.1Å; N16-V217 WeakPolarHBondContact OD1-CG2 3.45Å; N16-V217 PolarHBondContact OD1-N 3.2Å; V217-E221 HydrophobicContact CG1-CB 3.86Å; V217-K222 HydrophobicContact CG1-CG 4.47Å
218	T	68.1	Low	64.3	Low	69 Å²	69	90.9 Å²	90.9	42%	0.423	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-74.9	148.4	-176.9	60.9	0	0	0	0	110.9	A216 K220 E221 K222	A216-T218 PolarHBondContact O-N 3.39Å; T218-K220 PolarHBondContact O-N 2.99Å; T218-K220 VanDerWaalsContact O-N 3.14Å; T218-E221 PolarHBondContact N-OE2 3.42Å; T218-E221 PolarHBondContact O-N 2.96Å; T218-E221 PolarHBondContact OG1-OE2 3.02Å; T218-K222 PolarHBondContact O-N 3.39Å
219	P	59.3	Low	64.6	Low	92 Å²	92	94.3 Å²	94.3	60%	0.597	50%	0.502	S	S	*	.	H	α-helix	trans	-60.1	-24.4	179.4	19.9	-29.3	0	0	0	113.8	E221 K222 E223	P219-E221 VanDerWaalsContact C-N 3.34Å; P219-E221 PolarHBondContact O-N 3.23Å; P219-K222 VanDerWaalsContact O-CB 3.29Å; P219-K222 WeakPolarHBondContact O-CB 3.4Å; P219-K222 PolarHBondContact O-N 3.03Å; P219-K222 VanDerWaalsContact O-N 3.1Å; P219-E223 PolarHBondContact O-N 3.41Å
220	K	52.2	Low	65.1	Low	173 Å²	173	95 Å²	95	75%	0.752	50%	0.499	S	S	*	.	H	α-helix	trans	-67.7	-31.3	174.7	-70.6	-174	176.3	-176.4	0	113.4	T218 K222 E223 Q224	T218-K220 PolarHBondContact O-N 2.99Å; T218-K220 VanDerWaalsContact O-N 3.14Å; K220-K222 VanDerWaalsContact C-N 3.27Å; K220-E223 PolarHBondContact O-N 3.02Å; K220-Q224 PolarHBondContact O-N 3.49Å
221	E	53.6	Low	65.3	Low	112 Å²	112	92.6 Å²	92.6	52%	0.523	49%	0.493	S	S	.	.	H	α-helix	trans	-74.2	-21.9	172.2	-68.5	162.2	145.7	0	0	111.5	V217 T218 P219 E223	V217-E221 HydrophobicContact CG1-CB 3.86Å; T218-E221 PolarHBondContact N-OE2 3.42Å; T218-E221 PolarHBondContact O-N 2.96Å; T218-E221 PolarHBondContact OG1-OE2 3.02Å; P219-E221 VanDerWaalsContact C-N 3.34Å; P219-E221 PolarHBondContact O-N 3.23Å; E221-E223 VanDerWaalsContact C-N 3.34Å
222	K	51.5	Low	65.8	Low	131 Å²	131	93.6 Å²	93.6	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-75	-23.8	173.9	-55.9	-178.4	-176.8	180	0	113	A19 V217 T218 P219 K220	A19-K222 HydrophobicContact CB-CD 4.45Å; A19-K222 HydrophobicContact CB-CG 4.44Å; V217-K222 HydrophobicContact CG1-CG 4.47Å; T218-K222 PolarHBondContact O-N 3.39Å; P219-K222 VanDerWaalsContact O-CB 3.29Å; P219-K222 WeakPolarHBondContact O-CB 3.4Å; P219-K222 PolarHBondContact O-N 3.03Å; P219-K222 VanDerWaalsContact O-N 3.1Å; K220-K222 VanDerWaalsContact C-N 3.27Å
223	E	45.2	Very low	66.3	Low	154 Å²	154	94.3 Å²	94.3	72%	0.72	50%	0.495	S	S	*	.	S	Bend	trans	-99.8	-2.4	-177.7	-77.4	-177	173.1	0	0	114.2	P219 K220 E221 V225	P219-E223 PolarHBondContact O-N 3.41Å; K220-E223 PolarHBondContact O-N 3.02Å; E221-E223 VanDerWaalsContact C-N 3.34Å; E223-V225 PolarHBondContact O-N 2.87Å
224	Q	48.8	Very low	66.9	Low	161 Å²	161	94 Å²	94	75%	0.752	49%	0.489	S	S	*	.			trans	-67	79.4	159.4	-77.1	-172.3	-9	0	0	107.5	K220 S226	K220-Q224 PolarHBondContact O-N 3.49Å; Q224-S226 PolarHBondContact O-N 3.35Å
225	V	52.2	Low	67.1	Low	81 Å²	81	93 Å²	93	49%	0.491	48%	0.484	S	S	.	.			trans	-45.6	118.5	164	178	0	0	0	0	104.8	E223 S227 D229 L230	E223-V225 PolarHBondContact O-N 2.87Å; V225-S227 PolarHBondContact O-N 3.36Å; V225-D229 HydrophobicContact CG1-CB 3.88Å; V225-L230 HydrophobicContact CG1-CD1 4.47Å; V225-L230 HydrophobicContact CG1-CD2 4.44Å; V225-L230 HydrophobicContact CG1-CG 3.95Å
226	S	60	Low	67.3	Low	48 Å²	48	85.5 Å²	85.5	34%	0.336	45%	0.452	S	S	.	.			trans	-52.5	133.8	-175.6	74.6	0	0	0	0	107.7	Q224 N228 D229 L230	Q224-S226 PolarHBondContact O-N 3.35Å; S226-N228 PolarHBondContact O-N 3.42Å; S226-D229 PolarHBondContact O-N 3.2Å; S226-D229 PolarHBondContact OG-N 3.01Å; S226-D229 PolarHBondContact OG-OD2 2.72Å; S226-L230 PolarHBondContact O-N 3.26Å
227	S	67.3	Low	67.5	Low	90 Å²	90	88.5 Å²	88.5	63%	0.629	46%	0.455	S	S	*	.	H	α-helix	trans	-48.4	-28.9	177.5	49.1	0	0	0	0	111.9	V225 A231	V225-S227 PolarHBondContact O-N 3.36Å; S227-A231 WeakPolarHBondContact O-CB 3.48Å; S227-A231 PolarHBondContact O-N 3.07Å
228	N	66.7	Low	67.8	Low	64 Å²	64	90.8 Å²	90.8	34%	0.342	47%	0.473	S	S	.	.	H	α-helix	trans	-68.3	-39	178.2	-60.8	-2.7	0	0	0	113	S226 A231 F232	S226-N228 PolarHBondContact O-N 3.42Å; N228-A231 PolarHBondContact O-N 3.44Å; N228-F232 WeakPolarHBondContact O-CB 3.37Å; N228-F232 PolarHBondContact O-N 3.02Å
229	D	72.2	Confident	68.3	Low	74 Å²	74	89.1 Å²	89.1	40%	0.396	46%	0.461	S	S	.	.	H	α-helix	trans	-68.7	-36.3	178.1	-68.4	-44.2	0	0	0	111.9	V225 S226 K233	V225-D229 HydrophobicContact CG1-CB 3.88Å; S226-D229 PolarHBondContact O-N 3.2Å; S226-D229 PolarHBondContact OG-N 3.01Å; S226-D229 PolarHBondContact OG-OD2 2.72Å; D229-K233 WeakPolarHBondContact O-CG 3.43Å; D229-K233 PolarHBondContact O-N 3.44Å; D229-K233 VanDerWaalsContact O-N 3.14Å
230	L	76.4	Confident	68.7	Low	91 Å²	91	87.9 Å²	87.9	48%	0.476	46%	0.455	S	S	.	.	H	α-helix	trans	-67.1	-47.5	173.6	-73.4	169.4	0	0	0	111	V225 S226 F232 K233 Q234	V225-L230 HydrophobicContact CG1-CD1 4.47Å; V225-L230 HydrophobicContact CG1-CD2 4.44Å; V225-L230 HydrophobicContact CG1-CG 3.95Å; S226-L230 PolarHBondContact O-N 3.26Å; L230-F232 VanDerWaalsContact C-N 3.27Å; L230-F232 PolarHBondContact O-N 2.7Å; L230-K233 PolarHBondContact O-N 2.88Å; L230-Q234 WeakPolarHBondContact O-CG 3.47Å; L230-Q234 PolarHBondContact O-N 3Å
231	A	78.1	Confident	69.7	Low	30 Å²	30	86.6 Å²	86.6	25%	0.248	46%	0.456	C	S	.	.	H	α-helix	trans	-60.9	-36.1	175.8	0	0	0	0	0	112.3	S227 N228 Q234 L235 L255	S227-A231 WeakPolarHBondContact O-CB 3.48Å; S227-A231 PolarHBondContact O-N 3.07Å; N228-A231 PolarHBondContact O-N 3.44Å; A231-Q234 PolarHBondContact O-N 2.73Å; A231-L235 WeakPolarHBondContact O-CB 3.35Å; A231-L235 PolarHBondContact O-N 2.71Å; A231-L255 HydrophobicContact CB-CD2 3.88Å
232	F	79.8	Confident	71	Confident	25 Å²	25	83.7 Å²	83.7	11%	0.11	45%	0.448	C	S	.	.	H	α-helix	trans	-64.3	-43.1	175.4	179.7	-117.8	0	0	0	112.2	N228 L230 L235 L236 C252 L255 A258	N228-F232 WeakPolarHBondContact O-CB 3.37Å; N228-F232 PolarHBondContact O-N 3.02Å; L230-F232 VanDerWaalsContact C-N 3.27Å; L230-F232 PolarHBondContact O-N 2.7Å; F232-L235 PolarHBondContact O-N 2.9Å; F232-L236 HydrophobicContact CD1-CD1 4.11Å; F232-L236 HydrophobicContact CE1-CD1 3.64Å; F232-L236 HydrophobicContact CE1-CG 4.45Å; F232-L236 HydrophobicContact CE2-CD1 4.25Å; F232-L236 HydrophobicContact CE2-CD2 4.41Å; F232-L236 HydrophobicContact CE2-CG 4.22Å; F232-L236 HydrophobicContact CZ-CD1 3.73Å; F232-L236 HydrophobicContact CZ-CD2 4.37Å; F232-L236 HydrophobicContact CZ-CG 4.17Å; F232-L236 WeakPolarHBondContact O-CG 3.38Å; F232-L236 PolarHBondContact O-N 2.65Å; F232-C252 HydrophobicContact CE2-CB 4.49Å; F232-C252 HydrophobicContact CZ-CB 4.47Å; F232-C252 WeakPolarHBondContact CZ-O 3.5Å; F232-L255 HydrophobicContact CB-CB 4.29Å; F232-L255 HydrophobicContact CB-CD1 4.2Å; F232-L255 HydrophobicContact CD2-CD1 4.38Å; F232-A258 HydrophobicContact CD2-CB 3.98Å; F232-A258 HydrophobicContact CE2-CB 3.55Å
233	K	80.2	Confident	72.3	Confident	124 Å²	124	82 Å²	82	54%	0.539	45%	0.45	S	S	.	.	H	α-helix	trans	-62.8	-43.1	174.1	-71.9	176	-177.9	176.8	0	111.9	D229 L230 L235 L236 E237	D229-K233 WeakPolarHBondContact O-CG 3.43Å; D229-K233 PolarHBondContact O-N 3.44Å; D229-K233 VanDerWaalsContact O-N 3.14Å; L230-K233 PolarHBondContact O-N 2.88Å; K233-L235 VanDerWaalsContact C-N 3.34Å; K233-L235 PolarHBondContact O-N 3.26Å; K233-L236 PolarHBondContact O-N 3.01Å; K233-E237 WeakPolarHBondContact O-CG 3.46Å; K233-E237 PolarHBondContact O-N 3.36Å
234	Q	84.2	Confident	73.9	Confident	131 Å²	131	80.7 Å²	80.7	61%	0.612	45%	0.445	S	S	*	.	H	α-helix	trans	-60.3	-42	175.8	-71.6	174.3	-12.8	0	0	112.1	L230 A231 E237 S238	L230-Q234 WeakPolarHBondContact O-CG 3.47Å; L230-Q234 PolarHBondContact O-N 3Å; A231-Q234 PolarHBondContact O-N 2.73Å; Q234-E237 PolarHBondContact O-N 2.98Å; Q234-S238 PolarHBondContact O-N 3.29Å
235	L	81.6	Confident	75.5	Confident	27 Å²	27	75.1 Å²	75.1	14%	0.141	42%	0.42	C	S	.	.	H	α-helix	trans	-63	-43.2	175.9	-174.5	143.1	0	0	0	111.6	A231 F232 K233 E237 S238 L239 L249 L255 N259	A231-L235 WeakPolarHBondContact O-CB 3.35Å; A231-L235 PolarHBondContact O-N 2.71Å; F232-L235 PolarHBondContact O-N 2.9Å; K233-L235 VanDerWaalsContact C-N 3.34Å; K233-L235 PolarHBondContact O-N 3.26Å; L235-E237 VanDerWaalsContact C-N 3.28Å; L235-E237 PolarHBondContact O-N 3.44Å; L235-S238 PolarHBondContact O-N 3.23Å; L235-S238 PolarHBondContact O-OG 2.84Å; L235-L239 HydrophobicContact CD2-CD1 3.89Å; L235-L239 PolarHBondContact O-N 2.62Å; L235-L249 HydrophobicContact CD2-CD1 4.23Å; L235-L255 HydrophobicContact CB-CD1 4.37Å; L235-L255 HydrophobicContact CD1-CD1 4.1Å; L235-N259 WeakPolarHBondContact CD1-OD1 3.46Å
236	L	81.9	Confident	77	Confident	21 Å²	21	76.3 Å²	76.3	11%	0.11	42%	0.416	C	S	.	.	H	α-helix	trans	-64.5	-31.4	175.4	-70.3	175.4	0	0	0	113.2	F232 K233 R246 L249	F232-L236 HydrophobicContact CD1-CD1 4.11Å; F232-L236 HydrophobicContact CE1-CD1 3.64Å; F232-L236 HydrophobicContact CE1-CG 4.45Å; F232-L236 HydrophobicContact CE2-CD1 4.25Å; F232-L236 HydrophobicContact CE2-CD2 4.41Å; F232-L236 HydrophobicContact CE2-CG 4.22Å; F232-L236 HydrophobicContact CZ-CD1 3.73Å; F232-L236 HydrophobicContact CZ-CD2 4.37Å; F232-L236 HydrophobicContact CZ-CG 4.17Å; F232-L236 WeakPolarHBondContact O-CG 3.38Å; F232-L236 PolarHBondContact O-N 2.65Å; K233-L236 PolarHBondContact O-N 3.01Å; L236-R246 PolarHBondContact O-NE 2.87Å; L236-L249 HydrophobicContact CD2-CB 3.71Å
237	E	82.2	Confident	78.3	Confident	126 Å²	126	75.6 Å²	75.6	59%	0.589	41%	0.411	S	S	*	.	H	α-helix	trans	-72.5	-40.5	174.8	-75.9	171.6	-170.4	0	0	111.7	K233 Q234 L235 L239 S240	K233-E237 WeakPolarHBondContact O-CG 3.46Å; K233-E237 PolarHBondContact O-N 3.36Å; Q234-E237 PolarHBondContact O-N 2.98Å; L235-E237 VanDerWaalsContact C-N 3.28Å; L235-E237 PolarHBondContact O-N 3.44Å; E237-L239 PolarHBondContact O-N 3.42Å; E237-S240 PolarHBondContact O-N 2.96Å
238	S	83.2	Confident	79.3	Confident	82 Å²	82	71.4 Å²	71.4	57%	0.573	38%	0.381	S	S	*	.	H	α-helix	trans	-62.8	-21.7	178.1	73	0	0	0	0	114.2	Q234 L235	Q234-S238 PolarHBondContact O-N 3.29Å; L235-S238 PolarHBondContact O-N 3.23Å; L235-S238 PolarHBondContact O-OG 2.84Å
239	L	76.8	Confident	80.3	Confident	34 Å²	34	68.4 Å²	68.4	18%	0.178	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	27.2	-178.8	-64.9	170.8	0	0	0	112.6	L235 E237 D241 S242 L249 L262	L235-L239 HydrophobicContact CD2-CD1 3.89Å; L235-L239 PolarHBondContact O-N 2.62Å; E237-L239 PolarHBondContact O-N 3.42Å; L239-D241 PolarHBondContact O-N 2.75Å; L239-S242 PolarHBondContact O-N 3.26Å; L239-L249 HydrophobicContact CD1-CD1 3.24Å; L239-L262 HydrophobicContact CD1-CD1 4.23Å; L239-L262 HydrophobicContact CD1-CD2 4.48Å
240	S	69.1	Low	81	Confident	67 Å²	67	72.6 Å²	72.6	47%	0.469	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-31.7	175.8	49.3	0	0	0	0	113.3	E237 S242	E237-S240 PolarHBondContact O-N 2.96Å; S240-S242 VanDerWaalsContact C-N 3.27Å; S240-S242 PolarHBondContact O-N 3.13Å
241	D	73.4	Confident	81.6	Confident	145 Å²	145	71.2 Å²	71.2	78%	0.775	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-15.3	-171	-58.2	-12.5	0	0	0	113.2	L239	L239-D241 PolarHBondContact O-N 2.75Å
242	S	80.1	Confident	82	Confident	51 Å²	51	70.1 Å²	70.1	36%	0.357	36%	0.363	S	S	.	.			trans	-126.1	85.7	-180	-71.8	0	0	0	0	111	L239 S240 Q244 L245 R246	L239-S242 PolarHBondContact O-N 3.26Å; S240-S242 VanDerWaalsContact C-N 3.27Å; S240-S242 PolarHBondContact O-N 3.13Å; S242-Q244 VanDerWaalsContact C-N 3.27Å; S242-Q244 PolarHBondContact O-N 3.42Å; S242-L245 PolarHBondContact O-N 3.4Å; S242-R246 PolarHBondContact O-N 3.39Å
243	P	79.2	Confident	82.2	Confident	95 Å²	95	75.9 Å²	75.9	62%	0.617	39%	0.388	S	S	*	.	H	α-helix	trans	-62.6	-31.8	-172.4	23.5	-33.5	0	0	0	113.2	R246 S247	P243-R246 PolarHBondContact O-N 2.95Å; P243-S247 WeakPolarHBondContact O-CB 3.41Å; P243-S247 PolarHBondContact O-N 2.83Å
244	Q	79.4	Confident	82.5	Confident	128 Å²	128	70.6 Å²	70.6	60%	0.598	37%	0.366	S	S	*	.	H	α-helix	trans	-65.5	-48.1	176.5	-67.5	177.4	-5	0	0	111.5	S242 R246 S247 L248 L330	S242-Q244 VanDerWaalsContact C-N 3.27Å; S242-Q244 PolarHBondContact O-N 3.42Å; Q244-R246 VanDerWaalsContact C-N 3.34Å; Q244-R246 PolarHBondContact O-N 3.25Å; Q244-S247 PolarHBondContact O-N 2.89Å; Q244-S247 PolarHBondContact O-OG 2.67Å; Q244-L248 PolarHBondContact O-N 3.37Å; Q244-L330 HydrophobicContact CB-CD2 3.8Å; Q244-L330 HydrophobicContact CG-CD2 4.13Å
245	L	81.6	Confident	82.6	Confident	44 Å²	44	66.1 Å²	66.1	23%	0.23	35%	0.346	C	S	.	.	H	α-helix	trans	-61	-44.6	175.8	-67.2	176.2	0	0	0	110.8	S242 S247 L248 L249 L265	S242-L245 PolarHBondContact O-N 3.4Å; L245-S247 VanDerWaalsContact C-N 3.31Å; L245-S247 PolarHBondContact O-N 2.8Å; L245-L248 PolarHBondContact O-N 3.23Å; L245-L249 WeakPolarHBondContact O-CB 3.38Å; L245-L249 VanDerWaalsContact O-CG 3.32Å; L245-L249 WeakPolarHBondContact O-CG 3.23Å; L245-L249 PolarHBondContact O-N 2.79Å; L245-L265 HydrophobicContact CD2-CB 4.1Å; L245-L265 HydrophobicContact CD2-CD1 3.51Å; L245-L265 HydrophobicContact CD2-CG 4.32Å
246	R	84.6	Confident	83	Confident	106 Å²	106	66.7 Å²	66.7	40%	0.4	35%	0.349	S	S	.	.	H	α-helix	trans	-59.6	-40.7	177.6	-172.9	176.4	-179	166.6	5.5	112.5	L236 S242 P243 Q244 L249 K250	L236-R246 PolarHBondContact O-NE 2.87Å; S242-R246 PolarHBondContact O-N 3.39Å; P243-R246 PolarHBondContact O-N 2.95Å; Q244-R246 VanDerWaalsContact C-N 3.34Å; Q244-R246 PolarHBondContact O-N 3.25Å; R246-L249 PolarHBondContact O-N 2.82Å; R246-K250 WeakPolarHBondContact O-CB 3.37Å; R246-K250 PolarHBondContact O-N 2.83Å
247	S	87.1	Confident	83.4	Confident	33 Å²	33	65.9 Å²	65.9	23%	0.231	35%	0.345	C	S	.	.	H	α-helix	trans	-63.5	-41.3	178.4	73.2	0	0	0	0	112.4	P243 Q244 L245 A329	P243-S247 WeakPolarHBondContact O-CB 3.41Å; P243-S247 PolarHBondContact O-N 2.83Å; Q244-S247 PolarHBondContact O-N 2.89Å; Q244-S247 PolarHBondContact O-OG 2.67Å; L245-S247 VanDerWaalsContact C-N 3.31Å; L245-S247 PolarHBondContact O-N 2.8Å; S247-A329 PolarHBondContact OG-O 3.17Å
248	L	87.5	Confident	83.7	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-68.9	-44.3	176.3	-68.4	174.6	0	0	0	111.8	Q244 L245 K250 L251 L265 L293 A296 L330	Q244-L248 PolarHBondContact O-N 3.37Å; L245-L248 PolarHBondContact O-N 3.23Å; L248-K250 VanDerWaalsContact C-N 3.28Å; L248-K250 PolarHBondContact O-N 3.01Å; L248-L251 WeakPolarHBondContact O-CB 3.49Å; L248-L251 PolarHBondContact O-N 3.1Å; L248-L251 VanDerWaalsContact O-N 3.11Å; L248-L265 HydrophobicContact CD1-CD1 4.3Å; L248-L293 HydrophobicContact CD2-CD2 4.47Å; L248-A296 HydrophobicContact CD2-CB 4.46Å; L248-L330 HydrophobicContact CD1-CD1 4.29Å; L248-L330 HydrophobicContact CD1-CD2 4.18Å; L248-L330 HydrophobicContact CD1-CG 4.43Å; L248-L330 HydrophobicContact CD2-CD1 4.18Å; L248-L330 HydrophobicContact CD2-CD2 4.42Å; L248-L330 HydrophobicContact CD2-CG 3.98Å; L248-L330 HydrophobicContact CG-CD2 4.11Å; L248-L330 HydrophobicContact CG-CG 4.23Å
249	L	87	Confident	84.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.8	-29.5	180	-68.1	174.7	0	0	0	112.5	L235 L236 L239 L245 R246 L251 C252 A258 V261 L262	L235-L249 HydrophobicContact CD2-CD1 4.23Å; L236-L249 HydrophobicContact CD2-CB 3.71Å; L239-L249 HydrophobicContact CD1-CD1 3.24Å; L245-L249 WeakPolarHBondContact O-CB 3.38Å; L245-L249 VanDerWaalsContact O-CG 3.32Å; L245-L249 WeakPolarHBondContact O-CG 3.23Å; L245-L249 PolarHBondContact O-N 2.79Å; R246-L249 PolarHBondContact O-N 2.82Å; L249-L251 PolarHBondContact O-N 2.85Å; L249-C252 VanDerWaalsContact O-CB 3.25Å; L249-C252 WeakPolarHBondContact O-CB 3.34Å; L249-C252 PolarHBondContact O-N 3.34Å; L249-A258 HydrophobicContact CD2-CB 4.13Å; L249-A258 WeakPolarHBondContact CD2-O 3.22Å; L249-V261 HydrophobicContact CD2-CB 4.02Å; L249-V261 HydrophobicContact CD2-CG1 3.91Å; L249-L262 HydrophobicContact CD1-CD1 4.45Å
250	K	87.7	Confident	84.9	Confident	162 Å²	162	57.2 Å²	57.2	70%	0.704	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.7	173.7	-168.8	177.2	179.6	-177.5	0	113.1	R246 L248 C252	R246-K250 WeakPolarHBondContact O-CB 3.37Å; R246-K250 PolarHBondContact O-N 2.83Å; L248-K250 VanDerWaalsContact C-N 3.28Å; L248-K250 PolarHBondContact O-N 3.01Å; K250-C252 VanDerWaalsContact C-N 3.32Å
251	L	88.2	Confident	86	Confident	63 Å²	63	54 Å²	54	33%	0.33	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-15.4	174.2	-62.5	174.4	0	0	0	113	L248 L249 L293 R325 A329	L248-L251 WeakPolarHBondContact O-CB 3.49Å; L248-L251 PolarHBondContact O-N 3.1Å; L248-L251 VanDerWaalsContact O-N 3.11Å; L249-L251 PolarHBondContact O-N 2.85Å; L251-L293 HydrophobicContact CB-CD1 4.25Å; L251-L293 HydrophobicContact CB-CD2 4.08Å; L251-L293 HydrophobicContact CD1-CD2 3.57Å; L251-L293 HydrophobicContact CG-CD2 4.49Å; L251-R325 HydrophobicContact CD1-CB 4.34Å; L251-R325 WeakPolarHBondContact CD1-O 3.42Å; L251-A329 HydrophobicContact CD1-CB 3.79Å; L251-A329 HydrophobicContact CG-CB 4.4Å
252	C	87.3	Confident	86.9	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.041	25%	0.245	C	C	.	.			trans	-72.9	143.6	175.2	-61.7	0	0	0	0	110.1	F232 L249 K250 Q257 A258	F232-C252 HydrophobicContact CE2-CB 4.49Å; F232-C252 HydrophobicContact CZ-CB 4.47Å; F232-C252 WeakPolarHBondContact CZ-O 3.5Å; L249-C252 VanDerWaalsContact O-CB 3.25Å; L249-C252 WeakPolarHBondContact O-CB 3.34Å; L249-C252 PolarHBondContact O-N 3.34Å; K250-C252 VanDerWaalsContact C-N 3.32Å; C252-Q257 HydrophobicContact CB-CB 4.4Å; C252-Q257 HydrophobicContact CB-CG 4.2Å; C252-A258 HydrophobicContact CB-CB 4.13Å
253	K	84.2	Confident	87.4	Confident	146 Å²	146	51.7 Å²	51.7	64%	0.635	25%	0.252	S	S	*	.	S	Bend	trans	-89.6	-34.8	178.8	-77	-168.3	174.6	-172.1	0	113.3	I469	K253-I469 HydrophobicContact CD-CB 4.46Å
254	T	86.3	Confident	88.1	Confident	14 Å²	14	47.2 Å²	47.2	9%	0.086	22%	0.223	C	C	.	.	S	Bend	trans	-119.8	150.9	-170.1	53.6	0	0	0	0	110	D256 Q257 A258 E467 I469	T254-D256 VanDerWaalsContact C-N 3.29Å; T254-D256 PolarHBondContact O-N 2.86Å; T254-Q257 PolarHBondContact O-N 3.39Å; T254-Q257 WeakPolarHBondContact OG1-CB 3.34Å; T254-Q257 PolarHBondContact OG1-N 2.95Å; T254-A258 PolarHBondContact O-N 3.15Å; T254-A258 VanDerWaalsContact O-N 3.14Å; T254-E467 WeakPolarHBondContact CB-OE2 3.38Å; T254-E467 HydrophobicContact CG2-CB 4.38Å; T254-E467 HydrophobicContact CG2-CG 3.86Å; T254-I469 HydrophobicContact CG2-CG2 4.3Å
255	L	87.4	Confident	88.6	Confident	36 Å²	36	41.5 Å²	41.5	19%	0.188	20%	0.196	C	C	.	.	H	α-helix	trans	-57.9	-42.7	175.2	178.4	68.5	0	0	0	111.7	A231 F232 L235 A258 N259	A231-L255 HydrophobicContact CB-CD2 3.88Å; F232-L255 HydrophobicContact CB-CB 4.29Å; F232-L255 HydrophobicContact CB-CD1 4.2Å; F232-L255 HydrophobicContact CD2-CD1 4.38Å; L235-L255 HydrophobicContact CB-CD1 4.37Å; L235-L255 HydrophobicContact CD1-CD1 4.1Å; L255-A258 WeakPolarHBondContact O-CB 3.38Å; L255-A258 PolarHBondContact O-N 3.12Å; L255-A258 VanDerWaalsContact O-N 3.12Å; L255-N259 PolarHBondContact O-N 2.94Å; L255-N259 PolarHBondContact O-ND2 2.98Å
256	D	88.4	Confident	89	Confident	39 Å²	39	43.1 Å²	43.1	21%	0.209	21%	0.205	C	C	.	.	H	α-helix	trans	-61.5	-47.3	-178.2	-167.2	23.2	0	0	0	111.8	T254 A258 N259 V260 L465 E466 E467	T254-D256 VanDerWaalsContact C-N 3.29Å; T254-D256 PolarHBondContact O-N 2.86Å; D256-A258 VanDerWaalsContact C-N 3.29Å; D256-A258 PolarHBondContact O-N 2.94Å; D256-N259 PolarHBondContact O-N 2.92Å; D256-V260 PolarHBondContact O-N 3.3Å; D256-L465 HydrophobicContact CB-CD2 4.31Å; D256-L465 VanDerWaalsContact OD2-CA 3.27Å; D256-L465 WeakPolarHBondContact OD2-CA 3.44Å; D256-E466 PolarHBondContact OD2-N 3.45Å; D256-E467 HydrophobicContact CB-CB 4.15Å; D256-E467 PolarHBondContact OD2-N 3.37Å
257	Q	90.3	Very high	89.3	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.019	19%	0.189	C	C	.	.	H	α-helix	trans	-55.7	-42.7	171.9	-172.1	-175.9	29.5	0	0	112.5	C252 T254 V260 V261 A290	C252-Q257 HydrophobicContact CB-CB 4.4Å; C252-Q257 HydrophobicContact CB-CG 4.2Å; T254-Q257 PolarHBondContact O-N 3.39Å; T254-Q257 WeakPolarHBondContact OG1-CB 3.34Å; T254-Q257 PolarHBondContact OG1-N 2.95Å; Q257-V260 PolarHBondContact O-N 3.12Å; Q257-V261 WeakPolarHBondContact O-CG2 3.17Å; Q257-V261 PolarHBondContact O-N 3.49Å; Q257-A290 HydrophobicContact CG-CB 4.24Å
258	A	90.1	Very high	89.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.8	-42.4	179.9	0	0	0	0	0	112.2	F232 L249 C252 T254 L255 D256 V260 V261 L262	F232-A258 HydrophobicContact CD2-CB 3.98Å; F232-A258 HydrophobicContact CE2-CB 3.55Å; L249-A258 HydrophobicContact CD2-CB 4.13Å; L249-A258 WeakPolarHBondContact CD2-O 3.22Å; C252-A258 HydrophobicContact CB-CB 4.13Å; T254-A258 PolarHBondContact O-N 3.15Å; T254-A258 VanDerWaalsContact O-N 3.14Å; L255-A258 WeakPolarHBondContact O-CB 3.38Å; L255-A258 PolarHBondContact O-N 3.12Å; L255-A258 VanDerWaalsContact O-N 3.12Å; D256-A258 VanDerWaalsContact C-N 3.29Å; D256-A258 PolarHBondContact O-N 2.94Å; A258-V260 VanDerWaalsContact C-N 3.34Å; A258-V260 PolarHBondContact O-N 3.12Å; A258-V261 PolarHBondContact O-N 3.43Å; A258-L262 WeakPolarHBondContact O-CB 3.38Å; A258-L262 PolarHBondContact O-N 2.95Å
259	N	91.2	Very high	89.5	Confident	55 Å²	55	40.6 Å²	40.6	29%	0.294	21%	0.208	S	C	.	.	H	α-helix	trans	-61.5	-41.2	175.4	-74.2	-31.2	0	0	0	112.2	L235 L255 D256 L262 K263	L235-N259 WeakPolarHBondContact CD1-OD1 3.46Å; L255-N259 PolarHBondContact O-N 2.94Å; L255-N259 PolarHBondContact O-ND2 2.98Å; D256-N259 PolarHBondContact O-N 2.92Å; N259-L262 PolarHBondContact O-N 2.95Å; N259-K263 WeakPolarHBondContact O-CG 3.23Å; N259-K263 PolarHBondContact O-N 3.25Å
260	V	92.8	Very high	89.4	Confident	5 Å²	5	46.9 Å²	46.9	3%	0.03	24%	0.237	C	C	.	.	H	α-helix	trans	-65.8	-46	176.4	166.7	0	0	0	0	111.5	D256 Q257 A258 L262 K263 L264 L279 L463 L465	D256-V260 PolarHBondContact O-N 3.3Å; Q257-V260 PolarHBondContact O-N 3.12Å; A258-V260 VanDerWaalsContact C-N 3.34Å; A258-V260 PolarHBondContact O-N 3.12Å; V260-L262 VanDerWaalsContact C-N 3.32Å; V260-L262 PolarHBondContact O-N 2.94Å; V260-K263 PolarHBondContact O-N 3.38Å; V260-L264 HydrophobicContact CG1-CD1 4.04Å; V260-L264 HydrophobicContact CG1-CG 4.47Å; V260-L264 WeakPolarHBondContact O-CG 3.45Å; V260-L264 PolarHBondContact O-N 2.95Å; V260-L279 HydrophobicContact CG1-CD1 3.62Å; V260-L279 HydrophobicContact CG1-CD2 4.25Å; V260-L279 HydrophobicContact CG2-CD1 4.26Å; V260-L463 HydrophobicContact CG1-CD1 4.18Å; V260-L463 HydrophobicContact CG2-CB 4.43Å; V260-L465 HydrophobicContact CB-CD2 3.92Å; V260-L465 HydrophobicContact CB-CG 4.5Å; V260-L465 HydrophobicContact CG2-CD2 3.42Å; V260-L465 VanDerWaalsContact CG2-CD2 3.42Å; V260-L465 HydrophobicContact CG2-CG 3.91Å
261	V	92.7	Very high	89	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.5	-42.4	177.3	171.8	0	0	0	0	110.6	L249 Q257 A258 K263 L264 L265 A290 L293	L249-V261 HydrophobicContact CD2-CB 4.02Å; L249-V261 HydrophobicContact CD2-CG1 3.91Å; Q257-V261 WeakPolarHBondContact O-CG2 3.17Å; Q257-V261 PolarHBondContact O-N 3.49Å; A258-V261 PolarHBondContact O-N 3.43Å; V261-K263 PolarHBondContact O-N 3.41Å; V261-L264 PolarHBondContact O-N 3.16Å; V261-L265 HydrophobicContact CG1-CD1 3.74Å; V261-L265 HydrophobicContact CG1-CG 4.31Å; V261-L265 VanDerWaalsContact O-CG 3.26Å; V261-L265 WeakPolarHBondContact O-CG 3.43Å; V261-L265 PolarHBondContact O-N 2.94Å; V261-A290 HydrophobicContact CG2-CB 3.86Å; V261-L293 HydrophobicContact CG1-CB 4.45Å; V261-L293 HydrophobicContact CG2-CB 4.45Å
262	L	91.4	Very high	88.8	Confident	32 Å²	32	43.5 Å²	43.5	17%	0.168	23%	0.23	C	C	.	.	H	α-helix	trans	-59.9	-47.1	176.5	-177	65.4	0	0	0	111.9	L239 L249 A258 N259 V260 L264 L265 N266	L239-L262 HydrophobicContact CD1-CD1 4.23Å; L239-L262 HydrophobicContact CD1-CD2 4.48Å; L249-L262 HydrophobicContact CD1-CD1 4.45Å; A258-L262 WeakPolarHBondContact O-CB 3.38Å; A258-L262 PolarHBondContact O-N 2.95Å; N259-L262 PolarHBondContact O-N 2.95Å; V260-L262 VanDerWaalsContact C-N 3.32Å; V260-L262 PolarHBondContact O-N 2.94Å; L262-L264 PolarHBondContact O-N 3.1Å; L262-L265 PolarHBondContact O-N 2.84Å; L262-N266 VanDerWaalsContact O-CG 3.29Å; L262-N266 PolarHBondContact O-N 3.27Å; L262-N266 PolarHBondContact O-OD1 2.91Å
263	K	91.9	Very high	88.2	Confident	115 Å²	115	47.2 Å²	47.2	50%	0.5	25%	0.249	S	C	.	.	H	α-helix	trans	-62.2	-41	176.5	-74.2	179.4	-177.5	179.7	0	112.4	N259 V260 V261 N266 I267 L463	N259-K263 WeakPolarHBondContact O-CG 3.23Å; N259-K263 PolarHBondContact O-N 3.25Å; V260-K263 PolarHBondContact O-N 3.38Å; V261-K263 PolarHBondContact O-N 3.41Å; K263-N266 PolarHBondContact O-N 3.33Å; K263-I267 WeakPolarHBondContact O-CG1 3.21Å; K263-I267 PolarHBondContact O-N 3.03Å; K263-I267 VanDerWaalsContact O-N 3.1Å; K263-L463 HydrophobicContact CB-CD1 4.21Å; K263-L463 HydrophobicContact CB-CD2 4.3Å; K263-L463 HydrophobicContact CD-CD2 3.45Å; K263-L463 VanDerWaalsContact CD-CD2 3.45Å
264	L	92.8	Very high	88	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-45.2	175.5	-72.5	171.2	0	0	0	111.1	V260 V261 L262 N266 I267 V268 V277 L291 A294 F405 L463	V260-L264 HydrophobicContact CG1-CD1 4.04Å; V260-L264 HydrophobicContact CG1-CG 4.47Å; V260-L264 WeakPolarHBondContact O-CG 3.45Å; V260-L264 PolarHBondContact O-N 2.95Å; V261-L264 PolarHBondContact O-N 3.16Å; L262-L264 PolarHBondContact O-N 3.1Å; L264-N266 PolarHBondContact O-N 3.23Å; L264-I267 PolarHBondContact O-N 3.23Å; L264-V268 WeakPolarHBondContact O-CG2 3.31Å; L264-V268 PolarHBondContact O-N 3.38Å; L264-V277 HydrophobicContact CD2-CB 4.22Å; L264-V277 HydrophobicContact CD2-CG1 3.76Å; L264-V277 HydrophobicContact CD2-CG2 4.49Å; L264-L291 HydrophobicContact CD1-CD2 4.38Å; L264-A294 HydrophobicContact CB-CB 3.95Å; L264-A294 HydrophobicContact CD1-CB 3.85Å; L264-F405 HydrophobicContact CD2-CD1 4.05Å; L264-F405 HydrophobicContact CD2-CD2 4.12Å; L264-F405 HydrophobicContact CD2-CE1 3.97Å; L264-F405 HydrophobicContact CD2-CE2 4.05Å; L264-F405 HydrophobicContact CD2-CG 4.11Å; L264-F405 HydrophobicContact CD2-CZ 3.97Å; L264-L463 HydrophobicContact CD2-CD1 4.22Å; L264-L463 HydrophobicContact CG-CD1 4.23Å
265	L	90.6	Very high	88.1	Confident	8 Å²	8	46.4 Å²	46.4	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-35.6	179.6	-67.4	170.7	0	0	0	112.5	L245 L248 V261 L262 V268 A269	L245-L265 HydrophobicContact CD2-CB 4.1Å; L245-L265 HydrophobicContact CD2-CD1 3.51Å; L245-L265 HydrophobicContact CD2-CG 4.32Å; L248-L265 HydrophobicContact CD1-CD1 4.3Å; V261-L265 HydrophobicContact CG1-CD1 3.74Å; V261-L265 HydrophobicContact CG1-CG 4.31Å; V261-L265 VanDerWaalsContact O-CG 3.26Å; V261-L265 WeakPolarHBondContact O-CG 3.43Å; V261-L265 PolarHBondContact O-N 2.94Å; L262-L265 PolarHBondContact O-N 2.84Å; L265-V268 WeakPolarHBondContact O-CB 3.29Å; L265-V268 PolarHBondContact O-N 3.3Å; L265-A269 WeakPolarHBondContact O-CB 3.44Å; L265-A269 PolarHBondContact O-N 2.9Å
266	N	90.1	Very high	88.1	Confident	78 Å²	78	44.8 Å²	44.8	42%	0.417	23%	0.233	S	C	.	.	H	α-helix	trans	-63.1	-42.7	173	-69.4	-10.3	0	0	0	111.5	L262 K263 L264 V268 A269 E270	L262-N266 VanDerWaalsContact O-CG 3.29Å; L262-N266 PolarHBondContact O-N 3.27Å; L262-N266 PolarHBondContact O-OD1 2.91Å; K263-N266 PolarHBondContact O-N 3.33Å; L264-N266 PolarHBondContact O-N 3.23Å; N266-V268 VanDerWaalsContact C-N 3.33Å; N266-V268 PolarHBondContact O-N 3.04Å; N266-A269 WeakPolarHBondContact O-CB 3.34Å; N266-A269 PolarHBondContact O-N 3.32Å; N266-A269 VanDerWaalsContact O-N 3.12Å; N266-E270 PolarHBondContact O-N 2.95Å
267	I	90.2	Very high	88.3	Confident	13 Å²	13	43 Å²	43	7%	0.067	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-37.7	177.4	-68.2	168.1	0	0	0	111.5	K263 L264 A269 E270 H275 V277 L403 F405	K263-I267 WeakPolarHBondContact O-CG1 3.21Å; K263-I267 PolarHBondContact O-N 3.03Å; K263-I267 VanDerWaalsContact O-N 3.1Å; L264-I267 PolarHBondContact O-N 3.23Å; I267-A269 VanDerWaalsContact C-N 3.31Å; I267-E270 PolarHBondContact O-N 2.9Å; I267-H275 HydrophobicContact CG2-CB 4.44Å; I267-V277 HydrophobicContact CD1-CG1 4.46Å; I267-V277 HydrophobicContact CD1-CG2 3.47Å; I267-V277 VanDerWaalsContact CD1-CG2 3.47Å; I267-V277 HydrophobicContact CG2-CG2 4.02Å; I267-L403 HydrophobicContact CG2-CD1 3.94Å; I267-F405 HydrophobicContact CG2-CE1 4.12Å; I267-F405 HydrophobicContact CG2-CZ 4.47Å
268	V	90	Very high	88.2	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-42.4	171.6	168.9	0	0	0	0	110.6	L264 L265 N266 N271 A298 F303 L403 F405	L264-V268 WeakPolarHBondContact O-CG2 3.31Å; L264-V268 PolarHBondContact O-N 3.38Å; L265-V268 WeakPolarHBondContact O-CB 3.29Å; L265-V268 PolarHBondContact O-N 3.3Å; N266-V268 VanDerWaalsContact C-N 3.33Å; N266-V268 PolarHBondContact O-N 3.04Å; V268-N271 PolarHBondContact O-N 3.47Å; V268-A298 HydrophobicContact CG1-CB 3.76Å; V268-A298 HydrophobicContact CG2-CB 4.15Å; V268-F303 HydrophobicContact CB-CE2 4.4Å; V268-F303 HydrophobicContact CG1-CD2 3.84Å; V268-F303 HydrophobicContact CG1-CE2 3.36Å; V268-F303 HydrophobicContact CG1-CZ 4.15Å; V268-L403 HydrophobicContact CG2-CD2 4.47Å; V268-F405 HydrophobicContact CG2-CE2 3.87Å; V268-F405 HydrophobicContact CG2-CZ 3.65Å
269	A	88.2	Confident	88.2	Confident	74 Å²	74	43.3 Å²	43.3	61%	0.612	23%	0.226	S	C	*	.	H	α-helix	trans	-68.4	-31	179.4	0	0	0	0	0	113.4	L265 N266 I267 N271	L265-A269 WeakPolarHBondContact O-CB 3.44Å; L265-A269 PolarHBondContact O-N 2.9Å; N266-A269 WeakPolarHBondContact O-CB 3.34Å; N266-A269 PolarHBondContact O-N 3.32Å; N266-A269 VanDerWaalsContact O-N 3.12Å; I267-A269 VanDerWaalsContact C-N 3.31Å; A269-N271 PolarHBondContact O-N 3.02Å
270	E	86	Confident	88	Confident	132 Å²	132	41.3 Å²	41.3	62%	0.617	22%	0.216	S	C	*	.	H	α-helix	trans	-66	-19.4	173.8	-74.5	176.8	-172.3	0	0	113.3	N266 I267 S272	N266-E270 PolarHBondContact O-N 2.95Å; I267-E270 PolarHBondContact O-N 2.9Å; E270-S272 PolarHBondContact O-N 3.04Å; E270-S272 VanDerWaalsContact O-N 3.13Å
271	N	79.7	Confident	87.6	Confident	104 Å²	104	41.1 Å²	41.1	56%	0.556	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	31.7	177.8	-156.4	13.3	0	0	0	114.9	V268 A269 L273	V268-N271 PolarHBondContact O-N 3.47Å; A269-N271 PolarHBondContact O-N 3.02Å; N271-L273 PolarHBondContact O-N 3.31Å
272	S	82.4	Confident	87	Confident	49 Å²	49	42 Å²	42	34%	0.343	22%	0.222	S	C	.	.			trans	-84.3	106.4	177.1	-178.1	0	0	0	0	111.4	E270 R274 H275	E270-S272 PolarHBondContact O-N 3.04Å; E270-S272 VanDerWaalsContact O-N 3.13Å; S272-R274 PolarHBondContact O-N 2.78Å; S272-R274 VanDerWaalsContact O-N 3.08Å; S272-H275 PolarHBondContact O-N 3Å
273	L	76.6	Confident	86.4	Confident	84 Å²	84	41.9 Å²	41.9	44%	0.44	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-8	179.9	-62.7	173.5	0	0	0	114.3	N271 Y402 L403	N271-L273 PolarHBondContact O-N 3.31Å; L273-Y402 CarbonylContact O-C 3.5Å; L273-Y402 WeakPolarHBondContact O-CA 3.29Å; L273-Y402 PolarHBondContact O-N 2.87Å; L273-L403 PolarHBondContact O-N 3.32Å
274	R	78.8	Confident	85.7	Confident	131 Å²	131	37 Å²	37	49%	0.494	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	15.8	-178.6	-65.6	-175.7	-179.5	178.2	-5.9	113.6	S272 S456 R458 V459	S272-R274 PolarHBondContact O-N 2.78Å; S272-R274 VanDerWaalsContact O-N 3.08Å; R274-S456 PolarHBondContact NH1-OG 3.4Å; R274-R458 WeakPolarHBondContact O-CA 3.43Å; R274-R458 WeakPolarHBondContact O-CB 3.32Å; R274-V459 PolarHBondContact O-N 3.17Å; R274-V459 VanDerWaalsContact O-N 3.13Å
275	H	87.9	Confident	85.4	Confident	13 Å²	13	38 Å²	38	6%	0.06	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	137.9	179.7	-151.5	-1.9	0	0	0	111.3	I267 S272 L403 V404 R458 V459 S461	I267-H275 HydrophobicContact CG2-CB 4.44Å; S272-H275 PolarHBondContact O-N 3Å; H275-L403 HydrophobicContact CB-CD1 3.73Å; H275-L403 WeakPolarHBondContact O-CD1 3.45Å; H275-V404 PolarHBondContact O-N 3.37Å; H275-V404 VanDerWaalsContact O-N 3.12Å; H275-R458 PolarHBondContact O-NH2 2.96Å; H275-R458 VanDerWaalsContact O-NH2 3.1Å; H275-V459 PolarHBondContact ND1-O 3.43Å; H275-S461 VanDerWaalsContact CE1-CB 3.5Å; H275-S461 WeakPolarHBondContact CE1-CB 3.43Å; H275-S461 PolarHBondContact CE1-OG 2.75Å; H275-S461 PolarHBondContact NE2-OG 3.01Å; H275-S461 VanDerWaalsContact NE2-OG 3.08Å
276	T	88.9	Confident	85.2	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.2	169.8	-49.2	0	0	0	0	108.5	L399 V404 M406 L428 R458 V459 L460 S461	T276-L399 HydrophobicContact CG2-CD2 4.24Å; T276-V404 CarbonylContact C-O 3.58Å; T276-V404 WeakPolarHBondContact CA-O 3.49Å; T276-V404 HydrophobicContact CG2-CB 4.28Å; T276-M406 HydrophobicContact CG2-CG 4.47Å; T276-M406 HydrophobicContact CG2-SD 4.18Å; T276-L428 HydrophobicContact CG2-CD1 4.39Å; T276-R458 VanDerWaalsContact OG1-CZ 3.28Å; T276-R458 PolarHBondContact OG1-NE 3.24Å; T276-R458 PolarHBondContact OG1-NH2 3.05Å; T276-V459 PolarHBondContact N-O 3.38Å; T276-L460 HydrophobicContact CG2-CD1 4.4Å; T276-L460 WeakPolarHBondContact O-CA 3.38Å; T276-S461 PolarHBondContact O-N 3.33Å
277	V	91.2	Very high	85.2	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.012	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122.4	174.9	-171.1	0	0	0	0	108.6	L264 I267 V404 F405 M406 S461 L463	L264-V277 HydrophobicContact CD2-CB 4.22Å; L264-V277 HydrophobicContact CD2-CG1 3.76Å; L264-V277 HydrophobicContact CD2-CG2 4.49Å; I267-V277 HydrophobicContact CD1-CG1 4.46Å; I267-V277 HydrophobicContact CD1-CG2 3.47Å; I267-V277 VanDerWaalsContact CD1-CG2 3.47Å; I267-V277 HydrophobicContact CG2-CG2 4.02Å; V277-V404 PolarHBondContact N-O 3.22Å; V277-F405 HydrophobicContact CB-CD1 3.64Å; V277-F405 HydrophobicContact CB-CE1 4.02Å; V277-F405 HydrophobicContact CG2-CD1 3.65Å; V277-F405 HydrophobicContact CG2-CE1 3.51Å; V277-M406 PolarHBondContact O-N 3.12Å; V277-S461 CarbonylContact C-O 3.54Å; V277-S461 WeakPolarHBondContact CA-O 3.16Å; V277-L463 HydrophobicContact CG1-CD1 3.64Å; V277-L463 HydrophobicContact CG1-CG 4Å
278	S	89.4	Confident	85.1	Confident	7 Å²	7	35.1 Å²	35.1	5%	0.049	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	107.8	174.4	175	0	0	0	0	109.9	M406 S461 L463	S278-M406 CarbonylContact C-O 3.58Å; S278-S461 PolarHBondContact N-O 3.06Å; S278-L463 PolarHBondContact O-N 2.85Å
279	L	90.3	Very high	85.2	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	112.3	169.9	-178.2	62	0	0	0	109.8	V260 K287 M406 A407 S408 L463 L465	V260-L279 HydrophobicContact CG1-CD1 3.62Å; V260-L279 HydrophobicContact CG1-CD2 4.25Å; V260-L279 HydrophobicContact CG2-CD1 4.26Å; L279-K287 HydrophobicContact CD2-CB 4.21Å; L279-K287 HydrophobicContact CD2-CG 4.08Å; L279-K287 HydrophobicContact CG-CG 4.35Å; L279-M406 PolarHBondContact N-O 2.6Å; L279-A407 CarbonylContact O-C 3.52Å; L279-A407 WeakPolarHBondContact O-CA 3.16Å; L279-S408 PolarHBondContact O-N 3.5Å; L279-L463 WeakPolarHBondContact CA-O 3.38Å; L279-L463 HydrophobicContact CD1-CB 3.88Å; L279-L465 HydrophobicContact CD1-CD1 3.94Å; L279-L465 HydrophobicContact CD1-CG 3.94Å; L279-L465 HydrophobicContact CD2-CD1 4.12Å; L279-L465 HydrophobicContact CG-CD1 4.39Å
280	T	86.3	Confident	85.4	Confident	14 Å²	14	31.8 Å²	31.8	9%	0.086	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.9	175	60.4	0	0	0	0	109.2	I410 L463 V464 L465	T280-I410 HydrophobicContact CG2-CG2 4.3Å; T280-L463 PolarHBondContact N-O 3.2Å; T280-L463 PolarHBondContact OG1-O 3.16Å; T280-V464 CarbonylContact O-C 3.6Å; T280-V464 WeakPolarHBondContact O-CA 3.4Å; T280-L465 PolarHBondContact O-N 3.38Å
281	A	84.9	Confident	85.8	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	158.6	172.2	0	0	0	0	0	111.7	R285 K287 S408 N409 I410 L465	A281-R285 HydrophobicContact CB-CB 4.08Å; A281-R285 HydrophobicContact CB-CG 4.32Å; A281-K287 HydrophobicContact CB-CD 3.54Å; A281-K287 HydrophobicContact CB-CG 3.52Å; A281-K287 PolarHBondContact O-NZ 3.09Å; A281-S408 PolarHBondContact N-O 2.84Å; A281-S408 VanDerWaalsContact N-O 3.08Å; A281-N409 CarbonylContact O-C 3.46Å; A281-N409 VanDerWaalsContact O-CA 3.29Å; A281-N409 WeakPolarHBondContact O-CA 3.39Å; A281-I410 PolarHBondContact O-N 3.2Å; A281-L465 WeakPolarHBondContact CA-O 3.34Å; A281-L465 HydrophobicContact CB-CB 3.6Å; A281-L465 HydrophobicContact CB-CD1 4.39Å; A281-L465 HydrophobicContact CB-CG 4.47Å; A281-L465 WeakPolarHBondContact CB-O 3.22Å
282	A	79.5	Confident	86.5	Confident	19 Å²	19	20.6 Å²	20.6	16%	0.157	11%	0.111	C	C	.	.			trans	-62.2	161.5	164.4	0	0	0	0	0	111.6	R285 K287 I410	A282-R285 HydrophobicContact CB-CG 3.95Å; A282-R285 VanDerWaalsContact O-CG 3.24Å; A282-R285 WeakPolarHBondContact O-CG 3.42Å; A282-K287 PolarHBondContact O-NZ 3.25Å; A282-I410 VanDerWaalsContact CA-O 3.27Å; A282-I410 WeakPolarHBondContact CA-O 3.4Å
283	R	78.4	Confident	87	Confident	29 Å²	29	18.3 Å²	18.3	11%	0.109	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	146.5	175.9	-163.8	-168.8	-167.4	101	16.9	109.1	E137 R285 Y413 E414	E137-R283 WeakPolarHBondContact OE1-CB 3.49Å; E137-R283 WeakPolarHBondContact OE1-CD 3.44Å; E137-R283 WeakPolarHBondContact OE1-CG 3.31Å; E137-R283 WeakPolarHBondContact OE2-CB 3.43Å; E137-R283 VanDerWaalsContact OE2-CD 3.23Å; E137-R283 WeakPolarHBondContact OE2-CD 3.41Å; R283-R285 PolarHBondContact O-N 3.48Å; R283-Y413 PolarHBondContact NE-OH 3.35Å; R283-Y413 PolarHBondContact NH1-OH 3.04Å; R283-E414 IonicContact CZ-OE2 3.22Å; R283-E414 IonicContact NH1-OE1 3.47Å; R283-E414 PolarHBondContact NH1-OE1 3.02Å; R283-E414 VanDerWaalsContact NH1-OE1 3.09Å; R283-E414 IonicContact NH1-OE2 3.95Å; R283-E414 PolarHBondContact NH1-OE2 2.98Å
284	G	78.4	Confident	87.8	Confident	13 Å²	13	14.3 Å²	14.3	13%	0.134	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	9.5	-178	0	0	0	0	0	116.4	E137 I469	E137-G284 PolarHBondContact OE1-N 2.92Å; G284-I469 WeakPolarHBondContact O-CG1 3.44Å; G284-I469 PolarHBondContact O-N 2.97Å
285	R	86.3	Confident	88.6	Confident	22 Å²	22	8 Å²	8	8%	0.083	5%	0.05	C	C	.	.	S	Bend	trans	-91.4	0.7	175.5	-51.3	-59.9	-171.6	-152.7	-10.3	114.9	A281 A282 R283 L465 E466 E467 S468 E478	A281-R285 HydrophobicContact CB-CB 4.08Å; A281-R285 HydrophobicContact CB-CG 4.32Å; A282-R285 HydrophobicContact CB-CG 3.95Å; A282-R285 VanDerWaalsContact O-CG 3.24Å; A282-R285 WeakPolarHBondContact O-CG 3.42Å; R283-R285 PolarHBondContact O-N 3.48Å; R285-L465 HydrophobicContact CB-CB 4.18Å; R285-E466 VanDerWaalsContact CD-O 3.27Å; R285-E466 WeakPolarHBondContact CD-O 3.05Å; R285-E466 VanDerWaalsContact CZ-O 3.29Å; R285-E466 PolarHBondContact NE-O 3.13Å; R285-E467 VanDerWaalsContact CD-C 3.45Å; R285-E467 VanDerWaalsContact CD-O 3.3Å; R285-E467 WeakPolarHBondContact CD-O 3.41Å; R285-S468 PolarHBondContact NH1-OG 3.37Å; R285-E478 IonicContact CZ-OE1 3.65Å; R285-E478 IonicContact NH1-OE1 2.8Å; R285-E478 PolarHBondContact NH1-OE1 3.28Å; R285-E478 IonicContact NH1-OE2 2.68Å; R285-E478 IonicContact NH2-OE1 3.66Å; R285-E478 PolarHBondContact NH2-OE1 3.36Å; R285-E478 IonicContact NH2-OE2 3.24Å
286	G	86.6	Confident	88.8	Confident	10 Å²	10	7.4 Å²	7.4	10%	0.103	5%	0.047	C	C	.	.			trans	88.9	22.5	174.6	0	0	0	0	0	116.7	A289 A290	G286-A289 WeakPolarHBondContact O-CB 3.17Å; G286-A289 PolarHBondContact O-N 3.43Å; G286-A290 PolarHBondContact O-N 3.4Å
287	K	88.5	Confident	88.9	Confident	9 Å²	9	7.7 Å²	7.7	4%	0.039	5%	0.05	C	C	.	.	H	α-helix	trans	-51.6	-57.4	178.3	-70.3	-171.8	-70.8	-77.9	0	114.3	L279 A281 A282 A289 A290 L291 A407 N409 L465	L279-K287 HydrophobicContact CD2-CB 4.21Å; L279-K287 HydrophobicContact CD2-CG 4.08Å; L279-K287 HydrophobicContact CG-CG 4.35Å; A281-K287 HydrophobicContact CB-CD 3.54Å; A281-K287 HydrophobicContact CB-CG 3.52Å; A281-K287 PolarHBondContact O-NZ 3.09Å; A282-K287 PolarHBondContact O-NZ 3.25Å; K287-A289 PolarHBondContact O-N 2.97Å; K287-A290 WeakPolarHBondContact O-CB 3.31Å; K287-A290 PolarHBondContact O-N 3.18Å; K287-A290 VanDerWaalsContact O-N 3.08Å; K287-L291 PolarHBondContact O-N 2.83Å; K287-A407 HydrophobicContact CB-CB 4.46Å; K287-A407 HydrophobicContact CD-CB 4.27Å; K287-N409 WeakPolarHBondContact CE-OD1 3.35Å; K287-N409 PolarHBondContact NZ-OD1 3.43Å; K287-L465 HydrophobicContact CG-CD1 4.18Å
288	S	89.6	Confident	88.9	Confident	20 Å²	20	7.6 Å²	7.6	14%	0.14	5%	0.049	C	C	.	.	H	α-helix	trans	-61.8	-30.4	-178.7	-46	0	0	0	0	112.3	G292 D385	S288-G292 PolarHBondContact O-N 3.38Å; S288-D385 VanDerWaalsContact CB-OD2 3.28Å; S288-D385 WeakPolarHBondContact CB-OD2 3.33Å; S288-D385 PolarHBondContact OG-OD2 3.05Å
289	A	91.1	Very high	89	Confident	6 Å²	6	7.5 Å²	7.5	5%	0.05	5%	0.048	C	C	.	.	H	α-helix	trans	-70.4	-43.9	174.3	0	0	0	0	0	111.7	G286 K287 G292 L293 F322	G286-A289 WeakPolarHBondContact O-CB 3.17Å; G286-A289 PolarHBondContact O-N 3.43Å; K287-A289 PolarHBondContact O-N 2.97Å; A289-G292 PolarHBondContact O-N 3.36Å; A289-L293 WeakPolarHBondContact O-CG 3.35Å; A289-L293 PolarHBondContact O-N 3.4Å; A289-F322 HydrophobicContact CB-CB 4.45Å; A289-F322 HydrophobicContact CB-CD1 3.79Å; A289-F322 HydrophobicContact CB-CD2 3.62Å; A289-F322 HydrophobicContact CB-CE1 3.82Å; A289-F322 HydrophobicContact CB-CE2 3.65Å; A289-F322 HydrophobicContact CB-CG 3.68Å; A289-F322 HydrophobicContact CB-CZ 3.74Å
290	A	93.5	Very high	88.8	Confident	0 Å²	0	9.1 Å²	9.1	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61.9	-43.7	175.3	0	0	0	0	0	111.8	Q257 V261 G286 K287 L293 A294	Q257-A290 HydrophobicContact CG-CB 4.24Å; V261-A290 HydrophobicContact CG2-CB 3.86Å; G286-A290 PolarHBondContact O-N 3.4Å; K287-A290 WeakPolarHBondContact O-CB 3.31Å; K287-A290 PolarHBondContact O-N 3.18Å; K287-A290 VanDerWaalsContact O-N 3.08Å; A290-L293 PolarHBondContact O-N 2.95Å; A290-A294 WeakPolarHBondContact O-CB 3.17Å; A290-A294 PolarHBondContact O-N 3.08Å
291	L	93.8	Very high	88.8	Confident	1 Å²	1	12.1 Å²	12.1	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-63	-40.6	174.5	-71.3	-179.7	0	0	0	112.5	L264 K287 A294 T295 Y319 I383 D385 F405 A407	L264-L291 HydrophobicContact CD1-CD2 4.38Å; K287-L291 PolarHBondContact O-N 2.83Å; L291-A294 PolarHBondContact O-N 3.22Å; L291-T295 PolarHBondContact O-N 2.6Å; L291-T295 PolarHBondContact O-OG1 3.07Å; L291-Y319 HydrophobicContact CB-CD2 4.05Å; L291-Y319 HydrophobicContact CB-CE2 4.1Å; L291-I383 HydrophobicContact CB-CG2 4.4Å; L291-I383 HydrophobicContact CD1-CG2 3.79Å; L291-I383 HydrophobicContact CD2-CG2 4.28Å; L291-I383 HydrophobicContact CG-CG2 4.4Å; L291-D385 HydrophobicContact CD1-CB 4.38Å; L291-F405 HydrophobicContact CD2-CB 4.16Å; L291-A407 HydrophobicContact CD1-CB 3.45Å; L291-A407 VanDerWaalsContact CD1-CB 3.45Å; L291-A407 HydrophobicContact CG-CB 4.39Å
292	G	94	Very high	88.9	Confident	0 Å²	0	13.8 Å²	13.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.6	-43.1	176.6	0	0	0	0	0	112.5	S288 A289 T295 A296	S288-G292 PolarHBondContact O-N 3.38Å; A289-G292 PolarHBondContact O-N 3.36Å; G292-T295 WeakPolarHBondContact O-CB 3.41Å; G292-T295 PolarHBondContact O-N 3.42Å; G292-A296 PolarHBondContact O-N 2.72Å; G292-A296 VanDerWaalsContact O-N 3.09Å
293	L	93.3	Very high	89.4	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.5	-42.1	174.9	-68.7	174.2	0	0	0	112.2	L248 L251 V261 A289 A290 T295 A296 G297 F322	L248-L293 HydrophobicContact CD2-CD2 4.47Å; L251-L293 HydrophobicContact CB-CD1 4.25Å; L251-L293 HydrophobicContact CB-CD2 4.08Å; L251-L293 HydrophobicContact CD1-CD2 3.57Å; L251-L293 HydrophobicContact CG-CD2 4.49Å; V261-L293 HydrophobicContact CG1-CB 4.45Å; V261-L293 HydrophobicContact CG2-CB 4.45Å; A289-L293 WeakPolarHBondContact O-CG 3.35Å; A289-L293 PolarHBondContact O-N 3.4Å; A290-L293 PolarHBondContact O-N 2.95Å; L293-T295 VanDerWaalsContact C-N 3.28Å; L293-T295 PolarHBondContact O-N 3.45Å; L293-A296 PolarHBondContact O-N 3.03Å; L293-G297 PolarHBondContact O-N 2.87Å; L293-F322 HydrophobicContact CD1-CD1 4.37Å; L293-F322 HydrophobicContact CD2-CD1 4.29Å; L293-F322 HydrophobicContact CG-CD1 4.14Å
294	A	94	Very high	90	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.9	-37.3	175.7	0	0	0	0	0	111.9	L264 A290 L291 G297 A298	L264-A294 HydrophobicContact CB-CB 3.95Å; L264-A294 HydrophobicContact CD1-CB 3.85Å; A290-A294 WeakPolarHBondContact O-CB 3.17Å; A290-A294 PolarHBondContact O-N 3.08Å; L291-A294 PolarHBondContact O-N 3.22Å; A294-G297 PolarHBondContact O-N 3.41Å; A294-A298 WeakPolarHBondContact O-CB 3.27Å; A294-A298 PolarHBondContact O-N 2.89Å
295	T	94.5	Very high	90.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65.8	-43.8	176.1	-54.3	0	0	0	0	111.9	L291 G292 L293 G297 A298 I299 I306 Y319 V323 V365 I383	L291-T295 PolarHBondContact O-N 2.6Å; L291-T295 PolarHBondContact O-OG1 3.07Å; G292-T295 WeakPolarHBondContact O-CB 3.41Å; G292-T295 PolarHBondContact O-N 3.42Å; L293-T295 VanDerWaalsContact C-N 3.28Å; L293-T295 PolarHBondContact O-N 3.45Å; T295-G297 VanDerWaalsContact C-N 3.28Å; T295-G297 PolarHBondContact O-N 2.83Å; T295-A298 PolarHBondContact O-N 2.87Å; T295-I299 HydrophobicContact CG2-CD1 4.18Å; T295-I299 WeakPolarHBondContact O-CG1 3.23Å; T295-I299 PolarHBondContact O-N 3.06Å; T295-I306 HydrophobicContact CG2-CD1 3.91Å; T295-I306 HydrophobicContact CG2-CG2 4.16Å; T295-Y319 WeakPolarHBondContact CG2-OH 3.49Å; T295-Y319 WeakPolarHBondContact OG1-CE2 3.38Å; T295-Y319 PolarHBondContact OG1-OH 3.46Å; T295-V323 HydrophobicContact CG2-CG2 4.3Å; T295-V365 HydrophobicContact CG2-CG1 4.35Å; T295-V365 HydrophobicContact CG2-CG2 4.15Å; T295-I383 HydrophobicContact CG2-CD1 4.38Å; T295-I383 WeakPolarHBondContact OG1-CD1 3.46Å
296	A	92.8	Very high	91	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.7	-41.1	175.6	0	0	0	0	0	111.3	L248 G292 L293 I299 G300 F327 L330	L248-A296 HydrophobicContact CD2-CB 4.46Å; G292-A296 PolarHBondContact O-N 2.72Å; G292-A296 VanDerWaalsContact O-N 3.09Å; L293-A296 PolarHBondContact O-N 3.03Å; A296-I299 PolarHBondContact O-N 3.22Å; A296-G300 PolarHBondContact O-N 3.12Å; A296-G300 VanDerWaalsContact O-N 3.1Å; A296-F327 HydrophobicContact CB-CD1 3.98Å; A296-F327 HydrophobicContact CB-CE1 4.1Å; A296-L330 HydrophobicContact CB-CD1 4.47Å; A296-L330 WeakPolarHBondContact O-CD1 3.39Å
297	G	90.4	Very high	91.4	Very high	6 Å²	6	14.2 Å²	14.2	6%	0.062	10%	0.103	C	C	.	.	H	α-helix	trans	-64.7	-40.4	173.2	0	0	0	0	0	113.5	L293 A294 T295 I299 G300 S301	L293-G297 PolarHBondContact O-N 2.87Å; A294-G297 PolarHBondContact O-N 3.41Å; T295-G297 VanDerWaalsContact C-N 3.28Å; T295-G297 PolarHBondContact O-N 2.83Å; G297-I299 VanDerWaalsContact C-N 3.32Å; G297-I299 PolarHBondContact O-N 2.88Å; G297-G300 CarbonylContact O-C 3.59Å; G297-G300 WeakPolarHBondContact O-CA 3.42Å; G297-G300 PolarHBondContact O-N 3.18Å; G297-G300 VanDerWaalsContact O-N 3.09Å; G297-S301 PolarHBondContact O-N 3.45Å; G297-S301 PolarHBondContact O-OG 3.35Å
298	A	91.9	Very high	91.7	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.2	-37.8	176.5	0	0	0	0	0	113.1	V268 A294 T295 G300 S301 G302 F303 I306 L381	V268-A298 HydrophobicContact CG1-CB 3.76Å; V268-A298 HydrophobicContact CG2-CB 4.15Å; A294-A298 WeakPolarHBondContact O-CB 3.27Å; A294-A298 PolarHBondContact O-N 2.89Å; T295-A298 PolarHBondContact O-N 2.87Å; A298-G300 VanDerWaalsContact C-N 3.33Å; A298-S301 CarbonylContact O-C 3.57Å; A298-S301 PolarHBondContact O-N 3.34Å; A298-G302 PolarHBondContact O-N 3.06Å; A298-G302 VanDerWaalsContact O-N 3.15Å; A298-F303 HydrophobicContact CB-CD2 4.14Å; A298-F303 HydrophobicContact CB-CG 4.41Å; A298-F303 WeakPolarHBondContact O-CD2 3.19Å; A298-F303 PolarHBondContact O-N 2.92Å; A298-F303 VanDerWaalsContact O-N 3.13Å; A298-I306 HydrophobicContact CB-CD1 4.13Å; A298-L381 HydrophobicContact CB-CD2 4.17Å
299	I	91.3	Very high	91.8	Very high	6 Å²	6	12.9 Å²	12.9	3%	0.031	10%	0.095	C	C	.	.	H	α-helix	trans	-66.7	-40.1	173.5	-67.6	166.5	0	0	0	110.3	T295 A296 G297 S301 G302 I306 F327 V357 Q363 V365	T295-I299 HydrophobicContact CG2-CD1 4.18Å; T295-I299 WeakPolarHBondContact O-CG1 3.23Å; T295-I299 PolarHBondContact O-N 3.06Å; A296-I299 PolarHBondContact O-N 3.22Å; G297-I299 VanDerWaalsContact C-N 3.32Å; G297-I299 PolarHBondContact O-N 2.88Å; I299-S301 VanDerWaalsContact C-N 3.26Å; I299-S301 PolarHBondContact O-N 3.19Å; I299-G302 PolarHBondContact O-N 3.17Å; I299-G302 VanDerWaalsContact O-N 3.12Å; I299-I306 HydrophobicContact CD1-CD1 4.14Å; I299-I306 HydrophobicContact CG1-CD1 3.59Å; I299-F327 HydrophobicContact CB-CE1 4.1Å; I299-F327 HydrophobicContact CD1-CE1 3.72Å; I299-F327 HydrophobicContact CD1-CZ 3.43Å; I299-F327 VanDerWaalsContact CD1-CZ 3.43Å; I299-F327 HydrophobicContact CG2-CE1 3.97Å; I299-F327 HydrophobicContact CG2-CZ 4.29Å; I299-V357 HydrophobicContact CG2-CG1 4.43Å; I299-V357 HydrophobicContact CG2-CG2 4.24Å; I299-Q363 PolarHBondContact O-NE2 3.11Å; I299-V365 HydrophobicContact CD1-CG2 3.32Å; I299-V365 HydrophobicContact CG1-CG2 4.4Å
300	G	86.8	Confident	91.6	Very high	37 Å²	37	12.6 Å²	12.6	38%	0.381	9%	0.092	S	C	.	.	H	α-helix	trans	-58.9	-35.1	170.8	0	0	0	0	0	113.5	A296 G297 A298 G302	A296-G300 PolarHBondContact O-N 3.12Å; A296-G300 VanDerWaalsContact O-N 3.1Å; G297-G300 CarbonylContact O-C 3.59Å; G297-G300 WeakPolarHBondContact O-CA 3.42Å; G297-G300 PolarHBondContact O-N 3.18Å; G297-G300 VanDerWaalsContact O-N 3.09Å; A298-G300 VanDerWaalsContact C-N 3.33Å; G300-G302 VanDerWaalsContact C-N 3.33Å
301	S	86.2	Confident	91	Very high	77 Å²	77	14.9 Å²	14.9	54%	0.538	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-7.3	175.8	-60.2	0	0	0	0	114.6	G297 A298 I299	G297-S301 PolarHBondContact O-N 3.45Å; G297-S301 PolarHBondContact O-OG 3.35Å; A298-S301 CarbonylContact O-C 3.57Å; A298-S301 PolarHBondContact O-N 3.34Å; I299-S301 VanDerWaalsContact C-N 3.26Å; I299-S301 PolarHBondContact O-N 3.19Å
302	G	87	Confident	90.3	Very high	35 Å²	35	16.7 Å²	16.7	36%	0.361	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	105	12.6	172.8	0	0	0	0	0	116.9	A298 I299 G300 S304 H361	A298-G302 PolarHBondContact O-N 3.06Å; A298-G302 VanDerWaalsContact O-N 3.15Å; I299-G302 PolarHBondContact O-N 3.17Å; I299-G302 VanDerWaalsContact O-N 3.12Å; G300-G302 VanDerWaalsContact C-N 3.33Å; G302-S304 PolarHBondContact O-N 2.76Å; G302-H361 PolarHBondContact O-NE2 2.72Å
303	F	89.5	Confident	89.7	Confident	11 Å²	11	16.9 Å²	16.9	5%	0.048	12%	0.121	C	C	.	.			trans	-67.3	131	174.3	-78.9	-101	0	0	0	111.4	V268 A298 I306 Q363 E380 L381 L403	V268-F303 HydrophobicContact CB-CE2 4.4Å; V268-F303 HydrophobicContact CG1-CD2 3.84Å; V268-F303 HydrophobicContact CG1-CE2 3.36Å; V268-F303 HydrophobicContact CG1-CZ 4.15Å; A298-F303 HydrophobicContact CB-CD2 4.14Å; A298-F303 HydrophobicContact CB-CG 4.41Å; A298-F303 WeakPolarHBondContact O-CD2 3.19Å; A298-F303 PolarHBondContact O-N 2.92Å; A298-F303 VanDerWaalsContact O-N 3.13Å; F303-I306 HydrophobicContact CB-CD1 4.13Å; F303-I306 HydrophobicContact CB-CG1 4.2Å; F303-Q363 WeakPolarHBondContact O-CG 3.31Å; F303-Q363 PolarHBondContact O-NE2 2.87Å; F303-E380 WeakPolarHBondContact CA-OE2 3.31Å; F303-E380 HydrophobicContact CD1-CB 3.81Å; F303-E380 HydrophobicContact CE1-CB 4.25Å; F303-L381 HydrophobicContact CD1-CB 4.21Å; F303-L403 HydrophobicContact CZ-CD2 4.44Å
304	S	89.6	Confident	88.9	Confident	27 Å²	27	20.5 Å²	20.5	19%	0.189	14%	0.138	C	C	.	.			trans	-88.3	-53.3	-175.4	-76.7	0	0	0	0	112.9	G302 H361 Q363 T364 E380	G302-S304 PolarHBondContact O-N 2.76Å; S304-H361 PolarHBondContact OG-CD2 2.9Å; S304-H361 PolarHBondContact OG-NE2 3.21Å; S304-Q363 CarbonylContact O-C 3.58Å; S304-Q363 VanDerWaalsContact O-CA 3.32Å; S304-Q363 WeakPolarHBondContact O-CA 3.46Å; S304-T364 PolarHBondContact O-N 3.03Å; S304-E380 PolarHBondContact N-OE2 2.83Å
305	N	91.9	Very high	88.1	Confident	44 Å²	44	23 Å²	23	24%	0.235	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	100.6	-171.3	-69.9	-30.5	0	0	0	110.9	F307 T364 Q378 E380	N305-F307 HydrophobicContact CB-CE2 4.35Å; N305-T364 PolarHBondContact OD1-OG1 2.98Å; N305-Q378 PolarHBondContact ND2-O 3.14Å; N305-E380 PolarHBondContact O-N 3.11Å; N305-E380 VanDerWaalsContact O-N 3.13Å
306	I	94.5	Very high	87.7	Confident	1 Å²	1	23 Å²	23	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122	177.3	-52.2	178.5	0	0	0	109.1	T295 A298 I299 F303 T364 V365 Q366 L381 I383	T295-I306 HydrophobicContact CG2-CD1 3.91Å; T295-I306 HydrophobicContact CG2-CG2 4.16Å; A298-I306 HydrophobicContact CB-CD1 4.13Å; I299-I306 HydrophobicContact CD1-CD1 4.14Å; I299-I306 HydrophobicContact CG1-CD1 3.59Å; F303-I306 HydrophobicContact CB-CD1 4.13Å; F303-I306 HydrophobicContact CB-CG1 4.2Å; I306-T364 PolarHBondContact N-O 3.26Å; I306-V365 HydrophobicContact CB-CG2 4.41Å; I306-V365 VanDerWaalsContact O-CA 3.3Å; I306-V365 WeakPolarHBondContact O-CA 3.45Å; I306-Q366 PolarHBondContact O-N 3.33Å; I306-L381 WeakPolarHBondContact CA-O 3.41Å; I306-L381 HydrophobicContact CD1-CD2 4.26Å; I306-L381 HydrophobicContact CG1-CB 4.31Å; I306-L381 HydrophobicContact CG1-CD2 4.4Å; I306-L381 HydrophobicContact CG2-CB 4.31Å; I306-L381 HydrophobicContact CG2-CD2 4.05Å; I306-L381 HydrophobicContact CG2-CG 4.1Å; I306-I383 HydrophobicContact CG2-CD1 4.01Å; I306-I383 HydrophobicContact CG2-CG1 4.44Å
307	F	95	Very high	87.4	Confident	19 Å²	19	30.1 Å²	30.1	8%	0.083	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	134.8	175.1	-66.3	-71.8	0	0	0	111.2	N305 Q366 I368 L376 A379 L381 V382 I383	N305-F307 HydrophobicContact CB-CE2 4.35Å; F307-Q366 WeakPolarHBondContact CA-O 3.47Å; F307-Q366 HydrophobicContact CD1-CB 3.95Å; F307-Q366 HydrophobicContact CD1-CG 4.43Å; F307-Q366 HydrophobicContact CE1-CB 3.98Å; F307-Q366 HydrophobicContact CE1-CG 4.36Å; F307-I368 HydrophobicContact CB-CD1 4.11Å; F307-I368 HydrophobicContact CD1-CD1 3.12Å; F307-I368 HydrophobicContact CD1-CG1 3.64Å; F307-I368 HydrophobicContact CD2-CD1 4.3Å; F307-I368 HydrophobicContact CE1-CD1 3.45Å; F307-I368 VanDerWaalsContact CE1-CD1 3.45Å; F307-I368 HydrophobicContact CE1-CG1 4.15Å; F307-I368 HydrophobicContact CG-CD1 3.59Å; F307-I368 HydrophobicContact CG-CG1 4.33Å; F307-I368 HydrophobicContact CZ-CD1 4.15Å; F307-L376 HydrophobicContact CB-CD2 3.64Å; F307-L376 HydrophobicContact CD2-CD2 3.82Å; F307-L376 HydrophobicContact CG-CD2 3.8Å; F307-A379 HydrophobicContact CD2-CB 3.48Å; F307-A379 VanDerWaalsContact CD2-CB 3.48Å; F307-A379 HydrophobicContact CE2-CB 3.9Å; F307-L381 PolarHBondContact N-O 2.96Å; F307-V382 CarbonylContact O-C 3.27Å; F307-V382 WeakPolarHBondContact O-CA 3.41Å; F307-I383 PolarHBondContact O-N 3.24Å
308	V	94.5	Very high	87.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.9	174.6	63.9	0	0	0	0	110	L316 Y319 F320 Q366 Y367 I368 I383	V308-L316 HydrophobicContact CG1-CD1 3.89Å; V308-L316 HydrophobicContact CG2-CD1 3.91Å; V308-L316 HydrophobicContact CG2-CD2 3.65Å; V308-L316 HydrophobicContact CG2-CG 4.44Å; V308-Y319 HydrophobicContact CB-CE1 4.02Å; V308-Y319 HydrophobicContact CG1-CE1 3.96Å; V308-Y319 HydrophobicContact CG2-CD1 4.23Å; V308-Y319 HydrophobicContact CG2-CE1 3.87Å; V308-Y319 HydrophobicContact CG2-CE2 4.44Å; V308-F320 HydrophobicContact CG1-CE1 4.41Å; V308-F320 HydrophobicContact CG1-CE2 4.4Å; V308-F320 HydrophobicContact CG1-CZ 3.76Å; V308-Q366 PolarHBondContact N-O 3.33Å; V308-Y367 CarbonylContact O-C 3.59Å; V308-Y367 VanDerWaalsContact O-CA 3.28Å; V308-Y367 WeakPolarHBondContact O-CA 3.47Å; V308-Y367 WeakPolarHBondContact O-CD2 3.38Å; V308-I368 PolarHBondContact O-N 2.67Å; V308-I383 CarbonylContact C-O 3.49Å; V308-I383 VanDerWaalsContact CA-O 3.3Å; V308-I383 WeakPolarHBondContact CA-O 3.29Å; V308-I383 HydrophobicContact CG2-CB 4.31Å; V308-I383 HydrophobicContact CG2-CG2 4.31Å
309	T	92.4	Very high	87.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	140.1	178.6	-59.2	0	0	0	0	109.6	P370 I383 D385 I390 L398	T309-P370 HydrophobicContact CG2-CB 3.65Å; T309-P370 HydrophobicContact CG2-CG 4.25Å; T309-I383 PolarHBondContact N-O 3.02Å; T309-D385 PolarHBondContact O-N 3.01Å; T309-I390 HydrophobicContact CG2-CD1 4.01Å; T309-L398 HydrophobicContact CG2-CD1 3.89Å
310	S	87.7	Confident	87.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.191	C	C	.	.			trans	-153	162.4	172.7	70.8	0	0	0	0	108.5	S312 L316 Y367 P370	S310-S312 PolarHBondContact O-N 3.21Å; S310-S312 PolarHBondContact OG-O 2.81Å; S310-L316 WeakPolarHBondContact OG-CD1 3.43Å; S310-L316 WeakPolarHBondContact OG-CG 3.48Å; S310-Y367 PolarHBondContact O-OH 2.65Å; S310-P370 WeakPolarHBondContact O-CD 3.23Å
311	P	80.4	Confident	87.4	Confident	48 Å²	48	34 Å²	34	31%	0.312	19%	0.192	S	C	.	.	S	Bend	trans	-64.7	-27.1	177.5	25.9	-36.2	0	0	0	113.3	A389	P311-A389 HydrophobicContact CG-CB 4.03Å
312	S	79.3	Confident	87.7	Confident	39 Å²	39	32.1 Å²	32.1	27%	0.273	17%	0.174	S	C	.	.	S	Bend	trans	-150.8	138.3	178.6	62.1	0	0	0	0	110.1	S310 E314 N315	S310-S312 PolarHBondContact O-N 3.21Å; S310-S312 PolarHBondContact OG-O 2.81Å; S312-E314 PolarHBondContact O-N 2.79Å; S312-E314 VanDerWaalsContact O-N 3.1Å; S312-N315 PolarHBondContact O-N 3.06Å; S312-N315 VanDerWaalsContact O-N 3.1Å; S312-N315 PolarHBondContact OG-ND2 3.25Å
313	P	80.2	Confident	88.1	Confident	5 Å²	5	30.5 Å²	30.5	3%	0.032	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-64.4	-21.1	-175.2	26.1	-34.2	0	0	0	113.5	N315 L316 F348 A351 Y367	P313-N315 PolarHBondContact O-N 3.09Å; P313-L316 PolarHBondContact O-N 2.84Å; P313-L316 VanDerWaalsContact O-N 3.16Å; P313-F348 HydrophobicContact CG-CB 3.94Å; P313-F348 HydrophobicContact CG-CD1 3.32Å; P313-F348 HydrophobicContact CG-CD2 4.17Å; P313-F348 HydrophobicContact CG-CE1 3.79Å; P313-F348 HydrophobicContact CG-CG 3.55Å; P313-F348 HydrophobicContact CG-CZ 4.41Å; P313-A351 HydrophobicContact CB-CB 4.09Å; P313-Y367 HydrophobicContact CB-CD1 4.31Å; P313-Y367 HydrophobicContact CB-CE1 4.11Å; P313-Y367 HydrophobicContact CG-CE1 4.43Å
314	E	76.8	Confident	88.2	Confident	76 Å²	76	31 Å²	31	36%	0.355	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-60.7	-34	175.5	-61.3	-163.8	150.1	0	0	112.9	S312 L316 K317 N349	S312-E314 PolarHBondContact O-N 2.79Å; S312-E314 VanDerWaalsContact O-N 3.1Å; E314-L316 PolarHBondContact O-N 3.06Å; E314-K317 WeakPolarHBondContact O-CB 3.37Å; E314-K317 PolarHBondContact O-N 3.01Å; E314-N349 PolarHBondContact OE1-ND2 3.19Å
315	N	77	Confident	88.3	Confident	51 Å²	51	35.3 Å²	35.3	27%	0.273	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-67.4	-24.1	180	-68.4	-15.8	0	0	0	111.9	S312 P313 K317	S312-N315 PolarHBondContact O-N 3.06Å; S312-N315 VanDerWaalsContact O-N 3.1Å; S312-N315 PolarHBondContact OG-ND2 3.25Å; P313-N315 PolarHBondContact O-N 3.09Å; N315-K317 VanDerWaalsContact C-N 3.27Å; N315-K317 PolarHBondContact O-N 3.34Å
316	L	86.2	Confident	88.3	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-83.5	1.2	179.9	-64.9	175.2	0	0	0	113.5	V308 S310 P313 E314 T318 Y319 F320 Y367 D385	V308-L316 HydrophobicContact CG1-CD1 3.89Å; V308-L316 HydrophobicContact CG2-CD1 3.91Å; V308-L316 HydrophobicContact CG2-CD2 3.65Å; V308-L316 HydrophobicContact CG2-CG 4.44Å; S310-L316 WeakPolarHBondContact OG-CD1 3.43Å; S310-L316 WeakPolarHBondContact OG-CG 3.48Å; P313-L316 PolarHBondContact O-N 2.84Å; P313-L316 VanDerWaalsContact O-N 3.16Å; E314-L316 PolarHBondContact O-N 3.06Å; L316-T318 VanDerWaalsContact C-N 3.28Å; L316-T318 PolarHBondContact O-N 2.66Å; L316-Y319 HydrophobicContact CD2-CD1 4.26Å; L316-Y319 HydrophobicContact CD2-CG 4.22Å; L316-Y319 WeakPolarHBondContact O-CB 3.46Å; L316-Y319 PolarHBondContact O-N 3.49Å; L316-Y319 VanDerWaalsContact O-N 3.11Å; L316-F320 HydrophobicContact CB-CD2 3.86Å; L316-F320 HydrophobicContact CB-CE2 3.84Å; L316-F320 HydrophobicContact CD1-CE2 4.18Å; L316-F320 WeakPolarHBondContact O-CD2 3.46Å; L316-F320 PolarHBondContact O-N 3.5Å; L316-Y367 HydrophobicContact CD1-CD2 3.4Å; L316-Y367 VanDerWaalsContact CD1-CD2 3.4Å; L316-Y367 HydrophobicContact CD1-CE2 3.99Å; L316-Y367 HydrophobicContact CD1-CG 4.24Å; L316-D385 HydrophobicContact CD2-CB 3.97Å
317	K	86.4	Confident	88.1	Confident	151 Å²	151	33.1 Å²	33.1	66%	0.657	16%	0.163	S	C	*	.	H	α-helix	trans	-55.6	-45	178.3	-175.7	175.8	-178.3	175.5	0	112.1	E314 N315 Q321	E314-K317 WeakPolarHBondContact O-CB 3.37Å; E314-K317 PolarHBondContact O-N 3.01Å; N315-K317 VanDerWaalsContact C-N 3.27Å; N315-K317 PolarHBondContact O-N 3.34Å; K317-Q321 VanDerWaalsContact O-CB 3.32Å; K317-Q321 WeakPolarHBondContact O-CB 3.46Å; K317-Q321 PolarHBondContact O-N 2.89Å; K317-Q321 VanDerWaalsContact O-N 3.08Å
318	T	87	Confident	87.9	Confident	43 Å²	43	36.6 Å²	36.6	26%	0.264	18%	0.182	S	C	.	.	H	α-helix	trans	-69.2	-39.2	177.3	45.8	0	0	0	0	111.7	L316 Q321 F322	L316-T318 VanDerWaalsContact C-N 3.28Å; L316-T318 PolarHBondContact O-N 2.66Å; T318-Q321 PolarHBondContact O-N 3.36Å; T318-F322 WeakPolarHBondContact O-CD2 3.46Å; T318-F322 PolarHBondContact O-N 3.01Å; T318-F322 VanDerWaalsContact O-N 3.11Å
319	Y	92.2	Very high	87.6	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58	-55.9	176.5	166.9	-94.6	0	0	0	111.1	L291 T295 V308 L316 Q321 F322 V323 V365 I383	L291-Y319 HydrophobicContact CB-CD2 4.05Å; L291-Y319 HydrophobicContact CB-CE2 4.1Å; T295-Y319 WeakPolarHBondContact CG2-OH 3.49Å; T295-Y319 WeakPolarHBondContact OG1-CE2 3.38Å; T295-Y319 PolarHBondContact OG1-OH 3.46Å; V308-Y319 HydrophobicContact CB-CE1 4.02Å; V308-Y319 HydrophobicContact CG1-CE1 3.96Å; V308-Y319 HydrophobicContact CG2-CD1 4.23Å; V308-Y319 HydrophobicContact CG2-CE1 3.87Å; V308-Y319 HydrophobicContact CG2-CE2 4.44Å; L316-Y319 HydrophobicContact CD2-CD1 4.26Å; L316-Y319 HydrophobicContact CD2-CG 4.22Å; L316-Y319 WeakPolarHBondContact O-CB 3.46Å; L316-Y319 PolarHBondContact O-N 3.49Å; L316-Y319 VanDerWaalsContact O-N 3.11Å; Y319-Q321 VanDerWaalsContact C-N 3.31Å; Y319-Q321 PolarHBondContact O-N 2.96Å; Y319-F322 PolarHBondContact O-N 3.27Å; Y319-V323 HydrophobicContact CD1-CG2 4.34Å; Y319-V323 HydrophobicContact CE1-CG2 3.97Å; Y319-V323 HydrophobicContact CE2-CG2 4.37Å; Y319-V323 WeakPolarHBondContact O-CG2 3.49Å; Y319-V323 PolarHBondContact O-N 2.92Å; Y319-V365 HydrophobicContact CE1-CG1 4.49Å; Y319-I383 HydrophobicContact CE2-CD1 4.24Å; Y319-I383 HydrophobicContact CE2-CG2 4.37Å; Y319-I383 WeakPolarHBondContact OH-CD1 3.49Å
320	F	92.4	Very high	87.4	Confident	1 Å²	1	38.6 Å²	38.6	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-63.8	-35.4	-179.6	-75.5	-62.9	0	0	0	112.7	V308 L316 F322 V323 C324 I352 I355 V365	V308-F320 HydrophobicContact CG1-CE1 4.41Å; V308-F320 HydrophobicContact CG1-CE2 4.4Å; V308-F320 HydrophobicContact CG1-CZ 3.76Å; L316-F320 HydrophobicContact CB-CD2 3.86Å; L316-F320 HydrophobicContact CB-CE2 3.84Å; L316-F320 HydrophobicContact CD1-CE2 4.18Å; L316-F320 WeakPolarHBondContact O-CD2 3.46Å; L316-F320 PolarHBondContact O-N 3.5Å; F320-F322 VanDerWaalsContact C-N 3.28Å; F320-F322 PolarHBondContact O-N 2.83Å; F320-V323 WeakPolarHBondContact O-CB 3.42Å; F320-V323 PolarHBondContact O-N 2.95Å; F320-C324 PolarHBondContact O-N 2.87Å; F320-C324 PolarHBondContact O-SG 2.79Å; F320-I352 HydrophobicContact CB-CB 4.14Å; F320-I352 HydrophobicContact CB-CD1 3.81Å; F320-I352 HydrophobicContact CB-CG2 4.19Å; F320-I352 HydrophobicContact CD1-CG2 3.86Å; F320-I352 HydrophobicContact CD2-CB 3.83Å; F320-I352 HydrophobicContact CD2-CG2 3.98Å; F320-I352 HydrophobicContact CE1-CG2 4.17Å; F320-I352 HydrophobicContact CE2-CB 4.36Å; F320-I352 HydrophobicContact CE2-CG2 4.29Å; F320-I352 WeakPolarHBondContact CE2-O 3.42Å; F320-I352 HydrophobicContact CG-CB 3.94Å; F320-I352 HydrophobicContact CG-CG2 3.75Å; F320-I352 HydrophobicContact CZ-CG2 4.37Å; F320-I355 HydrophobicContact CD1-CD1 3.67Å; F320-I355 HydrophobicContact CD1-CG1 4.21Å; F320-I355 HydrophobicContact CE1-CD1 4.24Å; F320-I355 HydrophobicContact CE1-CG1 4.39Å; F320-V365 HydrophobicContact CE1-CG1 4.02Å
321	Q	90.4	Very high	87.4	Confident	86 Å²	86	44.7 Å²	44.7	40%	0.402	23%	0.228	S	C	.	.	H	α-helix	trans	-59.1	-40.2	173.8	-176	179.8	15.2	0	0	112	K317 T318 Y319 R325	K317-Q321 VanDerWaalsContact O-CB 3.32Å; K317-Q321 WeakPolarHBondContact O-CB 3.46Å; K317-Q321 PolarHBondContact O-N 2.89Å; K317-Q321 VanDerWaalsContact O-N 3.08Å; T318-Q321 PolarHBondContact O-N 3.36Å; Y319-Q321 VanDerWaalsContact C-N 3.31Å; Y319-Q321 PolarHBondContact O-N 2.96Å; Q321-R325 WeakPolarHBondContact O-CG 3.45Å; Q321-R325 PolarHBondContact O-N 2.82Å
322	F	92.4	Very high	87.7	Confident	38 Å²	38	43.4 Å²	43.4	17%	0.167	22%	0.218	C	C	.	.	H	α-helix	trans	-78.4	-24.9	177.8	-85.9	-93	0	0	0	113.2	A289 L293 T318 Y319 F320 G326	A289-F322 HydrophobicContact CB-CB 4.45Å; A289-F322 HydrophobicContact CB-CD1 3.79Å; A289-F322 HydrophobicContact CB-CD2 3.62Å; A289-F322 HydrophobicContact CB-CE1 3.82Å; A289-F322 HydrophobicContact CB-CE2 3.65Å; A289-F322 HydrophobicContact CB-CG 3.68Å; A289-F322 HydrophobicContact CB-CZ 3.74Å; L293-F322 HydrophobicContact CD1-CD1 4.37Å; L293-F322 HydrophobicContact CD2-CD1 4.29Å; L293-F322 HydrophobicContact CG-CD1 4.14Å; T318-F322 WeakPolarHBondContact O-CD2 3.46Å; T318-F322 PolarHBondContact O-N 3.01Å; T318-F322 VanDerWaalsContact O-N 3.11Å; Y319-F322 PolarHBondContact O-N 3.27Å; F320-F322 VanDerWaalsContact C-N 3.28Å; F320-F322 PolarHBondContact O-N 2.83Å; F322-G326 PolarHBondContact O-N 2.7Å
323	V	94	Very high	88	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.4	-51	166.5	177.5	0	0	0	0	110	T295 Y319 F320 R325 G326 F327 I355	T295-V323 HydrophobicContact CG2-CG2 4.3Å; Y319-V323 HydrophobicContact CD1-CG2 4.34Å; Y319-V323 HydrophobicContact CE1-CG2 3.97Å; Y319-V323 HydrophobicContact CE2-CG2 4.37Å; Y319-V323 WeakPolarHBondContact O-CG2 3.49Å; Y319-V323 PolarHBondContact O-N 2.92Å; F320-V323 WeakPolarHBondContact O-CB 3.42Å; F320-V323 PolarHBondContact O-N 2.95Å; V323-R325 PolarHBondContact O-N 2.85Å; V323-G326 PolarHBondContact O-N 3.37Å; V323-G326 VanDerWaalsContact O-N 3.14Å; V323-F327 HydrophobicContact CG1-CD2 4.18Å; V323-F327 HydrophobicContact CG1-CE1 4.23Å; V323-F327 HydrophobicContact CG1-CE2 3.63Å; V323-F327 HydrophobicContact CG1-CZ 3.66Å; V323-F327 WeakPolarHBondContact O-CG 3.2Å; V323-F327 PolarHBondContact O-N 2.67Å; V323-I355 HydrophobicContact CB-CD1 4.4Å; V323-I355 HydrophobicContact CG1-CD1 3.95Å
324	C	92.6	Very high	88.2	Confident	23 Å²	23	52.6 Å²	52.6	16%	0.155	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-43.7	177.4	-64.2	0	0	0	0	112.2	F320 G326 F327 D328	F320-C324 PolarHBondContact O-N 2.87Å; F320-C324 PolarHBondContact O-SG 2.79Å; C324-G326 VanDerWaalsContact C-N 3.3Å; C324-G326 PolarHBondContact O-N 3.43Å; C324-F327 WeakPolarHBondContact O-CB 3.36Å; C324-F327 PolarHBondContact O-N 2.76Å; C324-F327 VanDerWaalsContact O-N 3.16Å; C324-D328 VanDerWaalsContact O-CG 3.27Å; C324-D328 PolarHBondContact O-N 3.41Å
325	R	91.7	Very high	88.6	Confident	116 Å²	116	56.2 Å²	56.2	44%	0.438	27%	0.271	S	S	.	.	H	α-helix	trans	-63.5	-35.6	175.1	-73.6	-179.8	174.3	-167.6	-2.5	113.1	L251 Q321 V323 D328 A329	L251-R325 HydrophobicContact CD1-CB 4.34Å; L251-R325 WeakPolarHBondContact CD1-O 3.42Å; Q321-R325 WeakPolarHBondContact O-CG 3.45Å; Q321-R325 PolarHBondContact O-N 2.82Å; V323-R325 PolarHBondContact O-N 2.85Å; R325-D328 PolarHBondContact O-N 2.8Å; R325-A329 PolarHBondContact O-N 2.87Å; R325-A329 VanDerWaalsContact O-N 3.07Å
326	G	91.4	Very high	89	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.9	-40.4	173.5	0	0	0	0	0	111.7	F322 V323 C324 A329 L330	F322-G326 PolarHBondContact O-N 2.7Å; V323-G326 PolarHBondContact O-N 3.37Å; V323-G326 VanDerWaalsContact O-N 3.14Å; C324-G326 VanDerWaalsContact C-N 3.3Å; C324-G326 PolarHBondContact O-N 3.43Å; G326-A329 PolarHBondContact O-N 3.41Å; G326-L330 WeakPolarHBondContact O-CG 3.48Å; G326-L330 PolarHBondContact O-N 3.33Å
327	F	91.2	Very high	89.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.2	-45.1	172.2	-71.3	-18.6	0	0	0	112.6	A296 I299 V323 C324 A329 L330 N331 F332 Y338 I355 V357	A296-F327 HydrophobicContact CB-CD1 3.98Å; A296-F327 HydrophobicContact CB-CE1 4.1Å; I299-F327 HydrophobicContact CB-CE1 4.1Å; I299-F327 HydrophobicContact CD1-CE1 3.72Å; I299-F327 HydrophobicContact CD1-CZ 3.43Å; I299-F327 VanDerWaalsContact CD1-CZ 3.43Å; I299-F327 HydrophobicContact CG2-CE1 3.97Å; I299-F327 HydrophobicContact CG2-CZ 4.29Å; V323-F327 HydrophobicContact CG1-CD2 4.18Å; V323-F327 HydrophobicContact CG1-CE1 4.23Å; V323-F327 HydrophobicContact CG1-CE2 3.63Å; V323-F327 HydrophobicContact CG1-CZ 3.66Å; V323-F327 WeakPolarHBondContact O-CG 3.2Å; V323-F327 PolarHBondContact O-N 2.67Å; C324-F327 WeakPolarHBondContact O-CB 3.36Å; C324-F327 PolarHBondContact O-N 2.76Å; C324-F327 VanDerWaalsContact O-N 3.16Å; F327-A329 VanDerWaalsContact C-N 3.28Å; F327-A329 PolarHBondContact O-N 3.22Å; F327-L330 CarbonylContact O-C 3.58Å; F327-L330 PolarHBondContact O-N 3.19Å; F327-L330 VanDerWaalsContact O-N 3.1Å; F327-N331 PolarHBondContact O-N 3.17Å; F327-N331 VanDerWaalsContact O-N 3.1Å; F327-F332 HydrophobicContact CB-CB 3.86Å; F327-F332 HydrophobicContact CG-CB 4.4Å; F327-F332 PolarHBondContact O-N 3Å; F327-Y338 HydrophobicContact CB-CD1 4.47Å; F327-Y338 HydrophobicContact CB-CE1 3.95Å; F327-Y338 AromaticContact CD2-CD1 3.96Å; F327-Y338 HydrophobicContact CD2-CD1 3.96Å; F327-Y338 HydrophobicContact CD2-CD2 4.15Å; F327-Y338 AromaticContact CD2-CE1 3.96Å; F327-Y338 HydrophobicContact CD2-CE1 3.96Å; F327-Y338 HydrophobicContact CD2-CE2 4.16Å; F327-Y338 HydrophobicContact CD2-CG 4.04Å; F327-Y338 HydrophobicContact CE2-CD2 4.42Å; F327-Y338 HydrophobicContact CE2-CG 4.33Å; F327-Y338 HydrophobicContact CG-CE1 4.39Å; F327-I355 HydrophobicContact CE2-CG2 3.97Å; F327-V357 HydrophobicContact CE2-CG2 4.14Å; F327-V357 HydrophobicContact CZ-CG2 3.89Å
328	D	90.4	Very high	89.3	Confident	92 Å²	92	54.8 Å²	54.8	49%	0.492	27%	0.267	S	S	.	.	H	α-helix	trans	-58.7	-41.8	175.6	-60.4	-25.4	0	0	0	111	C324 R325 L330 N331	C324-D328 VanDerWaalsContact O-CG 3.27Å; C324-D328 PolarHBondContact O-N 3.41Å; R325-D328 PolarHBondContact O-N 2.8Å; D328-L330 VanDerWaalsContact C-N 3.35Å; D328-L330 PolarHBondContact O-N 3.47Å; D328-N331 PolarHBondContact O-N 2.86Å; D328-N331 VanDerWaalsContact O-N 3.12Å
329	A	88.3	Confident	89.5	Confident	25 Å²	25	57.8 Å²	57.8	21%	0.207	28%	0.278	C	S	.	.	H	α-helix	trans	-67.3	-32.7	176.6	0	0	0	0	0	113.5	S247 L251 R325 G326 F327 N331	S247-A329 PolarHBondContact OG-O 3.17Å; L251-A329 HydrophobicContact CD1-CB 3.79Å; L251-A329 HydrophobicContact CG-CB 4.4Å; R325-A329 PolarHBondContact O-N 2.87Å; R325-A329 VanDerWaalsContact O-N 3.07Å; G326-A329 PolarHBondContact O-N 3.41Å; F327-A329 VanDerWaalsContact C-N 3.28Å; F327-A329 PolarHBondContact O-N 3.22Å; A329-N331 PolarHBondContact O-N 3.33Å
330	L	86.9	Confident	89.4	Confident	16 Å²	16	59.2 Å²	59.2	8%	0.084	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	8.3	173.2	-66.3	173.2	0	0	0	113.2	Q244 L248 A296 G326 F327 D328 F332	Q244-L330 HydrophobicContact CB-CD2 3.8Å; Q244-L330 HydrophobicContact CG-CD2 4.13Å; L248-L330 HydrophobicContact CD1-CD1 4.29Å; L248-L330 HydrophobicContact CD1-CD2 4.18Å; L248-L330 HydrophobicContact CD1-CG 4.43Å; L248-L330 HydrophobicContact CD2-CD1 4.18Å; L248-L330 HydrophobicContact CD2-CD2 4.42Å; L248-L330 HydrophobicContact CD2-CG 3.98Å; L248-L330 HydrophobicContact CG-CD2 4.11Å; L248-L330 HydrophobicContact CG-CG 4.23Å; A296-L330 HydrophobicContact CB-CD1 4.47Å; A296-L330 WeakPolarHBondContact O-CD1 3.39Å; G326-L330 WeakPolarHBondContact O-CG 3.48Å; G326-L330 PolarHBondContact O-N 3.33Å; F327-L330 CarbonylContact O-C 3.58Å; F327-L330 PolarHBondContact O-N 3.19Å; F327-L330 VanDerWaalsContact O-N 3.1Å; D328-L330 VanDerWaalsContact C-N 3.35Å; D328-L330 PolarHBondContact O-N 3.47Å; L330-F332 VanDerWaalsContact C-N 3.34Å; L330-F332 HydrophobicContact CB-CD2 3.64Å; L330-F332 HydrophobicContact CB-CE2 3.81Å; L330-F332 HydrophobicContact CD1-CE2 4.46Å; L330-F332 PolarHBondContact O-N 3.37Å
331	N	88	Confident	89.2	Confident	128 Å²	128	62 Å²	62	68%	0.684	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	35.1	-178.2	-56.1	-54	0	0	0	114.4	F327 D328 A329	F327-N331 PolarHBondContact O-N 3.17Å; F327-N331 VanDerWaalsContact O-N 3.1Å; D328-N331 PolarHBondContact O-N 2.86Å; D328-N331 VanDerWaalsContact O-N 3.12Å; A329-N331 PolarHBondContact O-N 3.33Å
332	F	86.4	Confident	89	Confident	22 Å²	22	63.3 Å²	63.3	10%	0.096	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-87.3	133.2	167	-74.9	-107.4	0	0	0	109.2	F327 L330 D337 Y338 V357 R359	F327-F332 HydrophobicContact CB-CB 3.86Å; F327-F332 HydrophobicContact CG-CB 4.4Å; F327-F332 PolarHBondContact O-N 3Å; L330-F332 VanDerWaalsContact C-N 3.34Å; L330-F332 HydrophobicContact CB-CD2 3.64Å; L330-F332 HydrophobicContact CB-CE2 3.81Å; L330-F332 HydrophobicContact CD1-CE2 4.46Å; L330-F332 PolarHBondContact O-N 3.37Å; F332-D337 WeakPolarHBondContact CA-OD2 3.34Å; F332-D337 HydrophobicContact CB-CB 4.25Å; F332-D337 HydrophobicContact CD1-CB 3.8Å; F332-D337 HydrophobicContact CG-CB 4.45Å; F332-Y338 HydrophobicContact CB-CD1 4.1Å; F332-Y338 HydrophobicContact CB-CE1 4.23Å; F332-V357 HydrophobicContact CD1-CG1 4.12Å; F332-V357 HydrophobicContact CE1-CG1 3.86Å; F332-R359 HydrophobicContact CD1-CB 4.43Å; F332-R359 HydrophobicContact CE1-CB 3.95Å; F332-R359 HydrophobicContact CE1-CG 4.33Å
333	K	87.1	Confident	88.6	Confident	131 Å²	131	62.4 Å²	62.4	57%	0.57	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-99.4	133.1	-179.8	-66.9	-178.8	-178.5	-179.7	0	111.5	M336 D337	K333-M336 HydrophobicContact CB-CB 4.08Å; K333-M336 HydrophobicContact CB-CG 4.46Å; K333-M336 HydrophobicContact CB-SD 4.42Å; K333-M336 HydrophobicContact CD-SD 3.8Å; K333-M336 PolarHBondContact O-N 2.95Å; K333-D337 PolarHBondContact N-OD2 3.06Å; K333-D337 PolarHBondContact O-N 2.89Å
334	E	84.3	Confident	88	Confident	105 Å²	105	67.1 Å²	67.1	49%	0.491	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-60.5	140.9	172.2	-164.5	174.4	-170.6	0	0	110.4	M336 Y338	E334-M336 PolarHBondContact O-N 3.34Å; E334-Y338 HydrophobicContact CB-CE1 4.21Å; E334-Y338 HydrophobicContact CB-CE2 4.2Å; E334-Y338 HydrophobicContact CG-CE2 3.97Å
335	H	84.7	Confident	87.3	Confident	153 Å²	153	70.3 Å²	70.3	71%	0.708	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	-14.3	-175.4	-53.2	-63	0	0	0	117.1	Y338	H335-Y338 WeakPolarHBondContact CA-O 3.17Å; H335-Y338 PolarHBondContact N-O 3.44Å
336	M	85.1	Confident	86.5	Confident	137 Å²	137	70.4 Å²	70.4	68%	0.675	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-55.3	170.8	-66.3	-172.8	66.7	0	0	111.3	K333 E334	K333-M336 HydrophobicContact CB-CB 4.08Å; K333-M336 HydrophobicContact CB-CG 4.46Å; K333-M336 HydrophobicContact CB-SD 4.42Å; K333-M336 HydrophobicContact CD-SD 3.8Å; K333-M336 PolarHBondContact O-N 2.95Å; E334-M336 PolarHBondContact O-N 3.34Å
337	D	87.4	Confident	85.5	Confident	29 Å²	29	78 Å²	78	16%	0.155	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-27.7	-174.6	-61.6	-49.3	0	0	0	112.2	F332 K333 V357 I358 R359	F332-D337 WeakPolarHBondContact CA-OD2 3.34Å; F332-D337 HydrophobicContact CB-CB 4.25Å; F332-D337 HydrophobicContact CD1-CB 3.8Å; F332-D337 HydrophobicContact CG-CB 4.45Å; K333-D337 PolarHBondContact N-OD2 3.06Å; K333-D337 PolarHBondContact O-N 2.89Å; D337-V357 CarbonylContact O-C 3.59Å; D337-V357 WeakPolarHBondContact O-CA 3.47Å; D337-V357 WeakPolarHBondContact O-CG1 3.49Å; D337-I358 PolarHBondContact O-N 3.46Å; D337-R359 HydrophobicContact CB-CB 4.28Å
338	Y	90.8	Very high	84.4	Confident	5 Å²	5	80.9 Å²	80.9	2%	0.02	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	153.1	179.4	72.5	-88.1	0	0	0	113.7	F327 F332 E334 H335 V340 I355 S356	F327-Y338 HydrophobicContact CB-CD1 4.47Å; F327-Y338 HydrophobicContact CB-CE1 3.95Å; F327-Y338 AromaticContact CD2-CD1 3.96Å; F327-Y338 HydrophobicContact CD2-CD1 3.96Å; F327-Y338 HydrophobicContact CD2-CD2 4.15Å; F327-Y338 AromaticContact CD2-CE1 3.96Å; F327-Y338 HydrophobicContact CD2-CE1 3.96Å; F327-Y338 HydrophobicContact CD2-CE2 4.16Å; F327-Y338 HydrophobicContact CD2-CG 4.04Å; F327-Y338 HydrophobicContact CE2-CD2 4.42Å; F327-Y338 HydrophobicContact CE2-CG 4.33Å; F327-Y338 HydrophobicContact CG-CE1 4.39Å; F332-Y338 HydrophobicContact CB-CD1 4.1Å; F332-Y338 HydrophobicContact CB-CE1 4.23Å; E334-Y338 HydrophobicContact CB-CE1 4.21Å; E334-Y338 HydrophobicContact CB-CE2 4.2Å; E334-Y338 HydrophobicContact CG-CE2 3.97Å; H335-Y338 WeakPolarHBondContact CA-O 3.17Å; H335-Y338 PolarHBondContact N-O 3.44Å; Y338-V340 HydrophobicContact CD2-CG2 3.92Å; Y338-V340 HydrophobicContact CE2-CG2 3.73Å; Y338-I355 HydrophobicContact CD2-CG2 3.91Å; Y338-I355 HydrophobicContact CG-CG2 4.46Å; Y338-S356 CarbonylContact C-O 3.59Å; Y338-S356 WeakPolarHBondContact CA-O 3.44Å
339	E	91.5	Very high	83.5	Confident	107 Å²	107	82.4 Å²	82.4	50%	0.5	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	134.7	176.9	-173	-174.2	178.9	0	0	110.7	I355 S356	E339-I355 WeakPolarHBondContact O-CA 3.01Å; E339-S356 PolarHBondContact N-O 3.38Å; E339-S356 PolarHBondContact O-N 3.33Å
340	V	89.9	Confident	83	Confident	29 Å²	29	88.5 Å²	88.5	18%	0.176	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119	179.4	-175.6	0	0	0	0	110.1	Y338 I352 I355	Y338-V340 HydrophobicContact CD2-CG2 3.92Å; Y338-V340 HydrophobicContact CE2-CG2 3.73Å; V340-I352 HydrophobicContact CG1-CB 4.26Å; V340-I352 HydrophobicContact CG1-CD1 3.82Å; V340-I352 HydrophobicContact CG1-CG1 3.71Å; V340-I352 HydrophobicContact CG1-CG2 3.59Å; V340-I355 HydrophobicContact CG1-CG1 4.46Å; V340-I355 HydrophobicContact CG2-CG1 4.36Å
341	V	88.5	Confident	82.6	Confident	60 Å²	60	88.4 Å²	88.4	36%	0.364	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.2	178.4	-176.4	0	0	0	0	110	V353 R354	V341-V353 PolarHBondContact O-N 3.01Å; V341-R354 HydrophobicContact CB-CB 4.21Å; V341-R354 PolarHBondContact N-O 3.21Å; V341-R354 PolarHBondContact O-N 3.38Å
342	Q	87.3	Confident	82.4	Confident	113 Å²	113	84 Å²	84	53%	0.528	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	153.5	175.2	-64.7	178.2	6.3	0	0	111.3	A351 I352	Q342-A351 WeakPolarHBondContact CA-O 3.24Å; Q342-I352 HydrophobicContact CG-CG1 4.43Å
343	S	83.7	Confident	82.4	Confident	19 Å²	19	84.5 Å²	84.5	13%	0.133	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-68	140.2	176.2	-166.5	0	0	0	0	112.3	N345 F348 A351	S343-N345 PolarHBondContact OG-N 3.34Å; S343-N345 VanDerWaalsContact OG-N 3.14Å; S343-F348 WeakPolarHBondContact OG-CD2 3.41Å; S343-A351 PolarHBondContact N-O 3.37Å
344	A	80.4	Confident	82.5	Confident	100 Å²	100	81.2 Å²	81.2	83%	0.826	42%	0.423	S	S	*	.			trans	-79.9	-16.3	167.6	0	0	0	0	0	113.2
345	N	79.3	Confident	82.9	Confident	89 Å²	89	76.2 Å²	76.2	48%	0.476	40%	0.4	S	S	.	.			trans	-74.5	129.6	-174.7	-69.4	-6.4	0	0	0	111	S343 E347 F348	S343-N345 PolarHBondContact OG-N 3.34Å; S343-N345 VanDerWaalsContact OG-N 3.14Å; N345-E347 VanDerWaalsContact C-N 3.27Å; N345-E347 PolarHBondContact O-N 3.08Å; N345-F348 HydrophobicContact CB-CD2 3.67Å; N345-F348 HydrophobicContact CB-CE2 4.1Å; N345-F348 HydrophobicContact CB-CG 4.29Å; N345-F348 WeakPolarHBondContact ND2-CE2 3.21Å; N345-F348 PolarHBondContact O-N 3.05Å
346	P	73.4	Confident	83.3	Confident	118 Å²	118	69.6 Å²	69.6	77%	0.766	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-59.7	-36.3	179.4	-22.2	31.4	0	0	0	113.3	F348 N349	P346-F348 PolarHBondContact O-N 3.14Å; P346-N349 PolarHBondContact O-N 2.68Å
347	E	70.1	Confident	83.5	Confident	161 Å²	161	63 Å²	63	75%	0.752	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-63.1	-23.5	-178.9	-64.3	-169	156.6	0	0	113.3	N345	N345-E347 VanDerWaalsContact C-N 3.27Å; N345-E347 PolarHBondContact O-N 3.08Å
348	F	69	Low	83.5	Confident	60 Å²	60	67 Å²	67	26%	0.263	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-96.3	9.1	-178	-58.1	-30.9	0	0	0	113.1	P313 S343 N345 P346 K350 A351	P313-F348 HydrophobicContact CG-CB 3.94Å; P313-F348 HydrophobicContact CG-CD1 3.32Å; P313-F348 HydrophobicContact CG-CD2 4.17Å; P313-F348 HydrophobicContact CG-CE1 3.79Å; P313-F348 HydrophobicContact CG-CG 3.55Å; P313-F348 HydrophobicContact CG-CZ 4.41Å; S343-F348 WeakPolarHBondContact OG-CD2 3.41Å; N345-F348 HydrophobicContact CB-CD2 3.67Å; N345-F348 HydrophobicContact CB-CE2 4.1Å; N345-F348 HydrophobicContact CB-CG 4.29Å; N345-F348 WeakPolarHBondContact ND2-CE2 3.21Å; N345-F348 PolarHBondContact O-N 3.05Å; P346-F348 PolarHBondContact O-N 3.14Å; F348-K350 PolarHBondContact O-N 3.23Å; F348-A351 HydrophobicContact CB-CB 4.47Å; F348-A351 WeakPolarHBondContact O-CB 3.24Å; F348-A351 PolarHBondContact O-N 3.32Å
349	N	72	Confident	82.9	Confident	123 Å²	123	73.3 Å²	73.3	66%	0.658	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	40.8	172.6	-81.9	-37.5	0	0	0	114.5	E314 P346 A351	E314-N349 PolarHBondContact OE1-ND2 3.19Å; P346-N349 PolarHBondContact O-N 2.68Å; N349-A351 PolarHBondContact O-N 2.86Å
350	K	76.5	Confident	82.3	Confident	153 Å²	153	72.5 Å²	72.5	67%	0.665	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	33.7	-175.5	-55.3	-177.1	177.8	-174.4	0	113.9	F348	F348-K350 PolarHBondContact O-N 3.23Å
351	A	78.5	Confident	82.1	Confident	14 Å²	14	74.6 Å²	74.6	12%	0.116	40%	0.396	C	S	.	.			trans	-59.3	146.2	173.2	0	0	0	0	0	110.9	P313 Q342 S343 F348 N349 V353	P313-A351 HydrophobicContact CB-CB 4.09Å; Q342-A351 WeakPolarHBondContact CA-O 3.24Å; S343-A351 PolarHBondContact N-O 3.37Å; F348-A351 HydrophobicContact CB-CB 4.47Å; F348-A351 WeakPolarHBondContact O-CB 3.24Å; F348-A351 PolarHBondContact O-N 3.32Å; N349-A351 PolarHBondContact O-N 2.86Å; A351-V353 PolarHBondContact O-N 2.79Å
352	I	84.7	Confident	82.1	Confident	36 Å²	36	80.4 Å²	80.4	19%	0.185	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	126.8	172.9	-61.5	168.9	0	0	0	107.6	F320 V340 Q342 I355	F320-I352 HydrophobicContact CB-CB 4.14Å; F320-I352 HydrophobicContact CB-CD1 3.81Å; F320-I352 HydrophobicContact CB-CG2 4.19Å; F320-I352 HydrophobicContact CD1-CG2 3.86Å; F320-I352 HydrophobicContact CD2-CB 3.83Å; F320-I352 HydrophobicContact CD2-CG2 3.98Å; F320-I352 HydrophobicContact CE1-CG2 4.17Å; F320-I352 HydrophobicContact CE2-CB 4.36Å; F320-I352 HydrophobicContact CE2-CG2 4.29Å; F320-I352 WeakPolarHBondContact CE2-O 3.42Å; F320-I352 HydrophobicContact CG-CB 3.94Å; F320-I352 HydrophobicContact CG-CG2 3.75Å; F320-I352 HydrophobicContact CZ-CG2 4.37Å; V340-I352 HydrophobicContact CG1-CB 4.26Å; V340-I352 HydrophobicContact CG1-CD1 3.82Å; V340-I352 HydrophobicContact CG1-CG1 3.71Å; V340-I352 HydrophobicContact CG1-CG2 3.59Å; Q342-I352 HydrophobicContact CG-CG1 4.43Å; I352-I355 HydrophobicContact CG2-CG1 4.12Å
353	V	85.7	Confident	82.4	Confident	33 Å²	33	75.2 Å²	75.2	20%	0.2	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-33.7	-179.3	-178.5	0	0	0	0	110.9	V341 A351 Y367	V341-V353 PolarHBondContact O-N 3.01Å; A351-V353 PolarHBondContact O-N 2.79Å; V353-Y367 PolarHBondContact O-N 2.66Å
354	R	90.5	Very high	82.8	Confident	62 Å²	62	74.9 Å²	74.9	23%	0.234	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	142.3	-175.5	175.9	178	170.3	147.3	-1.3	111.5	V341 S356 T364 V365 Q366	V341-R354 HydrophobicContact CB-CB 4.21Å; V341-R354 PolarHBondContact N-O 3.21Å; V341-R354 PolarHBondContact O-N 3.38Å; R354-S356 PolarHBondContact NE-OG 2.77Å; R354-S356 VanDerWaalsContact NE-OG 3.11Å; R354-T364 VanDerWaalsContact NH2-CG2 3.3Å; R354-V365 CarbonylContact C-O 3.54Å; R354-V365 VanDerWaalsContact CA-O 3.23Å; R354-V365 WeakPolarHBondContact CA-O 3.47Å; R354-Q366 HydrophobicContact CG-CB 4.44Å
355	I	92.2	Very high	83.5	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.9	166.5	-54.9	174.3	0	0	0	107.9	F320 V323 F327 Y338 E339 V340 I352 V357 T364 V365	F320-I355 HydrophobicContact CD1-CD1 3.67Å; F320-I355 HydrophobicContact CD1-CG1 4.21Å; F320-I355 HydrophobicContact CE1-CD1 4.24Å; F320-I355 HydrophobicContact CE1-CG1 4.39Å; V323-I355 HydrophobicContact CB-CD1 4.4Å; V323-I355 HydrophobicContact CG1-CD1 3.95Å; F327-I355 HydrophobicContact CE2-CG2 3.97Å; Y338-I355 HydrophobicContact CD2-CG2 3.91Å; Y338-I355 HydrophobicContact CG-CG2 4.46Å; E339-I355 WeakPolarHBondContact O-CA 3.01Å; V340-I355 HydrophobicContact CG1-CG1 4.46Å; V340-I355 HydrophobicContact CG2-CG1 4.36Å; I352-I355 HydrophobicContact CG2-CG1 4.12Å; I355-V357 HydrophobicContact CG2-CG2 4.4Å; I355-T364 WeakPolarHBondContact O-CA 3.23Å; I355-V365 HydrophobicContact CB-CB 4.38Å; I355-V365 PolarHBondContact N-O 3.26Å; I355-V365 PolarHBondContact O-N 3.21Å
356	S	92	Very high	84.1	Confident	13 Å²	13	68.7 Å²	68.7	9%	0.091	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	125	175.7	-54	0	0	0	0	109	Y338 E339 R354	Y338-S356 CarbonylContact C-O 3.59Å; Y338-S356 WeakPolarHBondContact CA-O 3.44Å; E339-S356 PolarHBondContact N-O 3.38Å; E339-S356 PolarHBondContact O-N 3.33Å; R354-S356 PolarHBondContact NE-OG 2.77Å; R354-S356 VanDerWaalsContact NE-OG 3.11Å
357	V	90.6	Very high	85.1	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134.5	178.8	-174.8	0	0	0	0	108.3	I299 F327 F332 D337 I355 R359 Q363	I299-V357 HydrophobicContact CG2-CG1 4.43Å; I299-V357 HydrophobicContact CG2-CG2 4.24Å; F327-V357 HydrophobicContact CE2-CG2 4.14Å; F327-V357 HydrophobicContact CZ-CG2 3.89Å; F332-V357 HydrophobicContact CD1-CG1 4.12Å; F332-V357 HydrophobicContact CE1-CG1 3.86Å; D337-V357 CarbonylContact O-C 3.59Å; D337-V357 WeakPolarHBondContact O-CA 3.47Å; D337-V357 WeakPolarHBondContact O-CG1 3.49Å; I355-V357 HydrophobicContact CG2-CG2 4.4Å; V357-R359 HydrophobicContact CG1-CB 4.48Å; V357-Q363 HydrophobicContact CB-CB 4.2Å; V357-Q363 PolarHBondContact N-O 3.31Å; V357-Q363 PolarHBondContact O-N 3.03Å
358	I	87	Confident	86.1	Confident	113 Å²	113	57 Å²	57	58%	0.579	27%	0.27	S	S	*	.			trans	-118.9	-6.9	-170.2	-48.4	175.2	0	0	0	112	D337 S360	D337-I358 PolarHBondContact O-N 3.46Å; I358-S360 PolarHBondContact O-N 2.96Å
359	R	78.9	Confident	87.1	Confident	136 Å²	136	58.1 Å²	58.1	51%	0.513	28%	0.276	S	S	.	.	S	Bend	trans	-55.2	-48.3	-167.1	-170.5	177.5	176.4	175.1	2.2	115.8	F332 D337 V357	F332-R359 HydrophobicContact CD1-CB 4.43Å; F332-R359 HydrophobicContact CE1-CB 3.95Å; F332-R359 HydrophobicContact CE1-CG 4.33Å; D337-R359 HydrophobicContact CB-CB 4.28Å; V357-R359 HydrophobicContact CG1-CB 4.48Å
360	S	77.4	Confident	87.8	Confident	91 Å²	91	52.7 Å²	52.7	64%	0.636	25%	0.247	S	C	*	.	S	Bend	trans	-113.4	-56.4	-177.8	57.3	0	0	0	0	111.4	I358	I358-S360 PolarHBondContact O-N 2.96Å
361	H	87.1	Confident	88.2	Confident	73 Å²	73	49.1 Å²	49.1	34%	0.338	24%	0.239	S	C	.	.	S	Bend	trans	-139.2	167.5	170.3	61.7	-70.1	0	0	0	107.6	G302 S304 Q363	G302-H361 PolarHBondContact O-NE2 2.72Å; S304-H361 PolarHBondContact OG-CD2 2.9Å; S304-H361 PolarHBondContact OG-NE2 3.21Å; H361-Q363 VanDerWaalsContact NE2-CG 3.31Å; H361-Q363 WeakPolarHBondContact NE2-CG 3.44Å; H361-Q363 PolarHBondContact O-N 3.17Å
362	R	88.1	Confident	88.7	Confident	182 Å²	182	51.4 Å²	51.4	69%	0.687	25%	0.249	S	C	*	.			trans	-71	107.2	-178.6	-172.5	179.8	-177.1	-178.5	1.6	109.7
363	Q	93.2	Very high	88.6	Confident	3 Å²	3	50.7 Å²	50.7	1%	0.014	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	147.8	174.2	-54	168.9	-75.8	0	0	109.2	I299 F303 S304 V357 H361	I299-Q363 PolarHBondContact O-NE2 3.11Å; F303-Q363 WeakPolarHBondContact O-CG 3.31Å; F303-Q363 PolarHBondContact O-NE2 2.87Å; S304-Q363 CarbonylContact O-C 3.58Å; S304-Q363 VanDerWaalsContact O-CA 3.32Å; S304-Q363 WeakPolarHBondContact O-CA 3.46Å; V357-Q363 HydrophobicContact CB-CB 4.2Å; V357-Q363 PolarHBondContact N-O 3.31Å; V357-Q363 PolarHBondContact O-N 3.03Å; H361-Q363 VanDerWaalsContact NE2-CG 3.31Å; H361-Q363 WeakPolarHBondContact NE2-CG 3.44Å; H361-Q363 PolarHBondContact O-N 3.17Å
364	T	93.3	Very high	88.6	Confident	12 Å²	12	53.9 Å²	53.9	7%	0.074	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	132.2	-177	65.4	0	0	0	0	111.4	S304 N305 I306 R354 I355	S304-T364 PolarHBondContact O-N 3.03Å; N305-T364 PolarHBondContact OD1-OG1 2.98Å; I306-T364 PolarHBondContact N-O 3.26Å; R354-T364 VanDerWaalsContact NH2-CG2 3.3Å; I355-T364 WeakPolarHBondContact O-CA 3.23Å
365	V	94.2	Very high	88.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	117.6	166.5	-172.7	0	0	0	0	107.2	T295 I299 I306 Y319 F320 R354 I355	T295-V365 HydrophobicContact CG2-CG1 4.35Å; T295-V365 HydrophobicContact CG2-CG2 4.15Å; I299-V365 HydrophobicContact CD1-CG2 3.32Å; I299-V365 HydrophobicContact CG1-CG2 4.4Å; I306-V365 HydrophobicContact CB-CG2 4.41Å; I306-V365 VanDerWaalsContact O-CA 3.3Å; I306-V365 WeakPolarHBondContact O-CA 3.45Å; Y319-V365 HydrophobicContact CE1-CG1 4.49Å; F320-V365 HydrophobicContact CE1-CG1 4.02Å; R354-V365 CarbonylContact C-O 3.54Å; R354-V365 VanDerWaalsContact CA-O 3.23Å; R354-V365 WeakPolarHBondContact CA-O 3.47Å; I355-V365 HydrophobicContact CB-CB 4.38Å; I355-V365 PolarHBondContact N-O 3.26Å; I355-V365 PolarHBondContact O-N 3.21Å
366	Q	92.5	Very high	87.9	Confident	60 Å²	60	57.4 Å²	57.4	28%	0.28	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	137.9	-175.4	178.2	170.1	-9.4	0	0	112.2	I306 F307 V308 R354	I306-Q366 PolarHBondContact O-N 3.33Å; F307-Q366 WeakPolarHBondContact CA-O 3.47Å; F307-Q366 HydrophobicContact CD1-CB 3.95Å; F307-Q366 HydrophobicContact CD1-CG 4.43Å; F307-Q366 HydrophobicContact CE1-CB 3.98Å; F307-Q366 HydrophobicContact CE1-CG 4.36Å; V308-Q366 PolarHBondContact N-O 3.33Å; R354-Q366 HydrophobicContact CG-CB 4.44Å
367	Y	92.9	Very high	87.3	Confident	22 Å²	22	60.3 Å²	60.3	9%	0.086	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	133.3	168.7	169.6	-107	0	0	0	111.4	V308 S310 P313 L316 V353	V308-Y367 CarbonylContact O-C 3.59Å; V308-Y367 VanDerWaalsContact O-CA 3.28Å; V308-Y367 WeakPolarHBondContact O-CA 3.47Å; V308-Y367 WeakPolarHBondContact O-CD2 3.38Å; S310-Y367 PolarHBondContact O-OH 2.65Å; P313-Y367 HydrophobicContact CB-CD1 4.31Å; P313-Y367 HydrophobicContact CB-CE1 4.11Å; P313-Y367 HydrophobicContact CG-CE1 4.43Å; L316-Y367 HydrophobicContact CD1-CD2 3.4Å; L316-Y367 VanDerWaalsContact CD1-CD2 3.4Å; L316-Y367 HydrophobicContact CD1-CE2 3.99Å; L316-Y367 HydrophobicContact CD1-CG 4.24Å; V353-Y367 PolarHBondContact O-N 2.66Å
368	I	91.8	Very high	87	Confident	10 Å²	10	67.8 Å²	67.8	5%	0.051	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	140.3	171.2	-71.3	-177.5	0	0	0	109.2	F307 V308 D372 K375 L376	F307-I368 HydrophobicContact CB-CD1 4.11Å; F307-I368 HydrophobicContact CD1-CD1 3.12Å; F307-I368 HydrophobicContact CD1-CG1 3.64Å; F307-I368 HydrophobicContact CD2-CD1 4.3Å; F307-I368 HydrophobicContact CE1-CD1 3.45Å; F307-I368 VanDerWaalsContact CE1-CD1 3.45Å; F307-I368 HydrophobicContact CE1-CG1 4.15Å; F307-I368 HydrophobicContact CG-CD1 3.59Å; F307-I368 HydrophobicContact CG-CG1 4.33Å; F307-I368 HydrophobicContact CZ-CD1 4.15Å; V308-I368 PolarHBondContact O-N 2.67Å; I368-D372 HydrophobicContact CG2-CB 3.99Å; I368-K375 HydrophobicContact CD1-CB 4.22Å; I368-L376 HydrophobicContact CD1-CD2 3.72Å; I368-L376 HydrophobicContact CD1-CG 4.49Å
369	H	89.1	Confident	87.1	Confident	84 Å²	84	62.9 Å²	62.9	39%	0.389	34%	0.339	S	S	.	.			trans	-72.1	137.6	173.1	-171.2	-92.3	0	0	0	110.2	T371 D372	H369-T371 PolarHBondContact CE1-OG1 2.7Å; H369-T371 PolarHBondContact ND1-N 3.3Å; H369-T371 PolarHBondContact ND1-OG1 2.76Å; H369-T371 VanDerWaalsContact ND1-OG1 3.09Å; H369-T371 PolarHBondContact O-N 3.23Å; H369-D372 PolarHBondContact O-N 2.8Å
370	P	87.1	Confident	87.7	Confident	9 Å²	9	59.6 Å²	59.6	6%	0.058	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.4	-173.6	19.5	-32.9	0	0	0	115.5	T309 S310 I390 H394 L398	T309-P370 HydrophobicContact CG2-CB 3.65Å; T309-P370 HydrophobicContact CG2-CG 4.25Å; S310-P370 WeakPolarHBondContact O-CD 3.23Å; P370-I390 HydrophobicContact CB-CD1 4.27Å; P370-I390 HydrophobicContact CB-CG2 3.79Å; P370-I390 HydrophobicContact CG-CG2 4.41Å; P370-H394 HydrophobicContact CB-CB 4.44Å; P370-L398 HydrophobicContact CB-CD1 4.28Å
371	T	86.6	Confident	88.4	Confident	79 Å²	79	55.2 Å²	55.2	49%	0.485	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-24.7	176.1	-44.6	0	0	0	0	113	H369 A373	H369-T371 PolarHBondContact CE1-OG1 2.7Å; H369-T371 PolarHBondContact ND1-N 3.3Å; H369-T371 PolarHBondContact ND1-OG1 2.76Å; H369-T371 VanDerWaalsContact ND1-OG1 3.09Å; H369-T371 PolarHBondContact O-N 3.23Å; T371-A373 VanDerWaalsContact C-N 3.27Å; T371-A373 PolarHBondContact O-N 3.48Å; T371-A373 VanDerWaalsContact O-N 3.13Å
372	D	87.7	Confident	88.7	Confident	62 Å²	62	51.8 Å²	51.8	33%	0.332	28%	0.283	S	S	.	.			trans	-90.2	42.2	-172.2	-74	0.3	0	0	0	112.8	I368 H369 A374 K375	I368-D372 HydrophobicContact CG2-CB 3.99Å; H369-D372 PolarHBondContact O-N 2.8Å; D372-A374 PolarHBondContact O-N 2.81Å; D372-A374 VanDerWaalsContact O-N 3.1Å; D372-K375 HydrophobicContact CB-CD 4.15Å; D372-K375 PolarHBondContact O-N 2.89Å; D372-K375 VanDerWaalsContact O-N 3.14Å; D372-K375 IonicContact OD2-NZ 2.69Å; D372-K375 PolarHBondContact OD2-NZ 3.03Å
373	A	83.9	Confident	89.1	Confident	21 Å²	21	43.1 Å²	43.1	17%	0.174	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-59	-26.5	-176.5	0	0	0	0	0	113.6	T371 K375 L376 H397 L398	T371-A373 VanDerWaalsContact C-N 3.27Å; T371-A373 PolarHBondContact O-N 3.48Å; T371-A373 VanDerWaalsContact O-N 3.13Å; A373-K375 PolarHBondContact O-N 3.34Å; A373-L376 WeakPolarHBondContact O-CB 3.18Å; A373-L376 PolarHBondContact O-N 2.71Å; A373-L376 VanDerWaalsContact O-N 3.09Å; A373-H397 HydrophobicContact CB-CB 3.83Å; A373-L398 HydrophobicContact CB-CD2 4.16Å
374	A	84.9	Confident	89	Confident	99 Å²	99	43 Å²	43	82%	0.818	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-60.5	-26.6	178.5	0	0	0	0	0	113.6	D372 L376	D372-A374 PolarHBondContact O-N 2.81Å; D372-A374 VanDerWaalsContact O-N 3.1Å; A374-L376 PolarHBondContact O-N 2.95Å
375	K	84.2	Confident	88.8	Confident	134 Å²	134	42.4 Å²	42.4	58%	0.583	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-75.9	-11.1	179.4	-64.4	176.6	-174.5	160.9	0	113	I368 D372 A373 G377	I368-K375 HydrophobicContact CD1-CB 4.22Å; D372-K375 HydrophobicContact CB-CD 4.15Å; D372-K375 PolarHBondContact O-N 2.89Å; D372-K375 VanDerWaalsContact O-N 3.14Å; D372-K375 IonicContact OD2-NZ 2.69Å; D372-K375 PolarHBondContact OD2-NZ 3.03Å; A373-K375 PolarHBondContact O-N 3.34Å; K375-G377 VanDerWaalsContact C-N 3.26Å; K375-G377 PolarHBondContact O-N 2.81Å
376	L	84	Confident	88.3	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-81.1	1.8	-177.2	-62.3	171	0	0	0	113.9	F307 I368 A373 A374 Q378 A379 V382 L398 Y402	F307-L376 HydrophobicContact CB-CD2 3.64Å; F307-L376 HydrophobicContact CD2-CD2 3.82Å; F307-L376 HydrophobicContact CG-CD2 3.8Å; I368-L376 HydrophobicContact CD1-CD2 3.72Å; I368-L376 HydrophobicContact CD1-CG 4.49Å; A373-L376 WeakPolarHBondContact O-CB 3.18Å; A373-L376 PolarHBondContact O-N 2.71Å; A373-L376 VanDerWaalsContact O-N 3.09Å; A374-L376 PolarHBondContact O-N 2.95Å; L376-Q378 PolarHBondContact O-N 2.85Å; L376-A379 HydrophobicContact CB-CB 4.36Å; L376-A379 HydrophobicContact CD2-CB 4.38Å; L376-A379 WeakPolarHBondContact O-CB 3.42Å; L376-A379 PolarHBondContact O-N 3.46Å; L376-V382 HydrophobicContact CD1-CG2 4.49Å; L376-V382 HydrophobicContact CD2-CG2 3.91Å; L376-L398 HydrophobicContact CD1-CD2 3.36Å; L376-Y402 HydrophobicContact CB-CE1 4.03Å; L376-Y402 WeakPolarHBondContact CD1-OH 3.41Å; L376-Y402 WeakPolarHBondContact O-CE1 3.46Å
377	G	79.5	Confident	87.7	Confident	75 Å²	75	40.7 Å²	40.7	77%	0.773	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-58.7	-21.6	-179.6	0	0	0	0	0	114.8	K375	K375-G377 VanDerWaalsContact C-N 3.26Å; K375-G377 PolarHBondContact O-N 2.81Å
378	Q	83.7	Confident	86.9	Confident	156 Å²	156	39.9 Å²	39.9	73%	0.729	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-105.4	11	177.8	-63	-178.7	-11	0	0	113.5	N305 L376	N305-Q378 PolarHBondContact ND2-O 3.14Å; L376-Q378 PolarHBondContact O-N 2.85Å
379	A	88.5	Confident	86	Confident	11 Å²	11	41 Å²	41	9%	0.091	25%	0.248	C	C	.	.			trans	-77.5	136.4	-179	0	0	0	0	0	111.5	F307 L376 V382 Y402	F307-A379 HydrophobicContact CD2-CB 3.48Å; F307-A379 VanDerWaalsContact CD2-CB 3.48Å; F307-A379 HydrophobicContact CE2-CB 3.9Å; L376-A379 HydrophobicContact CB-CB 4.36Å; L376-A379 HydrophobicContact CD2-CB 4.38Å; L376-A379 WeakPolarHBondContact O-CB 3.42Å; L376-A379 PolarHBondContact O-N 3.46Å; A379-V382 HydrophobicContact CB-CG2 3.6Å; A379-Y402 HydrophobicContact CB-CD1 4.12Å; A379-Y402 HydrophobicContact CB-CE1 4.36Å; A379-Y402 HydrophobicContact CB-CG 4.35Å; A379-Y402 WeakPolarHBondContact O-CB 3.22Å
380	E	91.3	Very high	85.5	Confident	66 Å²	66	37.3 Å²	37.3	31%	0.308	23%	0.23	S	C	.	.	S	Bend	trans	-94.6	-39.9	168.5	-66.7	173.7	171	0	0	110.9	F303 S304 N305 L403	F303-E380 WeakPolarHBondContact CA-OE2 3.31Å; F303-E380 HydrophobicContact CD1-CB 3.81Å; F303-E380 HydrophobicContact CE1-CB 4.25Å; S304-E380 PolarHBondContact N-OE2 2.83Å; N305-E380 PolarHBondContact O-N 3.11Å; N305-E380 VanDerWaalsContact O-N 3.13Å; E380-L403 PolarHBondContact O-N 3.21Å
381	L	93	Very high	84.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	127.7	177.4	173	62.5	0	0	0	110.2	A298 F303 I306 F307 I383 L403 F405	A298-L381 HydrophobicContact CB-CD2 4.17Å; F303-L381 HydrophobicContact CD1-CB 4.21Å; I306-L381 WeakPolarHBondContact CA-O 3.41Å; I306-L381 HydrophobicContact CD1-CD2 4.26Å; I306-L381 HydrophobicContact CG1-CB 4.31Å; I306-L381 HydrophobicContact CG1-CD2 4.4Å; I306-L381 HydrophobicContact CG2-CB 4.31Å; I306-L381 HydrophobicContact CG2-CD2 4.05Å; I306-L381 HydrophobicContact CG2-CG 4.1Å; F307-L381 PolarHBondContact N-O 2.96Å; L381-I383 HydrophobicContact CD1-CG1 4.34Å; L381-I383 HydrophobicContact CD2-CD1 4.17Å; L381-I383 HydrophobicContact CD2-CG1 4.31Å; L381-I383 HydrophobicContact CG-CD1 4.45Å; L381-I383 HydrophobicContact CG-CG1 4.09Å; L381-L403 WeakPolarHBondContact CA-O 3.32Å; L381-L403 HydrophobicContact CD1-CB 4.08Å; L381-L403 HydrophobicContact CD1-CD2 3.87Å; L381-L403 HydrophobicContact CD1-CG 3.68Å; L381-F405 HydrophobicContact CD1-CD1 4.32Å; L381-F405 HydrophobicContact CD1-CD2 3.8Å; L381-F405 HydrophobicContact CD1-CE1 4.43Å; L381-F405 HydrophobicContact CD1-CE2 3.92Å; L381-F405 HydrophobicContact CD1-CG 4.02Å; L381-F405 HydrophobicContact CD1-CZ 4.25Å; L381-F405 HydrophobicContact CD2-CD2 4.36Å; L381-F405 HydrophobicContact CD2-CE2 4.16Å
382	V	94.2	Very high	84.4	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.2	172.6	178.4	0	0	0	0	109.9	F307 L376 A379 I384 Y402 L403 V404 F405	F307-V382 CarbonylContact O-C 3.27Å; F307-V382 WeakPolarHBondContact O-CA 3.41Å; L376-V382 HydrophobicContact CD1-CG2 4.49Å; L376-V382 HydrophobicContact CD2-CG2 3.91Å; A379-V382 HydrophobicContact CB-CG2 3.6Å; V382-I384 HydrophobicContact CG1-CG1 4.1Å; V382-Y402 HydrophobicContact CB-CD2 3.93Å; V382-Y402 HydrophobicContact CB-CE2 3.63Å; V382-Y402 HydrophobicContact CG1-CE2 4.36Å; V382-Y402 HydrophobicContact CG2-CD2 3.5Å; V382-Y402 VanDerWaalsContact CG2-CD2 3.5Å; V382-Y402 HydrophobicContact CG2-CE1 4.41Å; V382-Y402 HydrophobicContact CG2-CE2 3.22Å; V382-Y402 HydrophobicContact CG2-CG 4.23Å; V382-L403 PolarHBondContact N-O 3.13Å; V382-V404 HydrophobicContact CB-CG2 4.46Å; V382-V404 CarbonylContact O-C 3.55Å; V382-V404 VanDerWaalsContact O-CA 3.32Å; V382-V404 WeakPolarHBondContact O-CA 3.32Å; V382-F405 PolarHBondContact O-N 2.94Å
383	I	94.9	Very high	84	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120.5	178.1	-58.6	175.3	0	0	0	108	L291 T295 I306 F307 V308 T309 Y319 L381 F405	L291-I383 HydrophobicContact CB-CG2 4.4Å; L291-I383 HydrophobicContact CD1-CG2 3.79Å; L291-I383 HydrophobicContact CD2-CG2 4.28Å; L291-I383 HydrophobicContact CG-CG2 4.4Å; T295-I383 HydrophobicContact CG2-CD1 4.38Å; T295-I383 WeakPolarHBondContact OG1-CD1 3.46Å; I306-I383 HydrophobicContact CG2-CD1 4.01Å; I306-I383 HydrophobicContact CG2-CG1 4.44Å; F307-I383 PolarHBondContact O-N 3.24Å; V308-I383 CarbonylContact C-O 3.49Å; V308-I383 VanDerWaalsContact CA-O 3.3Å; V308-I383 WeakPolarHBondContact CA-O 3.29Å; V308-I383 HydrophobicContact CG2-CB 4.31Å; V308-I383 HydrophobicContact CG2-CG2 4.31Å; T309-I383 PolarHBondContact N-O 3.02Å; Y319-I383 HydrophobicContact CE2-CD1 4.24Å; Y319-I383 HydrophobicContact CE2-CG2 4.37Å; Y319-I383 WeakPolarHBondContact OH-CD1 3.49Å; L381-I383 HydrophobicContact CD1-CG1 4.34Å; L381-I383 HydrophobicContact CD2-CD1 4.17Å; L381-I383 HydrophobicContact CD2-CG1 4.31Å; L381-I383 HydrophobicContact CG-CD1 4.45Å; L381-I383 HydrophobicContact CG-CG1 4.09Å; I383-F405 CarbonylContact C-O 3.5Å; I383-F405 WeakPolarHBondContact CA-O 3.46Å; I383-F405 HydrophobicContact CG1-CB 4.29Å; I383-F405 HydrophobicContact CG1-CD2 4.36Å
384	I	92.2	Very high	84	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	99.6	177.2	-50	178.5	0	0	0	107.1	V382 A387 I390 L398 V404 F405 M406 A407	V382-I384 HydrophobicContact CG1-CG1 4.1Å; I384-A387 HydrophobicContact CB-CB 4.47Å; I384-A387 HydrophobicContact CG2-CB 3.73Å; I384-I390 HydrophobicContact CG2-CD1 3.72Å; I384-L398 HydrophobicContact CD1-CB 3.73Å; I384-L398 HydrophobicContact CD1-CD1 3.96Å; I384-L398 HydrophobicContact CD1-CG 4.49Å; I384-L398 HydrophobicContact CG1-CD1 4.39Å; I384-V404 HydrophobicContact CD1-CG1 4.08Å; I384-V404 HydrophobicContact CG1-CG1 4.39Å; I384-F405 PolarHBondContact N-O 3.39Å; I384-M406 HydrophobicContact CB-CG 4.45Å; I384-M406 HydrophobicContact CD1-CE 4.38Å; I384-M406 HydrophobicContact CD1-CG 4.22Å; I384-A407 PolarHBondContact O-N 3.12Å
385	D	89.3	Confident	84	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	143.6	173	-160	12.4	0	0	0	110.1	S288 L291 T309 L316 A387	S288-D385 VanDerWaalsContact CB-OD2 3.28Å; S288-D385 WeakPolarHBondContact CB-OD2 3.33Å; S288-D385 PolarHBondContact OG-OD2 3.05Å; L291-D385 HydrophobicContact CD1-CB 4.38Å; T309-D385 PolarHBondContact O-N 3.01Å; L316-D385 HydrophobicContact CD2-CB 3.97Å; D385-A387 VanDerWaalsContact C-N 3.29Å; D385-A387 PolarHBondContact O-N 3.35Å
386	E	82.3	Confident	83.9	Confident	21 Å²	21	30.2 Å²	30.2	10%	0.098	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	44.6	-173.9	-64.7	-68.9	-176.1	0	0	113.7	A388 A389 A407 N409	E386-A388 PolarHBondContact O-N 3.49Å; E386-A389 PolarHBondContact O-N 3.35Å; E386-A407 PolarHBondContact N-O 2.84Å; E386-N409 PolarHBondContact OE1-ND2 2.76Å; E386-N409 PolarHBondContact OE2-ND2 2.87Å
387	A	81.7	Confident	84	Confident	2 Å²	2	35.8 Å²	35.8	2%	0.017	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-54.3	-28.3	179.5	0	0	0	0	0	112.8	I384 D385 A389 I390 M406 A407 L420	I384-A387 HydrophobicContact CB-CB 4.47Å; I384-A387 HydrophobicContact CG2-CB 3.73Å; D385-A387 VanDerWaalsContact C-N 3.29Å; D385-A387 PolarHBondContact O-N 3.35Å; A387-A389 VanDerWaalsContact C-N 3.27Å; A387-A389 PolarHBondContact O-N 3.38Å; A387-I390 PolarHBondContact O-N 3.04Å; A387-M406 HydrophobicContact CB-CE 3.75Å; A387-A407 WeakPolarHBondContact CB-O 3.26Å; A387-A407 PolarHBondContact N-O 3.22Å; A387-L420 VanDerWaalsContact O-CD2 3.27Å; A387-L420 WeakPolarHBondContact O-CD2 3.42Å
388	A	74.4	Confident	84.4	Confident	6 Å²	6	32.2 Å²	32.2	5%	0.05	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-58.3	-32.9	173.5	0	0	0	0	0	113.9	E386 T416	E386-A388 PolarHBondContact O-N 3.49Å; A388-T416 VanDerWaalsContact C-OG1 3.26Å; A388-T416 WeakPolarHBondContact O-CB 3.37Å; A388-T416 PolarHBondContact O-OG1 2.87Å
389	A	73.9	Confident	84.5	Confident	34 Å²	34	26.5 Å²	26.5	28%	0.281	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-86.1	-13.5	-179.2	0	0	0	0	0	112.5	P311 E386 A387	P311-A389 HydrophobicContact CG-CB 4.03Å; E386-A389 PolarHBondContact O-N 3.35Å; A387-A389 VanDerWaalsContact C-N 3.27Å; A387-A389 PolarHBondContact O-N 3.38Å
390	I	77.9	Confident	84.1	Confident	5 Å²	5	26.8 Å²	26.8	3%	0.026	14%	0.143	C	C	.	.	S	Bend	trans	-89.1	135.9	-179.3	-58.7	173.3	0	0	0	109	T309 P370 I384 A387 L392 H394 V395	T309-I390 HydrophobicContact CG2-CD1 4.01Å; P370-I390 HydrophobicContact CB-CD1 4.27Å; P370-I390 HydrophobicContact CB-CG2 3.79Å; P370-I390 HydrophobicContact CG-CG2 4.41Å; I384-I390 HydrophobicContact CG2-CD1 3.72Å; A387-I390 PolarHBondContact O-N 3.04Å; I390-L392 PolarHBondContact O-N 2.6Å; I390-H394 HydrophobicContact CG2-CB 3.93Å; I390-V395 HydrophobicContact CB-CG2 3.79Å; I390-V395 HydrophobicContact CG2-CG2 3.67Å
391	P	75.6	Confident	83.8	Confident	17 Å²	17	29 Å²	29	11%	0.11	16%	0.163	C	C	.	.			trans	-57	138.1	177	-24.8	34.6	0	0	0	112.4	V393 H394 V395 E739 L740	P391-V393 PolarHBondContact O-N 3.3Å; P391-V393 VanDerWaalsContact O-N 3.1Å; P391-H394 PolarHBondContact O-N 3.07Å; P391-V395 PolarHBondContact O-N 3.06Å; P391-E739 WeakPolarHBondContact CG-O 3.28Å; P391-L740 WeakPolarHBondContact CA-O 3.3Å; P391-L740 WeakPolarHBondContact CB-O 3.35Å; P391-L740 WeakPolarHBondContact CG-O 3.39Å
392	L	76.3	Confident	83.6	Confident	34 Å²	34	29.6 Å²	29.6	18%	0.178	17%	0.165	C	C	.	.	H	α-helix	trans	-54.5	-36.4	-176.4	-177.5	62.3	0	0	0	112.6	I390 H394 V395 K396 L420 L424	I390-L392 PolarHBondContact O-N 2.6Å; L392-H394 PolarHBondContact O-N 3.1Å; L392-V395 PolarHBondContact O-N 3.33Å; L392-K396 WeakPolarHBondContact O-CG 3.2Å; L392-K396 PolarHBondContact O-N 2.66Å; L392-L420 HydrophobicContact CB-CD1 3.69Å; L392-L420 HydrophobicContact CD1-CD1 3.62Å; L392-L420 HydrophobicContact CD1-CG 4.49Å; L392-L420 HydrophobicContact CD2-CD1 4.47Å; L392-L420 HydrophobicContact CG-CD1 4.1Å; L392-L424 HydrophobicContact CD1-CB 4.33Å; L392-L424 HydrophobicContact CD1-CD1 3.89Å
393	V	78.2	Confident	83.4	Confident	62 Å²	62	29.6 Å²	29.6	38%	0.376	17%	0.165	S	C	.	.	H	α-helix	trans	-60.4	-45.9	177.9	-178.4	0	0	0	0	110.9	P391 K396 H397	P391-V393 PolarHBondContact O-N 3.3Å; P391-V393 VanDerWaalsContact O-N 3.1Å; V393-K396 PolarHBondContact O-N 3.25Å; V393-H397 PolarHBondContact O-N 3.21Å; V393-H397 PolarHBondContact O-ND1 3.29Å
394	H	84.4	Confident	83.3	Confident	56 Å²	56	29.6 Å²	29.6	26%	0.259	17%	0.165	S	C	.	.	H	α-helix	trans	-69.2	-41.7	177.2	-63	-54.9	0	0	0	111.3	P370 I390 P391 L392 K396 H397 L398	P370-H394 HydrophobicContact CB-CB 4.44Å; I390-H394 HydrophobicContact CG2-CB 3.93Å; P391-H394 PolarHBondContact O-N 3.07Å; L392-H394 PolarHBondContact O-N 3.1Å; H394-K396 VanDerWaalsContact C-N 3.27Å; H394-K396 PolarHBondContact O-N 2.99Å; H394-H397 PolarHBondContact O-N 3.38Å; H394-L398 VanDerWaalsContact O-CG 3.3Å; H394-L398 WeakPolarHBondContact O-CG 3.36Å; H394-L398 PolarHBondContact O-N 3.38Å
395	V	84.4	Confident	83.4	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-56.6	-41.8	175.9	177.3	0	0	0	0	111.6	I390 P391 L392 H397 L398 L399 M406 L424	I390-V395 HydrophobicContact CB-CG2 3.79Å; I390-V395 HydrophobicContact CG2-CG2 3.67Å; P391-V395 PolarHBondContact O-N 3.06Å; L392-V395 PolarHBondContact O-N 3.33Å; V395-H397 PolarHBondContact O-N 3.31Å; V395-L398 PolarHBondContact O-N 3.24Å; V395-L399 WeakPolarHBondContact O-CG 3.35Å; V395-L399 PolarHBondContact O-N 3.3Å; V395-M406 HydrophobicContact CG1-CE 3.49Å; V395-M406 VanDerWaalsContact CG1-CE 3.49Å; V395-L424 HydrophobicContact CG1-CD2 3.92Å
396	K	82.2	Confident	83.5	Confident	86 Å²	86	30 Å²	30	37%	0.374	17%	0.167	S	C	.	.	H	α-helix	trans	-62.5	-40.8	175.5	-75.3	-177.1	175.7	-167.7	0	112.8	L392 V393 H394 L398 L399	L392-K396 WeakPolarHBondContact O-CG 3.2Å; L392-K396 PolarHBondContact O-N 2.66Å; V393-K396 PolarHBondContact O-N 3.25Å; H394-K396 VanDerWaalsContact C-N 3.27Å; H394-K396 PolarHBondContact O-N 2.99Å; K396-L398 VanDerWaalsContact C-N 3.27Å; K396-L398 PolarHBondContact O-N 3.31Å; K396-L399 PolarHBondContact O-N 3.02Å
397	H	85.2	Confident	83.8	Confident	120 Å²	120	29 Å²	29	56%	0.556	16%	0.163	S	C	*	.	H	α-helix	trans	-68.9	-25	176.2	-63.8	130.9	0	0	0	113.2	A373 V393 H394 V395 L399	A373-H397 HydrophobicContact CB-CB 3.83Å; V393-H397 PolarHBondContact O-N 3.21Å; V393-H397 PolarHBondContact O-ND1 3.29Å; H394-H397 PolarHBondContact O-N 3.38Å; V395-H397 PolarHBondContact O-N 3.31Å; H397-L399 VanDerWaalsContact C-N 3.28Å
398	L	88.2	Confident	83.8	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-8.6	174.1	-62.9	170.4	0	0	0	113.2	T309 P370 A373 L376 I384 H394 V395 K396 G400 Y402	T309-L398 HydrophobicContact CG2-CD1 3.89Å; P370-L398 HydrophobicContact CB-CD1 4.28Å; A373-L398 HydrophobicContact CB-CD2 4.16Å; L376-L398 HydrophobicContact CD1-CD2 3.36Å; I384-L398 HydrophobicContact CD1-CB 3.73Å; I384-L398 HydrophobicContact CD1-CD1 3.96Å; I384-L398 HydrophobicContact CD1-CG 4.49Å; I384-L398 HydrophobicContact CG1-CD1 4.39Å; H394-L398 VanDerWaalsContact O-CG 3.3Å; H394-L398 WeakPolarHBondContact O-CG 3.36Å; H394-L398 PolarHBondContact O-N 3.38Å; V395-L398 PolarHBondContact O-N 3.24Å; K396-L398 VanDerWaalsContact C-N 3.27Å; K396-L398 PolarHBondContact O-N 3.31Å; L398-G400 PolarHBondContact O-N 3.32Å; L398-Y402 WeakPolarHBondContact O-CE2 3.37Å; L398-Y402 PolarHBondContact O-OH 2.9Å
399	L	85.8	Confident	84.1	Confident	35 Å²	35	29.6 Å²	29.6	18%	0.183	17%	0.165	C	C	.	.			trans	-90.3	82.8	176	-68.3	170.9	0	0	0	109.8	T276 V395 K396 H397 V404 M406 L424 L428	T276-L399 HydrophobicContact CG2-CD2 4.24Å; V395-L399 WeakPolarHBondContact O-CG 3.35Å; V395-L399 PolarHBondContact O-N 3.3Å; K396-L399 PolarHBondContact O-N 3.02Å; H397-L399 VanDerWaalsContact C-N 3.28Å; L399-V404 HydrophobicContact CD2-CB 4.27Å; L399-V404 HydrophobicContact CD2-CG1 3.95Å; L399-V404 HydrophobicContact CD2-CG2 4.21Å; L399-M406 HydrophobicContact CD2-SD 3.95Å; L399-L424 HydrophobicContact CD1-CD1 4.26Å; L399-L428 HydrophobicContact CD1-CD2 4.21Å
400	G	81.7	Confident	84	Confident	17 Å²	17	29.4 Å²	29.4	18%	0.175	16%	0.159	C	C	.	.			trans	-99	-172.5	176.9	0	0	0	0	0	114.4	L398 Y402 R458	L398-G400 PolarHBondContact O-N 3.32Å; G400-Y402 PolarHBondContact N-OH 2.82Å; G400-Y402 PolarHBondContact O-N 2.96Å; G400-R458 PolarHBondContact O-NH1 2.79Å
401	P	83.7	Confident	83.4	Confident	113 Å²	113	31.2 Å²	31.2	73%	0.734	17%	0.169	S	C	*	.	S	Bend	trans	-78.7	47.8	-178.8	35.4	-37.2	0	0	0	113.1
402	Y	88.7	Confident	82.8	Confident	12 Å²	12	31 Å²	31	5%	0.047	17%	0.17	C	C	.	.	S	Bend	trans	-139.1	170.4	179.8	41.7	-108.1	0	0	0	111.1	L273 L376 A379 V382 L398 G400 V404 R458	L273-Y402 CarbonylContact O-C 3.5Å; L273-Y402 WeakPolarHBondContact O-CA 3.29Å; L273-Y402 PolarHBondContact O-N 2.87Å; L376-Y402 HydrophobicContact CB-CE1 4.03Å; L376-Y402 WeakPolarHBondContact CD1-OH 3.41Å; L376-Y402 WeakPolarHBondContact O-CE1 3.46Å; A379-Y402 HydrophobicContact CB-CD1 4.12Å; A379-Y402 HydrophobicContact CB-CE1 4.36Å; A379-Y402 HydrophobicContact CB-CG 4.35Å; A379-Y402 WeakPolarHBondContact O-CB 3.22Å; V382-Y402 HydrophobicContact CB-CD2 3.93Å; V382-Y402 HydrophobicContact CB-CE2 3.63Å; V382-Y402 HydrophobicContact CG1-CE2 4.36Å; V382-Y402 HydrophobicContact CG2-CD2 3.5Å; V382-Y402 VanDerWaalsContact CG2-CD2 3.5Å; V382-Y402 HydrophobicContact CG2-CE1 4.41Å; V382-Y402 HydrophobicContact CG2-CE2 3.22Å; V382-Y402 HydrophobicContact CG2-CG 4.23Å; L398-Y402 WeakPolarHBondContact O-CE2 3.37Å; L398-Y402 PolarHBondContact O-OH 2.9Å; G400-Y402 PolarHBondContact N-OH 2.82Å; G400-Y402 PolarHBondContact O-N 2.96Å; Y402-V404 HydrophobicContact CD2-CG2 3.55Å; Y402-V404 HydrophobicContact CE2-CG2 3.58Å; Y402-V404 PolarHBondContact O-N 3.21Å; Y402-R458 PolarHBondContact O-NH1 2.96Å; Y402-R458 PolarHBondContact O-NH2 3.28Å
403	L	91.4	Very high	82.2	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	130.6	176.6	-178.6	60.5	0	0	0	109	I267 V268 L273 H275 F303 E380 L381 V382 F405	I267-L403 HydrophobicContact CG2-CD1 3.94Å; V268-L403 HydrophobicContact CG2-CD2 4.47Å; L273-L403 PolarHBondContact O-N 3.32Å; H275-L403 HydrophobicContact CB-CD1 3.73Å; H275-L403 WeakPolarHBondContact O-CD1 3.45Å; F303-L403 HydrophobicContact CZ-CD2 4.44Å; E380-L403 PolarHBondContact O-N 3.21Å; L381-L403 WeakPolarHBondContact CA-O 3.32Å; L381-L403 HydrophobicContact CD1-CB 4.08Å; L381-L403 HydrophobicContact CD1-CD2 3.87Å; L381-L403 HydrophobicContact CD1-CG 3.68Å; V382-L403 PolarHBondContact N-O 3.13Å; L403-F405 HydrophobicContact CD1-CE1 3.92Å; L403-F405 HydrophobicContact CD2-CE1 4.07Å; L403-F405 HydrophobicContact CD2-CZ 3.97Å; L403-F405 HydrophobicContact CG-CE1 3.96Å; L403-F405 HydrophobicContact CG-CZ 4.34Å
404	V	92.1	Very high	81.3	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.7	-179.2	-176	0	0	0	0	110.9	H275 T276 V277 V382 I384 L399 Y402 M406	H275-V404 PolarHBondContact O-N 3.37Å; H275-V404 VanDerWaalsContact O-N 3.12Å; T276-V404 CarbonylContact C-O 3.58Å; T276-V404 WeakPolarHBondContact CA-O 3.49Å; T276-V404 HydrophobicContact CG2-CB 4.28Å; V277-V404 PolarHBondContact N-O 3.22Å; V382-V404 HydrophobicContact CB-CG2 4.46Å; V382-V404 CarbonylContact O-C 3.55Å; V382-V404 VanDerWaalsContact O-CA 3.32Å; V382-V404 WeakPolarHBondContact O-CA 3.32Å; I384-V404 HydrophobicContact CD1-CG1 4.08Å; I384-V404 HydrophobicContact CG1-CG1 4.39Å; L399-V404 HydrophobicContact CD2-CB 4.27Å; L399-V404 HydrophobicContact CD2-CG1 3.95Å; L399-V404 HydrophobicContact CD2-CG2 4.21Å; Y402-V404 HydrophobicContact CD2-CG2 3.55Å; Y402-V404 HydrophobicContact CE2-CG2 3.58Å; Y402-V404 PolarHBondContact O-N 3.21Å; V404-M406 HydrophobicContact CG1-CG 3.69Å; V404-M406 HydrophobicContact CG1-SD 4.42Å
405	F	93.8	Very high	79.7	Confident	1 Å²	1	27.4 Å²	27.4	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.6	167.3	-63.1	-18.7	0	0	0	109.7	L264 I267 V268 V277 L291 L381 V382 I383 I384 L403	L264-F405 HydrophobicContact CD2-CD1 4.05Å; L264-F405 HydrophobicContact CD2-CD2 4.12Å; L264-F405 HydrophobicContact CD2-CE1 3.97Å; L264-F405 HydrophobicContact CD2-CE2 4.05Å; L264-F405 HydrophobicContact CD2-CG 4.11Å; L264-F405 HydrophobicContact CD2-CZ 3.97Å; I267-F405 HydrophobicContact CG2-CE1 4.12Å; I267-F405 HydrophobicContact CG2-CZ 4.47Å; V268-F405 HydrophobicContact CG2-CE2 3.87Å; V268-F405 HydrophobicContact CG2-CZ 3.65Å; V277-F405 HydrophobicContact CB-CD1 3.64Å; V277-F405 HydrophobicContact CB-CE1 4.02Å; V277-F405 HydrophobicContact CG2-CD1 3.65Å; V277-F405 HydrophobicContact CG2-CE1 3.51Å; L291-F405 HydrophobicContact CD2-CB 4.16Å; L381-F405 HydrophobicContact CD1-CD1 4.32Å; L381-F405 HydrophobicContact CD1-CD2 3.8Å; L381-F405 HydrophobicContact CD1-CE1 4.43Å; L381-F405 HydrophobicContact CD1-CE2 3.92Å; L381-F405 HydrophobicContact CD1-CG 4.02Å; L381-F405 HydrophobicContact CD1-CZ 4.25Å; L381-F405 HydrophobicContact CD2-CD2 4.36Å; L381-F405 HydrophobicContact CD2-CE2 4.16Å; V382-F405 PolarHBondContact O-N 2.94Å; I383-F405 CarbonylContact C-O 3.5Å; I383-F405 WeakPolarHBondContact CA-O 3.46Å; I383-F405 HydrophobicContact CG1-CB 4.29Å; I383-F405 HydrophobicContact CG1-CD2 4.36Å; I384-F405 PolarHBondContact N-O 3.39Å; L403-F405 HydrophobicContact CD1-CE1 3.92Å; L403-F405 HydrophobicContact CD2-CE1 4.07Å; L403-F405 HydrophobicContact CD2-CZ 3.97Å; L403-F405 HydrophobicContact CG-CE1 3.96Å; L403-F405 HydrophobicContact CG-CZ 4.34Å
406	M	90.6	Very high	78.1	Confident	8 Å²	8	28.2 Å²	28.2	4%	0.039	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.1	179.2	-58.6	-172.4	60	0	0	109.4	T276 V277 S278 L279 I384 A387 V395 L399 V404 L424	T276-M406 HydrophobicContact CG2-CG 4.47Å; T276-M406 HydrophobicContact CG2-SD 4.18Å; V277-M406 PolarHBondContact O-N 3.12Å; S278-M406 CarbonylContact C-O 3.58Å; L279-M406 PolarHBondContact N-O 2.6Å; I384-M406 HydrophobicContact CB-CG 4.45Å; I384-M406 HydrophobicContact CD1-CE 4.38Å; I384-M406 HydrophobicContact CD1-CG 4.22Å; A387-M406 HydrophobicContact CB-CE 3.75Å; V395-M406 HydrophobicContact CG1-CE 3.49Å; V395-M406 VanDerWaalsContact CG1-CE 3.49Å; L399-M406 HydrophobicContact CD2-SD 3.95Å; V404-M406 HydrophobicContact CG1-CG 3.69Å; V404-M406 HydrophobicContact CG1-SD 4.42Å; M406-L424 HydrophobicContact CE-CD2 3.48Å; M406-L424 VanDerWaalsContact CE-CD2 3.48Å; M406-L424 HydrophobicContact SD-CD2 4.12Å
407	A	89.3	Confident	76.7	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133	167.9	0	0	0	0	0	110.6	L279 K287 L291 I384 E386 A387	L279-A407 CarbonylContact O-C 3.52Å; L279-A407 WeakPolarHBondContact O-CA 3.16Å; K287-A407 HydrophobicContact CB-CB 4.46Å; K287-A407 HydrophobicContact CD-CB 4.27Å; L291-A407 HydrophobicContact CD1-CB 3.45Å; L291-A407 VanDerWaalsContact CD1-CB 3.45Å; L291-A407 HydrophobicContact CG-CB 4.39Å; I384-A407 PolarHBondContact O-N 3.12Å; E386-A407 PolarHBondContact N-O 2.84Å; A387-A407 WeakPolarHBondContact CB-O 3.26Å; A387-A407 PolarHBondContact N-O 3.22Å
408	S	83	Confident	75.2	Confident	8 Å²	8	21 Å²	21	6%	0.056	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.4	176.8	62.4	0	0	0	0	112.4	L279 A281	L279-S408 PolarHBondContact O-N 3.5Å; A281-S408 PolarHBondContact N-O 2.84Å; A281-S408 VanDerWaalsContact N-O 3.08Å
409	N	79.6	Confident	73.7	Confident	12 Å²	12	21.1 Å²	21.1	6%	0.064	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	119.1	172.4	-78.5	-21.6	0	0	0	110.5	A281 K287 E386 G417	A281-N409 CarbonylContact O-C 3.46Å; A281-N409 VanDerWaalsContact O-CA 3.29Å; A281-N409 WeakPolarHBondContact O-CA 3.39Å; K287-N409 WeakPolarHBondContact CE-OD1 3.35Å; K287-N409 PolarHBondContact NZ-OD1 3.43Å; E386-N409 PolarHBondContact OE1-ND2 2.76Å; E386-N409 PolarHBondContact OE2-ND2 2.87Å; N409-G417 VanDerWaalsContact O-CA 3.3Å; N409-G417 WeakPolarHBondContact O-CA 3.49Å
410	I	72	Confident	72.3	Confident	30 Å²	30	20.1 Å²	20.1	15%	0.154	12%	0.12	C	C	.	.			trans	-102.7	152.6	168	57	166.8	0	0	0	110.3	T280 A281 A282 G412 V464	T280-I410 HydrophobicContact CG2-CG2 4.3Å; A281-I410 PolarHBondContact O-N 3.2Å; A282-I410 VanDerWaalsContact CA-O 3.27Å; A282-I410 WeakPolarHBondContact CA-O 3.4Å; I410-G412 VanDerWaalsContact C-N 3.27Å; I410-G412 PolarHBondContact O-N 2.92Å; I410-G412 VanDerWaalsContact O-N 3.11Å; I410-V464 HydrophobicContact CD1-CG1 4.49Å
411	N	64.9	Low	71.4	Confident	43 Å²	43	19.9 Å²	19.9	23%	0.23	12%	0.115	C	C	.	.	S	Bend	trans	53.5	30.8	174.1	-55.2	-11.1	0	0	0	116.4	R418	N411-R418 PolarHBondContact OD1-NH1 2.81Å
412	G	62.7	Low	70.4	Confident	14 Å²	14	18.3 Å²	18.3	14%	0.144	10%	0.1	C	C	.	.	S	Bend	trans	-111.4	165.6	176.9	0	0	0	0	0	113.4	I410 E414 G415	I410-G412 VanDerWaalsContact C-N 3.27Å; I410-G412 PolarHBondContact O-N 2.92Å; I410-G412 VanDerWaalsContact O-N 3.11Å; G412-E414 PolarHBondContact O-N 3.44Å; G412-G415 PolarHBondContact O-N 3.36Å
413	Y	63.5	Low	69.5	Low	5 Å²	5	21.1 Å²	21.1	2%	0.02	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-14.2	177	63.6	-94.2	0	0	0	114.6	L114 N130 A133 R134 R283 G415 P542	L114-Y413 WeakPolarHBondContact CD1-OH 3.23Å; L114-Y413 WeakPolarHBondContact CD2-OH 3.42Å; N130-Y413 WeakPolarHBondContact OD1-CD2 3.37Å; A133-Y413 VanDerWaalsContact CB-CB 3.47Å; A133-Y413 HydrophobicContact CB-CD1 3.61Å; A133-Y413 HydrophobicContact CB-CG 3.77Å; R134-Y413 HydrophobicContact CB-CE1 4.49Å; R134-Y413 HydrophobicContact CG-CD1 4.19Å; R134-Y413 HydrophobicContact CG-CD2 3.79Å; R134-Y413 HydrophobicContact CG-CE1 3.79Å; R134-Y413 HydrophobicContact CG-CE2 3.37Å; R134-Y413 HydrophobicContact CG-CG 4.2Å; R134-Y413 VanDerWaalsContact NE-CE2 3.33Å; R283-Y413 PolarHBondContact NE-OH 3.35Å; R283-Y413 PolarHBondContact NH1-OH 3.04Å; Y413-G415 VanDerWaalsContact C-N 3.26Å; Y413-P542 VanDerWaalsContact CA-CG 3.46Å; Y413-P542 VanDerWaalsContact CB-CG 3.46Å; Y413-P542 WeakPolarHBondContact O-CD 3.46Å
414	E	59.1	Low	68.5	Low	52 Å²	52	21.6 Å²	21.6	24%	0.243	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-5	174.5	-100	160.9	-146	0	0	113.4	L114 R283 G412 T416	L114-E414 WeakPolarHBondContact CD1-OE1 3.46Å; R283-E414 IonicContact CZ-OE2 3.22Å; R283-E414 IonicContact NH1-OE1 3.47Å; R283-E414 PolarHBondContact NH1-OE1 3.02Å; R283-E414 VanDerWaalsContact NH1-OE1 3.09Å; R283-E414 IonicContact NH1-OE2 3.95Å; R283-E414 PolarHBondContact NH1-OE2 2.98Å; G412-E414 PolarHBondContact O-N 3.44Å; E414-T416 WeakPolarHBondContact O-CG2 3.43Å; E414-T416 PolarHBondContact O-N 2.89Å; E414-T416 PolarHBondContact O-OG1 3.39Å
415	G	50.7	Low	67.7	Low	18 Å²	18	22.1 Å²	22.1	19%	0.186	12%	0.118	C	C	.	.			trans	43.8	5.9	155.8	0	0	0	0	0	120.2	G412 Y413 N540	G412-G415 PolarHBondContact O-N 3.36Å; Y413-G415 VanDerWaalsContact C-N 3.26Å; G415-N540 VanDerWaalsContact CA-O 3.27Å; G415-N540 WeakPolarHBondContact CA-O 3.36Å; G415-N540 PolarHBondContact O-N 3.26Å; G415-N540 VanDerWaalsContact O-N 3.07Å
416	T	52.6	Low	66.7	Low	17 Å²	17	27.1 Å²	27.1	10%	0.104	14%	0.142	C	C	.	.			trans	-91.5	-25.6	177.9	51.9	0	0	0	0	111.6	A388 E414 S419 L420 Y538 K539	A388-T416 VanDerWaalsContact C-OG1 3.26Å; A388-T416 WeakPolarHBondContact O-CB 3.37Å; A388-T416 PolarHBondContact O-OG1 2.87Å; E414-T416 WeakPolarHBondContact O-CG2 3.43Å; E414-T416 PolarHBondContact O-N 2.89Å; E414-T416 PolarHBondContact O-OG1 3.39Å; T416-S419 PolarHBondContact O-OG 3.24Å; T416-L420 WeakPolarHBondContact O-CB 3.43Å; T416-L420 PolarHBondContact O-N 2.99Å; T416-Y538 WeakPolarHBondContact CA-O 3.41Å; T416-K539 HydrophobicContact CG2-CB 3.74Å; T416-K539 HydrophobicContact CG2-CD 3.55Å; T416-K539 HydrophobicContact CG2-CG 3.43Å; T416-K539 VanDerWaalsContact CG2-CG 3.43Å
417	G	51.1	Low	66	Low	3 Å²	3	29.6 Å²	29.6	3%	0.031	15%	0.153	C	C	.	.	H	α-helix	trans	-78.4	-27.1	-163.1	0	0	0	0	0	115.6	N409 S421	N409-G417 VanDerWaalsContact O-CA 3.3Å; N409-G417 WeakPolarHBondContact O-CA 3.49Å; G417-S421 WeakPolarHBondContact O-CA 3.42Å; G417-S421 WeakPolarHBondContact O-CB 3.03Å; G417-S421 PolarHBondContact O-N 3.37Å; G417-S421 PolarHBondContact O-OG 3.45Å
418	R	55	Low	65.3	Low	53 Å²	53	30 Å²	30	20%	0.2	16%	0.155	C	C	.	.	H	α-helix	trans	-81.9	-42.8	-175	-167.8	171.1	176.8	151.5	-2.7	113.3	N411 S421 L422 N490	N411-R418 PolarHBondContact OD1-NH1 2.81Å; R418-S421 WeakPolarHBondContact CA-OG 3.4Å; R418-S421 PolarHBondContact O-OG 3.25Å; R418-S421 VanDerWaalsContact O-OG 3.12Å; R418-L422 HydrophobicContact CG-CD1 4.01Å; R418-L422 HydrophobicContact CG-CG 4.35Å; R418-L422 WeakPolarHBondContact O-CB 3.37Å; R418-L422 WeakPolarHBondContact O-CG 3.48Å; R418-L422 PolarHBondContact O-N 3.01Å; R418-N490 PolarHBondContact NH1-OD1 3.19Å; R418-N490 PolarHBondContact NH2-OD1 3.34Å
419	S	55.6	Low	65	Low	1 Å²	1	35.4 Å²	35.4	1%	0.007	17%	0.174	C	C	.	.	H	α-helix	trans	-67.4	-39.3	173.7	49.3	0	0	0	0	111.7	T416 K423 H537 Y538	T416-S419 PolarHBondContact O-OG 3.24Å; S419-K423 WeakPolarHBondContact O-CB 3.37Å; S419-K423 WeakPolarHBondContact O-CG 3.28Å; S419-K423 PolarHBondContact O-N 3.06Å; S419-H537 WeakPolarHBondContact CB-O 3.48Å; S419-H537 PolarHBondContact OG-O 2.69Å; S419-Y538 WeakPolarHBondContact OG-CA 3Å; S419-Y538 PolarHBondContact OG-O 3.06Å
420	L	57.3	Low	64.7	Low	15 Å²	15	40 Å²	40	8%	0.079	20%	0.195	C	C	.	.	H	α-helix	trans	-67.1	-48.8	175.4	-171.1	80.9	0	0	0	110.2	A387 L392 T416 K423 L424	A387-L420 VanDerWaalsContact O-CD2 3.27Å; A387-L420 WeakPolarHBondContact O-CD2 3.42Å; L392-L420 HydrophobicContact CB-CD1 3.69Å; L392-L420 HydrophobicContact CD1-CD1 3.62Å; L392-L420 HydrophobicContact CD1-CG 4.49Å; L392-L420 HydrophobicContact CD2-CD1 4.47Å; L392-L420 HydrophobicContact CG-CD1 4.1Å; T416-L420 WeakPolarHBondContact O-CB 3.43Å; T416-L420 PolarHBondContact O-N 2.99Å; L420-K423 PolarHBondContact O-N 2.9Å; L420-L424 WeakPolarHBondContact O-CA 3.28Å; L420-L424 WeakPolarHBondContact O-CB 3.48Å; L420-L424 PolarHBondContact O-N 3.25Å
421	S	62.1	Low	64.6	Low	11 Å²	11	42.1 Å²	42.1	8%	0.077	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-46.1	177.4	70.2	0	0	0	0	110.2	G417 R418 K423 L425	G417-S421 WeakPolarHBondContact O-CA 3.42Å; G417-S421 WeakPolarHBondContact O-CB 3.03Å; G417-S421 PolarHBondContact O-N 3.37Å; G417-S421 PolarHBondContact O-OG 3.45Å; R418-S421 WeakPolarHBondContact CA-OG 3.4Å; R418-S421 PolarHBondContact O-OG 3.25Å; R418-S421 VanDerWaalsContact O-OG 3.12Å; S421-K423 PolarHBondContact O-N 3.41Å; S421-L425 WeakPolarHBondContact O-CA 3.46Å; S421-L425 WeakPolarHBondContact O-CB 3.26Å; S421-L425 WeakPolarHBondContact O-CD1 3.37Å; S421-L425 WeakPolarHBondContact O-CG 3.3Å; S421-L425 PolarHBondContact O-N 2.84Å
422	L	64.1	Low	64.7	Low	80 Å²	80	41.4 Å²	41.4	42%	0.419	20%	0.202	S	C	.	.	H	α-helix	trans	-61.4	-47.7	178.7	-73.9	172.3	0	0	0	112.1	R418 H426	R418-L422 HydrophobicContact CG-CD1 4.01Å; R418-L422 HydrophobicContact CG-CG 4.35Å; R418-L422 WeakPolarHBondContact O-CB 3.37Å; R418-L422 WeakPolarHBondContact O-CG 3.48Å; R418-L422 PolarHBondContact O-N 3.01Å; L422-H426 WeakPolarHBondContact O-CA 3.3Å; L422-H426 WeakPolarHBondContact O-CB 3.49Å; L422-H426 PolarHBondContact O-N 3.41Å
423	K	68.6	Low	64.7	Low	71 Å²	71	43.5 Å²	43.5	31%	0.309	22%	0.218	S	C	.	.	H	α-helix	trans	-70.1	-42.9	-179.8	-72.1	-179.2	179	-178.9	0	112.5	S419 L420 S421 H426 Q427 Y538	S419-K423 WeakPolarHBondContact O-CB 3.37Å; S419-K423 WeakPolarHBondContact O-CG 3.28Å; S419-K423 PolarHBondContact O-N 3.06Å; L420-K423 PolarHBondContact O-N 2.9Å; S421-K423 PolarHBondContact O-N 3.41Å; K423-H426 PolarHBondContact O-N 3.39Å; K423-Q427 WeakPolarHBondContact O-CB 3.48Å; K423-Q427 PolarHBondContact O-N 3.33Å; K423-Y538 HydrophobicContact CD-CD1 4.39Å; K423-Y538 HydrophobicContact CD-CE1 3.63Å; K423-Y538 PolarHBondContact NZ-OH 3.39Å; K423-Y538 VanDerWaalsContact NZ-OH 3.17Å
424	L	71.8	Confident	64.4	Low	11 Å²	11	48.7 Å²	48.7	6%	0.058	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-47.6	178.2	-178.2	71.7	0	0	0	111	L392 V395 L399 M406 L420 H426 Q427 L428	L392-L424 HydrophobicContact CD1-CB 4.33Å; L392-L424 HydrophobicContact CD1-CD1 3.89Å; V395-L424 HydrophobicContact CG1-CD2 3.92Å; L399-L424 HydrophobicContact CD1-CD1 4.26Å; M406-L424 HydrophobicContact CE-CD2 3.48Å; M406-L424 VanDerWaalsContact CE-CD2 3.48Å; M406-L424 HydrophobicContact SD-CD2 4.12Å; L420-L424 WeakPolarHBondContact O-CA 3.28Å; L420-L424 WeakPolarHBondContact O-CB 3.48Å; L420-L424 PolarHBondContact O-N 3.25Å; L424-H426 VanDerWaalsContact C-N 3.31Å; L424-H426 PolarHBondContact O-N 2.81Å; L424-Q427 PolarHBondContact O-N 3.24Å; L424-L428 HydrophobicContact CD1-CD1 4.46Å; L424-L428 HydrophobicContact CG-CD1 4.02Å; L424-L428 HydrophobicContact CG-CG 4.48Å; L424-L428 WeakPolarHBondContact O-CB 3.39Å; L424-L428 VanDerWaalsContact O-CG 3.32Å; L424-L428 WeakPolarHBondContact O-CG 3.43Å; L424-L428 PolarHBondContact O-N 3.27Å
425	L	74.2	Confident	64.1	Low	11 Å²	11	50.2 Å²	50.2	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-39.3	175.8	-65.5	168.9	0	0	0	110.5	S421 Q427 L428 R429 L460 E462	S421-L425 WeakPolarHBondContact O-CA 3.46Å; S421-L425 WeakPolarHBondContact O-CB 3.26Å; S421-L425 WeakPolarHBondContact O-CD1 3.37Å; S421-L425 WeakPolarHBondContact O-CG 3.3Å; S421-L425 PolarHBondContact O-N 2.84Å; L425-Q427 PolarHBondContact O-N 3.39Å; L425-L428 PolarHBondContact O-N 3.45Å; L425-R429 VanDerWaalsContact O-CB 3.23Å; L425-R429 WeakPolarHBondContact O-CB 3.26Å; L425-R429 WeakPolarHBondContact O-CG 3.44Å; L425-R429 PolarHBondContact O-N 3.17Å; L425-L460 HydrophobicContact CD2-CD1 3.89Å; L425-L460 HydrophobicContact CD2-CD2 3.86Å; L425-L460 HydrophobicContact CD2-CG 4.4Å; L425-E462 HydrophobicContact CD2-CG 4.15Å
426	H	73.4	Confident	64.1	Low	107 Å²	107	54 Å²	54	50%	0.495	28%	0.282	S	S	.	.	H	α-helix	trans	-62.4	-43.4	174.7	-171	68.2	0	0	0	111.6	L422 K423 L424 R429 Q430	L422-H426 WeakPolarHBondContact O-CA 3.3Å; L422-H426 WeakPolarHBondContact O-CB 3.49Å; L422-H426 PolarHBondContact O-N 3.41Å; K423-H426 PolarHBondContact O-N 3.39Å; L424-H426 VanDerWaalsContact C-N 3.31Å; L424-H426 PolarHBondContact O-N 2.81Å; H426-R429 PolarHBondContact O-N 3.45Å; H426-Q430 PolarHBondContact CD2-NE2 3.23Å; H426-Q430 VanDerWaalsContact CD2-NE2 3.3Å; H426-Q430 PolarHBondContact NE2-NE2 3.36Å; H426-Q430 WeakPolarHBondContact O-CG 3.3Å; H426-Q430 PolarHBondContact O-N 3.21Å
427	Q	75.9	Confident	63.6	Low	60 Å²	60	56.3 Å²	56.3	28%	0.28	31%	0.309	S	S	.	.	H	α-helix	trans	-63.4	-46.8	175.2	-168.1	-170.5	-33.8	0	0	111.6	K423 L424 L425 R429 Q430 E431	K423-Q427 WeakPolarHBondContact O-CB 3.48Å; K423-Q427 PolarHBondContact O-N 3.33Å; L424-Q427 PolarHBondContact O-N 3.24Å; L425-Q427 PolarHBondContact O-N 3.39Å; Q427-R429 VanDerWaalsContact C-N 3.33Å; Q427-R429 PolarHBondContact O-N 2.83Å; Q427-Q430 WeakPolarHBondContact O-CB 3.38Å; Q427-Q430 PolarHBondContact O-N 2.88Å; Q427-E431 PolarHBondContact NE2-OE1 2.8Å; Q427-E431 WeakPolarHBondContact O-CG 3.32Å; Q427-E431 PolarHBondContact O-N 3.13Å
428	L	74.7	Confident	62.7	Low	7 Å²	7	61.5 Å²	61.5	4%	0.037	34%	0.34	C	S	.	.	H	α-helix	trans	-62.7	-39.1	177.1	-71.7	172.6	0	0	0	111.7	T276 L399 L424 L425 E431 T432 L460	T276-L428 HydrophobicContact CG2-CD1 4.39Å; L399-L428 HydrophobicContact CD1-CD2 4.21Å; L424-L428 HydrophobicContact CD1-CD1 4.46Å; L424-L428 HydrophobicContact CG-CD1 4.02Å; L424-L428 HydrophobicContact CG-CG 4.48Å; L424-L428 WeakPolarHBondContact O-CB 3.39Å; L424-L428 VanDerWaalsContact O-CG 3.32Å; L424-L428 WeakPolarHBondContact O-CG 3.43Å; L424-L428 PolarHBondContact O-N 3.27Å; L425-L428 PolarHBondContact O-N 3.45Å; L428-E431 PolarHBondContact O-N 3.42Å; L428-T432 PolarHBondContact O-N 3.34Å; L428-T432 PolarHBondContact O-OG1 3.13Å; L428-L460 HydrophobicContact CB-CD2 4.11Å; L428-L460 HydrophobicContact CD1-CD1 4.19Å
429	R	75.6	Confident	61.6	Low	122 Å²	122	67.4 Å²	67.4	46%	0.46	37%	0.37	S	S	.	.	H	α-helix	trans	-62.5	-40.7	173.8	-75.9	171.1	-172.9	-177.6	1.8	111.7	L425 H426 Q427 T432 A433 L460 E462	L425-R429 VanDerWaalsContact O-CB 3.23Å; L425-R429 WeakPolarHBondContact O-CB 3.26Å; L425-R429 WeakPolarHBondContact O-CG 3.44Å; L425-R429 PolarHBondContact O-N 3.17Å; H426-R429 PolarHBondContact O-N 3.45Å; Q427-R429 VanDerWaalsContact C-N 3.33Å; Q427-R429 PolarHBondContact O-N 2.83Å; R429-T432 PolarHBondContact O-N 3Å; R429-A433 VanDerWaalsContact O-CB 3.3Å; R429-A433 WeakPolarHBondContact O-CB 3.37Å; R429-A433 PolarHBondContact O-N 3.47Å; R429-L460 HydrophobicContact CG-CD2 3.77Å; R429-E462 IonicContact CZ-OE1 2.7Å; R429-E462 IonicContact CZ-OE2 3.65Å; R429-E462 IonicContact NE-OE1 3.09Å; R429-E462 PolarHBondContact NE-OE1 3.25Å; R429-E462 IonicContact NH2-OE1 2.76Å; R429-E462 PolarHBondContact NH2-OE1 3.47Å; R429-E462 IonicContact NH2-OE2 3.43Å; R429-E462 PolarHBondContact NH2-OE2 3.49Å
430	Q	73.1	Confident	60.3	Low	108 Å²	108	73.9 Å²	73.9	51%	0.505	41%	0.41	S	S	.	.	H	α-helix	trans	-63.4	-44	174.7	-73.5	-179.4	7.5	0	0	111	H426 Q427 T432 A433 C434	H426-Q430 PolarHBondContact CD2-NE2 3.23Å; H426-Q430 VanDerWaalsContact CD2-NE2 3.3Å; H426-Q430 PolarHBondContact NE2-NE2 3.36Å; H426-Q430 WeakPolarHBondContact O-CG 3.3Å; H426-Q430 PolarHBondContact O-N 3.21Å; Q427-Q430 WeakPolarHBondContact O-CB 3.38Å; Q427-Q430 PolarHBondContact O-N 2.88Å; Q430-T432 VanDerWaalsContact C-N 3.33Å; Q430-T432 PolarHBondContact O-N 3.22Å; Q430-A433 PolarHBondContact O-N 2.84Å; Q430-C434 PolarHBondContact O-N 2.9Å; Q430-C434 VanDerWaalsContact O-N 3.13Å
431	E	70.2	Confident	58.9	Low	75 Å²	75	82.7 Å²	82.7	35%	0.35	45%	0.447	S	S	.	.	H	α-helix	trans	-62.1	-39.4	175.6	-70.8	170.9	-163.8	0	0	111.8	Q427 L428 I435	Q427-E431 PolarHBondContact NE2-OE1 2.8Å; Q427-E431 WeakPolarHBondContact O-CG 3.32Å; Q427-E431 PolarHBondContact O-N 3.13Å; L428-E431 PolarHBondContact O-N 3.42Å; E431-I435 WeakPolarHBondContact O-CG1 3.4Å
432	T	68.1	Low	57.4	Low	28 Å²	28	88.4 Å²	88.4	17%	0.172	49%	0.487	C	S	.	.	H	α-helix	trans	-66.7	-42.6	173.7	-51.5	0	0	0	0	112.1	L428 R429 Q430 C434 I435 T436 R458	L428-T432 PolarHBondContact O-N 3.34Å; L428-T432 PolarHBondContact O-OG1 3.13Å; R429-T432 PolarHBondContact O-N 3Å; Q430-T432 VanDerWaalsContact C-N 3.33Å; Q430-T432 PolarHBondContact O-N 3.22Å; T432-C434 VanDerWaalsContact C-N 3.27Å; T432-C434 PolarHBondContact O-N 3.33Å; T432-I435 WeakPolarHBondContact O-CB 3.49Å; T432-I435 PolarHBondContact O-N 3.12Å; T432-T436 PolarHBondContact O-N 3.38Å; T432-R458 WeakPolarHBondContact CB-O 3.32Å; T432-R458 PolarHBondContact OG1-O 2.84Å
433	A	61.1	Low	55.6	Low	58 Å²	58	89.7 Å²	89.7	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-30.8	-178.6	0	0	0	0	0	112.8	R429 Q430 I435 T436 G437	R429-A433 VanDerWaalsContact O-CB 3.3Å; R429-A433 WeakPolarHBondContact O-CB 3.37Å; R429-A433 PolarHBondContact O-N 3.47Å; Q430-A433 PolarHBondContact O-N 2.84Å; A433-I435 PolarHBondContact O-N 3.22Å; A433-T436 PolarHBondContact O-N 2.97Å; A433-G437 PolarHBondContact O-N 3.28Å
434	C	57.6	Low	53.8	Low	115 Å²	115	91.1 Å²	91.1	78%	0.777	53%	0.534	S	S	*	.	H	α-helix	trans	-64.5	-23.2	172.7	-78.2	0	0	0	0	113.6	Q430 T432	Q430-C434 PolarHBondContact O-N 2.9Å; Q430-C434 VanDerWaalsContact O-N 3.13Å; T432-C434 VanDerWaalsContact C-N 3.27Å; T432-C434 PolarHBondContact O-N 3.33Å
435	I	54	Low	51.7	Low	84 Å²	84	94.1 Å²	94.1	43%	0.431	57%	0.568	S	S	.	*	H	α-helix	trans	-84.9	-38.9	179.2	-45.1	158.4	0	0	0	111.1	E431 T432 A433 G437 G457	E431-I435 WeakPolarHBondContact O-CG1 3.4Å; T432-I435 WeakPolarHBondContact O-CB 3.49Å; T432-I435 PolarHBondContact O-N 3.12Å; A433-I435 PolarHBondContact O-N 3.22Å; I435-G437 VanDerWaalsContact C-N 3.31Å; I435-G437 PolarHBondContact O-N 3.49Å; I435-G457 VanDerWaalsContact CD1-O 3.26Å; I435-G457 WeakPolarHBondContact CD1-O 3.31Å
436	T	50	Low	49.6	Very low	97 Å²	97	99.1 Å²	99.1	60%	0.595	60%	0.604	S	S	*	*	H	α-helix	trans	-87.4	1.9	-173.3	53.5	0	0	0	0	113.6	T432 A433 T438	T432-T436 PolarHBondContact O-N 3.38Å; A433-T436 PolarHBondContact O-N 2.97Å; T436-T438 PolarHBondContact O-N 3.09Å; T436-T438 PolarHBondContact O-OG1 3.26Å
437	G	43.1	Very low	47.4	Very low	65 Å²	65	99.9 Å²	99.9	67%	0.67	62%	0.622	S	S	*	*			trans	-71.8	61.7	174.1	0	0	0	0	0	113.9	A433 I435	A433-G437 PolarHBondContact O-N 3.28Å; I435-G437 VanDerWaalsContact C-N 3.31Å; I435-G437 PolarHBondContact O-N 3.49Å
438	T	31.7	Very low	45.2	Very low	113 Å²	113	105.6 Å²	105.6	69%	0.693	65%	0.645	S	S	*	*			trans	-80.1	113.7	162.8	33.4	0	0	0	0	110.4	T436	T436-T438 PolarHBondContact O-N 3.09Å; T436-T438 PolarHBondContact O-OG1 3.26Å
439	H	32.1	Very low	42.8	Very low	177 Å²	177	115 Å²	115	82%	0.819	69%	0.689	S	S	*	*			trans	48.1	79.6	149.7	-60.2	-73.8	0	0	0	119.6
440	T	27.4	Very low	40.6	Very low	137 Å²	137	114.3 Å²	114.3	84%	0.84	70%	0.698	S	S	*	*			trans	-139.3	96.2	143.1	43.8	0	0	0	0	112.4
441	K	27.8	Very low	38.3	Very low	200 Å²	200	118.1 Å²	118.1	87%	0.87	72%	0.716	S	S	*	*			trans	53.2	98.4	152.9	-61.1	-178.2	-179.6	178.1	0	119.1
442	S	30.1	Very low	36.5	Very low	130 Å²	130	121.6 Å²	121.6	91%	0.909	74%	0.736	S	S	*	*			trans	-149.1	88.9	140	-66.6	0	0	0	0	109	A444	S442-A444 PolarHBondContact O-N 2.99Å
443	A	27	Very low	34.8	Very low	108 Å²	108	126.2 Å²	126.2	89%	0.893	76%	0.764	S	S	*	*			trans	-78.3	104.9	170.3	0	0	0	0	0	109.3
444	A	30.4	Very low	33.5	Very low	100 Å²	100	127.7 Å²	127.7	83%	0.826	78%	0.776	S	S	*	*			trans	-172.6	105.3	152.3	0	0	0	0	0	111.5	S442	S442-A444 PolarHBondContact O-N 2.99Å
445	G	27.9	Very low	32.9	Very low	75 Å²	75	128.6 Å²	128.6	77%	0.773	78%	0.778	S	S	*	*			trans	87.6	113.3	139.8	0	0	0	0	0	119.6
446	S	31.3	Very low	32.8	Very low	116 Å²	116	127.5 Å²	127.5	81%	0.811	78%	0.778	S	S	*	*			trans	91.1	97.5	155.4	77.7	0	0	0	0	118.4	K448	S446-K448 PolarHBondContact O-N 3.17Å
447	S	25.4	Very low	33.3	Very low	123 Å²	123	123.8 Å²	123.8	86%	0.86	76%	0.759	S	S	*	*			trans	-55.9	105.7	153.7	49.9	0	0	0	0	110.9
448	K	30.1	Very low	34.7	Very low	180 Å²	180	121.8 Å²	121.8	78%	0.783	73%	0.731	S	S	*	*			trans	-128.4	107.7	152.2	-83.1	-172.7	175.2	-179.2	0	107.8	S446 T450	S446-K448 PolarHBondContact O-N 3.17Å; K448-T450 VanDerWaalsContact C-N 3.3Å; K448-T450 PolarHBondContact O-N 3.46Å; K448-T450 PolarHBondContact O-OG1 2.82Å; K448-T450 VanDerWaalsContact O-OG1 3.08Å
449	E	25.1	Very low	37.1	Very low	205 Å²	205	120 Å²	120	96%	0.958	72%	0.721	S	S	*	*			trans	-49	99.9	160.6	-70.1	172.5	159.7	0	0	107.6
450	T	28.4	Very low	39.7	Very low	106 Å²	106	113.1 Å²	113.1	65%	0.65	69%	0.689	S	S	*	*			trans	-106.5	114.6	172.4	-47.6	0	0	0	0	103.5	K448 I452	K448-T450 VanDerWaalsContact C-N 3.3Å; K448-T450 PolarHBondContact O-N 3.46Å; K448-T450 PolarHBondContact O-OG1 2.82Å; K448-T450 VanDerWaalsContact O-OG1 3.08Å; T450-I452 VanDerWaalsContact C-N 3.3Å; T450-I452 PolarHBondContact O-N 3.25Å
451	E	26.3	Very low	42.6	Very low	189 Å²	189	108.3 Å²	108.3	88%	0.883	66%	0.661	S	S	*	*			trans	-55.1	98.3	169	-73.4	180	150.4	0	0	108	T453	E451-T453 VanDerWaalsContact C-N 3.33Å; E451-T453 PolarHBondContact O-N 2.9Å
452	I	31.9	Very low	45.4	Very low	147 Å²	147	102.5 Å²	102.5	75%	0.754	64%	0.637	S	S	*	*			trans	-68.4	98.4	171.8	-62.9	167.3	0	0	0	105.1	T450 A454	T450-I452 VanDerWaalsContact C-N 3.3Å; T450-I452 PolarHBondContact O-N 3.25Å; I452-A454 PolarHBondContact O-N 3.5Å
453	T	32.4	Very low	48.3	Very low	126 Å²	126	96.9 Å²	96.9	77%	0.773	60%	0.597	S	S	*	*			trans	-51.7	114.2	160.9	36.4	0	0	0	0	107.2	E451 T455	E451-T453 VanDerWaalsContact C-N 3.33Å; E451-T453 PolarHBondContact O-N 2.9Å; T453-T455 VanDerWaalsContact C-N 3.31Å; T453-T455 PolarHBondContact O-N 3.47Å
454	A	33.7	Very low	51.2	Low	88 Å²	88	94.9 Å²	94.9	73%	0.727	57%	0.574	S	S	*	*			trans	-63.2	81.6	-167.3	0	0	0	0	0	112.6	I452 S456	I452-A454 PolarHBondContact O-N 3.5Å; A454-S456 PolarHBondContact O-N 3.31Å
455	T	44.9	Very low	54	Low	134 Å²	134	90.2 Å²	90.2	82%	0.822	54%	0.535	S	S	*	.			trans	-78	73.4	155	39	0	0	0	0	107.3	T453 G457	T453-T455 VanDerWaalsContact C-N 3.31Å; T453-T455 PolarHBondContact O-N 3.47Å; T455-G457 PolarHBondContact O-N 2.94Å
456	S	52	Low	56.7	Low	61 Å²	61	93.8 Å²	93.8	43%	0.427	53%	0.532	S	S	.	.			trans	-66.7	105.1	179.3	-137.7	0	0	0	0	108.6	R274 A454	R274-S456 PolarHBondContact NH1-OG 3.4Å; A454-S456 PolarHBondContact O-N 3.31Å
457	G	59.8	Low	59.3	Low	20 Å²	20	90.5 Å²	90.5	21%	0.206	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-65.7	159.3	-170.2	0	0	0	0	0	113.1	I435 T455	I435-G457 VanDerWaalsContact CD1-O 3.26Å; I435-G457 WeakPolarHBondContact CD1-O 3.31Å; T455-G457 PolarHBondContact O-N 2.94Å
458	R	72.8	Confident	62.3	Low	22 Å²	22	85 Å²	85	8%	0.083	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-102.5	149.9	-174.9	-61.4	177	65.7	75.6	3.1	110.6	R274 H275 T276 G400 Y402 T432	R274-R458 WeakPolarHBondContact O-CA 3.43Å; R274-R458 WeakPolarHBondContact O-CB 3.32Å; H275-R458 PolarHBondContact O-NH2 2.96Å; H275-R458 VanDerWaalsContact O-NH2 3.1Å; T276-R458 VanDerWaalsContact OG1-CZ 3.28Å; T276-R458 PolarHBondContact OG1-NE 3.24Å; T276-R458 PolarHBondContact OG1-NH2 3.05Å; G400-R458 PolarHBondContact O-NH1 2.79Å; Y402-R458 PolarHBondContact O-NH1 2.96Å; Y402-R458 PolarHBondContact O-NH2 3.28Å; T432-R458 WeakPolarHBondContact CB-O 3.32Å; T432-R458 PolarHBondContact OG1-O 2.84Å
459	V	83.2	Confident	65	Low	77 Å²	77	78.8 Å²	78.8	47%	0.467	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	130.4	170.9	-176	0	0	0	0	108.3	R274 H275 T276	R274-V459 PolarHBondContact O-N 3.17Å; R274-V459 VanDerWaalsContact O-N 3.13Å; H275-V459 PolarHBondContact ND1-O 3.43Å; T276-V459 PolarHBondContact N-O 3.38Å
460	L	86.1	Confident	67.9	Low	31 Å²	31	70.4 Å²	70.4	16%	0.162	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.7	179	178.5	68.8	0	0	0	110.6	T276 L425 L428 R429 E462	T276-L460 HydrophobicContact CG2-CD1 4.4Å; T276-L460 WeakPolarHBondContact O-CA 3.38Å; L425-L460 HydrophobicContact CD2-CD1 3.89Å; L425-L460 HydrophobicContact CD2-CD2 3.86Å; L425-L460 HydrophobicContact CD2-CG 4.4Å; L428-L460 HydrophobicContact CB-CD2 4.11Å; L428-L460 HydrophobicContact CD1-CD1 4.19Å; R429-L460 HydrophobicContact CG-CD2 3.77Å; L460-E462 HydrophobicContact CD2-CG 4.23Å; L460-E462 HydrophobicContact CG-CG 4.21Å
461	S	87.7	Confident	70.8	Confident	36 Å²	36	65.7 Å²	65.7	25%	0.252	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	123.7	169.5	-80.3	0	0	0	0	109.9	H275 T276 V277 S278	H275-S461 VanDerWaalsContact CE1-CB 3.5Å; H275-S461 WeakPolarHBondContact CE1-CB 3.43Å; H275-S461 PolarHBondContact CE1-OG 2.75Å; H275-S461 PolarHBondContact NE2-OG 3.01Å; H275-S461 VanDerWaalsContact NE2-OG 3.08Å; T276-S461 PolarHBondContact O-N 3.33Å; V277-S461 CarbonylContact C-O 3.54Å; V277-S461 WeakPolarHBondContact CA-O 3.16Å; S278-S461 PolarHBondContact N-O 3.06Å
462	E	87.3	Confident	73.7	Confident	78 Å²	78	57.5 Å²	57.5	36%	0.364	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.6	179.8	-66.8	179.3	-162.5	0	0	110.6	L425 R429 L460	L425-E462 HydrophobicContact CD2-CG 4.15Å; R429-E462 IonicContact CZ-OE1 2.7Å; R429-E462 IonicContact CZ-OE2 3.65Å; R429-E462 IonicContact NE-OE1 3.09Å; R429-E462 PolarHBondContact NE-OE1 3.25Å; R429-E462 IonicContact NH2-OE1 2.76Å; R429-E462 PolarHBondContact NH2-OE1 3.47Å; R429-E462 IonicContact NH2-OE2 3.43Å; R429-E462 PolarHBondContact NH2-OE2 3.49Å; L460-E462 HydrophobicContact CD2-CG 4.23Å; L460-E462 HydrophobicContact CG-CG 4.21Å
463	L	90.3	Very high	76.2	Confident	12 Å²	12	53.9 Å²	53.9	6%	0.063	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.6	177	-58.5	179.7	0	0	0	109.1	V260 K263 L264 V277 S278 L279 T280	V260-L463 HydrophobicContact CG1-CD1 4.18Å; V260-L463 HydrophobicContact CG2-CB 4.43Å; K263-L463 HydrophobicContact CB-CD1 4.21Å; K263-L463 HydrophobicContact CB-CD2 4.3Å; K263-L463 HydrophobicContact CD-CD2 3.45Å; K263-L463 VanDerWaalsContact CD-CD2 3.45Å; L264-L463 HydrophobicContact CD2-CD1 4.22Å; L264-L463 HydrophobicContact CG-CD1 4.23Å; V277-L463 HydrophobicContact CG1-CD1 3.64Å; V277-L463 HydrophobicContact CG1-CG 4Å; S278-L463 PolarHBondContact O-N 2.85Å; L279-L463 WeakPolarHBondContact CA-O 3.38Å; L279-L463 HydrophobicContact CD1-CB 3.88Å; T280-L463 PolarHBondContact N-O 3.2Å; T280-L463 PolarHBondContact OG1-O 3.16Å
464	V	88.4	Confident	78.7	Confident	66 Å²	66	51 Å²	51	40%	0.4	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.3	178.8	-171.3	0	0	0	0	108.8	T280 I410 E466	T280-V464 CarbonylContact O-C 3.6Å; T280-V464 WeakPolarHBondContact O-CA 3.4Å; I410-V464 HydrophobicContact CD1-CG1 4.49Å; V464-E466 HydrophobicContact CG1-CG 3.93Å
465	L	88.5	Confident	81.5	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.2	163.7	-64.4	162	0	0	0	110.3	D256 V260 L279 T280 A281 R285 K287	D256-L465 HydrophobicContact CB-CD2 4.31Å; D256-L465 VanDerWaalsContact OD2-CA 3.27Å; D256-L465 WeakPolarHBondContact OD2-CA 3.44Å; V260-L465 HydrophobicContact CB-CD2 3.92Å; V260-L465 HydrophobicContact CB-CG 4.5Å; V260-L465 HydrophobicContact CG2-CD2 3.42Å; V260-L465 VanDerWaalsContact CG2-CD2 3.42Å; V260-L465 HydrophobicContact CG2-CG 3.91Å; L279-L465 HydrophobicContact CD1-CD1 3.94Å; L279-L465 HydrophobicContact CD1-CG 3.94Å; L279-L465 HydrophobicContact CD2-CD1 4.12Å; L279-L465 HydrophobicContact CG-CD1 4.39Å; T280-L465 PolarHBondContact O-N 3.38Å; A281-L465 WeakPolarHBondContact CA-O 3.34Å; A281-L465 HydrophobicContact CB-CB 3.6Å; A281-L465 HydrophobicContact CB-CD1 4.39Å; A281-L465 HydrophobicContact CB-CG 4.47Å; A281-L465 WeakPolarHBondContact CB-O 3.22Å; R285-L465 HydrophobicContact CB-CB 4.18Å; K287-L465 HydrophobicContact CG-CD1 4.18Å
466	E	85.5	Confident	83.7	Confident	150 Å²	150	42 Å²	42	70%	0.701	26%	0.26	S	S	*	.			trans	-110.3	-34.3	-178.6	-61.5	-169.1	165.8	0	0	112.3	D256 R285 V464	D256-E466 PolarHBondContact OD2-N 3.45Å; R285-E466 VanDerWaalsContact CD-O 3.27Å; R285-E466 WeakPolarHBondContact CD-O 3.05Å; R285-E466 VanDerWaalsContact CZ-O 3.29Å; R285-E466 PolarHBondContact NE-O 3.13Å; V464-E466 HydrophobicContact CG1-CG 3.93Å
467	E	86.5	Confident	85.6	Confident	46 Å²	46	39.1 Å²	39.1	22%	0.215	24%	0.24	C	C	.	.	S	Bend	trans	-78.7	129	-173.3	-164.5	171	-161.9	0	0	112.9	T254 D256 R285	T254-E467 WeakPolarHBondContact CB-OE2 3.38Å; T254-E467 HydrophobicContact CG2-CB 4.38Å; T254-E467 HydrophobicContact CG2-CG 3.86Å; D256-E467 HydrophobicContact CB-CB 4.15Å; D256-E467 PolarHBondContact OD2-N 3.37Å; R285-E467 VanDerWaalsContact CD-C 3.45Å; R285-E467 VanDerWaalsContact CD-O 3.3Å; R285-E467 WeakPolarHBondContact CD-O 3.41Å
468	S	86.9	Confident	87.1	Confident	9 Å²	9	39.4 Å²	39.4	6%	0.063	24%	0.236	C	C	.	.			trans	-72.1	142.9	176.8	21.4	0	0	0	0	112.7	R285 Y471	R285-S468 PolarHBondContact NH1-OG 3.37Å; S468-Y471 VanDerWaalsContact CB-O 3.3Å; S468-Y471 WeakPolarHBondContact CB-O 3.35Å; S468-Y471 WeakPolarHBondContact OG-CD2 3.39Å; S468-Y471 WeakPolarHBondContact OG-CE2 3.47Å; S468-Y471 PolarHBondContact OG-O 3.38Å
469	I	87.4	Confident	87.9	Confident	49 Å²	49	41 Å²	41	25%	0.251	25%	0.25	S	C	.	.	S	Bend	trans	-91.1	-12.8	168.6	59	157.4	0	0	0	113.5	K253 T254 G284	K253-I469 HydrophobicContact CD-CB 4.46Å; T254-I469 HydrophobicContact CG2-CG2 4.3Å; G284-I469 WeakPolarHBondContact O-CG1 3.44Å; G284-I469 PolarHBondContact O-N 2.97Å
470	R	87	Confident	88.3	Confident	29 Å²	29	37.6 Å²	37.6	11%	0.109	23%	0.229	C	C	.	.	S	Bend	trans	-91.4	-41.7	-176.1	-73.3	-174.1	176.3	148.1	8.7	113.2	T117 E137 E140 G141	T117-R470 HydrophobicContact CG2-CG 4.26Å; T117-R470 PolarHBondContact OG1-NE 3.33Å; E137-R470 VanDerWaalsContact O-CD 3.29Å; E137-R470 WeakPolarHBondContact O-CD 3.38Å; E137-R470 PolarHBondContact O-NH1 3.34Å; E137-R470 IonicContact OE1-NH1 2.87Å; E137-R470 PolarHBondContact OE1-NH1 3.4Å; E140-R470 CarbonylContact C-O 3.51Å; E140-R470 WeakPolarHBondContact CA-O 3.4Å; G141-R470 PolarHBondContact N-O 3.01Å
471	Y	88.8	Confident	88.5	Confident	7 Å²	7	36.6 Å²	36.6	3%	0.027	22%	0.223	C	C	.	.	S	Bend	trans	-138.9	161.2	-175	42.9	-99.5	0	0	0	109.8	R23 S468 D475 E478	R23-Y471 VanDerWaalsContact CZ-CE1 3.44Å; S468-Y471 VanDerWaalsContact CB-O 3.3Å; S468-Y471 WeakPolarHBondContact CB-O 3.35Å; S468-Y471 WeakPolarHBondContact OG-CD2 3.39Å; S468-Y471 WeakPolarHBondContact OG-CE2 3.47Å; S468-Y471 PolarHBondContact OG-O 3.38Å; Y471-D475 HydrophobicContact CD2-CB 4Å; Y471-E478 HydrophobicContact CE2-CB 4.47Å; Y471-E478 VanDerWaalsContact CE2-CD 3.44Å; Y471-E478 HydrophobicContact CE2-CG 4.37Å; Y471-E478 WeakPolarHBondContact CE2-OE2 3.08Å; Y471-E478 PolarHBondContact OH-OE1 2.89Å
472	G	85.7	Confident	88.6	Confident	17 Å²	17	36.3 Å²	36.3	18%	0.175	22%	0.219	C	C	.	.			trans	-65.5	158.6	179.3	0	0	0	0	0	112.9	N21	N21-G472 PolarHBondContact ND2-N 3.48Å; N21-G472 PolarHBondContact O-N 3.45Å
473	A	85.2	Confident	88.6	Confident	71 Å²	71	36.9 Å²	36.9	59%	0.587	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	146.8	176.3	0	0	0	0	0	111.6	H22	H22-A473 PolarHBondContact NE2-O 3.48Å
474	G	86	Confident	88.6	Confident	65 Å²	65	36.4 Å²	36.4	67%	0.67	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.8	27.9	177.2	0	0	0	0	0	114.9	P476	G474-P476 VanDerWaalsContact O-CD 3.31Å; G474-P476 WeakPolarHBondContact O-CD 3.14Å
475	D	90.6	Very high	88.6	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	20%	0.2	C	C	.	.			trans	-59.2	118.7	178.6	-178.4	-3.4	0	0	0	111.5	R23 Y471 V477 E478 S479	R23-D475 IonicContact CZ-OD2 2.64Å; R23-D475 PolarHBondContact N-OD1 3.49Å; R23-D475 PolarHBondContact N-OD2 2.86Å; R23-D475 IonicContact NE-OD2 3.32Å; R23-D475 PolarHBondContact NE-OD2 2.92Å; R23-D475 IonicContact NH2-OD2 3.24Å; R23-D475 PolarHBondContact NH2-OD2 2.82Å; Y471-D475 HydrophobicContact CD2-CB 4Å; D475-V477 PolarHBondContact O-N 3.01Å; D475-V477 PolarHBondContact OD1-N 2.98Å; D475-E478 HydrophobicContact CB-CB 4.01Å; D475-E478 WeakPolarHBondContact O-CB 3.45Å; D475-E478 PolarHBondContact O-N 2.99Å; D475-S479 PolarHBondContact O-N 3.09Å
476	P	91.5	Very high	88.5	Confident	33 Å²	33	33.2 Å²	33.2	21%	0.214	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-33.3	-178.9	-24.2	33.8	0	0	0	113.4	A194 G474 E478 S479 W480	A194-P476 HydrophobicContact CB-CB 4.06Å; A194-P476 HydrophobicContact CB-CG 4.41Å; G474-P476 VanDerWaalsContact O-CD 3.31Å; G474-P476 WeakPolarHBondContact O-CD 3.14Å; P476-E478 VanDerWaalsContact C-N 3.33Å; P476-S479 PolarHBondContact O-N 2.96Å; P476-W480 VanDerWaalsContact O-CB 3.27Å; P476-W480 WeakPolarHBondContact O-CB 3.47Å; P476-W480 PolarHBondContact O-N 2.73Å
477	V	92.8	Very high	88.1	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69.5	-34.9	178.1	177.6	0	0	0	0	110.7	R23 M25 I136 A194 D475 W480 L481	R23-V477 HydrophobicContact CB-CB 4.14Å; R23-V477 HydrophobicContact CB-CG1 4.46Å; R23-V477 HydrophobicContact CB-CG2 4.11Å; R23-V477 VanDerWaalsContact O-CG2 3.3Å; R23-V477 WeakPolarHBondContact O-CG2 3.35Å; M25-V477 HydrophobicContact CE-CG1 3.96Å; I136-V477 HydrophobicContact CG2-CG1 3.83Å; A194-V477 HydrophobicContact CB-CG2 3.87Å; D475-V477 PolarHBondContact O-N 3.01Å; D475-V477 PolarHBondContact OD1-N 2.98Å; V477-W480 HydrophobicContact CG1-CE3 4.49Å; V477-L481 VanDerWaalsContact O-CB 3.27Å; V477-L481 WeakPolarHBondContact O-CB 3.1Å; V477-L481 PolarHBondContact O-N 2.95Å
478	E	90.7	Very high	87.4	Confident	26 Å²	26	27.5 Å²	27.5	12%	0.121	18%	0.176	C	C	.	.	H	α-helix	trans	-65.7	-50.8	174.1	-166.7	174.8	-150.7	0	0	111.3	R23 R285 Y471 D475 P476 W480 L481 N482	R23-E478 VanDerWaalsContact NH2-CB 3.27Å; R285-E478 IonicContact CZ-OE1 3.65Å; R285-E478 IonicContact NH1-OE1 2.8Å; R285-E478 PolarHBondContact NH1-OE1 3.28Å; R285-E478 IonicContact NH1-OE2 2.68Å; R285-E478 IonicContact NH2-OE1 3.66Å; R285-E478 PolarHBondContact NH2-OE1 3.36Å; R285-E478 IonicContact NH2-OE2 3.24Å; Y471-E478 HydrophobicContact CE2-CB 4.47Å; Y471-E478 VanDerWaalsContact CE2-CD 3.44Å; Y471-E478 HydrophobicContact CE2-CG 4.37Å; Y471-E478 WeakPolarHBondContact CE2-OE2 3.08Å; Y471-E478 PolarHBondContact OH-OE1 2.89Å; D475-E478 HydrophobicContact CB-CB 4.01Å; D475-E478 WeakPolarHBondContact O-CB 3.45Å; D475-E478 PolarHBondContact O-N 2.99Å; P476-E478 VanDerWaalsContact C-N 3.33Å; E478-W480 VanDerWaalsContact C-N 3.32Å; E478-W480 PolarHBondContact O-N 3.31Å; E478-L481 PolarHBondContact O-N 3.12Å; E478-L481 VanDerWaalsContact O-N 3.12Å; E478-N482 PolarHBondContact O-N 3.19Å
479	S	89.7	Confident	86.3	Confident	54 Å²	54	27.5 Å²	27.5	38%	0.378	18%	0.175	S	C	.	.	H	α-helix	trans	-60.7	-44.5	-178.1	-176.4	0	0	0	0	110.9	D475 P476 L481 N482 Q483	D475-S479 PolarHBondContact O-N 3.09Å; P476-S479 PolarHBondContact O-N 2.96Å; S479-L481 PolarHBondContact O-N 3.34Å; S479-N482 PolarHBondContact O-N 3.42Å; S479-Q483 WeakPolarHBondContact O-CB 3.4Å; S479-Q483 VanDerWaalsContact O-CG 3.25Å; S479-Q483 WeakPolarHBondContact O-CG 3.48Å; S479-Q483 PolarHBondContact O-N 3.4Å; S479-Q483 PolarHBondContact OG-NE2 2.8Å
480	W	92.2	Very high	84.9	Confident	7 Å²	7	31 Å²	31	3%	0.027	20%	0.195	C	C	.	.	H	α-helix	trans	-59.1	-44.8	173.6	165.2	77.9	0	0	0	112.2	M25 I136 F185 S188 L189 C192 P476 V477 E478 Q483 L484	M25-W480 HydrophobicContact CE-CE3 3.92Å; M25-W480 HydrophobicContact CE-CH2 3.64Å; M25-W480 HydrophobicContact CE-CZ3 3.21Å; M25-W480 HydrophobicContact SD-CH2 3.98Å; M25-W480 HydrophobicContact SD-CZ3 4.11Å; I136-W480 HydrophobicContact CD1-CZ3 4.03Å; F185-W480 HydrophobicContact CD2-CZ2 4.25Å; F185-W480 AromaticContact CE2-CH2 3.86Å; F185-W480 HydrophobicContact CE2-CH2 3.86Å; F185-W480 AromaticContact CE2-CZ2 3.88Å; F185-W480 HydrophobicContact CE2-CZ2 3.88Å; S188-W480 PolarHBondContact O-NE1 3.37Å; S188-W480 VanDerWaalsContact O-NE1 3.12Å; S188-W480 PolarHBondContact OG-NE1 2.92Å; L189-W480 HydrophobicContact CD2-CH2 4.14Å; L189-W480 HydrophobicContact CD2-CZ2 3.6Å; L189-W480 HydrophobicContact CG-CZ2 4.43Å; C192-W480 HydrophobicContact CB-CB 4.13Å; C192-W480 HydrophobicContact CB-CD2 4.28Å; C192-W480 HydrophobicContact CB-CG 3.74Å; P476-W480 VanDerWaalsContact O-CB 3.27Å; P476-W480 WeakPolarHBondContact O-CB 3.47Å; P476-W480 PolarHBondContact O-N 2.73Å; V477-W480 HydrophobicContact CG1-CE3 4.49Å; E478-W480 VanDerWaalsContact C-N 3.32Å; E478-W480 PolarHBondContact O-N 3.31Å; W480-Q483 PolarHBondContact O-N 3.42Å; W480-L484 HydrophobicContact CH2-CD2 3.97Å; W480-L484 HydrophobicContact CZ2-CD2 3.66Å; W480-L484 VanDerWaalsContact O-CB 3.31Å; W480-L484 WeakPolarHBondContact O-CB 3.04Å; W480-L484 PolarHBondContact O-N 3.49Å
481	L	91.1	Very high	83.3	Confident	10 Å²	10	33.8 Å²	33.8	5%	0.052	21%	0.211	C	C	.	.	H	α-helix	trans	-64.9	-42.9	-179.5	-177.8	66.9	0	0	0	111.7	L132 I136 V477 E478 S479 Q483 L484 L485	L132-L481 HydrophobicContact CB-CD1 4.42Å; I136-L481 HydrophobicContact CB-CD2 4.03Å; I136-L481 HydrophobicContact CD1-CD1 3.98Å; I136-L481 HydrophobicContact CD1-CD2 4.42Å; I136-L481 HydrophobicContact CG2-CD2 3.92Å; V477-L481 VanDerWaalsContact O-CB 3.27Å; V477-L481 WeakPolarHBondContact O-CB 3.1Å; V477-L481 PolarHBondContact O-N 2.95Å; E478-L481 PolarHBondContact O-N 3.12Å; E478-L481 VanDerWaalsContact O-N 3.12Å; S479-L481 PolarHBondContact O-N 3.34Å; L481-Q483 VanDerWaalsContact C-N 3.35Å; L481-L484 PolarHBondContact O-N 3.38Å; L481-L485 HydrophobicContact CD1-CD1 3.68Å; L481-L485 HydrophobicContact CD1-CG 4.09Å; L481-L485 HydrophobicContact CG-CD1 4.1Å; L481-L485 WeakPolarHBondContact O-CB 3.37Å; L481-L485 WeakPolarHBondContact O-CG 3.1Å; L481-L485 PolarHBondContact O-N 3.16Å
482	N	88.4	Confident	81.6	Confident	30 Å²	30	35 Å²	35	16%	0.16	22%	0.222	C	C	.	.	H	α-helix	trans	-65.3	-39.1	177.8	-72.1	-13.1	0	0	0	111.7	E478 S479 C486 L487 D488	E478-N482 PolarHBondContact O-N 3.19Å; S479-N482 PolarHBondContact O-N 3.42Å; N482-C486 CarbonylContact O-C 3.54Å; N482-C486 VanDerWaalsContact O-CA 3.31Å; N482-C486 WeakPolarHBondContact O-CA 3.29Å; N482-C486 PolarHBondContact O-N 3.36Å; N482-L487 HydrophobicContact CB-CB 4.46Å; N482-L487 PolarHBondContact O-N 2.96Å; N482-D488 WeakPolarHBondContact CB-OD2 3.47Å
483	Q	88.7	Confident	80	Confident	90 Å²	90	36.4 Å²	36.4	42%	0.421	23%	0.229	S	C	.	.	H	α-helix	trans	-65.2	-52.2	173.4	-72.6	172.7	6.7	0	0	111	R184 S479 W480 L481 L485 C486 Q527	R184-Q483 PolarHBondContact NH2-O 3.47Å; S479-Q483 WeakPolarHBondContact O-CB 3.4Å; S479-Q483 VanDerWaalsContact O-CG 3.25Å; S479-Q483 WeakPolarHBondContact O-CG 3.48Å; S479-Q483 PolarHBondContact O-N 3.4Å; S479-Q483 PolarHBondContact OG-NE2 2.8Å; W480-Q483 PolarHBondContact O-N 3.42Å; L481-Q483 VanDerWaalsContact C-N 3.35Å; Q483-L485 VanDerWaalsContact C-N 3.29Å; Q483-L485 PolarHBondContact O-N 3.17Å; Q483-C486 PolarHBondContact O-N 3Å; Q483-C486 VanDerWaalsContact O-N 3.1Å; Q483-Q527 PolarHBondContact O-NE2 3.39Å
484	L	90	Very high	78.7	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-56.4	-43.1	179.3	173.9	64.9	0	0	0	112.4	F181 R184 F185 W480 L481 C486	F181-L484 HydrophobicContact CE2-CD1 4.46Å; R184-L484 HydrophobicContact CG-CD1 4.29Å; R184-L484 VanDerWaalsContact CZ-O 3.22Å; R184-L484 PolarHBondContact NH1-O 3.33Å; R184-L484 PolarHBondContact NH2-O 3.46Å; F185-L484 HydrophobicContact CD2-CD2 3.75Å; F185-L484 HydrophobicContact CE2-CD2 4.31Å; W480-L484 HydrophobicContact CH2-CD2 3.97Å; W480-L484 HydrophobicContact CZ2-CD2 3.66Å; W480-L484 VanDerWaalsContact O-CB 3.31Å; W480-L484 WeakPolarHBondContact O-CB 3.04Å; W480-L484 PolarHBondContact O-N 3.49Å; L481-L484 PolarHBondContact O-N 3.38Å; L484-C486 VanDerWaalsContact C-N 3.34Å
485	L	88.4	Confident	77.2	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	0	-178	-62.6	-174.8	0	0	0	114	P129 A133 F181 L481 Q483 L487 P542	P129-L485 HydrophobicContact CB-CD2 3.63Å; A133-L485 HydrophobicContact CB-CD1 3.73Å; F181-L485 HydrophobicContact CZ-CD2 4.41Å; L481-L485 HydrophobicContact CD1-CD1 3.68Å; L481-L485 HydrophobicContact CD1-CG 4.09Å; L481-L485 HydrophobicContact CG-CD1 4.1Å; L481-L485 WeakPolarHBondContact O-CB 3.37Å; L481-L485 WeakPolarHBondContact O-CG 3.1Å; L481-L485 PolarHBondContact O-N 3.16Å; Q483-L485 VanDerWaalsContact C-N 3.29Å; Q483-L485 PolarHBondContact O-N 3.17Å; L485-L487 VanDerWaalsContact C-N 3.28Å; L485-L487 HydrophobicContact CB-CD1 4.06Å; L485-L487 HydrophobicContact CB-CD2 4.4Å; L485-L487 HydrophobicContact CB-CG 3.81Å; L485-L487 HydrophobicContact CD1-CD1 4.3Å; L485-L487 PolarHBondContact O-N 2.79Å; L485-P542 HydrophobicContact CD2-CB 4.45Å
486	C	85.6	Confident	75.6	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.014	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	43.5	-177.3	-49.2	0	0	0	0	113.6	R184 N482 Q483 L484 D488 Q527 M530	R184-C486 PolarHBondContact NH2-SG 3.37Å; N482-C486 CarbonylContact O-C 3.54Å; N482-C486 VanDerWaalsContact O-CA 3.31Å; N482-C486 WeakPolarHBondContact O-CA 3.29Å; N482-C486 PolarHBondContact O-N 3.36Å; Q483-C486 PolarHBondContact O-N 3Å; Q483-C486 VanDerWaalsContact O-N 3.1Å; L484-C486 VanDerWaalsContact C-N 3.34Å; C486-D488 VanDerWaalsContact C-N 3.31Å; C486-Q527 PolarHBondContact SG-NE2 3.35Å; C486-M530 HydrophobicContact CB-CB 3.73Å; C486-M530 HydrophobicContact CB-CG 3.77Å
487	L	78.3	Confident	74	Confident	23 Å²	23	49 Å²	49	12%	0.12	28%	0.277	C	S	.	.			trans	-80.5	-15.3	-179.3	-62.5	174.4	0	0	0	112.7	N482 L485 V489	N482-L487 HydrophobicContact CB-CB 4.46Å; N482-L487 PolarHBondContact O-N 2.96Å; L485-L487 VanDerWaalsContact C-N 3.28Å; L485-L487 HydrophobicContact CB-CD1 4.06Å; L485-L487 HydrophobicContact CB-CD2 4.4Å; L485-L487 HydrophobicContact CB-CG 3.81Å; L485-L487 HydrophobicContact CD1-CD1 4.3Å; L485-L487 PolarHBondContact O-N 2.79Å; L487-V489 VanDerWaalsContact C-N 3.35Å; L487-V489 PolarHBondContact O-N 3.21Å
488	D	71.7	Confident	72.8	Confident	53 Å²	53	52.4 Å²	52.4	28%	0.283	31%	0.312	S	S	.	.			trans	-82	77.2	-178.4	-67.8	-28.3	0	0	0	111.2	N482 C486 N490	N482-D488 WeakPolarHBondContact CB-OD2 3.47Å; C486-D488 VanDerWaalsContact C-N 3.31Å; D488-N490 PolarHBondContact O-N 3.39Å; D488-N490 VanDerWaalsContact O-N 3.12Å
489	V	62.6	Low	72.1	Confident	9 Å²	9	54.5 Å²	54.5	6%	0.055	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-75.6	4.8	-177.1	179.3	0	0	0	0	112.8	L487 L491 S531 V534	L487-V489 VanDerWaalsContact C-N 3.35Å; L487-V489 PolarHBondContact O-N 3.21Å; V489-L491 PolarHBondContact O-N 2.79Å; V489-S531 WeakPolarHBondContact CG1-OG 3.22Å; V489-S531 PolarHBondContact O-OG 3Å; V489-V534 HydrophobicContact CG2-CB 4.02Å; V489-V534 HydrophobicContact CG2-CG1 3.99Å; V489-V534 HydrophobicContact CG2-CG2 4.4Å
490	N	58.9	Low	71.9	Confident	123 Å²	123	53.4 Å²	53.4	66%	0.658	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-76.5	2.1	178.1	-69.8	-6.5	0	0	0	113.7	R418 D488	R418-N490 PolarHBondContact NH1-OD1 3.19Å; R418-N490 PolarHBondContact NH2-OD1 3.34Å; D488-N490 PolarHBondContact O-N 3.39Å; D488-N490 VanDerWaalsContact O-N 3.12Å
491	L	53.3	Low	71.8	Confident	87 Å²	87	55.4 Å²	55.4	46%	0.455	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-91.3	0.6	-177	-77.9	159.7	0	0	0	114.8	V489 P493 Q527	V489-L491 PolarHBondContact O-N 2.79Å; L491-P493 WeakPolarHBondContact O-CD 3.13Å; L491-P493 VanDerWaalsContact O-N 3.12Å; L491-Q527 HydrophobicContact CD1-CB 3.86Å; L491-Q527 HydrophobicContact CD1-CG 4.21Å
492	A	52.8	Low	71.6	Confident	32 Å²	32	56.8 Å²	56.8	26%	0.264	35%	0.348	S	S	.	.	S	Bend	trans	-67.1	105.2	165	0	0	0	0	0	108	K494	A492-K494 PolarHBondContact O-N 3.09Å
493	P	52.8	Low	71.7	Confident	47 Å²	47	61.2 Å²	61.2	31%	0.305	37%	0.372	S	S	.	.			trans	-60.7	132.6	-178.6	26.9	-31.9	0	0	0	108.4	L491 V495	L491-P493 WeakPolarHBondContact O-CD 3.13Å; L491-P493 VanDerWaalsContact O-N 3.12Å; P493-V495 PolarHBondContact O-N 3.27Å
494	K	56.3	Low	71.7	Confident	182 Å²	182	61.8 Å²	61.8	79%	0.791	38%	0.378	S	S	*	.			trans	-58.2	132.2	167.8	-69.5	-177.3	179.6	179.8	0	107.5	A492 S496	A492-K494 PolarHBondContact O-N 3.09Å; K494-S496 PolarHBondContact O-N 3.04Å; K494-S496 PolarHBondContact O-OG 3.26Å
495	V	56	Low	71.8	Confident	66 Å²	66	61.7 Å²	61.7	40%	0.4	38%	0.377	S	S	.	.			trans	-42.1	103.7	-175.8	-176	0	0	0	0	110.3	P493 S497 D634 Y635	P493-V495 PolarHBondContact O-N 3.27Å; V495-S497 VanDerWaalsContact CG1-O 3.3Å; V495-S497 WeakPolarHBondContact CG1-O 3.48Å; V495-D634 HydrophobicContact CG2-CB 3.96Å; V495-Y635 HydrophobicContact CG1-CE1 4.11Å; V495-Y635 WeakPolarHBondContact CG1-OH 3.42Å; V495-Y635 HydrophobicContact CG2-CE1 3.78Å; V495-Y635 WeakPolarHBondContact CG2-OH 3.3Å
496	S	56.1	Low	71.9	Confident	115 Å²	115	65.3 Å²	65.3	80%	0.804	40%	0.396	S	S	*	.			trans	-102.8	-19.1	-178.5	-53.4	0	0	0	0	111.4	K494	K494-S496 PolarHBondContact O-N 3.04Å; K494-S496 PolarHBondContact O-OG 3.26Å
497	S	58	Low	72.3	Confident	70 Å²	70	65.3 Å²	65.3	49%	0.49	40%	0.397	S	S	.	.	S	Bend	trans	-121.1	142.7	178.7	45.3	0	0	0	0	110.5	V495	V495-S497 VanDerWaalsContact CG1-O 3.3Å; V495-S497 WeakPolarHBondContact CG1-O 3.48Å
498	G	66.8	Low	73	Confident	72 Å²	72	66 Å²	66	74%	0.742	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-52.8	146.2	-179.8	0	0	0	0	0	112.7	P500	G498-P500 WeakPolarHBondContact O-CD 3.22Å
499	C	76.5	Confident	73.9	Confident	70 Å²	70	63.8 Å²	63.8	47%	0.473	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-65.6	118	179.4	56.9	0	0	0	0	111.1	Y635 M638 Y640	C499-Y635 HydrophobicContact CB-CE1 4.45Å; C499-M638 HydrophobicContact CB-CE 3.85Å; C499-M638 HydrophobicContact CB-SD 4.46Å; C499-M638 WeakPolarHBondContact SG-CE 3.29Å; C499-Y640 WeakPolarHBondContact CB-OH 3.19Å
500	P	85.6	Confident	74.9	Confident	32 Å²	32	64.3 Å²	64.3	21%	0.208	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-68.6	151.7	176.1	28.1	-33.2	0	0	0	110.5	G498 P562 L574 Y640	G498-P500 WeakPolarHBondContact O-CD 3.22Å; P500-P562 HydrophobicContact CB-CG 4.41Å; P500-L574 HydrophobicContact CG-CD1 3.99Å; P500-Y640 PolarHBondContact O-OH 2.93Å
501	A	89.3	Confident	76.1	Confident	49 Å²	49	59.7 Å²	59.7	41%	0.405	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-63	139.3	174.7	0	0	0	0	0	109.6	N503 D504 C505	A501-N503 PolarHBondContact O-N 3.14Å; A501-D504 PolarHBondContact O-N 3.15Å; A501-C505 PolarHBondContact O-SG 3.38Å; A501-C505 VanDerWaalsContact O-SG 3.41Å
502	P	88.6	Confident	77.5	Confident	39 Å²	39	56.4 Å²	56.4	25%	0.253	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-56.4	-26.4	-179.2	-27.5	34.1	0	0	0	114.1	D504 C505 M638 Y640 R643	P502-D504 VanDerWaalsContact C-N 3.33Å; P502-C505 PolarHBondContact O-N 2.85Å; P502-M638 WeakPolarHBondContact CG-O 3.47Å; P502-Y640 HydrophobicContact CB-CD1 4.31Å; P502-Y640 HydrophobicContact CB-CE1 4.47Å; P502-Y640 HydrophobicContact CG-CD1 4.29Å; P502-Y640 HydrophobicContact CG-CE1 4.16Å; P502-R643 HydrophobicContact CB-CB 4.36Å; P502-R643 WeakPolarHBondContact O-CD 3.04Å; P502-R643 VanDerWaalsContact O-CG 3.23Å; P502-R643 WeakPolarHBondContact O-CG 3.24Å; P502-R643 PolarHBondContact O-NE 2.88Å
503	N	89.5	Confident	78.9	Confident	123 Å²	123	56.9 Å²	56.9	66%	0.658	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-70.7	-28.8	179.6	-67.8	-12.3	0	0	0	113.1	A501 C505 R643	A501-N503 PolarHBondContact O-N 3.14Å; N503-C505 VanDerWaalsContact C-N 3.25Å; N503-C505 PolarHBondContact O-N 3.29Å; N503-R643 PolarHBondContact O-NH2 2.85Å
504	D	88.9	Confident	80.4	Confident	101 Å²	101	55.3 Å²	55.3	54%	0.54	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-87.1	-0.6	-179	-53.2	-29.7	0	0	0	112	A501 P502	A501-D504 PolarHBondContact O-N 3.15Å; P502-D504 VanDerWaalsContact C-N 3.33Å
505	C	91.3	Very high	81.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	30%	0.301	C	S	.	.			trans	-93.7	135	178.3	-58.3	0	0	0	0	110.1	A501 P502 N503 L559 L560 R643	A501-C505 PolarHBondContact O-SG 3.38Å; A501-C505 VanDerWaalsContact O-SG 3.41Å; P502-C505 PolarHBondContact O-N 2.85Å; N503-C505 VanDerWaalsContact C-N 3.25Å; N503-C505 PolarHBondContact O-N 3.29Å; C505-L559 HydrophobicContact CB-CD1 4.09Å; C505-L559 HydrophobicContact CB-CD2 4.04Å; C505-L559 HydrophobicContact CB-CG 3.97Å; C505-L560 WeakPolarHBondContact CA-O 3.45Å; C505-L560 WeakPolarHBondContact CB-O 3.49Å; C505-R643 PolarHBondContact O-NE 3.09Å
506	D	91.8	Very high	83.4	Confident	76 Å²	76	43.7 Å²	43.7	41%	0.406	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	154.8	179.2	-75.5	-30.3	0	0	0	111.6	Y508 L559 L560	D506-Y508 HydrophobicContact CB-CE2 3.75Å; D506-Y508 WeakPolarHBondContact O-CD2 3.45Å; D506-L559 WeakPolarHBondContact O-CA 3.19Å; D506-L560 PolarHBondContact N-O 3.42Å; D506-L560 PolarHBondContact O-N 3.37Å
507	L	93.4	Very high	84.6	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.016	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	134.7	-179	-170.2	77	0	0	0	109	F557 V558 L559 A644 L647 L648 L698	L507-F557 HydrophobicContact CD1-CB 3.79Å; L507-F557 HydrophobicContact CD2-CB 3.93Å; L507-F557 HydrophobicContact CD2-CD1 4.05Å; L507-F557 HydrophobicContact CD2-CG 4.17Å; L507-F557 HydrophobicContact CG-CB 3.83Å; L507-F557 HydrophobicContact CG-CD1 4.32Å; L507-F557 HydrophobicContact CG-CG 4.45Å; L507-V558 WeakPolarHBondContact CA-O 3.47Å; L507-L559 HydrophobicContact CB-CD1 4.35Å; L507-L559 HydrophobicContact CD1-CB 4.26Å; L507-L559 HydrophobicContact CD1-CD1 4.32Å; L507-A644 HydrophobicContact CD1-CB 4.2Å; L507-L647 HydrophobicContact CB-CB 3.95Å; L507-L647 HydrophobicContact CB-CD1 3.79Å; L507-L647 HydrophobicContact CD2-CB 4.12Å; L507-L648 HydrophobicContact CD2-CB 4.06Å; L507-L648 HydrophobicContact CD2-CD1 4.12Å; L507-L698 HydrophobicContact CB-CD1 3.96Å; L507-L698 WeakPolarHBondContact O-CD1 3.32Å; L507-L698 VanDerWaalsContact O-CG 3.26Å; L507-L698 WeakPolarHBondContact O-CG 3.45Å
508	Y	92.1	Very high	85.9	Confident	38 Å²	38	37.8 Å²	37.8	15%	0.149	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122.8	-177.9	-65.4	-96.2	0	0	0	110.1	D506 F557 V558 L560 A696 K697	D506-Y508 HydrophobicContact CB-CE2 3.75Å; D506-Y508 WeakPolarHBondContact O-CD2 3.45Å; Y508-F557 WeakPolarHBondContact O-CA 3.45Å; Y508-V558 PolarHBondContact N-O 2.84Å; Y508-V558 PolarHBondContact O-N 3.02Å; Y508-L560 HydrophobicContact CD2-CB 4.07Å; Y508-L560 HydrophobicContact CD2-CD1 3.75Å; Y508-L560 HydrophobicContact CD2-CG 3.95Å; Y508-L560 HydrophobicContact CE2-CB 4.06Å; Y508-L560 HydrophobicContact CE2-CD1 4.19Å; Y508-L560 HydrophobicContact CE2-CG 4.41Å; Y508-L560 HydrophobicContact CG-CD1 4.21Å; Y508-A696 WeakPolarHBondContact CD1-O 3.41Å; Y508-K697 HydrophobicContact CE1-CG 4.08Å
509	P	91.2	Very high	86.7	Confident	5 Å²	5	39.4 Å²	39.4	3%	0.032	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	148.9	163.3	26.8	-34.6	0	0	0	110.6	F557 A696 L698	P509-F557 HydrophobicContact CB-CD1 3.96Å; P509-F557 HydrophobicContact CB-CE1 3.84Å; P509-A696 WeakPolarHBondContact CD-O 3.15Å; P509-A696 HydrophobicContact CG-CB 4.32Å; P509-A696 PolarHBondContact O-N 3.47Å; P509-A696 VanDerWaalsContact O-N 3.1Å; P509-L698 HydrophobicContact CG-CD2 4.36Å
510	F	84.7	Confident	87.1	Confident	20 Å²	20	44.5 Å²	44.5	9%	0.088	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-118.9	151.2	172.3	63.3	-107.2	0	0	0	113.2	L515 L529 L556 V558 L694 L695	F510-L515 HydrophobicContact CD2-CB 4.46Å; F510-L515 HydrophobicContact CD2-CD2 3.9Å; F510-L515 HydrophobicContact CE2-CD2 3.38Å; F510-L515 HydrophobicContact CZ-CD2 3.69Å; F510-L529 HydrophobicContact CE1-CD1 3.65Å; F510-L529 HydrophobicContact CZ-CD1 3.87Å; F510-L556 HydrophobicContact CD1-CB 3.78Å; F510-L556 WeakPolarHBondContact CD1-O 3.37Å; F510-L556 HydrophobicContact CD2-CB 4.44Å; F510-L556 HydrophobicContact CE1-CB 3Å; F510-L556 HydrophobicContact CE1-CD1 4.25Å; F510-L556 HydrophobicContact CE1-CD2 4.32Å; F510-L556 HydrophobicContact CE1-CG 4.01Å; F510-L556 HydrophobicContact CE2-CB 3.72Å; F510-L556 HydrophobicContact CE2-CD1 3.55Å; F510-L556 HydrophobicContact CE2-CG 4.2Å; F510-L556 HydrophobicContact CG-CB 4.49Å; F510-L556 HydrophobicContact CZ-CB 3Å; F510-L556 HydrophobicContact CZ-CD1 3.32Å; F510-L556 HydrophobicContact CZ-CD2 3.92Å; F510-L556 HydrophobicContact CZ-CG 3.55Å; F510-L556 PolarHBondContact N-O 2.95Å; F510-V558 HydrophobicContact CD1-CG1 4.25Å; F510-V558 HydrophobicContact CE1-CG1 4.24Å; F510-L694 VanDerWaalsContact CA-O 3.26Å; F510-L694 WeakPolarHBondContact CA-O 3.2Å; F510-L694 VanDerWaalsContact CB-O 3.23Å; F510-L694 WeakPolarHBondContact CB-O 3.5Å; F510-L695 HydrophobicContact CB-CD2 4.41Å
511	S	82.7	Confident	87.2	Confident	26 Å²	26	46.5 Å²	46.5	18%	0.182	25%	0.248	C	C	.	.			trans	-80.7	117.9	168.7	177.8	0	0	0	0	110.4	D513 T514 L515 P692 L694	S511-D513 PolarHBondContact O-N 2.71Å; S511-D513 PolarHBondContact OG-N 3.24Å; S511-T514 PolarHBondContact O-N 3.34Å; S511-T514 PolarHBondContact OG-OG1 3Å; S511-L515 PolarHBondContact O-N 3.38Å; S511-P692 VanDerWaalsContact OG-CG 3.32Å; S511-P692 WeakPolarHBondContact OG-CG 3.14Å; S511-L694 PolarHBondContact N-O 3.31Å
512	A	82.8	Confident	87.1	Confident	19 Å²	19	44.5 Å²	44.5	16%	0.157	23%	0.231	C	C	.	.	H	α-helix	trans	-61.1	-35.6	176.3	0	0	0	0	0	111.6	T514 L515 F516	A512-T514 PolarHBondContact O-N 3.19Å; A512-L515 PolarHBondContact O-N 3.43Å; A512-F516 HydrophobicContact CB-CD2 4.45Å; A512-F516 VanDerWaalsContact O-CD2 3.22Å; A512-F516 WeakPolarHBondContact O-CD2 3.46Å; A512-F516 PolarHBondContact O-N 3.37Å
513	D	82.3	Confident	87.1	Confident	42 Å²	42	43.8 Å²	43.8	23%	0.225	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-44.8	178.9	-66.5	-62.1	0	0	0	111.7	R180 S511 C517 L691	R180-D513 IonicContact CZ-OD1 2.73Å; R180-D513 IonicContact CZ-OD2 2.71Å; R180-D513 VanDerWaalsContact NE-CG 3.32Å; R180-D513 IonicContact NE-OD1 2.77Å; R180-D513 PolarHBondContact NE-OD1 2.79Å; R180-D513 IonicContact NE-OD2 3.18Å; R180-D513 IonicContact NH2-OD1 2.8Å; R180-D513 PolarHBondContact NH2-OD1 2.93Å; R180-D513 IonicContact NH2-OD2 3.81Å; R180-D513 PolarHBondContact NH2-OD2 3.1Å; S511-D513 PolarHBondContact O-N 2.71Å; S511-D513 PolarHBondContact OG-N 3.24Å; D513-C517 PolarHBondContact O-N 3.33Å; D513-L691 HydrophobicContact CB-CD2 4.35Å
514	T	85.1	Confident	87	Confident	14 Å²	14	40.6 Å²	40.6	9%	0.086	21%	0.209	C	C	.	.	H	α-helix	trans	-74.4	-30.3	178.9	-43.4	0	0	0	0	112.5	S511 A512 C517 S522 L691 P692 L694	S511-T514 PolarHBondContact O-N 3.34Å; S511-T514 PolarHBondContact OG-OG1 3Å; A512-T514 PolarHBondContact O-N 3.19Å; T514-C517 PolarHBondContact O-SG 3.07Å; T514-S522 PolarHBondContact O-OG 3.17Å; T514-L691 HydrophobicContact CG2-CB 4.24Å; T514-P692 WeakPolarHBondContact CB-O 3.41Å; T514-P692 WeakPolarHBondContact CG2-O 3.42Å; T514-P692 PolarHBondContact OG1-O 3.35Å; T514-L694 HydrophobicContact CG2-CB 4.23Å; T514-L694 HydrophobicContact CG2-CD1 4.41Å
515	L	87.3	Confident	87	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.5	-42	176.5	-176.3	64.4	0	0	0	111.7	F510 S511 A512 F525 L526 L529 L694	F510-L515 HydrophobicContact CD2-CB 4.46Å; F510-L515 HydrophobicContact CD2-CD2 3.9Å; F510-L515 HydrophobicContact CE2-CD2 3.38Å; F510-L515 HydrophobicContact CZ-CD2 3.69Å; S511-L515 PolarHBondContact O-N 3.38Å; A512-L515 PolarHBondContact O-N 3.43Å; L515-F525 HydrophobicContact CD1-CD1 3.8Å; L515-L526 HydrophobicContact CD1-CB 4.03Å; L515-L526 HydrophobicContact CD1-CD1 4.32Å; L515-L526 HydrophobicContact CD2-CD1 3.89Å; L515-L526 HydrophobicContact CG-CD1 4.04Å; L515-L529 HydrophobicContact CD2-CD1 4.49Å; L515-L694 HydrophobicContact CB-CD1 3.99Å; L515-L694 HydrophobicContact CD1-CD1 4.01Å
516	F	87.1	Confident	86.9	Confident	3 Å²	3	36 Å²	36	1%	0.013	18%	0.184	C	C	.	.	H	α-helix	trans	-92.6	3.4	-175.2	-69	-68.7	0	0	0	114.9	R180 A512 F518 L526 L545 I548 S549	R180-F516 HydrophobicContact CB-CB 4.1Å; R180-F516 HydrophobicContact CB-CG 4.49Å; A512-F516 HydrophobicContact CB-CD2 4.45Å; A512-F516 VanDerWaalsContact O-CD2 3.22Å; A512-F516 WeakPolarHBondContact O-CD2 3.46Å; A512-F516 PolarHBondContact O-N 3.37Å; F516-F518 PolarHBondContact O-N 3.1Å; F516-L526 HydrophobicContact CD1-CD2 4.01Å; F516-L526 HydrophobicContact CE1-CD1 3.8Å; F516-L526 HydrophobicContact CE1-CD2 3.79Å; F516-L526 HydrophobicContact CE1-CG 4.48Å; F516-L526 HydrophobicContact CZ-CD1 4.05Å; F516-L545 HydrophobicContact CE1-CD1 3.89Å; F516-L545 HydrophobicContact CE1-CG 4.46Å; F516-L545 HydrophobicContact CZ-CD1 4.23Å; F516-I548 HydrophobicContact CE2-CG2 4.21Å; F516-I548 HydrophobicContact CZ-CG2 3.95Å; F516-S549 VanDerWaalsContact CE2-CA 3.41Å; F516-S549 VanDerWaalsContact CE2-CB 3.48Å
517	C	82.5	Confident	86.7	Confident	8 Å²	8	33 Å²	33	5%	0.054	17%	0.168	C	C	.	.	S	Bend	trans	-68.1	2.5	179.3	73.8	0	0	0	0	116	L187 D513 T514 H519 L691	L187-C517 WeakPolarHBondContact CD1-O 3.36Å; D513-C517 PolarHBondContact O-N 3.33Å; T514-C517 PolarHBondContact O-SG 3.07Å; C517-H519 PolarHBondContact O-N 2.93Å; C517-L691 HydrophobicContact CB-CD1 3.77Å
518	F	83.5	Confident	86.4	Confident	54 Å²	54	35.6 Å²	35.6	24%	0.237	18%	0.177	C	C	.	.			trans	58.6	39.4	179.8	-158.7	-108.3	0	0	0	114.7	R184 L187 S188 F516	R184-F518 HydrophobicContact CG-CB 4.38Å; R184-F518 HydrophobicContact CG-CD2 3.87Å; L187-F518 HydrophobicContact CB-CB 3.77Å; L187-F518 HydrophobicContact CB-CD1 3.75Å; L187-F518 HydrophobicContact CB-CG 3.94Å; L187-F518 HydrophobicContact CD1-CB 3.85Å; L187-F518 HydrophobicContact CG-CB 4.48Å; S188-F518 VanDerWaalsContact CA-CZ 3.48Å; F516-F518 PolarHBondContact O-N 3.1Å
519	H	85.2	Confident	86.2	Confident	106 Å²	106	33.9 Å²	33.9	49%	0.491	17%	0.171	S	C	.	.			trans	-86.9	148	168.8	-178.2	-109.3	0	0	0	111.5	C517 V521 S522 E523	C517-H519 PolarHBondContact O-N 2.93Å; H519-V521 VanDerWaalsContact C-N 3.32Å; H519-V521 PolarHBondContact ND1-N 3.47Å; H519-V521 PolarHBondContact O-N 3.5Å; H519-S522 PolarHBondContact O-N 2.96Å; H519-S522 VanDerWaalsContact O-N 3.13Å; H519-E523 WeakPolarHBondContact O-CB 3.43Å; H519-E523 PolarHBondContact O-N 2.97Å
520	K	85	Confident	86	Confident	177 Å²	177	33.9 Å²	33.9	77%	0.77	17%	0.17	S	C	*	.	H	α-helix	trans	-54.8	-42.4	-174.4	-171.3	177.5	-178.4	-179.9	0	113.5	V524	K520-V524 WeakPolarHBondContact O-CG2 3.29Å; K520-V524 PolarHBondContact O-N 2.81Å
521	V	86	Confident	85.9	Confident	73 Å²	73	33 Å²	33	44%	0.442	17%	0.167	S	C	.	.	H	α-helix	trans	-72.3	-44.2	179.2	-179.8	0	0	0	0	111.1	H519 E523 V524 F525 I570	H519-V521 VanDerWaalsContact C-N 3.32Å; H519-V521 PolarHBondContact ND1-N 3.47Å; H519-V521 PolarHBondContact O-N 3.5Å; V521-E523 VanDerWaalsContact C-N 3.27Å; V521-E523 PolarHBondContact O-N 2.81Å; V521-V524 PolarHBondContact O-N 2.8Å; V521-F525 PolarHBondContact O-N 2.97Å; V521-I570 HydrophobicContact CG1-CD1 4.12Å; V521-I570 HydrophobicContact CG1-CG1 4.21Å
522	S	87.6	Confident	85.9	Confident	7 Å²	7	32.1 Å²	32.1	5%	0.049	16%	0.16	C	C	.	.	H	α-helix	trans	-61.7	-37.6	177.6	-53.2	0	0	0	0	111.5	T514 H519 F525 L526	T514-S522 PolarHBondContact O-OG 3.17Å; H519-S522 PolarHBondContact O-N 2.96Å; H519-S522 VanDerWaalsContact O-N 3.13Å; S522-F525 PolarHBondContact O-N 3.25Å; S522-L526 VanDerWaalsContact O-CB 3.29Å; S522-L526 WeakPolarHBondContact O-CB 3.48Å; S522-L526 PolarHBondContact O-N 3.45Å
523	E	88.5	Confident	85.9	Confident	24 Å²	24	31.2 Å²	31.2	11%	0.112	15%	0.153	C	C	.	.	H	α-helix	trans	-67.4	-45.5	178.2	-171.5	57.6	-138.3	0	0	111.2	R184 H519 V521 F525 L526 Q527	R184-E523 IonicContact CZ-OE1 3.96Å; R184-E523 IonicContact CZ-OE2 2.76Å; R184-E523 IonicContact NE-OE2 3.99Å; R184-E523 PolarHBondContact NE-OE2 2.94Å; R184-E523 VanDerWaalsContact NH2-CD 3.25Å; R184-E523 IonicContact NH2-OE1 3.56Å; R184-E523 PolarHBondContact NH2-OE1 3.48Å; R184-E523 IonicContact NH2-OE2 2.69Å; R184-E523 PolarHBondContact NH2-OE2 3.12Å; H519-E523 WeakPolarHBondContact O-CB 3.43Å; H519-E523 PolarHBondContact O-N 2.97Å; V521-E523 VanDerWaalsContact C-N 3.27Å; V521-E523 PolarHBondContact O-N 2.81Å; E523-F525 VanDerWaalsContact C-N 3.28Å; E523-F525 PolarHBondContact O-N 3.49Å; E523-L526 PolarHBondContact O-N 3.2Å; E523-Q527 VanDerWaalsContact O-CG 3.23Å; E523-Q527 WeakPolarHBondContact O-CG 3.39Å; E523-Q527 PolarHBondContact O-N 3.12Å; E523-Q527 PolarHBondContact OE1-NE2 2.98Å
524	V	87.9	Confident	85.8	Confident	56 Å²	56	30.1 Å²	30.1	34%	0.339	15%	0.147	S	C	.	.	H	α-helix	trans	-60.4	-39.8	174	174.5	0	0	0	0	111.3	K520 V521 Q527 R528 I570	K520-V524 WeakPolarHBondContact O-CG2 3.29Å; K520-V524 PolarHBondContact O-N 2.81Å; V521-V524 PolarHBondContact O-N 2.8Å; V524-Q527 PolarHBondContact O-N 2.85Å; V524-R528 WeakPolarHBondContact O-CG 3.31Å; V524-R528 PolarHBondContact O-N 3.44Å; V524-R528 VanDerWaalsContact O-N 3.13Å; V524-I570 HydrophobicContact CB-CD1 4.03Å; V524-I570 HydrophobicContact CG1-CD1 3.67Å
525	F	88.5	Confident	85.3	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.018	15%	0.15	C	C	.	.	H	α-helix	trans	-65.6	-43.8	176.1	-170	-93.8	0	0	0	112	L515 V521 S522 E523 Q527 R528 L529 V558 I570 I573 L694 L695	L515-F525 HydrophobicContact CD1-CD1 3.8Å; V521-F525 PolarHBondContact O-N 2.97Å; S522-F525 PolarHBondContact O-N 3.25Å; E523-F525 VanDerWaalsContact C-N 3.28Å; E523-F525 PolarHBondContact O-N 3.49Å; F525-Q527 PolarHBondContact O-N 2.93Å; F525-R528 PolarHBondContact O-N 3.2Å; F525-L529 HydrophobicContact CE1-CD1 4.42Å; F525-L529 WeakPolarHBondContact O-CB 2.98Å; F525-L529 PolarHBondContact O-N 3.42Å; F525-V558 HydrophobicContact CZ-CG1 4.47Å; F525-V558 HydrophobicContact CZ-CG2 4.27Å; F525-I570 HydrophobicContact CD2-CG2 3.81Å; F525-I573 HydrophobicContact CD1-CD1 4.43Å; F525-I573 HydrophobicContact CD2-CD1 4.08Å; F525-I573 HydrophobicContact CD2-CG1 4.49Å; F525-I573 HydrophobicContact CE1-CD1 4.03Å; F525-I573 HydrophobicContact CE2-CD1 3.64Å; F525-I573 HydrophobicContact CE2-CG1 3.76Å; F525-I573 HydrophobicContact CG-CD1 4.46Å; F525-I573 HydrophobicContact CZ-CD1 3.61Å; F525-I573 HydrophobicContact CZ-CG1 3.93Å; F525-L694 HydrophobicContact CD1-CD2 4.3Å; F525-L694 HydrophobicContact CG-CD2 4.28Å; F525-L695 HydrophobicContact CZ-CD2 4.18Å
526	L	90.3	Very high	84.8	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-41.6	176.1	-178.3	64.5	0	0	0	111.8	L515 F516 S522 E523 L529 M530 L545	L515-L526 HydrophobicContact CD1-CB 4.03Å; L515-L526 HydrophobicContact CD1-CD1 4.32Å; L515-L526 HydrophobicContact CD2-CD1 3.89Å; L515-L526 HydrophobicContact CG-CD1 4.04Å; F516-L526 HydrophobicContact CD1-CD2 4.01Å; F516-L526 HydrophobicContact CE1-CD1 3.8Å; F516-L526 HydrophobicContact CE1-CD2 3.79Å; F516-L526 HydrophobicContact CE1-CG 4.48Å; F516-L526 HydrophobicContact CZ-CD1 4.05Å; S522-L526 VanDerWaalsContact O-CB 3.29Å; S522-L526 WeakPolarHBondContact O-CB 3.48Å; S522-L526 PolarHBondContact O-N 3.45Å; E523-L526 PolarHBondContact O-N 3.2Å; L526-L529 PolarHBondContact O-N 3.48Å; L526-M530 WeakPolarHBondContact O-CB 3.39Å; L526-M530 PolarHBondContact O-N 2.8Å; L526-L545 HydrophobicContact CD1-CD1 4.23Å
527	Q	87.6	Confident	84	Confident	12 Å²	12	33.2 Å²	33.2	6%	0.056	17%	0.166	C	C	.	.	H	α-helix	trans	-59.8	-45.9	174.4	-68.5	-67	-24.8	0	0	111.5	Q483 C486 L491 E523 V524 F525 M530 S531	Q483-Q527 PolarHBondContact O-NE2 3.39Å; C486-Q527 PolarHBondContact SG-NE2 3.35Å; L491-Q527 HydrophobicContact CD1-CB 3.86Å; L491-Q527 HydrophobicContact CD1-CG 4.21Å; E523-Q527 VanDerWaalsContact O-CG 3.23Å; E523-Q527 WeakPolarHBondContact O-CG 3.39Å; E523-Q527 PolarHBondContact O-N 3.12Å; E523-Q527 PolarHBondContact OE1-NE2 2.98Å; V524-Q527 PolarHBondContact O-N 2.85Å; F525-Q527 PolarHBondContact O-N 2.93Å; Q527-M530 PolarHBondContact O-N 2.77Å; Q527-S531 WeakPolarHBondContact O-CB 3.29Å; Q527-S531 PolarHBondContact O-N 2.76Å
528	R	86.1	Confident	83	Confident	58 Å²	58	36.2 Å²	36.2	22%	0.219	18%	0.177	C	C	.	.	H	α-helix	trans	-62.8	-43.9	176.4	-72	179	177.7	-174.2	-0	111.7	V524 F525 S531 I532 I570 I573	V524-R528 WeakPolarHBondContact O-CG 3.31Å; V524-R528 PolarHBondContact O-N 3.44Å; V524-R528 VanDerWaalsContact O-N 3.13Å; F525-R528 PolarHBondContact O-N 3.2Å; R528-S531 WeakPolarHBondContact O-CB 3.34Å; R528-S531 PolarHBondContact O-N 3.38Å; R528-I532 WeakPolarHBondContact O-CG1 3.23Å; R528-I532 PolarHBondContact O-N 2.73Å; R528-I532 VanDerWaalsContact O-N 3.12Å; R528-I570 PolarHBondContact NH1-O 3.35Å; R528-I573 HydrophobicContact CB-CD1 4.05Å
529	L	88.5	Confident	82.2	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-52	177.1	-175.8	154.1	0	0	0	110.7	F510 L515 F525 L526 S531 I532 Y533 V558 I573 V576	F510-L529 HydrophobicContact CE1-CD1 3.65Å; F510-L529 HydrophobicContact CZ-CD1 3.87Å; L515-L529 HydrophobicContact CD2-CD1 4.49Å; F525-L529 HydrophobicContact CE1-CD1 4.42Å; F525-L529 WeakPolarHBondContact O-CB 2.98Å; F525-L529 PolarHBondContact O-N 3.42Å; L526-L529 PolarHBondContact O-N 3.48Å; L529-S531 VanDerWaalsContact C-N 3.3Å; L529-S531 PolarHBondContact O-N 2.94Å; L529-I532 PolarHBondContact O-N 2.82Å; L529-Y533 WeakPolarHBondContact O-CB 3.15Å; L529-Y533 PolarHBondContact O-N 2.73Å; L529-V558 HydrophobicContact CD1-CG1 4.17Å; L529-I573 HydrophobicContact CB-CD1 4.01Å; L529-V576 HydrophobicContact CD1-CG1 4.4Å; L529-V576 HydrophobicContact CG-CG1 4.25Å; L529-V576 HydrophobicContact CG-CG2 4.2Å
530	M	86.6	Confident	81.6	Confident	5 Å²	5	33.6 Å²	33.6	3%	0.025	17%	0.165	C	C	.	.	H	α-helix	trans	-66.8	-33.6	-179.1	-166.1	60.4	177	0	0	111.7	C486 L526 Q527 I532 Y533 V534	C486-M530 HydrophobicContact CB-CB 3.73Å; C486-M530 HydrophobicContact CB-CG 3.77Å; L526-M530 WeakPolarHBondContact O-CB 3.39Å; L526-M530 PolarHBondContact O-N 2.8Å; Q527-M530 PolarHBondContact O-N 2.77Å; M530-I532 PolarHBondContact O-N 2.7Å; M530-Y533 VanDerWaalsContact O-CB 3.31Å; M530-Y533 WeakPolarHBondContact O-CB 3.35Å; M530-Y533 PolarHBondContact O-N 3.09Å; M530-Y533 HydrophobicContact SD-CD1 4.29Å; M530-Y533 HydrophobicContact SD-CG 4.48Å; M530-V534 HydrophobicContact CE-CG2 4.04Å; M530-V534 HydrophobicContact CG-CG2 4.25Å; M530-V534 WeakPolarHBondContact O-CB 3.39Å; M530-V534 VanDerWaalsContact O-CG2 3.28Å; M530-V534 WeakPolarHBondContact O-CG2 3.07Å; M530-V534 PolarHBondContact O-N 2.83Å; M530-V534 HydrophobicContact SD-CG2 4.47Å
531	S	82.1	Confident	81.3	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-57.9	-48.1	173.4	175.4	0	0	0	0	111.9	V489 Q527 R528 L529 Y533 V534 A535	V489-S531 WeakPolarHBondContact CG1-OG 3.22Å; V489-S531 PolarHBondContact O-OG 3Å; Q527-S531 WeakPolarHBondContact O-CB 3.29Å; Q527-S531 PolarHBondContact O-N 2.76Å; R528-S531 WeakPolarHBondContact O-CB 3.34Å; R528-S531 PolarHBondContact O-N 3.38Å; L529-S531 VanDerWaalsContact C-N 3.3Å; L529-S531 PolarHBondContact O-N 2.94Å; S531-Y533 VanDerWaalsContact C-N 3.34Å; S531-V534 PolarHBondContact O-N 2.87Å; S531-A535 WeakPolarHBondContact O-CB 3.45Å; S531-A535 PolarHBondContact O-N 2.85Å
532	I	83.3	Confident	81.1	Confident	8 Å²	8	23.5 Å²	23.5	4%	0.041	12%	0.119	C	C	.	.	H	α-helix	trans	-65	-41.8	175.7	-66.6	164.8	0	0	0	110.7	R528 L529 M530 V534 A535 A536 I573 V576 A630	R528-I532 WeakPolarHBondContact O-CG1 3.23Å; R528-I532 PolarHBondContact O-N 2.73Å; R528-I532 VanDerWaalsContact O-N 3.12Å; L529-I532 PolarHBondContact O-N 2.82Å; M530-I532 PolarHBondContact O-N 2.7Å; I532-V534 VanDerWaalsContact C-N 3.31Å; I532-V534 PolarHBondContact O-N 2.76Å; I532-A535 PolarHBondContact O-N 3.37Å; I532-A536 PolarHBondContact O-N 2.7Å; I532-A536 VanDerWaalsContact O-N 3.09Å; I532-I573 HydrophobicContact CD1-CB 3.56Å; I532-I573 HydrophobicContact CD1-CG2 3.59Å; I532-I573 WeakPolarHBondContact CD1-O 3.44Å; I532-V576 HydrophobicContact CG2-CG2 4.3Å; I532-A630 HydrophobicContact CG2-CB 3.88Å
533	Y	83.7	Confident	81	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-56.8	-46.2	177	-136.1	-112	0	0	0	112.2	L529 M530 S531 I548 V576 Q578 R628 A630	L529-Y533 WeakPolarHBondContact O-CB 3.15Å; L529-Y533 PolarHBondContact O-N 2.73Å; M530-Y533 VanDerWaalsContact O-CB 3.31Å; M530-Y533 WeakPolarHBondContact O-CB 3.35Å; M530-Y533 PolarHBondContact O-N 3.09Å; M530-Y533 HydrophobicContact SD-CD1 4.29Å; M530-Y533 HydrophobicContact SD-CG 4.48Å; S531-Y533 VanDerWaalsContact C-N 3.34Å; Y533-I548 HydrophobicContact CD1-CD1 4.25Å; Y533-I548 HydrophobicContact CE1-CD1 3.75Å; Y533-V576 HydrophobicContact CD2-CG1 4.3Å; Y533-V576 HydrophobicContact CE2-CG1 4.22Å; Y533-Q578 HydrophobicContact CE2-CB 4.46Å; Y533-Q578 WeakPolarHBondContact OH-CB 3.28Å; Y533-Q578 PolarHBondContact OH-OE1 2.94Å; Y533-R628 VanDerWaalsContact CE1-CD 3.42Å; Y533-R628 VanDerWaalsContact CE1-NH1 3.3Å; Y533-R628 HydrophobicContact CE2-CB 4.28Å; Y533-R628 WeakPolarHBondContact OH-CB 3.46Å; Y533-R628 WeakPolarHBondContact OH-CD 3.35Å; Y533-A630 HydrophobicContact CD2-CB 4.16Å
534	V	78.6	Confident	80.8	Confident	19 Å²	19	25 Å²	25	12%	0.115	13%	0.128	C	C	.	.	H	α-helix	trans	-70	-38	-179.6	174.1	0	0	0	0	111.3	V489 M530 S531 I532 N540	V489-V534 HydrophobicContact CG2-CB 4.02Å; V489-V534 HydrophobicContact CG2-CG1 3.99Å; V489-V534 HydrophobicContact CG2-CG2 4.4Å; M530-V534 HydrophobicContact CE-CG2 4.04Å; M530-V534 HydrophobicContact CG-CG2 4.25Å; M530-V534 WeakPolarHBondContact O-CB 3.39Å; M530-V534 VanDerWaalsContact O-CG2 3.28Å; M530-V534 WeakPolarHBondContact O-CG2 3.07Å; M530-V534 PolarHBondContact O-N 2.83Å; M530-V534 HydrophobicContact SD-CG2 4.47Å; S531-V534 PolarHBondContact O-N 2.87Å; I532-V534 VanDerWaalsContact C-N 3.31Å; I532-V534 PolarHBondContact O-N 2.76Å; V534-N540 VanDerWaalsContact CA-ND2 3.29Å; V534-N540 WeakPolarHBondContact CA-ND2 3.33Å; V534-N540 HydrophobicContact CG2-CB 4.29Å; V534-N540 PolarHBondContact O-ND2 3.41Å
535	A	76.3	Confident	80.9	Confident	16 Å²	16	22.5 Å²	22.5	13%	0.132	11%	0.112	C	C	.	.	H	α-helix	trans	-68.4	-34.8	-178.6	0	0	0	0	0	113.5	S531 I532 P633	S531-A535 WeakPolarHBondContact O-CB 3.45Å; S531-A535 PolarHBondContact O-N 2.85Å; I532-A535 PolarHBondContact O-N 3.37Å; A535-P633 HydrophobicContact CB-CG 3.64Å
536	A	75	Confident	80.8	Confident	18 Å²	18	22.3 Å²	22.3	15%	0.149	11%	0.111	C	C	.	.	H	α-helix	trans	-77.2	-31	-175.7	0	0	0	0	0	114.1	I532 A630	I532-A536 PolarHBondContact O-N 2.7Å; I532-A536 VanDerWaalsContact O-N 3.09Å; A536-A630 HydrophobicContact CB-CB 3.54Å
537	H	70.4	Confident	80.6	Confident	47 Å²	47	23.9 Å²	23.9	22%	0.218	12%	0.119	C	C	.	.	S	Bend	trans	-104.2	142.1	-169.6	-80.6	-80.1	0	0	0	114.1	S419 K539 N540 R628	S419-H537 WeakPolarHBondContact CB-O 3.48Å; S419-H537 PolarHBondContact OG-O 2.69Å; H537-K539 VanDerWaalsContact C-N 3.25Å; H537-K539 PolarHBondContact O-N 2.71Å; H537-N540 PolarHBondContact O-ND2 2.61Å; H537-R628 WeakPolarHBondContact NE2-CB 3Å; H537-R628 WeakPolarHBondContact NE2-CD 3.49Å; H537-R628 VanDerWaalsContact NE2-CG 3.35Å; H537-R628 WeakPolarHBondContact NE2-CG 3.43Å
538	Y	61.9	Low	80.6	Confident	71 Å²	71	23.5 Å²	23.5	28%	0.278	12%	0.117	S	C	.	.	S	Bend	trans	-62.4	-26.7	179.1	-68	-77.5	0	0	0	114.8	T416 S419 K423	T416-Y538 WeakPolarHBondContact CA-O 3.41Å; S419-Y538 WeakPolarHBondContact OG-CA 3Å; S419-Y538 PolarHBondContact OG-O 3.06Å; K423-Y538 HydrophobicContact CD-CD1 4.39Å; K423-Y538 HydrophobicContact CD-CE1 3.63Å; K423-Y538 PolarHBondContact NZ-OH 3.39Å; K423-Y538 VanDerWaalsContact NZ-OH 3.17Å
539	K	67.9	Low	80.6	Confident	101 Å²	101	20.7 Å²	20.7	44%	0.439	11%	0.107	S	C	.	.			trans	-148.4	128.4	-179.7	-179.6	165.6	-173	175.8	0	109.3	T416 H537 L740	T416-K539 HydrophobicContact CG2-CB 3.74Å; T416-K539 HydrophobicContact CG2-CD 3.55Å; T416-K539 HydrophobicContact CG2-CG 3.43Å; T416-K539 VanDerWaalsContact CG2-CG 3.43Å; H537-K539 VanDerWaalsContact C-N 3.25Å; H537-K539 PolarHBondContact O-N 2.71Å; K539-L740 HydrophobicContact CD-CD1 3.93Å; K539-L740 VanDerWaalsContact NZ-CD1 3.31Å
540	N	72.3	Confident	80.5	Confident	5 Å²	5	20.6 Å²	20.6	3%	0.027	11%	0.106	C	C	.	.			trans	-122.3	150	169.8	-60.7	-69.2	0	0	0	109.7	G415 V534 H537 R628	G415-N540 VanDerWaalsContact CA-O 3.27Å; G415-N540 WeakPolarHBondContact CA-O 3.36Å; G415-N540 PolarHBondContact O-N 3.26Å; G415-N540 VanDerWaalsContact O-N 3.07Å; V534-N540 VanDerWaalsContact CA-ND2 3.29Å; V534-N540 WeakPolarHBondContact CA-ND2 3.33Å; V534-N540 HydrophobicContact CG2-CB 4.29Å; V534-N540 PolarHBondContact O-ND2 3.41Å; H537-N540 PolarHBondContact O-ND2 2.61Å; N540-R628 PolarHBondContact OD1-NH1 2.78Å
541	S	78.4	Confident	80.4	Confident	31 Å²	31	20.5 Å²	20.5	22%	0.217	11%	0.106	C	C	.	.			trans	-117.1	144.4	167.4	-173.7	0	0	0	0	108.5	N543 D544	S541-N543 PolarHBondContact O-N 3.39Å; S541-N543 VanDerWaalsContact O-N 3.09Å; S541-N543 PolarHBondContact OG-N 3.49Å; S541-D544 PolarHBondContact N-OD2 3.42Å; S541-D544 VanDerWaalsContact N-OD2 3.15Å; S541-D544 WeakPolarHBondContact O-CB 3.48Å; S541-D544 PolarHBondContact O-N 3.01Å
542	P	82.3	Confident	80.5	Confident	6 Å²	6	21.9 Å²	21.9	4%	0.039	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-22.5	170	-27.9	36	0	0	0	113.1	P129 Y413 L485 D544 L545	P129-P542 HydrophobicContact CB-CB 3.74Å; P129-P542 WeakPolarHBondContact CB-O 3.45Å; Y413-P542 VanDerWaalsContact CA-CG 3.46Å; Y413-P542 VanDerWaalsContact CB-CG 3.46Å; Y413-P542 WeakPolarHBondContact O-CD 3.46Å; L485-P542 HydrophobicContact CD2-CB 4.45Å; P542-D544 PolarHBondContact O-N 3.13Å; P542-L545 VanDerWaalsContact O-CB 3.29Å; P542-L545 WeakPolarHBondContact O-CB 3.07Å; P542-L545 PolarHBondContact O-N 3.01Å; P542-L545 VanDerWaalsContact O-N 3.14Å
543	N	85.4	Confident	80.8	Confident	41 Å²	41	21.5 Å²	21.5	22%	0.219	11%	0.113	C	C	.	.	H	α-helix	trans	-65.8	-19.3	173	-68.4	-8	0	0	0	112.6	N130 S541 L545 Q546 M547	N130-N543 WeakPolarHBondContact CB-OD1 3.3Å; N130-N543 PolarHBondContact N-OD1 3.19Å; S541-N543 PolarHBondContact O-N 3.39Å; S541-N543 VanDerWaalsContact O-N 3.09Å; S541-N543 PolarHBondContact OG-N 3.49Å; N543-L545 PolarHBondContact O-N 3.22Å; N543-Q546 PolarHBondContact O-N 3.35Å; N543-M547 PolarHBondContact O-N 3.48Å
544	D	84.6	Confident	81.1	Confident	23 Å²	23	22.8 Å²	22.8	12%	0.123	12%	0.119	C	C	.	.	H	α-helix	trans	-62.9	-33	173.4	-62.1	-15.6	0	0	0	110.5	S541 P542 Q546 M547 I548 R628	S541-D544 PolarHBondContact N-OD2 3.42Å; S541-D544 VanDerWaalsContact N-OD2 3.15Å; S541-D544 WeakPolarHBondContact O-CB 3.48Å; S541-D544 PolarHBondContact O-N 3.01Å; P542-D544 PolarHBondContact O-N 3.13Å; D544-Q546 VanDerWaalsContact C-N 3.34Å; D544-M547 WeakPolarHBondContact O-CB 3.37Å; D544-M547 PolarHBondContact O-N 3.42Å; D544-I548 WeakPolarHBondContact O-CB 3.36Å; D544-I548 WeakPolarHBondContact O-CD1 3.35Å; D544-I548 WeakPolarHBondContact O-CG1 3.47Å; D544-I548 PolarHBondContact O-N 3.23Å; D544-R628 IonicContact OD1-NH2 3.34Å; D544-R628 IonicContact OD2-CZ 3.89Å; D544-R628 IonicContact OD2-NH1 2.83Å; D544-R628 PolarHBondContact OD2-NH1 2.57Å; D544-R628 IonicContact OD2-NH2 3.75Å; D544-R628 PolarHBondContact OD2-NH2 3.08Å
545	L	88.1	Confident	81.7	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-64	-41.3	175.7	-171.7	62.2	0	0	0	111.5	F181 F516 L526 P542 N543 M547 I548 S549	F181-L545 HydrophobicContact CE2-CD2 4.5Å; F516-L545 HydrophobicContact CE1-CD1 3.89Å; F516-L545 HydrophobicContact CE1-CG 4.46Å; F516-L545 HydrophobicContact CZ-CD1 4.23Å; L526-L545 HydrophobicContact CD1-CD1 4.23Å; P542-L545 VanDerWaalsContact O-CB 3.29Å; P542-L545 WeakPolarHBondContact O-CB 3.07Å; P542-L545 PolarHBondContact O-N 3.01Å; P542-L545 VanDerWaalsContact O-N 3.14Å; N543-L545 PolarHBondContact O-N 3.22Å; L545-M547 VanDerWaalsContact C-N 3.35Å; L545-I548 PolarHBondContact O-N 3.43Å; L545-S549 WeakPolarHBondContact O-CB 3.23Å; L545-S549 PolarHBondContact O-N 3.11Å; L545-S549 PolarHBondContact O-OG 2.85Å
546	Q	87.2	Confident	82.4	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67.3	-37	174.9	-177.7	174.4	16.4	0	0	111.8	P129 M163 Y169 F181 N543 D544 S549 D550	P129-Q546 HydrophobicContact CG-CB 3.8Å; M163-Q546 PolarHBondContact SD-NE2 3.44Å; Y169-Q546 HydrophobicContact CE2-CG 4.35Å; F181-Q546 HydrophobicContact CB-CG 4.32Å; N543-Q546 PolarHBondContact O-N 3.35Å; D544-Q546 VanDerWaalsContact C-N 3.34Å; Q546-S549 WeakPolarHBondContact CA-OG 3.32Å; Q546-S549 PolarHBondContact O-N 2.66Å; Q546-S549 PolarHBondContact O-OG 3.13Å; Q546-D550 WeakPolarHBondContact CG-OD2 3.28Å; Q546-D550 PolarHBondContact NE2-OD2 3.28Å; Q546-D550 WeakPolarHBondContact O-CB 3.13Å; Q546-D550 PolarHBondContact O-N 3.09Å
547	M	85.5	Confident	83.3	Confident	35 Å²	35	22.2 Å²	22.2	17%	0.172	11%	0.11	C	C	.	.	H	α-helix	trans	-63.5	-43.4	174.2	-176.3	-179.3	71.5	0	0	111.1	Y169 N543 D544 L545 S549 A551	Y169-M547 HydrophobicContact CD1-CG 4.21Å; Y169-M547 HydrophobicContact CE1-CB 3.82Å; Y169-M547 HydrophobicContact CE1-CG 3.68Å; Y169-M547 HydrophobicContact CE1-SD 4.49Å; N543-M547 PolarHBondContact O-N 3.48Å; D544-M547 WeakPolarHBondContact O-CB 3.37Å; D544-M547 PolarHBondContact O-N 3.42Å; L545-M547 VanDerWaalsContact C-N 3.35Å; M547-S549 VanDerWaalsContact C-N 3.29Å; M547-S549 PolarHBondContact O-N 3.2Å; M547-A551 HydrophobicContact CG-CB 4.5Å; M547-A551 WeakPolarHBondContact O-CB 3.38Å; M547-A551 PolarHBondContact O-N 3.4Å
548	I	88	Confident	84.4	Confident	3 Å²	3	20 Å²	20	2%	0.015	10%	0.099	C	C	.	.	H	α-helix	trans	-65.2	-33.4	178.5	-71.1	164.9	0	0	0	111.7	F516 Y533 D544 L545 L556	F516-I548 HydrophobicContact CE2-CG2 4.21Å; F516-I548 HydrophobicContact CZ-CG2 3.95Å; Y533-I548 HydrophobicContact CD1-CD1 4.25Å; Y533-I548 HydrophobicContact CE1-CD1 3.75Å; D544-I548 WeakPolarHBondContact O-CB 3.36Å; D544-I548 WeakPolarHBondContact O-CD1 3.35Å; D544-I548 WeakPolarHBondContact O-CG1 3.47Å; D544-I548 PolarHBondContact O-N 3.23Å; L545-I548 PolarHBondContact O-N 3.43Å; I548-L556 HydrophobicContact CG2-CD1 3.54Å; I548-L556 HydrophobicContact CG2-CD2 4.16Å; I548-L556 HydrophobicContact CG2-CG 4.49Å
549	S	87.3	Confident	85.9	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-83	-45.6	-178.6	68.6	0	0	0	0	113.3	R180 F181 F516 L545 Q546 M547	R180-S549 WeakPolarHBondContact CD-O 3.24Å; R180-S549 PolarHBondContact NH1-O 2.77Å; F181-S549 WeakPolarHBondContact CB-OG 3.49Å; F516-S549 VanDerWaalsContact CE2-CA 3.41Å; F516-S549 VanDerWaalsContact CE2-CB 3.48Å; L545-S549 WeakPolarHBondContact O-CB 3.23Å; L545-S549 PolarHBondContact O-N 3.11Å; L545-S549 PolarHBondContact O-OG 2.85Å; Q546-S549 WeakPolarHBondContact CA-OG 3.32Å; Q546-S549 PolarHBondContact O-N 2.66Å; Q546-S549 PolarHBondContact O-OG 3.13Å; M547-S549 VanDerWaalsContact C-N 3.29Å; M547-S549 PolarHBondContact O-N 3.2Å
550	D	84.7	Confident	87	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-98.9	-22.7	-163.6	-62.2	-2.9	0	0	0	112.6	H166 Y169 I177 R180 F181 Q546 P552	H166-D550 IonicContact CD2-OD2 2.8Å; H166-D550 IonicContact CE1-OD2 3.73Å; H166-D550 IonicContact NE2-OD2 2.89Å; H166-D550 PolarHBondContact NE2-OD2 3.49Å; Y169-D550 HydrophobicContact CD2-CB 4.39Å; I177-D550 HydrophobicContact CG2-CB 4.32Å; R180-D550 PolarHBondContact N-OD1 3.26Å; F181-D550 PolarHBondContact N-OD1 3.13Å; Q546-D550 WeakPolarHBondContact CG-OD2 3.28Å; Q546-D550 PolarHBondContact NE2-OD2 3.28Å; Q546-D550 WeakPolarHBondContact O-CB 3.13Å; Q546-D550 PolarHBondContact O-N 3.09Å; D550-P552 WeakPolarHBondContact O-CD 3.44Å
551	A	85.6	Confident	87.7	Confident	3 Å²	3	12.4 Å²	12.4	3%	0.025	7%	0.072	C	C	.	.			trans	-79.5	120	-173.6	0	0	0	0	0	111.5	Y169 M547 A553 H554	Y169-A551 HydrophobicContact CD1-CB 4.24Å; Y169-A551 HydrophobicContact CD2-CB 4.36Å; Y169-A551 HydrophobicContact CG-CB 3.9Å; M547-A551 HydrophobicContact CG-CB 4.5Å; M547-A551 WeakPolarHBondContact O-CB 3.38Å; M547-A551 PolarHBondContact O-N 3.4Å; A551-A553 PolarHBondContact O-N 3.03Å; A551-H554 HydrophobicContact CB-CB 4.36Å; A551-H554 WeakPolarHBondContact CB-CD2 3.34Å; A551-H554 PolarHBondContact O-N 3.38Å
552	P	84.9	Confident	87.9	Confident	30 Å²	30	15 Å²	15	20%	0.195	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-35.5	-171.1	25.3	-34.1	0	0	0	113.3	H174 D176 I177 D550 H554	H174-P552 HydrophobicContact CB-CB 4.17Å; H174-P552 HydrophobicContact CB-CG 3.84Å; D176-P552 WeakPolarHBondContact O-CB 3.09Å; D176-P552 WeakPolarHBondContact O-CG 3.34Å; I177-P552 HydrophobicContact CG1-CG 4.42Å; D550-P552 WeakPolarHBondContact O-CD 3.44Å; P552-H554 PolarHBondContact O-N 2.64Å
553	A	88.5	Confident	87.7	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.008	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-7.7	179.9	0	0	0	0	0	113.5	H174 A551 C580 L581	H174-A553 HydrophobicContact CB-CB 4.4Å; A551-A553 PolarHBondContact O-N 3.03Å; A553-C580 CarbonylContact O-C 3.57Å; A553-C580 VanDerWaalsContact O-CA 3.31Å; A553-C580 WeakPolarHBondContact O-CA 3.39Å; A553-L581 HydrophobicContact CB-CB 4.33Å; A553-L581 PolarHBondContact O-N 3.12Å
554	H	90	Very high	87.1	Confident	26 Å²	26	21 Å²	21	12%	0.12	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	119.5	-178.6	-77.3	-101.1	0	0	0	111.4	A551 P552 Q578 V579	A551-H554 HydrophobicContact CB-CB 4.36Å; A551-H554 WeakPolarHBondContact CB-CD2 3.34Å; A551-H554 PolarHBondContact O-N 3.38Å; P552-H554 PolarHBondContact O-N 2.64Å; H554-Q578 PolarHBondContact ND1-NE2 2.96Å; H554-V579 CarbonylContact C-O 3.59Å; H554-V579 WeakPolarHBondContact CA-O 3.41Å
555	H	90.6	Very high	86.4	Confident	37 Å²	37	26.7 Å²	26.7	17%	0.171	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	147.4	170.3	-62.4	-51.8	0	0	0	110.5	F557 V579 L581 R701 E704	H555-F557 HydrophobicContact CB-CE2 3.95Å; H555-F557 HydrophobicContact CB-CZ 4.45Å; H555-V579 PolarHBondContact N-O 3.05Å; H555-V579 PolarHBondContact O-N 3.3Å; H555-L581 WeakPolarHBondContact NE2-CD1 3.17Å; H555-R701 PolarHBondContact CE1-NH2 3.21Å; H555-R701 PolarHBondContact ND1-NH2 3.22Å; H555-R701 PolarHBondContact NE2-NH2 3.24Å; H555-E704 IonicContact NE2-OE1 3.21Å
556	L	91.8	Very high	85.4	Confident	5 Å²	5	34.1 Å²	34.1	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	142.6	-177.5	-65.9	121.3	0	0	0	110.1	F510 I548 I577 Q578	F510-L556 HydrophobicContact CD1-CB 3.78Å; F510-L556 WeakPolarHBondContact CD1-O 3.37Å; F510-L556 HydrophobicContact CD2-CB 4.44Å; F510-L556 HydrophobicContact CE1-CB 3Å; F510-L556 HydrophobicContact CE1-CD1 4.25Å; F510-L556 HydrophobicContact CE1-CD2 4.32Å; F510-L556 HydrophobicContact CE1-CG 4.01Å; F510-L556 HydrophobicContact CE2-CB 3.72Å; F510-L556 HydrophobicContact CE2-CD1 3.55Å; F510-L556 HydrophobicContact CE2-CG 4.2Å; F510-L556 HydrophobicContact CG-CB 4.49Å; F510-L556 HydrophobicContact CZ-CB 3Å; F510-L556 HydrophobicContact CZ-CD1 3.32Å; F510-L556 HydrophobicContact CZ-CD2 3.92Å; F510-L556 HydrophobicContact CZ-CG 3.55Å; F510-L556 PolarHBondContact N-O 2.95Å; I548-L556 HydrophobicContact CG2-CD1 3.54Å; I548-L556 HydrophobicContact CG2-CD2 4.16Å; I548-L556 HydrophobicContact CG2-CG 4.49Å; L556-I577 WeakPolarHBondContact CA-O 3.29Å; L556-Q578 HydrophobicContact CD2-CB 3.84Å; L556-Q578 HydrophobicContact CD2-CG 3.94Å; L556-Q578 HydrophobicContact CG-CB 4.49Å; L556-Q578 HydrophobicContact CG-CG 4.29Å
557	F	94	Very high	84.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.7	-176.8	-60.1	-93.9	0	0	0	108.8	L507 Y508 P509 H555 V576 I577 V579 L648 Y651 L698	L507-F557 HydrophobicContact CD1-CB 3.79Å; L507-F557 HydrophobicContact CD2-CB 3.93Å; L507-F557 HydrophobicContact CD2-CD1 4.05Å; L507-F557 HydrophobicContact CD2-CG 4.17Å; L507-F557 HydrophobicContact CG-CB 3.83Å; L507-F557 HydrophobicContact CG-CD1 4.32Å; L507-F557 HydrophobicContact CG-CG 4.45Å; Y508-F557 WeakPolarHBondContact O-CA 3.45Å; P509-F557 HydrophobicContact CB-CD1 3.96Å; P509-F557 HydrophobicContact CB-CE1 3.84Å; H555-F557 HydrophobicContact CB-CE2 3.95Å; H555-F557 HydrophobicContact CB-CZ 4.45Å; F557-V576 CarbonylContact O-C 3.52Å; F557-V576 WeakPolarHBondContact O-CA 3.15Å; F557-I577 HydrophobicContact CB-CB 4.42Å; F557-I577 PolarHBondContact N-O 3.27Å; F557-I577 PolarHBondContact O-N 2.94Å; F557-V579 HydrophobicContact CD2-CG2 4.06Å; F557-V579 HydrophobicContact CE2-CB 4.36Å; F557-V579 HydrophobicContact CE2-CG2 4.01Å; F557-L648 HydrophobicContact CD1-CD1 4.25Å; F557-L648 HydrophobicContact CD2-CD1 3.47Å; F557-L648 VanDerWaalsContact CD2-CD1 3.47Å; F557-L648 HydrophobicContact CE1-CD1 4.31Å; F557-L648 HydrophobicContact CE2-CD1 3.58Å; F557-L648 HydrophobicContact CG-CD1 3.83Å; F557-L648 HydrophobicContact CZ-CD1 4Å; F557-Y651 HydrophobicContact CE1-CD1 4.36Å; F557-Y651 HydrophobicContact CE1-CE1 4.21Å; F557-Y651 HydrophobicContact CZ-CD1 4.4Å; F557-Y651 HydrophobicContact CZ-CE1 4.15Å; F557-L698 HydrophobicContact CD1-CD2 4.2Å; F557-L698 HydrophobicContact CE1-CD2 4.04Å
558	V	93.9	Very high	83.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	132.5	177.4	-66.5	0	0	0	0	109.7	L507 Y508 F510 F525 L529 L560 I573 C575 V576 L695	L507-V558 WeakPolarHBondContact CA-O 3.47Å; Y508-V558 PolarHBondContact N-O 2.84Å; Y508-V558 PolarHBondContact O-N 3.02Å; F510-V558 HydrophobicContact CD1-CG1 4.25Å; F510-V558 HydrophobicContact CE1-CG1 4.24Å; F525-V558 HydrophobicContact CZ-CG1 4.47Å; F525-V558 HydrophobicContact CZ-CG2 4.27Å; L529-V558 HydrophobicContact CD1-CG1 4.17Å; V558-L560 HydrophobicContact CB-CD2 4.39Å; V558-L560 HydrophobicContact CG2-CD1 4.31Å; V558-L560 HydrophobicContact CG2-CD2 4.2Å; V558-L560 HydrophobicContact CG2-CG 4.14Å; V558-I573 HydrophobicContact CB-CG2 4.38Å; V558-I573 HydrophobicContact CG1-CG2 4.3Å; V558-C575 CarbonylContact C-O 3.52Å; V558-C575 WeakPolarHBondContact CA-O 3.27Å; V558-V576 HydrophobicContact CG1-CG1 4.36Å; V558-V576 HydrophobicContact CG1-CG2 4.24Å; V558-L695 HydrophobicContact CG2-CD2 3.86Å
559	L	93.6	Very high	82.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120	170.6	-167.9	81.7	0	0	0	107.9	C505 D506 L507 L574 C575 Y640 R643 A644 L647	C505-L559 HydrophobicContact CB-CD1 4.09Å; C505-L559 HydrophobicContact CB-CD2 4.04Å; C505-L559 HydrophobicContact CB-CG 3.97Å; D506-L559 WeakPolarHBondContact O-CA 3.19Å; L507-L559 HydrophobicContact CB-CD1 4.35Å; L507-L559 HydrophobicContact CD1-CB 4.26Å; L507-L559 HydrophobicContact CD1-CD1 4.32Å; L559-L574 PolarHBondContact O-N 2.73Å; L559-C575 HydrophobicContact CB-CB 3.84Å; L559-C575 HydrophobicContact CD2-CB 4.29Å; L559-C575 PolarHBondContact N-O 3.46Å; L559-Y640 HydrophobicContact CD2-CD1 4.03Å; L559-Y640 HydrophobicContact CD2-CG 4.43Å; L559-R643 HydrophobicContact CD1-CG 4.24Å; L559-A644 HydrophobicContact CB-CB 4.27Å; L559-A644 HydrophobicContact CD1-CB 4.22Å; L559-A644 HydrophobicContact CD2-CB 4.36Å; L559-L647 HydrophobicContact CD1-CD1 4Å
560	L	91.1	Very high	82.4	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	149.3	179.3	-56.4	178.2	0	0	0	109.2	C505 D506 Y508 V558 P571 E572 I573 L695	C505-L560 WeakPolarHBondContact CA-O 3.45Å; C505-L560 WeakPolarHBondContact CB-O 3.49Å; D506-L560 PolarHBondContact N-O 3.42Å; D506-L560 PolarHBondContact O-N 3.37Å; Y508-L560 HydrophobicContact CD2-CB 4.07Å; Y508-L560 HydrophobicContact CD2-CD1 3.75Å; Y508-L560 HydrophobicContact CD2-CG 3.95Å; Y508-L560 HydrophobicContact CE2-CB 4.06Å; Y508-L560 HydrophobicContact CE2-CD1 4.19Å; Y508-L560 HydrophobicContact CE2-CG 4.41Å; Y508-L560 HydrophobicContact CG-CD1 4.21Å; V558-L560 HydrophobicContact CB-CD2 4.39Å; V558-L560 HydrophobicContact CG2-CD1 4.31Å; V558-L560 HydrophobicContact CG2-CD2 4.2Å; V558-L560 HydrophobicContact CG2-CG 4.14Å; L560-P571 HydrophobicContact CD1-CB 4.18Å; L560-P571 HydrophobicContact CD1-CG 3.94Å; L560-P571 HydrophobicContact CD2-CB 4.26Å; L560-P571 HydrophobicContact CD2-CG 4.42Å; L560-E572 WeakPolarHBondContact CD2-O 3.17Å; L560-I573 HydrophobicContact CD2-CB 4.46Å; L560-I573 HydrophobicContact CD2-CG1 4.09Å; L560-L695 HydrophobicContact CD1-CD1 3.7Å
561	G	86.4	Confident	82.2	Confident	16 Å²	16	57.2 Å²	57.2	17%	0.165	31%	0.31	C	S	.	.			trans	-65.8	170.4	165.5	0	0	0	0	0	111.4	V563	G561-V563 WeakPolarHBondContact O-CG2 2.86Å; G561-V563 PolarHBondContact O-N 2.62Å; G561-V563 VanDerWaalsContact O-N 3.16Å
562	P	83.4	Confident	81.9	Confident	85 Å²	85	59.1 Å²	59.1	55%	0.552	32%	0.318	S	S	*	.			trans	-55.2	122.8	175.7	21.4	-31.1	0	0	0	110.2	P500	P500-P562 HydrophobicContact CB-CG 4.41Å
563	V	76.3	Confident	82.1	Confident	74 Å²	74	57.8 Å²	57.8	45%	0.448	31%	0.309	S	S	.	.			trans	-92.4	113.1	-176.7	-175	0	0	0	0	108.8	G561 V565 P571	G561-V563 WeakPolarHBondContact O-CG2 2.86Å; G561-V563 PolarHBondContact O-N 2.62Å; G561-V563 VanDerWaalsContact O-N 3.16Å; V563-V565 PolarHBondContact O-N 2.96Å; V563-P571 HydrophobicContact CG2-CB 4.29Å
564	D	73.1	Confident	82.1	Confident	101 Å²	101	57.9 Å²	57.9	54%	0.54	31%	0.31	S	S	.	.			trans	-68.9	113.9	169.4	-79	-22.7	0	0	0	109.5	N566 Q567	D564-N566 PolarHBondContact O-N 3.04Å; D564-Q567 HydrophobicContact CB-CB 4.29Å; D564-Q567 HydrophobicContact CB-CG 4.04Å; D564-Q567 PolarHBondContact O-N 2.7Å; D564-Q567 PolarHBondContact OD2-NE2 3.29Å
565	V	69.7	Low	82.2	Confident	141 Å²	141	56.7 Å²	56.7	86%	0.855	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-24.7	179.3	-173.5	0	0	0	0	112.4	V563	V563-V565 PolarHBondContact O-N 2.96Å
566	N	67.3	Low	82.4	Confident	159 Å²	159	54.9 Å²	54.9	85%	0.85	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-17.5	-178.4	-63.4	-28	0	0	0	114	D564	D564-N566 PolarHBondContact O-N 3.04Å
567	Q	68	Low	82.5	Confident	110 Å²	110	54.7 Å²	54.7	51%	0.514	29%	0.294	S	S	.	.			trans	-92.5	122.1	-179.3	-68.9	-167.7	24.6	0	0	111	D564 N569	D564-Q567 HydrophobicContact CB-CB 4.29Å; D564-Q567 HydrophobicContact CB-CG 4.04Å; D564-Q567 PolarHBondContact O-N 2.7Å; D564-Q567 PolarHBondContact OD2-NE2 3.29Å; Q567-N569 PolarHBondContact O-N 3.2Å; Q567-N569 VanDerWaalsContact O-N 3.14Å
568	K	68.8	Low	82.5	Confident	210 Å²	210	54.7 Å²	54.7	91%	0.913	29%	0.294	S	S	*	.			trans	-76.7	12.7	173.4	-68.7	-174.9	178.3	179.5	0	113.8
569	N	72	Confident	82.5	Confident	123 Å²	123	54.7 Å²	54.7	66%	0.658	29%	0.294	S	S	*	.	S	Bend	trans	-79.8	140.5	-178.7	-72.5	-22.2	0	0	0	110.3	Q567	Q567-N569 PolarHBondContact O-N 3.2Å; Q567-N569 VanDerWaalsContact O-N 3.14Å
570	I	76	Confident	82.5	Confident	47 Å²	47	55 Å²	55	24%	0.241	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-64.9	123.5	175.2	-58.6	170.9	0	0	0	107.7	V521 V524 F525 R528	V521-I570 HydrophobicContact CG1-CD1 4.12Å; V521-I570 HydrophobicContact CG1-CG1 4.21Å; V524-I570 HydrophobicContact CB-CD1 4.03Å; V524-I570 HydrophobicContact CG1-CD1 3.67Å; F525-I570 HydrophobicContact CD2-CG2 3.81Å; R528-I570 PolarHBondContact NH1-O 3.35Å
571	P	80.7	Confident	82.6	Confident	33 Å²	33	55.4 Å²	55.4	21%	0.214	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-60	147.3	-176.4	24.9	-33.8	0	0	0	111	L560 V563 L695	L560-P571 HydrophobicContact CD1-CB 4.18Å; L560-P571 HydrophobicContact CD1-CG 3.94Å; L560-P571 HydrophobicContact CD2-CB 4.26Å; L560-P571 HydrophobicContact CD2-CG 4.42Å; V563-P571 HydrophobicContact CG2-CB 4.29Å; P571-L695 HydrophobicContact CG-CD1 4.42Å
572	E	80.8	Confident	82.8	Confident	42 Å²	42	54.9 Å²	54.9	20%	0.196	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-77.1	130	175.5	-168	178	161.1	0	0	109.6	L560 Y635	L560-E572 WeakPolarHBondContact CD2-O 3.17Å; E572-Y635 VanDerWaalsContact OE1-CE2 3.28Å; E572-Y635 WeakPolarHBondContact OE1-CE2 3.41Å; E572-Y635 PolarHBondContact OE1-OH 2.87Å
573	I	88.1	Confident	83	Confident	3 Å²	3	51 Å²	51	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	115.8	179.4	-56.2	171.5	0	0	0	107.7	F525 R528 L529 I532 V558 L560 V576	F525-I573 HydrophobicContact CD1-CD1 4.43Å; F525-I573 HydrophobicContact CD2-CD1 4.08Å; F525-I573 HydrophobicContact CD2-CG1 4.49Å; F525-I573 HydrophobicContact CE1-CD1 4.03Å; F525-I573 HydrophobicContact CE2-CD1 3.64Å; F525-I573 HydrophobicContact CE2-CG1 3.76Å; F525-I573 HydrophobicContact CG-CD1 4.46Å; F525-I573 HydrophobicContact CZ-CD1 3.61Å; F525-I573 HydrophobicContact CZ-CG1 3.93Å; R528-I573 HydrophobicContact CB-CD1 4.05Å; L529-I573 HydrophobicContact CB-CD1 4.01Å; I532-I573 HydrophobicContact CD1-CB 3.56Å; I532-I573 HydrophobicContact CD1-CG2 3.59Å; I532-I573 WeakPolarHBondContact CD1-O 3.44Å; V558-I573 HydrophobicContact CB-CG2 4.38Å; V558-I573 HydrophobicContact CG1-CG2 4.3Å; L560-I573 HydrophobicContact CD2-CB 4.46Å; L560-I573 HydrophobicContact CD2-CG1 4.09Å; I573-V576 HydrophobicContact CG2-CG2 3.55Å
574	L	89.4	Confident	83.6	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-42	-178.6	-58.6	175.3	0	0	0	111.4	P500 L559 H632 Y635 Y640	P500-L574 HydrophobicContact CG-CD1 3.99Å; L559-L574 PolarHBondContact O-N 2.73Å; L574-H632 PolarHBondContact O-N 3.02Å; L574-Y635 HydrophobicContact CD2-CD2 3.71Å; L574-Y635 HydrophobicContact CD2-CE2 3.46Å; L574-Y635 VanDerWaalsContact CD2-CE2 3.46Å; L574-Y640 HydrophobicContact CD1-CD1 4.08Å; L574-Y640 HydrophobicContact CD1-CE1 3.92Å
575	C	92.2	Very high	84.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	146.7	179.2	-172.7	0	0	0	0	111	V558 L559 A630 T631 A644	V558-C575 CarbonylContact C-O 3.52Å; V558-C575 WeakPolarHBondContact CA-O 3.27Å; L559-C575 HydrophobicContact CB-CB 3.84Å; L559-C575 HydrophobicContact CD2-CB 4.29Å; L559-C575 PolarHBondContact N-O 3.46Å; C575-A630 CarbonylContact C-O 3.56Å; C575-A630 VanDerWaalsContact CA-O 3.26Å; C575-A630 WeakPolarHBondContact CA-O 3.45Å; C575-A630 PolarHBondContact SG-O 2.88Å; C575-A630 VanDerWaalsContact SG-O 3.37Å; C575-T631 HydrophobicContact CB-CG2 4.15Å; C575-A644 HydrophobicContact CB-CB 4.46Å
576	V	93	Very high	85	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.4	174.3	-173.2	0	0	0	0	108.3	L529 I532 Y533 F557 V558 I573 I629 A630	L529-V576 HydrophobicContact CD1-CG1 4.4Å; L529-V576 HydrophobicContact CG-CG1 4.25Å; L529-V576 HydrophobicContact CG-CG2 4.2Å; I532-V576 HydrophobicContact CG2-CG2 4.3Å; Y533-V576 HydrophobicContact CD2-CG1 4.3Å; Y533-V576 HydrophobicContact CE2-CG1 4.22Å; F557-V576 CarbonylContact O-C 3.52Å; F557-V576 WeakPolarHBondContact O-CA 3.15Å; V558-V576 HydrophobicContact CG1-CG1 4.36Å; V558-V576 HydrophobicContact CG1-CG2 4.24Å; I573-V576 HydrophobicContact CG2-CG2 3.55Å; V576-I629 WeakPolarHBondContact O-CA 3.31Å; V576-A630 HydrophobicContact CB-CB 4.49Å; V576-A630 PolarHBondContact N-O 2.99Å; V576-A630 PolarHBondContact O-N 3.05Å
577	I	94.7	Very high	85.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127	172.4	-58	-175.8	0	0	0	108.2	L556 F557 V579 I626 I629 A644 V645 L648	L556-I577 WeakPolarHBondContact CA-O 3.29Å; F557-I577 HydrophobicContact CB-CB 4.42Å; F557-I577 PolarHBondContact N-O 3.27Å; F557-I577 PolarHBondContact O-N 2.94Å; I577-V579 HydrophobicContact CG2-CG2 3.79Å; I577-I626 HydrophobicContact CG2-CG2 3.9Å; I577-I629 HydrophobicContact CG1-CG1 4.31Å; I577-I629 HydrophobicContact CG1-CG2 4.5Å; I577-I629 HydrophobicContact CG2-CG1 4.43Å; I577-A644 VanDerWaalsContact CD1-C 3.44Å; I577-A644 HydrophobicContact CD1-CB 3.45Å; I577-A644 VanDerWaalsContact CD1-CB 3.45Å; I577-A644 WeakPolarHBondContact CD1-O 3.35Å; I577-A644 HydrophobicContact CG1-CB 4.12Å; I577-V645 HydrophobicContact CD1-CG2 4.23Å; I577-L648 HydrophobicContact CG2-CD2 4.19Å
578	Q	94.1	Very high	86.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	125.9	167.7	-177.8	-174.6	39.1	0	0	109.4	Y533 H554 L556 I626 V627 R628	Y533-Q578 HydrophobicContact CE2-CB 4.46Å; Y533-Q578 WeakPolarHBondContact OH-CB 3.28Å; Y533-Q578 PolarHBondContact OH-OE1 2.94Å; H554-Q578 PolarHBondContact ND1-NE2 2.96Å; L556-Q578 HydrophobicContact CD2-CB 3.84Å; L556-Q578 HydrophobicContact CD2-CG 3.94Å; L556-Q578 HydrophobicContact CG-CB 4.49Å; L556-Q578 HydrophobicContact CG-CG 4.29Å; Q578-I626 CarbonylContact O-C 3.58Å; Q578-V627 HydrophobicContact CB-CB 4.49Å; Q578-V627 HydrophobicContact CG-CB 4.17Å; Q578-V627 PolarHBondContact O-N 2.88Å; Q578-R628 HydrophobicContact CB-CB 4.33Å; Q578-R628 PolarHBondContact N-O 2.87Å; Q578-R628 PolarHBondContact O-N 3.29Å
579	V	93.9	Very high	87.5	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	141.7	177.7	-175.2	0	0	0	0	108.7	H554 H555 F557 I577 A624 R625 L648 Y652	H554-V579 CarbonylContact C-O 3.59Å; H554-V579 WeakPolarHBondContact CA-O 3.41Å; H555-V579 PolarHBondContact N-O 3.05Å; H555-V579 PolarHBondContact O-N 3.3Å; F557-V579 HydrophobicContact CD2-CG2 4.06Å; F557-V579 HydrophobicContact CE2-CB 4.36Å; F557-V579 HydrophobicContact CE2-CG2 4.01Å; I577-V579 HydrophobicContact CG2-CG2 3.79Å; V579-A624 HydrophobicContact CG1-CB 3.56Å; V579-R625 CarbonylContact C-O 3.53Å; V579-R625 WeakPolarHBondContact CA-O 3.3Å; V579-L648 HydrophobicContact CG2-CD1 3.95Å; V579-L648 HydrophobicContact CG2-CD2 3.86Å; V579-Y652 HydrophobicContact CG1-CE2 4.47Å
580	C	93.1	Very high	88	Confident	7 Å²	7	25 Å²	25	5%	0.047	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.6	171	-176.6	0	0	0	0	107.7	A553 A624 R625 V627	A553-C580 CarbonylContact O-C 3.57Å; A553-C580 VanDerWaalsContact O-CA 3.31Å; A553-C580 WeakPolarHBondContact O-CA 3.39Å; C580-A624 CarbonylContact O-C 3.59Å; C580-A624 WeakPolarHBondContact O-CA 3.48Å; C580-R625 PolarHBondContact N-O 2.94Å; C580-R625 PolarHBondContact O-N 3.43Å; C580-V627 HydrophobicContact CB-CG2 3.51Å
581	L	92.9	Very high	88.4	Confident	10 Å²	10	27 Å²	27	5%	0.052	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	130.5	169.2	-56.5	-176.7	0	0	0	108.5	A553 H555 A624 E704 L706	A553-L581 HydrophobicContact CB-CB 4.33Å; A553-L581 PolarHBondContact O-N 3.12Å; H555-L581 WeakPolarHBondContact NE2-CD1 3.17Å; L581-A624 HydrophobicContact CD2-CB 3.86Å; L581-E704 HydrophobicContact CD1-CG 4Å; L581-L706 HydrophobicContact CD2-CD1 4.44Å; L581-L706 HydrophobicContact CD2-CD2 4.12Å
582	E	92.1	Very high	88.7	Confident	4 Å²	4	28.2 Å²	28.2	2%	0.019	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144	-179.1	-63.6	-168.6	168.3	0	0	109.5	D603 L604 I605 P606 G623 R625 W708	E582-D603 VanDerWaalsContact CA-OD1 3.31Å; E582-D603 WeakPolarHBondContact CA-OD1 3.39Å; E582-D603 WeakPolarHBondContact CB-OD1 2.79Å; E582-L604 PolarHBondContact OE1-N 3.33Å; E582-L604 PolarHBondContact OE2-N 3.41Å; E582-I605 PolarHBondContact OE2-N 3.33Å; E582-P606 HydrophobicContact CB-CG 4.12Å; E582-P606 WeakPolarHBondContact OE2-CD 3.47Å; E582-G623 PolarHBondContact N-O 3.37Å; E582-G623 CarbonylContact O-C 3.58Å; E582-G623 WeakPolarHBondContact O-CA 3.4Å; E582-G623 PolarHBondContact O-N 3.14Å; E582-R625 HydrophobicContact CG-CB 4.36Å; E582-R625 IonicContact OE1-CZ 2.85Å; E582-R625 IonicContact OE1-NE 2.72Å; E582-R625 PolarHBondContact OE1-NE 3.49Å; E582-R625 IonicContact OE1-NH2 3.02Å; E582-R625 PolarHBondContact OE1-NH2 3.06Å; E582-R625 IonicContact OE2-NE 2.9Å; E582-W708 HydrophobicContact CB-CH2 4.25Å; E582-W708 HydrophobicContact CB-CZ2 4.42Å
583	G	87.9	Confident	88.8	Confident	3 Å²	3	28.4 Å²	28.4	3%	0.031	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	114.6	-155.6	179.5	0	0	0	0	0	113.6	I585 D603 L621	G583-I585 PolarHBondContact O-N 3.35Å; G583-D603 PolarHBondContact N-OD1 2.98Å; G583-L621 WeakPolarHBondContact CA-O 3.25Å
584	D	88.2	Confident	88.4	Confident	89 Å²	89	31.3 Å²	31.3	48%	0.476	18%	0.177	S	C	.	.			trans	51.9	36.7	-170.3	-69.1	-40.8	0	0	0	112.8	A173 P619 L621 S622	A173-D584 HydrophobicContact CB-CB 4.25Å; D584-P619 PolarHBondContact N-O 3.02Å; D584-L621 PolarHBondContact N-O 3.11Å; D584-S622 WeakPolarHBondContact OD1-CB 3.39Å; D584-S622 VanDerWaalsContact OD2-CB 3.23Å; D584-S622 WeakPolarHBondContact OD2-CB 3.46Å; D584-S622 PolarHBondContact OD2-OG 2.89Å
585	I	85.5	Confident	88.1	Confident	6 Å²	6	35.7 Å²	35.7	3%	0.031	21%	0.208	C	C	.	.			trans	-83.5	133.1	-178.8	-53	-179	0	0	0	108.8	E172 G583 K587 V590 D603 P606 W607 P619	E172-I585 WeakPolarHBondContact OE2-CG2 3.37Å; G583-I585 PolarHBondContact O-N 3.35Å; I585-K587 PolarHBondContact O-N 2.96Å; I585-V590 HydrophobicContact CB-CG2 4.2Å; I585-V590 HydrophobicContact CG2-CG2 3.68Å; I585-D603 HydrophobicContact CD1-CB 3.92Å; I585-P606 HydrophobicContact CD1-CB 3.96Å; I585-W607 HydrophobicContact CD1-CZ2 4.13Å; I585-W607 HydrophobicContact CG2-CZ2 4.19Å; I585-P619 HydrophobicContact CB-CB 4.17Å; I585-P619 WeakPolarHBondContact CB-O 3.27Å; I585-P619 HydrophobicContact CD1-CB 4.22Å; I585-P619 PolarHBondContact N-O 3.19Å
586	S	86.6	Confident	87.6	Confident	53 Å²	53	42.9 Å²	42.9	37%	0.371	24%	0.235	S	C	.	.			trans	-65.4	137.3	178.7	69.1	0	0	0	0	111.3	E172 A588 S589 V590	E172-S586 VanDerWaalsContact OE1-CB 3.24Å; E172-S586 WeakPolarHBondContact OE1-CB 3.12Å; E172-S586 PolarHBondContact OE1-N 3.48Å; E172-S586 PolarHBondContact OE1-OG 2.75Å; S586-A588 PolarHBondContact O-N 2.82Å; S586-S589 WeakPolarHBondContact O-CB 2.98Å; S586-S589 PolarHBondContact O-N 3.25Å; S586-S589 WeakPolarHBondContact OG-CB 3.4Å; S586-S589 PolarHBondContact OG-N 2.78Å; S586-V590 WeakPolarHBondContact O-CG2 3.18Å; S586-V590 PolarHBondContact O-N 2.91Å
587	K	84.5	Confident	86.7	Confident	117 Å²	117	46.2 Å²	46.2	51%	0.509	27%	0.269	S	S	.	.	H	α-helix	trans	-54.7	-38.7	179.2	-69.1	-171.3	171.7	-163.8	0	112.7	I585 S589 V590 D591 D617	I585-K587 PolarHBondContact O-N 2.96Å; K587-S589 VanDerWaalsContact C-N 3.33Å; K587-S589 PolarHBondContact O-N 3.13Å; K587-V590 WeakPolarHBondContact O-CB 3.04Å; K587-V590 PolarHBondContact O-N 2.81Å; K587-D591 PolarHBondContact O-N 2.88Å; K587-D617 VanDerWaalsContact CE-OD1 3.27Å; K587-D617 WeakPolarHBondContact CE-OD1 3.41Å; K587-D617 IonicContact NZ-OD1 3.76Å; K587-D617 PolarHBondContact NZ-OD1 2.78Å
588	A	86.4	Confident	85.6	Confident	76 Å²	76	52.7 Å²	52.7	63%	0.628	30%	0.298	S	S	*	.	H	α-helix	trans	-61.5	-38.8	176.6	0	0	0	0	0	112.9	S586 D592	S586-A588 PolarHBondContact O-N 2.82Å; A588-D592 PolarHBondContact O-N 3.1Å; A588-D592 VanDerWaalsContact O-N 3.08Å
589	S	85	Confident	84.5	Confident	31 Å²	31	59.8 Å²	59.8	22%	0.217	32%	0.324	C	S	.	.	H	α-helix	trans	-67.8	-41.6	175.6	-176.5	0	0	0	0	111.2	E172 S586 K587 Q593	E172-S589 WeakPolarHBondContact OE2-CB 3.5Å; E172-S589 PolarHBondContact OE2-OG 3.04Å; S586-S589 WeakPolarHBondContact O-CB 2.98Å; S586-S589 PolarHBondContact O-N 3.25Å; S586-S589 WeakPolarHBondContact OG-CB 3.4Å; S586-S589 PolarHBondContact OG-N 2.78Å; K587-S589 VanDerWaalsContact C-N 3.33Å; K587-S589 PolarHBondContact O-N 3.13Å; S589-Q593 WeakPolarHBondContact O-CB 3.35Å; S589-Q593 VanDerWaalsContact O-CG 3.26Å; S589-Q593 WeakPolarHBondContact O-CG 3.11Å; S589-Q593 PolarHBondContact O-N 3.46Å
590	V	82.6	Confident	83.4	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-58.9	-50.3	175.2	-179.5	0	0	0	0	111.1	I585 S586 K587 Q593 M594 W607 P619	I585-V590 HydrophobicContact CB-CG2 4.2Å; I585-V590 HydrophobicContact CG2-CG2 3.68Å; S586-V590 WeakPolarHBondContact O-CG2 3.18Å; S586-V590 PolarHBondContact O-N 2.91Å; K587-V590 WeakPolarHBondContact O-CB 3.04Å; K587-V590 PolarHBondContact O-N 2.81Å; V590-Q593 PolarHBondContact O-N 3.17Å; V590-M594 HydrophobicContact CG1-CG 4.17Å; V590-M594 WeakPolarHBondContact O-CB 3.43Å; V590-M594 VanDerWaalsContact O-CG 3.24Å; V590-M594 WeakPolarHBondContact O-CG 3.32Å; V590-M594 PolarHBondContact O-N 2.87Å; V590-W607 HydrophobicContact CG1-CZ3 4.41Å; V590-W607 HydrophobicContact CG2-CH2 4.37Å; V590-P619 HydrophobicContact CG1-CG 4.18Å; V590-P619 HydrophobicContact CG2-CB 3.66Å; V590-P619 HydrophobicContact CG2-CG 4.08Å
591	D	85.4	Confident	82.3	Confident	89 Å²	89	65.1 Å²	65.1	48%	0.476	36%	0.361	S	S	.	.	H	α-helix	trans	-66	-42	-177.5	-68.1	-24	0	0	0	112.1	K587 S595	K587-D591 PolarHBondContact O-N 2.88Å; D591-S595 VanDerWaalsContact O-CB 3.32Å; D591-S595 WeakPolarHBondContact O-CB 3.39Å; D591-S595 PolarHBondContact O-N 3.48Å; D591-S595 PolarHBondContact O-OG 3.31Å
592	D	85.5	Confident	81.4	Confident	60 Å²	60	66.1 Å²	66.1	32%	0.321	37%	0.374	S	S	.	.	H	α-helix	trans	-63.8	-43.6	176.4	-176	60.4	0	0	0	111.6	A588 S595 R596	A588-D592 PolarHBondContact O-N 3.1Å; A588-D592 VanDerWaalsContact O-N 3.08Å; D592-S595 PolarHBondContact O-OG 2.99Å; D592-R596 VanDerWaalsContact CG-CZ 3.46Å; D592-R596 VanDerWaalsContact O-CG 3.3Å; D592-R596 WeakPolarHBondContact O-CG 2.99Å; D592-R596 PolarHBondContact O-N 3.14Å; D592-R596 IonicContact OD1-CZ 3.02Å; D592-R596 IonicContact OD1-NE 3.77Å; D592-R596 PolarHBondContact OD1-NE 2.97Å; D592-R596 IonicContact OD1-NH2 2.95Å; D592-R596 PolarHBondContact OD1-NH2 3.41Å; D592-R596 IonicContact OD2-CZ 2.8Å; D592-R596 IonicContact OD2-NE 3.38Å; D592-R596 PolarHBondContact OD2-NE 3.05Å; D592-R596 IonicContact OD2-NH1 3.74Å; D592-R596 PolarHBondContact OD2-NH1 3.3Å; D592-R596 IonicContact OD2-NH2 3.73Å; D592-R596 PolarHBondContact OD2-NH2 3.49Å
593	Q	82.9	Confident	81	Confident	45 Å²	45	66.4 Å²	66.4	21%	0.21	38%	0.375	C	S	.	.	H	α-helix	trans	-72.4	-40.1	-179.5	-66.7	-67.1	-15.7	0	0	112.7	S589 V590 S595 R596 G597 K598 P600 W607	S589-Q593 WeakPolarHBondContact O-CB 3.35Å; S589-Q593 VanDerWaalsContact O-CG 3.26Å; S589-Q593 WeakPolarHBondContact O-CG 3.11Å; S589-Q593 PolarHBondContact O-N 3.46Å; V590-Q593 PolarHBondContact O-N 3.17Å; Q593-S595 VanDerWaalsContact C-N 3.33Å; Q593-R596 PolarHBondContact O-N 2.87Å; Q593-G597 PolarHBondContact O-N 3.02Å; Q593-K598 PolarHBondContact O-N 3.23Å; Q593-P600 HydrophobicContact CB-CG 4.47Å; Q593-P600 HydrophobicContact CG-CG 3.93Å; Q593-W607 HydrophobicContact CB-CH2 3.61Å; Q593-W607 HydrophobicContact CB-CZ3 3.76Å; Q593-W607 HydrophobicContact CG-CH2 3.85Å; Q593-W607 HydrophobicContact CG-CZ2 4.4Å; Q593-W607 HydrophobicContact CG-CZ3 4.49Å
594	M	79.4	Confident	81	Confident	65 Å²	65	69.5 Å²	69.5	32%	0.32	39%	0.391	S	S	.	.	H	α-helix	trans	-60.3	-43.9	174.2	-80.2	-92	-92.8	0	0	110.8	V590 R596 G597 A610	V590-M594 HydrophobicContact CG1-CG 4.17Å; V590-M594 WeakPolarHBondContact O-CB 3.43Å; V590-M594 VanDerWaalsContact O-CG 3.24Å; V590-M594 WeakPolarHBondContact O-CG 3.32Å; V590-M594 PolarHBondContact O-N 2.87Å; M594-R596 VanDerWaalsContact C-N 3.26Å; M594-R596 PolarHBondContact O-N 3.47Å; M594-G597 PolarHBondContact O-N 3.03Å; M594-G597 VanDerWaalsContact O-N 3.17Å; M594-A610 WeakPolarHBondContact CE-O 3.23Å
595	S	83.2	Confident	81.3	Confident	95 Å²	95	65.3 Å²	65.3	66%	0.664	37%	0.368	S	S	*	.	H	α-helix	trans	-62.7	-32.2	177.2	76.6	0	0	0	0	113.1	D591 D592 Q593	D591-S595 VanDerWaalsContact O-CB 3.32Å; D591-S595 WeakPolarHBondContact O-CB 3.39Å; D591-S595 PolarHBondContact O-N 3.48Å; D591-S595 PolarHBondContact O-OG 3.31Å; D592-S595 PolarHBondContact O-OG 2.99Å; Q593-S595 VanDerWaalsContact C-N 3.33Å
596	R	81.6	Confident	81.6	Confident	150 Å²	150	65 Å²	65	57%	0.566	37%	0.367	S	S	*	.	H	α-helix	trans	-86.9	-8	179.1	-67.7	173.6	-172.8	-173.5	4.2	113.7	D592 Q593 M594 K598	D592-R596 VanDerWaalsContact CG-CZ 3.46Å; D592-R596 VanDerWaalsContact O-CG 3.3Å; D592-R596 WeakPolarHBondContact O-CG 2.99Å; D592-R596 PolarHBondContact O-N 3.14Å; D592-R596 IonicContact OD1-CZ 3.02Å; D592-R596 IonicContact OD1-NE 3.77Å; D592-R596 PolarHBondContact OD1-NE 2.97Å; D592-R596 IonicContact OD1-NH2 2.95Å; D592-R596 PolarHBondContact OD1-NH2 3.41Å; D592-R596 IonicContact OD2-CZ 2.8Å; D592-R596 IonicContact OD2-NE 3.38Å; D592-R596 PolarHBondContact OD2-NE 3.05Å; D592-R596 IonicContact OD2-NH1 3.74Å; D592-R596 PolarHBondContact OD2-NH1 3.3Å; D592-R596 IonicContact OD2-NH2 3.73Å; D592-R596 PolarHBondContact OD2-NH2 3.49Å; Q593-R596 PolarHBondContact O-N 2.87Å; M594-R596 VanDerWaalsContact C-N 3.26Å; M594-R596 PolarHBondContact O-N 3.47Å; R596-K598 HydrophobicContact CB-CG 4.42Å; R596-K598 PolarHBondContact O-N 3.03Å; R596-K598 VanDerWaalsContact O-N 3.13Å
597	G	75.9	Confident	81.8	Confident	70 Å²	70	63.4 Å²	63.4	72%	0.722	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	20.6	-174.8	0	0	0	0	0	113.9	Q593 M594	Q593-G597 PolarHBondContact O-N 3.02Å; M594-G597 PolarHBondContact O-N 3.03Å; M594-G597 VanDerWaalsContact O-N 3.17Å
598	K	71.4	Confident	82.1	Confident	137 Å²	137	58.4 Å²	58.4	60%	0.596	33%	0.332	S	S	*	.			trans	-93.6	134.5	179.6	-77.5	-177.2	-179.7	175.6	0	109.1	Q593 R596 P600	Q593-K598 PolarHBondContact O-N 3.23Å; R596-K598 HydrophobicContact CB-CG 4.42Å; R596-K598 PolarHBondContact O-N 3.03Å; R596-K598 VanDerWaalsContact O-N 3.13Å; K598-P600 WeakPolarHBondContact O-CD 3.46Å
599	R	69.8	Low	82.3	Confident	148 Å²	148	54.8 Å²	54.8	56%	0.558	30%	0.302	S	S	*	.			trans	-94	113.8	169.6	-68.6	-176.8	-177.9	171.1	0.7	108.5
600	P	72.4	Confident	82.6	Confident	45 Å²	45	53.3 Å²	53.3	29%	0.292	29%	0.292	S	S	.	.			trans	-58.8	158.8	170.3	-22.7	35.5	0	0	0	111.2	Q593 K598 W607	Q593-P600 HydrophobicContact CB-CG 4.47Å; Q593-P600 HydrophobicContact CG-CG 3.93Å; K598-P600 WeakPolarHBondContact O-CD 3.46Å; P600-W607 HydrophobicContact CB-CZ2 4.5Å; P600-W607 HydrophobicContact CG-CD2 4.23Å; P600-W607 HydrophobicContact CG-CH2 4.18Å; P600-W607 HydrophobicContact CG-CZ2 3.56Å
601	S	68.7	Low	82.8	Confident	74 Å²	74	57.6 Å²	57.6	52%	0.517	31%	0.312	S	S	.	.	S	Bend	trans	-84.6	121.8	172.2	-55.6	0	0	0	0	108.1
602	G	74.7	Confident	83.1	Confident	32 Å²	32	55.8 Å²	55.8	33%	0.33	30%	0.3	S	S	.	.	S	Bend	trans	117.1	174.6	-171	0	0	0	0	0	111.3	L604	G602-L604 PolarHBondContact O-N 3.47Å
603	D	83.1	Confident	83.3	Confident	9 Å²	9	54.8 Å²	54.8	5%	0.048	29%	0.294	C	S	.	.			trans	43.8	58	172.4	-58.9	-49.1	0	0	0	114.7	T171 E582 G583 I585 I605 P606 W607	T171-D603 WeakPolarHBondContact CG2-OD1 3.26Å; T171-D603 WeakPolarHBondContact CG2-OD2 3.36Å; E582-D603 VanDerWaalsContact CA-OD1 3.31Å; E582-D603 WeakPolarHBondContact CA-OD1 3.39Å; E582-D603 WeakPolarHBondContact CB-OD1 2.79Å; G583-D603 PolarHBondContact N-OD1 2.98Å; I585-D603 HydrophobicContact CD1-CB 3.92Å; D603-I605 PolarHBondContact O-N 2.71Å; D603-P606 HydrophobicContact CB-CB 4.25Å; D603-P606 HydrophobicContact CB-CG 4.1Å; D603-P606 WeakPolarHBondContact O-CD 3.12Å; D603-W607 PolarHBondContact O-N 3.05Å
604	L	89.2	Confident	83.5	Confident	69 Å²	69	60.5 Å²	60.5	36%	0.361	32%	0.32	S	S	.	.	H	α-helix	trans	-59.7	-45.6	-170.9	178	66.8	0	0	0	112.1	E582 G602 T608 C712	E582-L604 PolarHBondContact OE1-N 3.33Å; E582-L604 PolarHBondContact OE2-N 3.41Å; G602-L604 PolarHBondContact O-N 3.47Å; L604-T608 VanDerWaalsContact O-CB 3.23Å; L604-T608 WeakPolarHBondContact O-CB 3.2Å; L604-T608 PolarHBondContact O-N 3.09Å; L604-T608 VanDerWaalsContact O-N 3.11Å; L604-T608 PolarHBondContact O-OG1 2.78Å; L604-C712 HydrophobicContact CD2-CB 4.26Å
605	I	93.2	Very high	84	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-71.2	-52.7	-175.9	-67.6	172.7	0	0	0	110.6	E582 D603 W607 T608 L609 F618 R625 W708 I747 I749	E582-I605 PolarHBondContact OE2-N 3.33Å; D603-I605 PolarHBondContact O-N 2.71Å; I605-W607 PolarHBondContact O-N 3.05Å; I605-T608 PolarHBondContact O-N 3.19Å; I605-T608 VanDerWaalsContact O-N 3.17Å; I605-L609 HydrophobicContact CG2-CD1 3.87Å; I605-L609 HydrophobicContact CG2-CG 4.13Å; I605-L609 WeakPolarHBondContact O-CG 3.47Å; I605-L609 PolarHBondContact O-N 3.38Å; I605-F618 HydrophobicContact CG2-CE1 4.11Å; I605-F618 HydrophobicContact CG2-CZ 4.22Å; I605-R625 HydrophobicContact CD1-CB 3.92Å; I605-R625 HydrophobicContact CD1-CG 3.73Å; I605-W708 HydrophobicContact CB-CH2 3.74Å; I605-W708 HydrophobicContact CB-CZ2 4.47Å; I605-W708 HydrophobicContact CB-CZ3 4.23Å; I605-W708 HydrophobicContact CD1-CH2 3.95Å; I605-W708 HydrophobicContact CD1-CZ3 3.68Å; I605-W708 HydrophobicContact CG1-CH2 4.44Å; I605-W708 HydrophobicContact CG2-CH2 3.67Å; I605-W708 HydrophobicContact CG2-CZ2 4.17Å; I605-W708 HydrophobicContact CG2-CZ3 3.93Å; I605-I747 HydrophobicContact CD1-CG2 4.23Å; I605-I747 HydrophobicContact CG1-CD1 4.47Å; I605-I747 HydrophobicContact CG1-CG2 4.07Å; I605-I747 HydrophobicContact CG2-CG2 4.38Å; I605-I749 HydrophobicContact CG2-CD1 3.93Å
606	P	92.1	Very high	84.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-48.2	-53.1	175.7	-32.6	37.7	0	0	0	113.8	E582 I585 D603 T608 L609 A610 P619 W708	E582-P606 HydrophobicContact CB-CG 4.12Å; E582-P606 WeakPolarHBondContact OE2-CD 3.47Å; I585-P606 HydrophobicContact CD1-CB 3.96Å; D603-P606 HydrophobicContact CB-CB 4.25Å; D603-P606 HydrophobicContact CB-CG 4.1Å; D603-P606 WeakPolarHBondContact O-CD 3.12Å; P606-T608 PolarHBondContact O-N 3Å; P606-L609 PolarHBondContact O-N 3.39Å; P606-A610 VanDerWaalsContact O-CB 3.23Å; P606-A610 WeakPolarHBondContact O-CB 3.46Å; P606-A610 PolarHBondContact O-N 2.97Å; P606-P619 HydrophobicContact CB-CB 4.15Å; P606-W708 HydrophobicContact CG-CZ2 4.18Å
607	W	90	Very high	84.5	Confident	20 Å²	20	53.9 Å²	53.9	8%	0.076	29%	0.293	C	S	.	.	H	α-helix	trans	-68.2	-35.8	-178.5	-71	117.5	0	0	0	113.3	I585 V590 Q593 P600 D603 I605 Q611	I585-W607 HydrophobicContact CD1-CZ2 4.13Å; I585-W607 HydrophobicContact CG2-CZ2 4.19Å; V590-W607 HydrophobicContact CG1-CZ3 4.41Å; V590-W607 HydrophobicContact CG2-CH2 4.37Å; Q593-W607 HydrophobicContact CB-CH2 3.61Å; Q593-W607 HydrophobicContact CB-CZ3 3.76Å; Q593-W607 HydrophobicContact CG-CH2 3.85Å; Q593-W607 HydrophobicContact CG-CZ2 4.4Å; Q593-W607 HydrophobicContact CG-CZ3 4.49Å; P600-W607 HydrophobicContact CB-CZ2 4.5Å; P600-W607 HydrophobicContact CG-CD2 4.23Å; P600-W607 HydrophobicContact CG-CH2 4.18Å; P600-W607 HydrophobicContact CG-CZ2 3.56Å; D603-W607 PolarHBondContact O-N 3.05Å; I605-W607 PolarHBondContact O-N 3.05Å; W607-Q611 WeakPolarHBondContact O-CB 3.49Å; W607-Q611 PolarHBondContact O-N 2.91Å; W607-Q611 VanDerWaalsContact O-N 3.12Å
608	T	91.3	Very high	85.2	Confident	12 Å²	12	50.6 Å²	50.6	7%	0.074	26%	0.259	C	S	.	.	H	α-helix	trans	-67.8	-44.1	178.4	-58.2	0	0	0	0	110.7	L604 I605 P606 Q612 Y732 I747	L604-T608 VanDerWaalsContact O-CB 3.23Å; L604-T608 WeakPolarHBondContact O-CB 3.2Å; L604-T608 PolarHBondContact O-N 3.09Å; L604-T608 VanDerWaalsContact O-N 3.11Å; L604-T608 PolarHBondContact O-OG1 2.78Å; I605-T608 PolarHBondContact O-N 3.19Å; I605-T608 VanDerWaalsContact O-N 3.17Å; P606-T608 PolarHBondContact O-N 3Å; T608-Q612 HydrophobicContact CG2-CG 4.36Å; T608-Q612 WeakPolarHBondContact O-CB 3.28Å; T608-Q612 WeakPolarHBondContact O-CG 3.01Å; T608-Q612 PolarHBondContact O-N 3.4Å; T608-Y732 HydrophobicContact CG2-CD1 3.76Å; T608-Y732 HydrophobicContact CG2-CE1 3.81Å; T608-Y732 HydrophobicContact CG2-CG 4.27Å; T608-I747 HydrophobicContact CG2-CD1 3.74Å
609	L	91.4	Very high	86	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-70.9	-44.4	179.5	-63	-171.2	0	0	0	112	I605 P606 Q611 Q612 F613 F618 V731 I749 Y765	I605-L609 HydrophobicContact CG2-CD1 3.87Å; I605-L609 HydrophobicContact CG2-CG 4.13Å; I605-L609 WeakPolarHBondContact O-CG 3.47Å; I605-L609 PolarHBondContact O-N 3.38Å; P606-L609 PolarHBondContact O-N 3.39Å; L609-Q611 PolarHBondContact O-N 2.73Å; L609-Q612 PolarHBondContact O-N 3.23Å; L609-F613 HydrophobicContact CB-CD2 4.29Å; L609-F613 HydrophobicContact CD2-CD2 4.2Å; L609-F613 HydrophobicContact CD2-CE2 3.83Å; L609-F613 WeakPolarHBondContact O-CD2 3.09Å; L609-F613 PolarHBondContact O-N 3.37Å; L609-F618 HydrophobicContact CB-CD1 3.88Å; L609-F618 HydrophobicContact CB-CE1 4.08Å; L609-F618 HydrophobicContact CB-CG 4.45Å; L609-F618 HydrophobicContact CD1-CD1 3.82Å; L609-F618 HydrophobicContact CD1-CD2 4.2Å; L609-F618 HydrophobicContact CD1-CE1 3.3Å; L609-F618 HydrophobicContact CD1-CE2 3.73Å; L609-F618 HydrophobicContact CD1-CG 4.26Å; L609-F618 HydrophobicContact CD1-CZ 3.26Å; L609-F618 HydrophobicContact CG-CD1 4.4Å; L609-F618 HydrophobicContact CG-CE1 4.1Å; L609-F618 HydrophobicContact CG-CZ 4.47Å; L609-V731 HydrophobicContact CD1-CG1 4.44Å; L609-V731 HydrophobicContact CD2-CB 4.34Å; L609-V731 HydrophobicContact CD2-CG1 3.5Å; L609-V731 VanDerWaalsContact CD2-CG1 3.5Å; L609-I749 HydrophobicContact CD1-CD1 3.23Å; L609-I749 HydrophobicContact CG-CD1 4.36Å; L609-Y765 HydrophobicContact CD1-CD2 4.48Å; L609-Y765 HydrophobicContact CD1-CE2 4.1Å
610	A	90	Very high	87	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-53.4	-42.7	174.9	0	0	0	0	0	111.4	M594 P606 Q614 D615 P619	M594-A610 WeakPolarHBondContact CE-O 3.23Å; P606-A610 VanDerWaalsContact O-CB 3.23Å; P606-A610 WeakPolarHBondContact O-CB 3.46Å; P606-A610 PolarHBondContact O-N 2.97Å; A610-Q614 WeakPolarHBondContact O-CA 3.42Å; A610-Q614 PolarHBondContact O-N 3.03Å; A610-D615 WeakPolarHBondContact CA-O 3.31Å; A610-D615 WeakPolarHBondContact CB-O 3.42Å; A610-D615 PolarHBondContact O-N 3.46Å; A610-P619 HydrophobicContact CB-CG 3.61Å
611	Q	88.3	Confident	87.8	Confident	89 Å²	89	38.6 Å²	38.6	42%	0.416	22%	0.217	S	C	.	.	H	α-helix	trans	-72.1	-38.4	177.5	-173.1	175.2	5.9	0	0	113.6	W607 L609	W607-Q611 WeakPolarHBondContact O-CB 3.49Å; W607-Q611 PolarHBondContact O-N 2.91Å; W607-Q611 VanDerWaalsContact O-N 3.12Å; L609-Q611 PolarHBondContact O-N 2.73Å
612	Q	90.2	Very high	88.9	Confident	51 Å²	51	36 Å²	36	24%	0.238	20%	0.198	C	C	.	.	H	α-helix	trans	-76.3	-33.3	-175.6	-71.5	-61.4	-41.9	0	0	113.2	T608 L609 Y732 R772	T608-Q612 HydrophobicContact CG2-CG 4.36Å; T608-Q612 WeakPolarHBondContact O-CB 3.28Å; T608-Q612 WeakPolarHBondContact O-CG 3.01Å; T608-Q612 PolarHBondContact O-N 3.4Å; L609-Q612 PolarHBondContact O-N 3.23Å; Q612-Y732 VanDerWaalsContact CD-CE2 3.41Å; Q612-Y732 HydrophobicContact CG-CD2 3.72Å; Q612-Y732 HydrophobicContact CG-CE2 3.66Å; Q612-Y732 HydrophobicContact CG-CG 4.49Å; Q612-R772 PolarHBondContact O-NH1 3.19Å; Q612-R772 PolarHBondContact O-NH2 3.08Å
613	F	91.1	Very high	89.8	Confident	40 Å²	40	34.5 Å²	34.5	18%	0.175	18%	0.183	C	C	.	.	H	α-helix	trans	-105	-9	-178.6	-64.2	-77.8	0	0	0	113	L609 D615 V731 Y765 D768	L609-F613 HydrophobicContact CB-CD2 4.29Å; L609-F613 HydrophobicContact CD2-CD2 4.2Å; L609-F613 HydrophobicContact CD2-CE2 3.83Å; L609-F613 WeakPolarHBondContact O-CD2 3.09Å; L609-F613 PolarHBondContact O-N 3.37Å; F613-D615 HydrophobicContact CB-CB 4.14Å; F613-D615 PolarHBondContact O-N 3.12Å; F613-V731 HydrophobicContact CE2-CG1 3.56Å; F613-V731 HydrophobicContact CZ-CG1 3.77Å; F613-Y765 HydrophobicContact CB-CE1 4.11Å; F613-Y765 AromaticContact CD1-CD1 3.91Å; F613-Y765 HydrophobicContact CD1-CD1 3.91Å; F613-Y765 HydrophobicContact CD1-CE1 4.13Å; F613-Y765 HydrophobicContact CD1-CG 4.4Å; F613-Y765 HydrophobicContact CD2-CD1 4.44Å; F613-Y765 HydrophobicContact CD2-CD2 4.31Å; F613-Y765 HydrophobicContact CD2-CE1 4.34Å; F613-Y765 HydrophobicContact CD2-CE2 4.18Å; F613-Y765 HydrophobicContact CD2-CG 4.43Å; F613-Y765 HydrophobicContact CE1-CD1 4.11Å; F613-Y765 HydrophobicContact CE1-CG 4.21Å; F613-Y765 HydrophobicContact CE2-CD2 4.22Å; F613-Y765 HydrophobicContact CE2-CG 4.28Å; F613-Y765 HydrophobicContact CG-CD1 4.09Å; F613-Y765 AromaticContact CG-CE1 3.91Å; F613-Y765 HydrophobicContact CG-CE1 3.91Å; F613-Y765 HydrophobicContact CZ-CD1 4.48Å; F613-Y765 HydrophobicContact CZ-CG 4.15Å; F613-D768 HydrophobicContact CE1-CB 4.06Å; F613-D768 WeakPolarHBondContact CE1-OD2 3.33Å
614	Q	87.8	Confident	90.4	Very high	165 Å²	165	34 Å²	34	77%	0.771	18%	0.18	S	C	*	.			trans	54.8	35.7	-171.8	-63	-176.2	-8.6	0	0	112.5	A610	A610-Q614 WeakPolarHBondContact O-CA 3.42Å; A610-Q614 PolarHBondContact O-N 3.03Å
615	D	87.9	Confident	90.7	Very high	39 Å²	39	32.7 Å²	32.7	21%	0.209	17%	0.171	C	C	.	.			trans	-100.1	118.5	-176.6	-167.6	-18.8	0	0	0	109.8	A610 F613 D617 F618 P619 Y765	A610-D615 WeakPolarHBondContact CA-O 3.31Å; A610-D615 WeakPolarHBondContact CB-O 3.42Å; A610-D615 PolarHBondContact O-N 3.46Å; F613-D615 HydrophobicContact CB-CB 4.14Å; F613-D615 PolarHBondContact O-N 3.12Å; D615-D617 WeakPolarHBondContact OD1-CB 3.34Å; D615-D617 PolarHBondContact OD1-N 2.78Å; D615-F618 PolarHBondContact OD1-N 3.01Å; D615-P619 WeakPolarHBondContact O-CD 3.3Å; D615-Y765 WeakPolarHBondContact CB-OH 3.32Å; D615-Y765 VanDerWaalsContact CG-OH 3.26Å; D615-Y765 PolarHBondContact OD2-OH 2.74Å
616	S	86.3	Confident	90.8	Very high	41 Å²	41	32.9 Å²	32.9	29%	0.287	17%	0.172	S	C	.	.	S	Bend	trans	-88.1	-15.2	178.5	50.1	0	0	0	0	112.9
617	D	88.9	Confident	90.7	Very high	90 Å²	90	34.2 Å²	34.2	48%	0.481	18%	0.18	S	C	.	.	S	Bend	trans	-82.4	-37.8	-179.2	-69.5	-37.7	0	0	0	111.6	K587 D615 G620	K587-D617 VanDerWaalsContact CE-OD1 3.27Å; K587-D617 WeakPolarHBondContact CE-OD1 3.41Å; K587-D617 IonicContact NZ-OD1 3.76Å; K587-D617 PolarHBondContact NZ-OD1 2.78Å; D615-D617 WeakPolarHBondContact OD1-CB 3.34Å; D615-D617 PolarHBondContact OD1-N 2.78Å; D617-G620 PolarHBondContact O-N 3.36Å
618	F	90.9	Very high	90.7	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.009	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-56.7	-44.3	-177.6	-177.6	-87.1	0	0	0	114.4	I605 L609 D615 G620 L621 W708 I749 W761 Y765	I605-F618 HydrophobicContact CG2-CE1 4.11Å; I605-F618 HydrophobicContact CG2-CZ 4.22Å; L609-F618 HydrophobicContact CB-CD1 3.88Å; L609-F618 HydrophobicContact CB-CE1 4.08Å; L609-F618 HydrophobicContact CB-CG 4.45Å; L609-F618 HydrophobicContact CD1-CD1 3.82Å; L609-F618 HydrophobicContact CD1-CD2 4.2Å; L609-F618 HydrophobicContact CD1-CE1 3.3Å; L609-F618 HydrophobicContact CD1-CE2 3.73Å; L609-F618 HydrophobicContact CD1-CG 4.26Å; L609-F618 HydrophobicContact CD1-CZ 3.26Å; L609-F618 HydrophobicContact CG-CD1 4.4Å; L609-F618 HydrophobicContact CG-CE1 4.1Å; L609-F618 HydrophobicContact CG-CZ 4.47Å; D615-F618 PolarHBondContact OD1-N 3.01Å; F618-G620 PolarHBondContact O-N 3.1Å; F618-L621 HydrophobicContact CD2-CD1 4.03Å; F618-L621 HydrophobicContact CE2-CD1 4.4Å; F618-L621 WeakPolarHBondContact O-CB 3.02Å; F618-L621 PolarHBondContact O-N 3.09Å; F618-W708 HydrophobicContact CE1-CZ2 4.37Å; F618-W708 HydrophobicContact CZ-CD2 4.12Å; F618-W708 AromaticContact CZ-CE2 3.73Å; F618-W708 HydrophobicContact CZ-CG 4.35Å; F618-W708 HydrophobicContact CZ-CZ2 4.19Å; F618-W708 AromaticContact CZ-NE1 3.7Å; F618-I749 HydrophobicContact CZ-CD1 4.17Å; F618-W761 HydrophobicContact CD2-CE3 4.1Å; F618-W761 HydrophobicContact CD2-CH2 4.35Å; F618-W761 AromaticContact CD2-CZ3 3.93Å; F618-W761 HydrophobicContact CD2-CZ3 3.93Å; F618-W761 HydrophobicContact CE2-CE3 4.14Å; F618-W761 AromaticContact CE2-CH2 3.65Å; F618-W761 HydrophobicContact CE2-CH2 3.65Å; F618-W761 HydrophobicContact CE2-CZ2 4.39Å; F618-W761 AromaticContact CE2-CZ3 3.5Å; F618-W761 HydrophobicContact CE2-CZ3 3.5Å; F618-Y765 WeakPolarHBondContact CB-OH 3.33Å; F618-Y765 AromaticContact CD2-CE2 3.87Å; F618-Y765 HydrophobicContact CD2-CE2 3.87Å; F618-Y765 HydrophobicContact CE2-CE2 4.38Å; F618-Y765 HydrophobicContact CG-CE2 4.33Å
619	P	89.5	Confident	90.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-62.9	-20.8	176.5	-25.5	37.2	0	0	0	115.1	D584 I585 V590 P606 A610 D615 L621	D584-P619 PolarHBondContact N-O 3.02Å; I585-P619 HydrophobicContact CB-CB 4.17Å; I585-P619 WeakPolarHBondContact CB-O 3.27Å; I585-P619 HydrophobicContact CD1-CB 4.22Å; I585-P619 PolarHBondContact N-O 3.19Å; V590-P619 HydrophobicContact CG1-CG 4.18Å; V590-P619 HydrophobicContact CG2-CB 3.66Å; V590-P619 HydrophobicContact CG2-CG 4.08Å; P606-P619 HydrophobicContact CB-CB 4.15Å; A610-P619 HydrophobicContact CB-CG 3.61Å; D615-P619 WeakPolarHBondContact O-CD 3.3Å; P619-L621 VanDerWaalsContact C-N 3.28Å
620	G	89.3	Confident	90.7	Very high	30 Å²	30	36.2 Å²	36.2	31%	0.309	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-76	-14.3	174	0	0	0	0	0	113.5	D617 F618	D617-G620 PolarHBondContact O-N 3.36Å; F618-G620 PolarHBondContact O-N 3.1Å
621	L	91.1	Very high	90.6	Very high	48 Å²	48	37.6 Å²	37.6	25%	0.251	20%	0.196	S	C	.	.	S	Bend	trans	-76.6	141.2	174.7	-61.4	175.3	0	0	0	110.7	G583 D584 F618 P619 D707 W761	G583-L621 WeakPolarHBondContact CA-O 3.25Å; D584-L621 PolarHBondContact N-O 3.11Å; F618-L621 HydrophobicContact CD2-CD1 4.03Å; F618-L621 HydrophobicContact CE2-CD1 4.4Å; F618-L621 WeakPolarHBondContact O-CB 3.02Å; F618-L621 PolarHBondContact O-N 3.09Å; P619-L621 VanDerWaalsContact C-N 3.28Å; L621-D707 HydrophobicContact CB-CB 4.49Å; L621-W761 HydrophobicContact CD1-CZ2 4.48Å
622	S	91.8	Very high	90.4	Very high	19 Å²	19	33.7 Å²	33.7	13%	0.133	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130.9	175.2	-156.9	0	0	0	0	109.8	D584 D707	D584-S622 WeakPolarHBondContact OD1-CB 3.39Å; D584-S622 VanDerWaalsContact OD2-CB 3.23Å; D584-S622 WeakPolarHBondContact OD2-CB 3.46Å; D584-S622 PolarHBondContact OD2-OG 2.89Å; S622-D707 PolarHBondContact N-OD2 2.69Å; S622-D707 WeakPolarHBondContact O-CB 3.5Å; S622-D707 PolarHBondContact O-N 3.19Å
623	G	93.1	Very high	89.8	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	-179.7	178.2	0	0	0	0	0	113.3	E582 W708	E582-G623 PolarHBondContact N-O 3.37Å; E582-G623 CarbonylContact O-C 3.58Å; E582-G623 WeakPolarHBondContact O-CA 3.4Å; E582-G623 PolarHBondContact O-N 3.14Å; G623-W708 VanDerWaalsContact CA-O 3.22Å; G623-W708 WeakPolarHBondContact CA-O 3.42Å
624	A	94.3	Very high	89.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	135.4	176	0	0	0	0	0	112	V579 C580 L581 L706 W708 L709 G710	V579-A624 HydrophobicContact CG1-CB 3.56Å; C580-A624 CarbonylContact O-C 3.59Å; C580-A624 WeakPolarHBondContact O-CA 3.48Å; L581-A624 HydrophobicContact CD2-CB 3.86Å; A624-L706 HydrophobicContact CB-CD1 3.41Å; A624-L706 VanDerWaalsContact CB-CD1 3.41Å; A624-L706 HydrophobicContact CB-CD2 4.45Å; A624-W708 PolarHBondContact N-O 3.36Å; A624-L709 HydrophobicContact CB-CD1 3.95Å; A624-L709 CarbonylContact O-C 3.58Å; A624-L709 WeakPolarHBondContact O-CA 3.35Å; A624-G710 PolarHBondContact O-N 2.87Å
625	R	95.3	Very high	88.9	Confident	41 Å²	41	28.9 Å²	28.9	16%	0.155	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	121.2	173.8	-179.7	168.3	57	121	-1.2	110	V579 C580 E582 I605 V627 G710	V579-R625 CarbonylContact C-O 3.53Å; V579-R625 WeakPolarHBondContact CA-O 3.3Å; C580-R625 PolarHBondContact N-O 2.94Å; C580-R625 PolarHBondContact O-N 3.43Å; E582-R625 HydrophobicContact CG-CB 4.36Å; E582-R625 IonicContact OE1-CZ 2.85Å; E582-R625 IonicContact OE1-NE 2.72Å; E582-R625 PolarHBondContact OE1-NE 3.49Å; E582-R625 IonicContact OE1-NH2 3.02Å; E582-R625 PolarHBondContact OE1-NH2 3.06Å; E582-R625 IonicContact OE2-NE 2.9Å; I605-R625 HydrophobicContact CD1-CB 3.92Å; I605-R625 HydrophobicContact CD1-CG 3.73Å; R625-V627 PolarHBondContact O-N 3.39Å; R625-G710 CarbonylContact C-O 3.55Å; R625-G710 VanDerWaalsContact CA-O 3.29Å; R625-G710 WeakPolarHBondContact CA-O 3.28Å
626	I	95.5	Very high	88.6	Confident	4 Å²	4	31 Å²	31	2%	0.021	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	105.5	161.8	-52.8	175.4	0	0	0	107.1	I577 Q578 I629 L648 L709 G710 V711 W723	I577-I626 HydrophobicContact CG2-CG2 3.9Å; Q578-I626 CarbonylContact O-C 3.58Å; I626-I629 HydrophobicContact CG2-CD1 4.01Å; I626-I629 HydrophobicContact CG2-CG1 3.59Å; I626-L648 HydrophobicContact CD1-CD2 3.88Å; I626-L648 HydrophobicContact CG1-CD2 4.03Å; I626-L709 HydrophobicContact CD1-CD2 3.86Å; I626-L709 HydrophobicContact CD1-CG 4.31Å; I626-L709 HydrophobicContact CG1-CD1 4.46Å; I626-L709 HydrophobicContact CG1-CD2 4.33Å; I626-L709 HydrophobicContact CG1-CG 4.3Å; I626-G710 PolarHBondContact N-O 3.44Å; I626-V711 HydrophobicContact CB-CG1 4.07Å; I626-V711 HydrophobicContact CD1-CG1 4.09Å; I626-V711 HydrophobicContact CG1-CG1 4.33Å; I626-W723 HydrophobicContact CD1-CH2 4.05Å; I626-W723 HydrophobicContact CD1-CZ3 4.23Å
627	V	91.8	Very high	88.4	Confident	28 Å²	28	36.9 Å²	36.9	17%	0.17	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	-43.9	-178.3	-173.5	0	0	0	0	109.8	Q578 C580 R625	Q578-V627 HydrophobicContact CB-CB 4.49Å; Q578-V627 HydrophobicContact CG-CB 4.17Å; Q578-V627 PolarHBondContact O-N 2.88Å; C580-V627 HydrophobicContact CB-CG2 3.51Å; R625-V627 PolarHBondContact O-N 3.39Å
628	R	89.6	Confident	88.4	Confident	38 Å²	38	36.7 Å²	36.7	14%	0.143	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	145.9	-177.6	-69.2	-172.9	-178.7	173.3	10.4	111.5	Y533 H537 N540 D544 Q578	Y533-R628 VanDerWaalsContact CE1-CD 3.42Å; Y533-R628 VanDerWaalsContact CE1-NH1 3.3Å; Y533-R628 HydrophobicContact CE2-CB 4.28Å; Y533-R628 WeakPolarHBondContact OH-CB 3.46Å; Y533-R628 WeakPolarHBondContact OH-CD 3.35Å; H537-R628 WeakPolarHBondContact NE2-CB 3Å; H537-R628 WeakPolarHBondContact NE2-CD 3.49Å; H537-R628 VanDerWaalsContact NE2-CG 3.35Å; H537-R628 WeakPolarHBondContact NE2-CG 3.43Å; N540-R628 PolarHBondContact OD1-NH1 2.78Å; D544-R628 IonicContact OD1-NH2 3.34Å; D544-R628 IonicContact OD2-CZ 3.89Å; D544-R628 IonicContact OD2-NH1 2.83Å; D544-R628 PolarHBondContact OD2-NH1 2.57Å; D544-R628 IonicContact OD2-NH2 3.75Å; D544-R628 PolarHBondContact OD2-NH2 3.08Å; Q578-R628 HydrophobicContact CB-CB 4.33Å; Q578-R628 PolarHBondContact N-O 2.87Å; Q578-R628 PolarHBondContact O-N 3.29Å
629	I	91.8	Very high	88.4	Confident	35 Å²	35	38.1 Å²	38.1	18%	0.179	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.5	166.2	-60.3	-178.7	0	0	0	106.7	V576 I577 I626 V645 F722 W723	V576-I629 WeakPolarHBondContact O-CA 3.31Å; I577-I629 HydrophobicContact CG1-CG1 4.31Å; I577-I629 HydrophobicContact CG1-CG2 4.5Å; I577-I629 HydrophobicContact CG2-CG1 4.43Å; I626-I629 HydrophobicContact CG2-CD1 4.01Å; I626-I629 HydrophobicContact CG2-CG1 3.59Å; I629-V645 HydrophobicContact CD1-CG2 3.32Å; I629-F722 HydrophobicContact CD1-CE1 4.23Å; I629-F722 HydrophobicContact CD1-CZ 4.43Å; I629-W723 HydrophobicContact CD1-CH2 3.3Å; I629-W723 HydrophobicContact CD1-CZ2 3.8Å; I629-W723 HydrophobicContact CD1-CZ3 4.21Å; I629-W723 HydrophobicContact CG1-CH2 4.35Å
630	A	89.8	Confident	88.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	110.8	179	0	0	0	0	0	109.1	I532 Y533 A536 C575 V576	I532-A630 HydrophobicContact CG2-CB 3.88Å; Y533-A630 HydrophobicContact CD2-CB 4.16Å; A536-A630 HydrophobicContact CB-CB 3.54Å; C575-A630 CarbonylContact C-O 3.56Å; C575-A630 VanDerWaalsContact CA-O 3.26Å; C575-A630 WeakPolarHBondContact CA-O 3.45Å; C575-A630 PolarHBondContact SG-O 2.88Å; C575-A630 VanDerWaalsContact SG-O 3.37Å; V576-A630 HydrophobicContact CB-CB 4.49Å; V576-A630 PolarHBondContact N-O 2.99Å; V576-A630 PolarHBondContact O-N 3.05Å
631	T	88.3	Confident	88.7	Confident	29 Å²	29	37.1 Å²	37.1	18%	0.178	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	144.1	168.6	51.3	0	0	0	0	109.1	C575	C575-T631 HydrophobicContact CB-CG2 4.15Å
632	H	84.3	Confident	88.8	Confident	8 Å²	8	35.9 Å²	35.9	4%	0.037	20%	0.197	C	C	.	.			trans	-53.1	136.2	171.7	-166.2	-91.6	0	0	0	110.7	L574 D634 Y635 Q636	L574-H632 PolarHBondContact O-N 3.02Å; H632-D634 VanDerWaalsContact C-N 3.27Å; H632-D634 IonicContact CE1-OD2 2.73Å; H632-D634 PolarHBondContact CE1-OD2 3.32Å; H632-D634 VanDerWaalsContact CE1-OD2 3.31Å; H632-D634 PolarHBondContact ND1-N 2.88Å; H632-D634 IonicContact ND1-OD2 3.48Å; H632-D634 PolarHBondContact O-N 2.83Å; H632-Y635 HydrophobicContact CB-CD2 3.47Å; H632-Y635 VanDerWaalsContact CB-CD2 3.47Å; H632-Y635 HydrophobicContact CB-CE2 4.13Å; H632-Y635 HydrophobicContact CB-CG 4.27Å; H632-Y635 AromaticContact CG-CD2 3.88Å; H632-Y635 AromaticContact ND1-CD2 3.98Å; H632-Y635 PolarHBondContact O-N 3.3Å; H632-Q636 PolarHBondContact O-N 3.36Å
633	P	76.9	Confident	88.9	Confident	48 Å²	48	37 Å²	37	31%	0.312	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-53.6	-41.2	-177.3	-28.3	35.6	0	0	0	114.1	A535 Y635 Q636	A535-P633 HydrophobicContact CB-CG 3.64Å; P633-Y635 VanDerWaalsContact C-N 3.26Å; P633-Y635 PolarHBondContact O-N 2.86Å; P633-Q636 WeakPolarHBondContact O-CG 3.3Å; P633-Q636 PolarHBondContact O-N 3Å
634	D	78.8	Confident	89	Confident	98 Å²	98	37 Å²	37	52%	0.524	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-72.8	-18.5	-177.7	-58.3	-20.4	0	0	0	113.2	V495 H632	V495-D634 HydrophobicContact CG2-CB 3.96Å; H632-D634 VanDerWaalsContact C-N 3.27Å; H632-D634 IonicContact CE1-OD2 2.73Å; H632-D634 PolarHBondContact CE1-OD2 3.32Å; H632-D634 VanDerWaalsContact CE1-OD2 3.31Å; H632-D634 PolarHBondContact ND1-N 2.88Å; H632-D634 IonicContact ND1-OD2 3.48Å; H632-D634 PolarHBondContact O-N 2.83Å
635	Y	82.1	Confident	89	Confident	8 Å²	8	37 Å²	37	3%	0.031	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-104.3	11.3	-179.8	-57.7	-47.1	0	0	0	113	V495 C499 E572 L574 H632 P633 M638 Y640	V495-Y635 HydrophobicContact CG1-CE1 4.11Å; V495-Y635 WeakPolarHBondContact CG1-OH 3.42Å; V495-Y635 HydrophobicContact CG2-CE1 3.78Å; V495-Y635 WeakPolarHBondContact CG2-OH 3.3Å; C499-Y635 HydrophobicContact CB-CE1 4.45Å; E572-Y635 VanDerWaalsContact OE1-CE2 3.28Å; E572-Y635 WeakPolarHBondContact OE1-CE2 3.41Å; E572-Y635 PolarHBondContact OE1-OH 2.87Å; L574-Y635 HydrophobicContact CD2-CD2 3.71Å; L574-Y635 HydrophobicContact CD2-CE2 3.46Å; L574-Y635 VanDerWaalsContact CD2-CE2 3.46Å; H632-Y635 HydrophobicContact CB-CD2 3.47Å; H632-Y635 VanDerWaalsContact CB-CD2 3.47Å; H632-Y635 HydrophobicContact CB-CE2 4.13Å; H632-Y635 HydrophobicContact CB-CG 4.27Å; H632-Y635 AromaticContact CG-CD2 3.88Å; H632-Y635 AromaticContact ND1-CD2 3.98Å; H632-Y635 PolarHBondContact O-N 3.3Å; P633-Y635 VanDerWaalsContact C-N 3.26Å; P633-Y635 PolarHBondContact O-N 2.86Å; Y635-M638 HydrophobicContact CD1-SD 4.13Å; Y635-M638 PolarHBondContact O-N 3.07Å; Y635-Y640 HydrophobicContact CD1-CE2 4.26Å; Y635-Y640 HydrophobicContact CG-CD2 4.45Å; Y635-Y640 HydrophobicContact CG-CE2 4.07Å
636	Q	81.1	Confident	89	Confident	83 Å²	83	38.5 Å²	38.5	39%	0.388	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	149.8	174.8	-70.1	-179	9.9	0	0	110.6	H632 P633 M638	H632-Q636 PolarHBondContact O-N 3.36Å; P633-Q636 WeakPolarHBondContact O-CG 3.3Å; P633-Q636 PolarHBondContact O-N 3Å; Q636-M638 PolarHBondContact O-N 3.36Å; Q636-M638 VanDerWaalsContact O-N 3.09Å
637	N	82.9	Confident	88.9	Confident	165 Å²	165	38.5 Å²	38.5	88%	0.882	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.8	0.6	-177.4	-57	-44.9	0	0	0	117
638	M	88.7	Confident	89	Confident	86 Å²	86	37.1 Å²	37.1	42%	0.424	20%	0.199	S	C	.	.	S	Bend	trans	-87.8	-4.9	176.8	-58.3	-171.9	78.8	0	0	114.5	C499 P502 Y635 Q636 Y640	C499-M638 HydrophobicContact CB-CE 3.85Å; C499-M638 HydrophobicContact CB-SD 4.46Å; C499-M638 WeakPolarHBondContact SG-CE 3.29Å; P502-M638 WeakPolarHBondContact CG-O 3.47Å; Y635-M638 HydrophobicContact CD1-SD 4.13Å; Y635-M638 PolarHBondContact O-N 3.07Å; Q636-M638 PolarHBondContact O-N 3.36Å; Q636-M638 VanDerWaalsContact O-N 3.09Å; M638-Y640 HydrophobicContact CB-CD2 3.85Å; M638-Y640 HydrophobicContact CB-CE2 3.59Å; M638-Y640 HydrophobicContact CG-CE2 4.37Å; M638-Y640 HydrophobicContact SD-CE2 4.04Å
639	G	90.2	Very high	89.2	Confident	32 Å²	32	36.6 Å²	36.6	33%	0.33	20%	0.198	S	C	.	.	S	Bend	trans	96	-0.5	174.2	0	0	0	0	0	116.4	G641 S642 R643	G639-G641 PolarHBondContact O-N 3.17Å; G639-S642 WeakPolarHBondContact O-CA 3.4Å; G639-S642 VanDerWaalsContact O-CB 3.24Å; G639-S642 WeakPolarHBondContact O-CB 3.26Å; G639-S642 PolarHBondContact O-N 2.82Å; G639-R643 PolarHBondContact O-N 2.81Å
640	Y	92.7	Very high	89.2	Confident	3 Å²	3	38.4 Å²	38.4	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-59.2	-43.2	178.8	-61.4	-72.1	0	0	0	113.9	C499 P500 P502 L559 L574 Y635 M638 S642 R643 A644	C499-Y640 WeakPolarHBondContact CB-OH 3.19Å; P500-Y640 PolarHBondContact O-OH 2.93Å; P502-Y640 HydrophobicContact CB-CD1 4.31Å; P502-Y640 HydrophobicContact CB-CE1 4.47Å; P502-Y640 HydrophobicContact CG-CD1 4.29Å; P502-Y640 HydrophobicContact CG-CE1 4.16Å; L559-Y640 HydrophobicContact CD2-CD1 4.03Å; L559-Y640 HydrophobicContact CD2-CG 4.43Å; L574-Y640 HydrophobicContact CD1-CD1 4.08Å; L574-Y640 HydrophobicContact CD1-CE1 3.92Å; Y635-Y640 HydrophobicContact CD1-CE2 4.26Å; Y635-Y640 HydrophobicContact CG-CD2 4.45Å; Y635-Y640 HydrophobicContact CG-CE2 4.07Å; M638-Y640 HydrophobicContact CB-CD2 3.85Å; M638-Y640 HydrophobicContact CB-CE2 3.59Å; M638-Y640 HydrophobicContact CG-CE2 4.37Å; M638-Y640 HydrophobicContact SD-CE2 4.04Å; Y640-S642 PolarHBondContact O-N 2.74Å; Y640-R643 PolarHBondContact O-N 2.88Å; Y640-A644 WeakPolarHBondContact O-CB 3.47Å; Y640-A644 PolarHBondContact O-N 2.93Å
641	G	92.5	Very high	89.3	Confident	6 Å²	6	38.4 Å²	38.4	6%	0.062	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-31.3	174.8	0	0	0	0	0	112.5	G639 V645	G639-G641 PolarHBondContact O-N 3.17Å; G641-V645 WeakPolarHBondContact O-CG2 2.88Å; G641-V645 PolarHBondContact O-N 2.85Å
642	S	93.6	Very high	89.4	Confident	22 Å²	22	37.6 Å²	37.6	15%	0.154	20%	0.199	C	C	.	.	H	α-helix	trans	-69	-42.1	174.8	-83.6	0	0	0	0	112	G639 Y640 E646 F722 K726	G639-S642 WeakPolarHBondContact O-CA 3.4Å; G639-S642 VanDerWaalsContact O-CB 3.24Å; G639-S642 WeakPolarHBondContact O-CB 3.26Å; G639-S642 PolarHBondContact O-N 2.82Å; Y640-S642 PolarHBondContact O-N 2.74Å; S642-E646 WeakPolarHBondContact O-CG 3.17Å; S642-E646 PolarHBondContact O-N 3.48Å; S642-F722 WeakPolarHBondContact OG-CE2 3.14Å; S642-K726 VanDerWaalsContact CB-NZ 3.33Å; S642-K726 WeakPolarHBondContact O-CE 3.29Å; S642-K726 PolarHBondContact O-NZ 3.46Å; S642-K726 VanDerWaalsContact O-NZ 3.11Å; S642-K726 WeakPolarHBondContact OG-CE 3.44Å
643	R	94.5	Very high	89.6	Confident	42 Å²	42	41.3 Å²	41.3	16%	0.158	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-45.7	174.4	175.6	68.8	172.4	151.4	-1.8	111.7	P502 N503 C505 L559 G639 Y640 V645 E646 L647	P502-R643 HydrophobicContact CB-CB 4.36Å; P502-R643 WeakPolarHBondContact O-CD 3.04Å; P502-R643 VanDerWaalsContact O-CG 3.23Å; P502-R643 WeakPolarHBondContact O-CG 3.24Å; P502-R643 PolarHBondContact O-NE 2.88Å; N503-R643 PolarHBondContact O-NH2 2.85Å; C505-R643 PolarHBondContact O-NE 3.09Å; L559-R643 HydrophobicContact CD1-CG 4.24Å; G639-R643 PolarHBondContact O-N 2.81Å; Y640-R643 PolarHBondContact O-N 2.88Å; R643-V645 VanDerWaalsContact C-N 3.32Å; R643-V645 PolarHBondContact O-N 2.9Å; R643-E646 WeakPolarHBondContact O-CB 3.41Å; R643-E646 PolarHBondContact O-N 2.88Å; R643-E646 VanDerWaalsContact O-N 3.15Å; R643-L647 HydrophobicContact CG-CD1 4.06Å; R643-L647 HydrophobicContact CG-CG 4.45Å; R643-L647 PolarHBondContact O-N 3.17Å
644	A	95	Very high	89.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62	-40.4	-176.9	0	0	0	0	0	111.8	L507 L559 C575 I577 Y640 L648	L507-A644 HydrophobicContact CD1-CB 4.2Å; L559-A644 HydrophobicContact CB-CB 4.27Å; L559-A644 HydrophobicContact CD1-CB 4.22Å; L559-A644 HydrophobicContact CD2-CB 4.36Å; C575-A644 HydrophobicContact CB-CB 4.46Å; I577-A644 VanDerWaalsContact CD1-C 3.44Å; I577-A644 HydrophobicContact CD1-CB 3.45Å; I577-A644 VanDerWaalsContact CD1-CB 3.45Å; I577-A644 WeakPolarHBondContact CD1-O 3.35Å; I577-A644 HydrophobicContact CG1-CB 4.12Å; Y640-A644 WeakPolarHBondContact O-CB 3.47Å; Y640-A644 PolarHBondContact O-N 2.93Å; A644-L648 VanDerWaalsContact O-CB 3.31Å; A644-L648 WeakPolarHBondContact O-CB 3.46Å; A644-L648 PolarHBondContact O-N 3.33Å
645	V	94.7	Very high	90.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-68.5	-37.6	174.6	174.5	0	0	0	0	112.2	I577 I629 G641 R643 L648 Q649 F722 W723 F728	I577-V645 HydrophobicContact CD1-CG2 4.23Å; I629-V645 HydrophobicContact CD1-CG2 3.32Å; G641-V645 WeakPolarHBondContact O-CG2 2.88Å; G641-V645 PolarHBondContact O-N 2.85Å; R643-V645 VanDerWaalsContact C-N 3.32Å; R643-V645 PolarHBondContact O-N 2.9Å; V645-L648 PolarHBondContact O-N 3.34Å; V645-Q649 WeakPolarHBondContact O-CB 3.27Å; V645-Q649 PolarHBondContact O-N 3.08Å; V645-F722 HydrophobicContact CG2-CE1 4.44Å; V645-F722 HydrophobicContact CG2-CZ 4.15Å; V645-W723 HydrophobicContact CG1-CZ3 4.28Å; V645-W723 HydrophobicContact CG2-CH2 4.42Å; V645-W723 HydrophobicContact CG2-CZ3 4.26Å; V645-F728 HydrophobicContact CG1-CE2 4.27Å
646	E	94	Very high	89.9	Confident	74 Å²	74	42.4 Å²	42.4	35%	0.346	24%	0.238	S	C	.	.	H	α-helix	trans	-62.7	-47.7	175.7	-77.7	168.9	176.2	0	0	111.9	S642 R643 L648 Q649 Q650 K726	S642-E646 WeakPolarHBondContact O-CG 3.17Å; S642-E646 PolarHBondContact O-N 3.48Å; R643-E646 WeakPolarHBondContact O-CB 3.41Å; R643-E646 PolarHBondContact O-N 2.88Å; R643-E646 VanDerWaalsContact O-N 3.15Å; E646-L648 VanDerWaalsContact C-N 3.33Å; E646-L648 PolarHBondContact O-N 3.31Å; E646-Q649 PolarHBondContact O-N 2.96Å; E646-Q650 WeakPolarHBondContact O-CB 3.33Å; E646-Q650 WeakPolarHBondContact O-CG 3.27Å; E646-Q650 PolarHBondContact O-N 3.4Å; E646-K726 HydrophobicContact CG-CD 4.48Å; E646-K726 IonicContact OE1-NZ 2.7Å; E646-K726 PolarHBondContact OE1-NZ 3.12Å; E646-K726 IonicContact OE2-NZ 2.76Å
647	L	94.2	Very high	89.5	Confident	3 Å²	3	43 Å²	43	2%	0.016	25%	0.25	C	C	.	.	H	α-helix	trans	-62.5	-41.2	177	-74.9	176.2	0	0	0	111.8	L507 L559 R643 Q649 Q650 Y651 F656	L507-L647 HydrophobicContact CB-CB 3.95Å; L507-L647 HydrophobicContact CB-CD1 3.79Å; L507-L647 HydrophobicContact CD2-CB 4.12Å; L559-L647 HydrophobicContact CD1-CD1 4Å; R643-L647 HydrophobicContact CG-CD1 4.06Å; R643-L647 HydrophobicContact CG-CG 4.45Å; R643-L647 PolarHBondContact O-N 3.17Å; L647-Q649 VanDerWaalsContact C-N 3.35Å; L647-Q650 PolarHBondContact O-N 2.86Å; L647-Y651 WeakPolarHBondContact O-CB 3.27Å; L647-Y651 PolarHBondContact O-N 2.95Å; L647-F656 HydrophobicContact CD2-CE2 4.49Å; L647-F656 HydrophobicContact CD2-CZ 3.92Å
648	L	94.2	Very high	88.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-43.7	175.4	-171.7	87.7	0	0	0	111.7	L507 F557 I577 V579 I626 A644 V645 E646 Y651 Y652 L709	L507-L648 HydrophobicContact CD2-CB 4.06Å; L507-L648 HydrophobicContact CD2-CD1 4.12Å; F557-L648 HydrophobicContact CD1-CD1 4.25Å; F557-L648 HydrophobicContact CD2-CD1 3.47Å; F557-L648 VanDerWaalsContact CD2-CD1 3.47Å; F557-L648 HydrophobicContact CE1-CD1 4.31Å; F557-L648 HydrophobicContact CE2-CD1 3.58Å; F557-L648 HydrophobicContact CG-CD1 3.83Å; F557-L648 HydrophobicContact CZ-CD1 4Å; I577-L648 HydrophobicContact CG2-CD2 4.19Å; V579-L648 HydrophobicContact CG2-CD1 3.95Å; V579-L648 HydrophobicContact CG2-CD2 3.86Å; I626-L648 HydrophobicContact CD1-CD2 3.88Å; I626-L648 HydrophobicContact CG1-CD2 4.03Å; A644-L648 VanDerWaalsContact O-CB 3.31Å; A644-L648 WeakPolarHBondContact O-CB 3.46Å; A644-L648 PolarHBondContact O-N 3.33Å; V645-L648 PolarHBondContact O-N 3.34Å; E646-L648 VanDerWaalsContact C-N 3.33Å; E646-L648 PolarHBondContact O-N 3.31Å; L648-Y651 WeakPolarHBondContact O-CB 3.29Å; L648-Y651 PolarHBondContact O-N 3.17Å; L648-Y652 HydrophobicContact CD1-CE2 3.88Å; L648-Y652 HydrophobicContact CD2-CE2 4.33Å; L648-Y652 HydrophobicContact CG-CD2 4.07Å; L648-Y652 HydrophobicContact CG-CE2 3.83Å; L648-Y652 VanDerWaalsContact O-CD2 3.29Å; L648-Y652 WeakPolarHBondContact O-CD2 3.4Å; L648-Y652 PolarHBondContact O-N 2.91Å; L648-Y652 VanDerWaalsContact O-N 3.17Å; L648-L709 HydrophobicContact CD2-CD2 4.24Å
649	Q	92.8	Very high	87.6	Confident	27 Å²	27	39.5 Å²	39.5	13%	0.126	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-48.7	177.4	-176.3	-167.7	-28.7	0	0	110.6	V645 E646 L647 Y651 Y652 E653 K750 L752	V645-Q649 WeakPolarHBondContact O-CB 3.27Å; V645-Q649 PolarHBondContact O-N 3.08Å; E646-Q649 PolarHBondContact O-N 2.96Å; L647-Q649 VanDerWaalsContact C-N 3.35Å; Q649-Y651 PolarHBondContact O-N 3.08Å; Q649-Y652 PolarHBondContact O-N 3.08Å; Q649-E653 HydrophobicContact CG-CG 4.38Å; Q649-E653 VanDerWaalsContact CG-OE1 3.32Å; Q649-E653 WeakPolarHBondContact CG-OE1 3.33Å; Q649-E653 PolarHBondContact NE2-OE1 3.18Å; Q649-E653 WeakPolarHBondContact O-CB 3.19Å; Q649-E653 WeakPolarHBondContact O-CG 3.48Å; Q649-E653 PolarHBondContact O-N 2.88Å; Q649-K750 VanDerWaalsContact NE2-CE 3.28Å; Q649-L752 HydrophobicContact CG-CD2 3.8Å
650	Q	90.9	Very high	86.1	Confident	72 Å²	72	43.6 Å²	43.6	34%	0.336	25%	0.251	S	S	.	.	H	α-helix	trans	-58.5	-36.8	177.1	-74.5	173.9	-4.1	0	0	112.2	E646 L647 E653 G654 A655 F656	E646-Q650 WeakPolarHBondContact O-CB 3.33Å; E646-Q650 WeakPolarHBondContact O-CG 3.27Å; E646-Q650 PolarHBondContact O-N 3.4Å; L647-Q650 PolarHBondContact O-N 2.86Å; Q650-E653 PolarHBondContact O-N 3.21Å; Q650-G654 PolarHBondContact O-N 2.86Å; Q650-A655 HydrophobicContact CB-CB 4.01Å; Q650-A655 VanDerWaalsContact O-CB 3.26Å; Q650-A655 WeakPolarHBondContact O-CB 3.49Å; Q650-A655 PolarHBondContact O-N 3.42Å; Q650-F656 HydrophobicContact CB-CD2 4.43Å; Q650-F656 HydrophobicContact CB-CE2 3.74Å
651	Y	92.1	Very high	84	Confident	1 Å²	1	53 Å²	53	0%	0.004	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-51.7	174.3	175.6	-106	0	0	0	112.5	F557 L647 L648 Q649 E653 G654 L698 R701 R702 A703	F557-Y651 HydrophobicContact CE1-CD1 4.36Å; F557-Y651 HydrophobicContact CE1-CE1 4.21Å; F557-Y651 HydrophobicContact CZ-CD1 4.4Å; F557-Y651 HydrophobicContact CZ-CE1 4.15Å; L647-Y651 WeakPolarHBondContact O-CB 3.27Å; L647-Y651 PolarHBondContact O-N 2.95Å; L648-Y651 WeakPolarHBondContact O-CB 3.29Å; L648-Y651 PolarHBondContact O-N 3.17Å; Q649-Y651 PolarHBondContact O-N 3.08Å; Y651-E653 VanDerWaalsContact C-N 3.32Å; Y651-E653 PolarHBondContact O-N 2.85Å; Y651-G654 PolarHBondContact O-N 2.97Å; Y651-G654 VanDerWaalsContact O-N 3.12Å; Y651-L698 HydrophobicContact CD1-CD2 4.35Å; Y651-L698 HydrophobicContact CD2-CB 4.05Å; Y651-L698 HydrophobicContact CD2-CD2 3.53Å; Y651-L698 HydrophobicContact CD2-CG 4.28Å; Y651-L698 HydrophobicContact CE2-CB 4.43Å; Y651-L698 HydrophobicContact CE2-CD2 3.91Å; Y651-L698 WeakPolarHBondContact CE2-O 3.45Å; Y651-L698 HydrophobicContact CG-CD2 3.76Å; Y651-R701 VanDerWaalsContact OH-CD 3.32Å; Y651-R701 WeakPolarHBondContact OH-CD 3.36Å; Y651-R701 WeakPolarHBondContact OH-CG 3.44Å; Y651-R701 PolarHBondContact OH-O 3.12Å; Y651-R702 PolarHBondContact OH-O 3.05Å; Y651-A703 HydrophobicContact CD1-CB 4.06Å; Y651-A703 HydrophobicContact CD2-CB 4.29Å; Y651-A703 HydrophobicContact CE1-CB 3.66Å; Y651-A703 HydrophobicContact CE2-CB 3.94Å; Y651-A703 HydrophobicContact CG-CB 4.36Å; Y651-A703 WeakPolarHBondContact O-CB 2.88Å; Y651-A703 WeakPolarHBondContact OH-CA 3.39Å; Y651-A703 PolarHBondContact OH-N 3.02Å
652	Y	91.4	Very high	81.8	Confident	12 Å²	12	58.2 Å²	58.2	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-74.7	-19.8	179.2	-68.1	-62	0	0	0	114.2	V579 L648 Q649 G654 A703 L706 L709	V579-Y652 HydrophobicContact CG1-CE2 4.47Å; L648-Y652 HydrophobicContact CD1-CE2 3.88Å; L648-Y652 HydrophobicContact CD2-CE2 4.33Å; L648-Y652 HydrophobicContact CG-CD2 4.07Å; L648-Y652 HydrophobicContact CG-CE2 3.83Å; L648-Y652 VanDerWaalsContact O-CD2 3.29Å; L648-Y652 WeakPolarHBondContact O-CD2 3.4Å; L648-Y652 PolarHBondContact O-N 2.91Å; L648-Y652 VanDerWaalsContact O-N 3.17Å; Q649-Y652 PolarHBondContact O-N 3.08Å; Y652-G654 PolarHBondContact O-N 3.1Å; Y652-A703 HydrophobicContact CD1-CB 4.27Å; Y652-L706 HydrophobicContact CD1-CD1 3.37Å; Y652-L706 HydrophobicContact CD1-CG 3.99Å; Y652-L706 HydrophobicContact CD2-CD1 4.02Å; Y652-L706 HydrophobicContact CE1-CD1 3.63Å; Y652-L706 HydrophobicContact CE1-CG 4.42Å; Y652-L706 HydrophobicContact CE2-CD1 4.24Å; Y652-L706 HydrophobicContact CG-CD1 3.59Å; Y652-L706 HydrophobicContact CG-CG 4.46Å; Y652-L709 HydrophobicContact CD2-CD1 4.3Å
653	E	88.5	Confident	79.3	Confident	85 Å²	85	63.7 Å²	63.7	40%	0.397	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-9.9	169.1	-74.3	173.5	178.4	0	0	112.9	Q649 Q650 Y651 L752	Q649-E653 HydrophobicContact CG-CG 4.38Å; Q649-E653 VanDerWaalsContact CG-OE1 3.32Å; Q649-E653 WeakPolarHBondContact CG-OE1 3.33Å; Q649-E653 PolarHBondContact NE2-OE1 3.18Å; Q649-E653 WeakPolarHBondContact O-CB 3.19Å; Q649-E653 WeakPolarHBondContact O-CG 3.48Å; Q649-E653 PolarHBondContact O-N 2.88Å; Q650-E653 PolarHBondContact O-N 3.21Å; Y651-E653 VanDerWaalsContact C-N 3.32Å; Y651-E653 PolarHBondContact O-N 2.85Å; E653-L752 HydrophobicContact CG-CB 4.26Å; E653-L752 HydrophobicContact CG-CD2 4Å
654	G	82.9	Confident	76.7	Confident	51 Å²	51	67.3 Å²	67.3	53%	0.526	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	19	178.4	0	0	0	0	0	114.9	Q650 Y651 Y652 F656	Q650-G654 PolarHBondContact O-N 2.86Å; Y651-G654 PolarHBondContact O-N 2.97Å; Y651-G654 VanDerWaalsContact O-N 3.12Å; Y652-G654 PolarHBondContact O-N 3.1Å; G654-F656 PolarHBondContact O-N 3.19Å
655	A	82.5	Confident	74	Confident	62 Å²	62	72.3 Å²	72.3	51%	0.512	40%	0.403	S	S	.	.			trans	-69.1	-16.9	177.9	0	0	0	0	0	113.7	Q650 P657	Q650-A655 HydrophobicContact CB-CB 4.01Å; Q650-A655 VanDerWaalsContact O-CB 3.26Å; Q650-A655 WeakPolarHBondContact O-CB 3.49Å; Q650-A655 PolarHBondContact O-N 3.42Å; A655-P657 VanDerWaalsContact O-CD 3.29Å; A655-P657 WeakPolarHBondContact O-CD 3.22Å
656	F	79.2	Confident	71.5	Confident	65 Å²	65	79 Å²	79	29%	0.285	44%	0.438	S	S	.	.	S	Bend	trans	-108.9	91.5	176	-61.3	-86.1	0	0	0	109.2	L647 Q650 G654 L698	L647-F656 HydrophobicContact CD2-CE2 4.49Å; L647-F656 HydrophobicContact CD2-CZ 3.92Å; Q650-F656 HydrophobicContact CB-CD2 4.43Å; Q650-F656 HydrophobicContact CB-CE2 3.74Å; G654-F656 PolarHBondContact O-N 3.19Å; F656-L698 HydrophobicContact CD1-CB 4.45Å; F656-L698 HydrophobicContact CE2-CD1 4.25Å; F656-L698 HydrophobicContact CG-CB 4.3Å; F656-L698 HydrophobicContact CZ-CD1 4.35Å
657	P	71.9	Confident	68.6	Low	96 Å²	96	82.9 Å²	82.9	62%	0.623	46%	0.456	S	S	*	.			trans	-65	136.3	176.2	25.1	-31.3	0	0	0	110.1	A655 L659	A655-P657 VanDerWaalsContact O-CD 3.29Å; A655-P657 WeakPolarHBondContact O-CD 3.22Å; P657-L659 PolarHBondContact O-N 2.88Å
658	A	66	Low	65.9	Low	40 Å²	40	87.5 Å²	87.5	33%	0.331	49%	0.486	S	S	.	.			trans	-67.5	129	175.6	0	0	0	0	0	109.6	D660 S699 R702	A658-D660 VanDerWaalsContact C-N 3.32Å; A658-S699 VanDerWaalsContact CA-O 3.3Å; A658-S699 WeakPolarHBondContact CA-O 3.35Å; A658-R702 HydrophobicContact CB-CB 4.24Å
659	L	66.6	Low	63.5	Low	136 Å²	136	91.2 Å²	91.2	71%	0.712	51%	0.506	S	S	*	.	S	Bend	trans	-75.6	-21.3	-178.6	-72.2	166.8	0	0	0	113.1	P657 S699	P657-L659 PolarHBondContact O-N 2.88Å; L659-S699 PolarHBondContact N-O 2.93Å
660	D	57.9	Low	60.9	Low	118 Å²	118	97.3 Å²	97.3	63%	0.631	53%	0.534	S	S	*	.			trans	-102.3	117.5	-179.9	-66.9	-34.9	0	0	0	110.9	A658 V662	A658-D660 VanDerWaalsContact C-N 3.32Å; D660-V662 PolarHBondContact O-N 2.79Å
661	E	48.7	Very low	58.7	Low	201 Å²	201	97.2 Å²	97.2	94%	0.939	54%	0.538	S	S	*	.			trans	-74.7	-13.2	174.4	-73.3	-171.4	157.7	0	0	113.1	Q663	E661-Q663 PolarHBondContact O-N 2.84Å
662	V	45.5	Very low	56.1	Low	115 Å²	115	101.9 Å²	101.9	70%	0.697	56%	0.563	S	S	*	*	S	Bend	trans	-82.2	112.6	-178.7	-172.9	0	0	0	0	108.2	D660 T664	D660-V662 PolarHBondContact O-N 2.79Å; V662-T664 PolarHBondContact O-N 2.89Å
663	Q	41.9	Very low	53.6	Low	138 Å²	138	104.3 Å²	104.3	65%	0.645	59%	0.592	S	S	*	*			trans	-56.2	89.3	155.4	-79.9	179.8	-74.3	0	0	107.6	E661 D665	E661-Q663 PolarHBondContact O-N 2.84Å; Q663-D665 PolarHBondContact NE2-OD1 2.87Å; Q663-D665 PolarHBondContact O-N 2.87Å
664	T	40.2	Very low	51.2	Low	118 Å²	118	107.2 Å²	107.2	72%	0.724	61%	0.606	S	S	*	*			trans	-68.1	80.1	131.7	40.9	0	0	0	0	104.4	V662 L666	V662-T664 PolarHBondContact O-N 2.89Å; T664-L666 PolarHBondContact O-N 2.97Å
665	D	37.2	Very low	49.3	Very low	105 Å²	105	113.2 Å²	113.2	56%	0.561	62%	0.62	S	S	*	*			trans	-45.4	107.9	140.8	-73.1	-19.6	0	0	0	102.2	Q663 Q667	Q663-D665 PolarHBondContact NE2-OD1 2.87Å; Q663-D665 PolarHBondContact O-N 2.87Å; D665-Q667 PolarHBondContact O-N 2.97Å
666	L	42.6	Very low	47.4	Very low	140 Å²	140	114 Å²	114	73%	0.733	62%	0.621	S	S	*	*			trans	-60.9	81.4	164.9	-76.5	159.9	0	0	0	102.7	T664 P668	T664-L666 PolarHBondContact O-N 2.97Å; L666-P668 WeakPolarHBondContact O-CD 3.47Å
667	Q	33.3	Very low	45.7	Very low	156 Å²	156	115 Å²	115	73%	0.729	65%	0.651	S	S	*	*			trans	-45.7	118.6	161	-76.8	-174.8	-6.8	0	0	101.9	D665 L669	D665-Q667 PolarHBondContact O-N 2.97Å; Q667-L669 VanDerWaalsContact C-N 3.32Å; Q667-L669 PolarHBondContact O-N 2.89Å
668	P	38.6	Very low	44.6	Very low	99 Å²	99	111.8 Å²	111.8	64%	0.643	64%	0.635	S	S	*	*			trans	-51.1	111.3	-177.5	18.8	-29.6	0	0	0	104.1	L666 E670	L666-P668 WeakPolarHBondContact O-CD 3.47Å; P668-E670 VanDerWaalsContact C-N 3.28Å; P668-E670 VanDerWaalsContact O-CA 3.31Å; P668-E670 WeakPolarHBondContact O-CA 3.32Å; P668-E670 PolarHBondContact O-N 2.74Å
669	L	43.7	Very low	44.2	Very low	79 Å²	79	112.3 Å²	112.3	41%	0.414	64%	0.644	S	S	.	*			trans	-42.2	104.2	-172.9	-108.9	146.8	0	0	0	104.4	Q667 V671	Q667-L669 VanDerWaalsContact C-N 3.32Å; Q667-L669 PolarHBondContact O-N 2.89Å; L669-V671 PolarHBondContact O-N 3.36Å
670	E	37.6	Very low	44.2	Very low	154 Å²	154	107.7 Å²	107.7	72%	0.72	62%	0.62	S	S	*	*			trans	-55.9	117	-170	-81.9	-169.3	161	0	0	102.6	P668 N672	P668-E670 VanDerWaalsContact C-N 3.28Å; P668-E670 VanDerWaalsContact O-CA 3.31Å; P668-E670 WeakPolarHBondContact O-CA 3.32Å; P668-E670 PolarHBondContact O-N 2.74Å; E670-N672 PolarHBondContact O-N 3.2Å
671	V	44.1	Very low	44.4	Very low	70 Å²	70	106.5 Å²	106.5	42%	0.424	61%	0.613	S	S	.	*			trans	-62.3	97.2	171.1	178	0	0	0	0	100.6	T160 L669 G673	T160-V671 HydrophobicContact CG2-CG1 4.38Å; L669-V671 PolarHBondContact O-N 3.36Å; V671-G673 PolarHBondContact O-N 3.37Å
672	N	37	Very low	45	Very low	99 Å²	99	104.2 Å²	104.2	53%	0.529	60%	0.603	S	S	.	*			trans	-62.2	83	175	-93.1	-30.6	0	0	0	104.3	E670 Q674	E670-N672 PolarHBondContact O-N 3.2Å; N672-Q674 HydrophobicContact CB-CB 4.5Å; N672-Q674 HydrophobicContact CB-CG 4.48Å; N672-Q674 PolarHBondContact O-N 3.24Å
673	G	39.2	Very low	45.9	Very low	64 Å²	64	99.8 Å²	99.8	66%	0.66	57%	0.574	S	S	*	*			trans	-69.5	31.7	155.1	0	0	0	0	0	109.1	V671 E675	V671-G673 PolarHBondContact O-N 3.37Å; G673-E675 PolarHBondContact O-N 3.23Å
674	Q	38.7	Very low	46.9	Very low	145 Å²	145	101.9 Å²	101.9	68%	0.678	58%	0.581	S	S	*	*			trans	-56.3	99.6	150.4	-75.9	-168.3	-21.4	0	0	105.1	N672 S676	N672-Q674 HydrophobicContact CB-CB 4.5Å; N672-Q674 HydrophobicContact CB-CG 4.48Å; N672-Q674 PolarHBondContact O-N 3.24Å; Q674-S676 PolarHBondContact O-N 3.1Å
675	E	43.4	Very low	48.1	Very low	177 Å²	177	97.9 Å²	97.9	83%	0.827	56%	0.555	S	S	*	*			trans	-39.2	94.5	158.2	-65.4	-179.2	160.8	0	0	106.4	G673 G677	G673-E675 PolarHBondContact O-N 3.23Å; E675-G677 PolarHBondContact O-N 3.1Å
676	S	43.3	Very low	49.6	Very low	78 Å²	78	95.6 Å²	95.6	55%	0.545	55%	0.551	S	S	.	*			trans	-65.3	102	160.7	-59.4	0	0	0	0	102.2	R156 Q674 G678	R156-S676 PolarHBondContact NH1-OG 2.97Å; Q674-S676 PolarHBondContact O-N 3.1Å; S676-G678 PolarHBondContact O-N 3.33Å
677	G	42.7	Very low	50.8	Low	88 Å²	88	92.2 Å²	92.2	91%	0.907	54%	0.537	S	S	*	.	S	Bend	trans	-64.2	27	-169.6	0	0	0	0	0	115.9	E675	E675-G677 PolarHBondContact O-N 3.1Å
678	G	48	Very low	52.5	Low	28 Å²	28	87.3 Å²	87.3	29%	0.289	51%	0.512	S	S	.	.	S	Bend	trans	-94.3	137.1	169.8	0	0	0	0	0	110.4	S676	S676-G678 PolarHBondContact O-N 3.33Å
679	G	57.6	Low	53.6	Low	51 Å²	51	90.9 Å²	90.9	53%	0.526	52%	0.518	S	S	.	.			trans	-62	168.7	175.1	0	0	0	0	0	112.6	L681 E682	G679-L681 PolarHBondContact O-N 3.34Å; G679-E682 PolarHBondContact O-N 3.18Å
680	L	66.3	Low	54.7	Low	38 Å²	38	94 Å²	94	20%	0.199	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.3	-32.4	-176.4	-70.8	166.7	0	0	0	114.6	V29 L155 L205 E682	V29-L680 HydrophobicContact CG1-CD1 4.29Å; V29-L680 HydrophobicContact CG1-CD2 4.32Å; L155-L680 HydrophobicContact CG-CD2 4.26Å; L205-L680 HydrophobicContact CD2-CB 3.78Å; L205-L680 VanDerWaalsContact CD2-O 3.29Å; L205-L680 WeakPolarHBondContact CD2-O 3.43Å; L680-E682 PolarHBondContact O-N 3.39Å
681	L	63.7	Low	56.3	Low	93 Å²	93	89.3 Å²	89.3	49%	0.487	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.1	-179.1	-67.6	167	0	0	0	114.5	N203 L205 P206 G679	N203-L681 HydrophobicContact CB-CD2 4.26Å; L205-L681 HydrophobicContact CD2-CD2 4.05Å; L205-L681 HydrophobicContact CD2-CG 4.5Å; P206-L681 VanDerWaalsContact CG-O 3.3Å; P206-L681 WeakPolarHBondContact CG-O 3.36Å; G679-L681 PolarHBondContact O-N 3.34Å
682	E	60	Low	58	Low	154 Å²	154	87.8 Å²	87.8	72%	0.72	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-8.8	-178.7	-65	179.2	177.1	0	0	112.5	G679 L680 K684	G679-E682 PolarHBondContact O-N 3.18Å; L680-E682 PolarHBondContact O-N 3.39Å; E682-K684 PolarHBondContact O-N 2.97Å
683	E	65.7	Low	60.2	Low	22 Å²	22	87.4 Å²	87.4	10%	0.103	51%	0.508	C	S	.	.			trans	-72.8	109.3	-173	-162.6	173.2	-163.3	0	0	111.5	S154 L155 R156	S154-E683 PolarHBondContact OG-OE1 3.1Å; L155-E683 PolarHBondContact N-OE2 3.05Å; R156-E683 WeakPolarHBondContact CG-OE1 3.36Å; R156-E683 IonicContact NE-OE1 3.89Å
684	K	62	Low	62.3	Low	181 Å²	181	85.9 Å²	85.9	79%	0.787	49%	0.485	S	S	*	.			trans	-89.5	116	169.4	-74.1	-176.7	-179.8	175.3	0	110.2	E682	E682-K684 PolarHBondContact O-N 2.97Å
685	I	66.6	Low	64.5	Low	34 Å²	34	81.3 Å²	81.3	17%	0.174	47%	0.465	C	S	.	.			trans	-82.9	120.4	174.6	-57.6	167.6	0	0	0	108.1	L155 Y159 L186 L187 I207	L155-I685 HydrophobicContact CB-CD1 4.22Å; L155-I685 HydrophobicContact CD1-CD1 3.95Å; Y159-I685 WeakPolarHBondContact OH-CG2 3.34Å; L186-I685 HydrophobicContact CD1-CD1 4.2Å; L186-I685 HydrophobicContact CD2-CD1 3.71Å; L186-I685 HydrophobicContact CD2-CG1 4.43Å; L186-I685 HydrophobicContact CD2-CG2 4.22Å; L186-I685 HydrophobicContact CG-CD1 3.92Å; L187-I685 HydrophobicContact CD2-CG2 3.67Å; I207-I685 HydrophobicContact CD1-CD1 3.69Å; I207-I685 HydrophobicContact CG1-CD1 3.84Å; I207-I685 HydrophobicContact CG2-CD1 3.93Å
686	A	68	Low	66.5	Low	57 Å²	57	74 Å²	74	47%	0.471	44%	0.435	S	S	.	.			trans	-133.3	150.3	176.2	0	0	0	0	0	108.9
687	P	66.8	Low	68.5	Low	69 Å²	69	75.7 Å²	75.7	45%	0.448	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-58.1	152.3	172.4	25.3	-33.3	0	0	0	110.4	K689	P687-K689 PolarHBondContact O-N 2.83Å
688	R	69.3	Low	70.5	Confident	53 Å²	53	72.1 Å²	72.1	20%	0.2	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-52.9	137.8	178.5	-63.1	179.5	-163.9	-160.5	3.8	110.8	E183 L691	E183-R688 WeakPolarHBondContact OE1-CG 3.38Å; E183-R688 IonicContact OE1-NE 2.65Å; E183-R688 PolarHBondContact OE1-NE 3.24Å; E183-R688 IonicContact OE2-CZ 2.71Å; E183-R688 IonicContact OE2-NE 3.62Å; E183-R688 PolarHBondContact OE2-NE 3.27Å; E183-R688 IonicContact OE2-NH2 3.68Å; E183-R688 PolarHBondContact OE2-NH2 2.93Å; R688-L691 HydrophobicContact CB-CD2 4.32Å
689	K	62.3	Low	72.2	Confident	175 Å²	175	72.2 Å²	72.2	76%	0.761	39%	0.389	S	S	*	.	S	Bend	trans	-82.2	151.9	172.1	-63.1	-177.6	179.5	-179.2	0	108.7	P687	P687-K689 PolarHBondContact O-N 2.83Å
690	D	66.6	Low	73.4	Confident	145 Å²	145	74.3 Å²	74.3	78%	0.775	39%	0.385	S	S	*	.	S	Bend	trans	63.4	55.4	179.1	-49.7	-37.3	0	0	0	114.9
691	L	70.7	Confident	74.1	Confident	55 Å²	55	75.1 Å²	75.1	29%	0.288	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-81	140.2	175.4	-71.7	160.9	0	0	0	111.4	D513 T514 C517 R688	D513-L691 HydrophobicContact CB-CD2 4.35Å; T514-L691 HydrophobicContact CG2-CB 4.24Å; C517-L691 HydrophobicContact CB-CD1 3.77Å; R688-L691 HydrophobicContact CB-CD2 4.32Å
692	P	79.9	Confident	74.9	Confident	38 Å²	38	79 Å²	79	25%	0.247	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-63.8	161	171.4	28.4	-34.7	0	0	0	111	S511 T514	S511-P692 VanDerWaalsContact OG-CG 3.32Å; S511-P692 WeakPolarHBondContact OG-CG 3.14Å; T514-P692 WeakPolarHBondContact CB-O 3.41Å; T514-P692 WeakPolarHBondContact CG2-O 3.42Å; T514-P692 PolarHBondContact OG1-O 3.35Å
693	P	83.6	Confident	76.1	Confident	90 Å²	90	72.8 Å²	72.8	58%	0.584	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-57.2	145.9	176.5	25.3	-34.4	0	0	0	111.3	L695	P693-L695 VanDerWaalsContact C-N 3.3Å; P693-L695 PolarHBondContact O-N 3.39Å
694	L	83.5	Confident	77.1	Confident	33 Å²	33	74.5 Å²	74.5	17%	0.173	38%	0.377	C	S	.	.	S	Bend	trans	-60.9	-41.7	-178.6	178.9	65.9	0	0	0	111.8	F510 S511 T514 L515 F525	F510-L694 VanDerWaalsContact CA-O 3.26Å; F510-L694 WeakPolarHBondContact CA-O 3.2Å; F510-L694 VanDerWaalsContact CB-O 3.23Å; F510-L694 WeakPolarHBondContact CB-O 3.5Å; S511-L694 PolarHBondContact N-O 3.31Å; T514-L694 HydrophobicContact CG2-CB 4.23Å; T514-L694 HydrophobicContact CG2-CD1 4.41Å; L515-L694 HydrophobicContact CB-CD1 3.99Å; L515-L694 HydrophobicContact CD1-CD1 4.01Å; F525-L694 HydrophobicContact CD1-CD2 4.3Å; F525-L694 HydrophobicContact CG-CD2 4.28Å
695	L	84.7	Confident	78.2	Confident	48 Å²	48	75 Å²	75	25%	0.251	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-118.5	132.6	178.5	-60.6	171.9	0	0	0	107.8	F510 F525 V558 L560 P571 P693	F510-L695 HydrophobicContact CB-CD2 4.41Å; F525-L695 HydrophobicContact CZ-CD2 4.18Å; V558-L695 HydrophobicContact CG2-CD2 3.86Å; L560-L695 HydrophobicContact CD1-CD1 3.7Å; P571-L695 HydrophobicContact CG-CD1 4.42Å; P693-L695 VanDerWaalsContact C-N 3.3Å; P693-L695 PolarHBondContact O-N 3.39Å
696	A	85	Confident	79.3	Confident	24 Å²	24	73.6 Å²	73.6	20%	0.198	37%	0.366	C	S	.	.			trans	-114.6	152.2	169.4	0	0	0	0	0	108.9	Y508 P509 E700	Y508-A696 WeakPolarHBondContact CD1-O 3.41Å; P509-A696 WeakPolarHBondContact CD-O 3.15Å; P509-A696 HydrophobicContact CG-CB 4.32Å; P509-A696 PolarHBondContact O-N 3.47Å; P509-A696 VanDerWaalsContact O-N 3.1Å; A696-E700 WeakPolarHBondContact CA-OE2 3.48Å
697	K	85.4	Confident	80.4	Confident	114 Å²	114	72.4 Å²	72.4	50%	0.496	35%	0.352	S	S	.	.			trans	-72.8	152.9	169.3	-69	-178.6	175.4	178.5	0	109.8	Y508 S699 E700	Y508-K697 HydrophobicContact CE1-CG 4.08Å; K697-S699 PolarHBondContact O-N 3.37Å; K697-E700 HydrophobicContact CB-CG 4.05Å; K697-E700 PolarHBondContact N-OE2 3.5Å; K697-E700 WeakPolarHBondContact O-CB 3.49Å; K697-E700 PolarHBondContact O-N 2.77Å
698	L	85.5	Confident	81.6	Confident	12 Å²	12	69.1 Å²	69.1	6%	0.063	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-58.1	-30.7	175.3	-73.7	169.2	0	0	0	112.8	L507 P509 F557 Y651 F656 E700 R701	L507-L698 HydrophobicContact CB-CD1 3.96Å; L507-L698 WeakPolarHBondContact O-CD1 3.32Å; L507-L698 VanDerWaalsContact O-CG 3.26Å; L507-L698 WeakPolarHBondContact O-CG 3.45Å; P509-L698 HydrophobicContact CG-CD2 4.36Å; F557-L698 HydrophobicContact CD1-CD2 4.2Å; F557-L698 HydrophobicContact CE1-CD2 4.04Å; Y651-L698 HydrophobicContact CD1-CD2 4.35Å; Y651-L698 HydrophobicContact CD2-CB 4.05Å; Y651-L698 HydrophobicContact CD2-CD2 3.53Å; Y651-L698 HydrophobicContact CD2-CG 4.28Å; Y651-L698 HydrophobicContact CE2-CB 4.43Å; Y651-L698 HydrophobicContact CE2-CD2 3.91Å; Y651-L698 WeakPolarHBondContact CE2-O 3.45Å; Y651-L698 HydrophobicContact CG-CD2 3.76Å; F656-L698 HydrophobicContact CD1-CB 4.45Å; F656-L698 HydrophobicContact CE2-CD1 4.25Å; F656-L698 HydrophobicContact CG-CB 4.3Å; F656-L698 HydrophobicContact CZ-CD1 4.35Å; L698-E700 VanDerWaalsContact C-N 3.27Å; L698-E700 PolarHBondContact O-N 2.92Å; L698-R701 VanDerWaalsContact O-O 3.11Å
699	S	82.7	Confident	82.8	Confident	30 Å²	30	66.6 Å²	66.6	21%	0.21	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-75.1	-10.7	177	56.1	0	0	0	0	114.5	A658 L659 K697	A658-S699 VanDerWaalsContact CA-O 3.3Å; A658-S699 WeakPolarHBondContact CA-O 3.35Å; L659-S699 PolarHBondContact N-O 2.93Å; K697-S699 PolarHBondContact O-N 3.37Å
700	E	82.3	Confident	84.4	Confident	95 Å²	95	58.3 Å²	58.3	44%	0.444	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-93.9	-13.9	-179.6	-67.1	163.1	-171.3	0	0	111.6	A696 K697 L698	A696-E700 WeakPolarHBondContact CA-OE2 3.48Å; K697-E700 HydrophobicContact CB-CG 4.05Å; K697-E700 PolarHBondContact N-OE2 3.5Å; K697-E700 WeakPolarHBondContact O-CB 3.49Å; K697-E700 PolarHBondContact O-N 2.77Å; L698-E700 VanDerWaalsContact C-N 3.27Å; L698-E700 PolarHBondContact O-N 2.92Å
701	R	81.4	Confident	85.8	Confident	55 Å²	55	51.4 Å²	51.4	21%	0.208	25%	0.248	C	C	.	.	S	Bend	trans	-114.8	131	177.8	-175.2	-175.2	167.6	-171.3	0.6	109.9	H555 Y651 L698 E704	H555-R701 PolarHBondContact CE1-NH2 3.21Å; H555-R701 PolarHBondContact ND1-NH2 3.22Å; H555-R701 PolarHBondContact NE2-NH2 3.24Å; Y651-R701 VanDerWaalsContact OH-CD 3.32Å; Y651-R701 WeakPolarHBondContact OH-CD 3.36Å; Y651-R701 WeakPolarHBondContact OH-CG 3.44Å; Y651-R701 PolarHBondContact OH-O 3.12Å; L698-R701 VanDerWaalsContact O-O 3.11Å; R701-E704 IonicContact CZ-OE1 2.71Å; R701-E704 IonicContact NE-OE1 3.84Å; R701-E704 IonicContact NH2-OE1 3.31Å; R701-E704 PolarHBondContact NH2-OE1 3.25Å; R701-E704 IonicContact NH2-OE2 3.92Å
702	R	81.5	Confident	86.9	Confident	174 Å²	174	50.4 Å²	50.4	66%	0.657	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-73	127.7	169.8	-171.9	176.8	-179.8	177.7	2	110.1	Y651 A658	Y651-R702 PolarHBondContact OH-O 3.05Å; A658-R702 HydrophobicContact CB-CB 4.24Å
703	A	84.2	Confident	87.4	Confident	24 Å²	24	49.8 Å²	49.8	20%	0.198	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-69.8	140.7	174.4	0	0	0	0	0	111.7	Y651 Y652	Y651-A703 HydrophobicContact CD1-CB 4.06Å; Y651-A703 HydrophobicContact CD2-CB 4.29Å; Y651-A703 HydrophobicContact CE1-CB 3.66Å; Y651-A703 HydrophobicContact CE2-CB 3.94Å; Y651-A703 HydrophobicContact CG-CB 4.36Å; Y651-A703 WeakPolarHBondContact O-CB 2.88Å; Y651-A703 WeakPolarHBondContact OH-CA 3.39Å; Y651-A703 PolarHBondContact OH-N 3.02Å; Y652-A703 HydrophobicContact CD1-CB 4.27Å
704	E	86.4	Confident	87.8	Confident	59 Å²	59	46.5 Å²	46.5	28%	0.276	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-62.9	146	167.3	-61.7	78.6	-170.6	0	0	110.2	H555 L581 R701 L706	H555-E704 IonicContact NE2-OE1 3.21Å; L581-E704 HydrophobicContact CD1-CG 4Å; R701-E704 IonicContact CZ-OE1 2.71Å; R701-E704 IonicContact NE-OE1 3.84Å; R701-E704 IonicContact NH2-OE1 3.31Å; R701-E704 PolarHBondContact NH2-OE1 3.25Å; R701-E704 IonicContact NH2-OE2 3.92Å; E704-L706 HydrophobicContact CB-CD2 4.4Å; E704-L706 PolarHBondContact O-N 3.47Å
705	R	85.7	Confident	88.1	Confident	190 Å²	190	45.4 Å²	45.4	72%	0.717	22%	0.215	S	C	*	.			trans	-78.2	110.1	177.6	-72.3	-174.8	172.2	-177.7	-1.8	109.4
706	L	90	Very high	88.3	Confident	6 Å²	6	44 Å²	44	3%	0.031	21%	0.209	C	C	.	.			trans	-114.3	143.8	179.3	-57.1	-178	0	0	0	111.6	L581 A624 Y652 E704 L752	L581-L706 HydrophobicContact CD2-CD1 4.44Å; L581-L706 HydrophobicContact CD2-CD2 4.12Å; A624-L706 HydrophobicContact CB-CD1 3.41Å; A624-L706 VanDerWaalsContact CB-CD1 3.41Å; A624-L706 HydrophobicContact CB-CD2 4.45Å; Y652-L706 HydrophobicContact CD1-CD1 3.37Å; Y652-L706 HydrophobicContact CD1-CG 3.99Å; Y652-L706 HydrophobicContact CD2-CD1 4.02Å; Y652-L706 HydrophobicContact CE1-CD1 3.63Å; Y652-L706 HydrophobicContact CE1-CG 4.42Å; Y652-L706 HydrophobicContact CE2-CD1 4.24Å; Y652-L706 HydrophobicContact CG-CD1 3.59Å; Y652-L706 HydrophobicContact CG-CG 4.46Å; E704-L706 HydrophobicContact CB-CD2 4.4Å; E704-L706 PolarHBondContact O-N 3.47Å; L706-L752 HydrophobicContact CB-CD1 3.75Å; L706-L752 HydrophobicContact CD1-CD1 4.44Å
707	D	90.6	Very high	88.5	Confident	32 Å²	32	46.3 Å²	46.3	17%	0.171	22%	0.222	C	C	.	.	S	Bend	trans	-92.7	-37.1	175.5	-57.8	-44.7	0	0	0	111.1	L621 S622 L752 R753	L621-D707 HydrophobicContact CB-CB 4.49Å; S622-D707 PolarHBondContact N-OD2 2.69Å; S622-D707 WeakPolarHBondContact O-CB 3.5Å; S622-D707 PolarHBondContact O-N 3.19Å; D707-L752 PolarHBondContact O-N 2.75Å; D707-R753 IonicContact OD1-CZ 3.93Å; D707-R753 IonicContact OD1-NE 3.21Å; D707-R753 PolarHBondContact OD1-NE 3.29Å; D707-R753 IonicContact OD1-NH1 3.1Å; D707-R753 PolarHBondContact OD1-NH1 3.3Å; D707-R753 IonicContact OD1-NH2 2.71Å; D707-R753 PolarHBondContact OD1-NH2 3.09Å
708	W	92.8	Very high	88.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	151.2	-177.7	64	-90.6	0	0	0	113.7	E582 I605 P606 F618 G623 A624 I749 K750 W761	E582-W708 HydrophobicContact CB-CH2 4.25Å; E582-W708 HydrophobicContact CB-CZ2 4.42Å; I605-W708 HydrophobicContact CB-CH2 3.74Å; I605-W708 HydrophobicContact CB-CZ2 4.47Å; I605-W708 HydrophobicContact CB-CZ3 4.23Å; I605-W708 HydrophobicContact CD1-CH2 3.95Å; I605-W708 HydrophobicContact CD1-CZ3 3.68Å; I605-W708 HydrophobicContact CG1-CH2 4.44Å; I605-W708 HydrophobicContact CG2-CH2 3.67Å; I605-W708 HydrophobicContact CG2-CZ2 4.17Å; I605-W708 HydrophobicContact CG2-CZ3 3.93Å; P606-W708 HydrophobicContact CG-CZ2 4.18Å; F618-W708 HydrophobicContact CE1-CZ2 4.37Å; F618-W708 HydrophobicContact CZ-CD2 4.12Å; F618-W708 AromaticContact CZ-CE2 3.73Å; F618-W708 HydrophobicContact CZ-CG 4.35Å; F618-W708 HydrophobicContact CZ-CZ2 4.19Å; F618-W708 AromaticContact CZ-NE1 3.7Å; G623-W708 VanDerWaalsContact CA-O 3.22Å; G623-W708 WeakPolarHBondContact CA-O 3.42Å; A624-W708 PolarHBondContact N-O 3.36Å; W708-I749 HydrophobicContact CB-CG2 3.89Å; W708-I749 HydrophobicContact CD2-CG2 4.44Å; W708-I749 HydrophobicContact CE3-CG2 4.15Å; W708-I749 HydrophobicContact CG-CG2 4.37Å; W708-K750 CarbonylContact C-O 3.57Å; W708-K750 WeakPolarHBondContact CA-O 3.33Å; W708-W761 HydrophobicContact CB-CH2 4.32Å; W708-W761 HydrophobicContact CB-CZ2 4.42Å
709	L	94.7	Very high	88.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.8	169.4	-159.5	74.2	0	0	0	109.4	A624 I626 L648 Y652 F728 I749 K750 L752	A624-L709 HydrophobicContact CB-CD1 3.95Å; A624-L709 CarbonylContact O-C 3.58Å; A624-L709 WeakPolarHBondContact O-CA 3.35Å; I626-L709 HydrophobicContact CD1-CD2 3.86Å; I626-L709 HydrophobicContact CD1-CG 4.31Å; I626-L709 HydrophobicContact CG1-CD1 4.46Å; I626-L709 HydrophobicContact CG1-CD2 4.33Å; I626-L709 HydrophobicContact CG1-CG 4.3Å; L648-L709 HydrophobicContact CD2-CD2 4.24Å; Y652-L709 HydrophobicContact CD2-CD1 4.3Å; L709-F728 HydrophobicContact CB-CE1 4.45Å; L709-F728 HydrophobicContact CD2-CE1 4.44Å; L709-F728 HydrophobicContact CD2-CZ 3.97Å; L709-F728 WeakPolarHBondContact O-CE1 3.38Å; L709-I749 CarbonylContact O-C 3.56Å; L709-I749 WeakPolarHBondContact O-CA 3.41Å; L709-K750 PolarHBondContact N-O 3.19Å; L709-K750 PolarHBondContact O-N 3.2Å; L709-L752 HydrophobicContact CB-CD1 4.25Å; L709-L752 HydrophobicContact CB-CD2 4.19Å; L709-L752 HydrophobicContact CB-CG 4.27Å
710	G	95	Very high	89.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	157.9	-175.1	0	0	0	0	0	113	A624 R625 I626 K748	A624-G710 PolarHBondContact O-N 2.87Å; R625-G710 CarbonylContact C-O 3.55Å; R625-G710 VanDerWaalsContact CA-O 3.29Å; R625-G710 WeakPolarHBondContact CA-O 3.28Å; I626-G710 PolarHBondContact N-O 3.44Å; G710-K748 CarbonylContact C-O 3.49Å; G710-K748 VanDerWaalsContact CA-O 3.31Å; G710-K748 WeakPolarHBondContact CA-O 3.19Å
711	V	95.6	Very high	89.7	Confident	1 Å²	1	51 Å²	51	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	141.5	178.7	-50.9	0	0	0	0	109	I626 Y713 W723 F728 I747 K748	I626-V711 HydrophobicContact CB-CG1 4.07Å; I626-V711 HydrophobicContact CD1-CG1 4.09Å; I626-V711 HydrophobicContact CG1-CG1 4.33Å; V711-Y713 HydrophobicContact CG2-CD1 3.95Å; V711-Y713 HydrophobicContact CG2-CE1 3.97Å; V711-W723 HydrophobicContact CB-CH2 4.2Å; V711-W723 HydrophobicContact CB-CZ2 4.09Å; V711-W723 HydrophobicContact CG1-CD2 4.37Å; V711-W723 HydrophobicContact CG1-CE3 4.04Å; V711-W723 HydrophobicContact CG1-CH2 3.47Å; V711-W723 VanDerWaalsContact CG1-CH2 3.47Å; V711-W723 HydrophobicContact CG1-CZ2 3.88Å; V711-W723 HydrophobicContact CG1-CZ3 3.6Å; V711-W723 HydrophobicContact CG2-CD2 4.09Å; V711-W723 HydrophobicContact CG2-CE3 4.4Å; V711-W723 HydrophobicContact CG2-CG 4.41Å; V711-W723 HydrophobicContact CG2-CZ2 4.41Å; V711-F728 HydrophobicContact CG1-CD1 4.06Å; V711-F728 HydrophobicContact CG1-CE1 3.74Å; V711-F728 HydrophobicContact CG1-CZ 4.32Å; V711-F728 HydrophobicContact CG2-CD1 4.34Å; V711-I747 VanDerWaalsContact O-CA 3.29Å; V711-I747 WeakPolarHBondContact O-CA 3.06Å; V711-K748 HydrophobicContact CG2-CB 3.75Å; V711-K748 HydrophobicContact CG2-CG 4.34Å; V711-K748 PolarHBondContact N-O 2.8Å; V711-K748 PolarHBondContact O-N 2.92Å
712	C	93.6	Very high	90.2	Very high	34 Å²	34	50.2 Å²	50.2	23%	0.23	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	117.6	173.5	178.4	0	0	0	0	109.1	L604 C746 I747	L604-C712 HydrophobicContact CD2-CB 4.26Å; C712-C746 WeakPolarHBondContact CA-O 3.42Å; C712-I747 HydrophobicContact CB-CG1 4.38Å
713	Y	92	Very high	90.8	Very high	25 Å²	25	42.5 Å²	42.5	10%	0.098	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	161.1	-175.2	66.6	-80.9	0	0	0	112.5	V711 L715 L719 Q720 W723 S745 C746 K748	V711-Y713 HydrophobicContact CG2-CD1 3.95Å; V711-Y713 HydrophobicContact CG2-CE1 3.97Å; Y713-L715 HydrophobicContact CE2-CD1 4.35Å; Y713-L719 HydrophobicContact CD2-CB 3.64Å; Y713-L719 HydrophobicContact CD2-CD1 3.73Å; Y713-L719 HydrophobicContact CD2-CG 4.32Å; Y713-L719 HydrophobicContact CE2-CB 3.55Å; Y713-L719 HydrophobicContact CE2-CD1 4.47Å; Y713-L719 HydrophobicContact CG-CD1 4.47Å; Y713-Q720 PolarHBondContact OH-OE1 2.67Å; Y713-W723 AromaticContact CD1-CD1 3.77Å; Y713-W723 AromaticContact CD1-NE1 3.59Å; Y713-W723 AromaticContact CE1-CD1 3.28Å; Y713-W723 HydrophobicContact CE1-CG 4.09Å; Y713-W723 AromaticContact CE1-NE1 3.63Å; Y713-W723 AromaticContact CE2-CD1 3.94Å; Y713-W723 AromaticContact CG-NE1 3.93Å; Y713-W723 AromaticContact CZ-CD1 3.4Å; Y713-S745 WeakPolarHBondContact O-CA 3.27Å; Y713-C746 HydrophobicContact CE1-CB 4.47Å; Y713-C746 PolarHBondContact N-O 3.14Å; Y713-C746 PolarHBondContact O-N 3.33Å; Y713-K748 HydrophobicContact CE1-CD 4.14Å; Y713-K748 HydrophobicContact CE1-CG 4.12Å; Y713-K748 WeakPolarHBondContact OH-CE 3.35Å
714	G	90.3	Very high	91	Very high	20 Å²	20	43 Å²	43	21%	0.206	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	121.6	170.1	0	0	0	0	0	110.4	T716 E743	G714-T716 PolarHBondContact O-N 2.59Å; G714-T716 VanDerWaalsContact O-N 3.1Å; G714-E743 WeakPolarHBondContact CA-OE2 3.33Å
715	L	91.1	Very high	91.1	Very high	10 Å²	10	47.9 Å²	47.9	5%	0.052	23%	0.23	C	C	.	.			trans	-68	108.1	-170	-176.7	71.5	0	0	0	111.5	Y713 Q720 I733 F744 C746 F784 L788 I792	Y713-L715 HydrophobicContact CE2-CD1 4.35Å; L715-Q720 HydrophobicContact CD1-CB 4.41Å; L715-I733 HydrophobicContact CD2-CD1 4.32Å; L715-F744 WeakPolarHBondContact CB-O 3.3Å; L715-F744 PolarHBondContact N-O 2.72Å; L715-C746 HydrophobicContact CB-CB 4.32Å; L715-C746 HydrophobicContact CD1-CB 4.08Å; L715-F784 HydrophobicContact CD2-CE1 4.02Å; L715-F784 HydrophobicContact CD2-CE2 4.18Å; L715-F784 HydrophobicContact CD2-CZ 3.77Å; L715-L788 HydrophobicContact CD1-CD1 4.2Å; L715-L788 HydrophobicContact CD2-CD2 3.97Å; L715-L788 HydrophobicContact CD2-CG 4.43Å; L715-L788 HydrophobicContact CG-CD1 4.14Å; L715-L788 HydrophobicContact CG-CD2 4.07Å; L715-L788 HydrophobicContact CG-CG 4.46Å; L715-I792 HydrophobicContact CD1-CD1 4.12Å; L715-I792 HydrophobicContact CD2-CD1 3.74Å; L715-I792 HydrophobicContact CG-CD1 4.48Å
716	T	88	Confident	91.2	Very high	20 Å²	20	39.8 Å²	39.8	12%	0.123	20%	0.2	C	C	.	.			trans	-123.6	155.9	171.1	65.8	0	0	0	0	110.9	G714 E718 L719 Q720 E743	G714-T716 PolarHBondContact O-N 2.59Å; G714-T716 VanDerWaalsContact O-N 3.1Å; T716-E718 VanDerWaalsContact C-N 3.29Å; T716-E718 PolarHBondContact O-N 2.64Å; T716-L719 PolarHBondContact O-N 3.24Å; T716-L719 WeakPolarHBondContact OG1-CB 3.24Å; T716-L719 WeakPolarHBondContact OG1-CG 3.42Å; T716-L719 PolarHBondContact OG1-N 3.4Å; T716-Q720 VanDerWaalsContact O-CB 3.27Å; T716-Q720 WeakPolarHBondContact O-CB 3.38Å; T716-Q720 PolarHBondContact O-N 2.77Å; T716-E743 HydrophobicContact CG2-CG 4.38Å; T716-E743 WeakPolarHBondContact CG2-OE1 3.25Å
717	P	89.1	Confident	91.2	Very high	72 Å²	72	43.2 Å²	43.2	47%	0.468	22%	0.219	S	C	.	.	H	α-helix	trans	-57.7	-39	178.5	-25.7	34.8	0	0	0	113.7	K721 L788	P717-K721 WeakPolarHBondContact O-CB 3.3Å; P717-K721 PolarHBondContact O-N 2.79Å; P717-L788 HydrophobicContact CG-CD1 4.41Å
718	E	88	Confident	91.2	Very high	155 Å²	155	41.7 Å²	41.7	72%	0.724	21%	0.21	S	C	*	.	H	α-helix	trans	-65.7	-50.5	179.8	-65	178.6	175.6	0	0	111.8	T716 K721 F722	T716-E718 VanDerWaalsContact C-N 3.29Å; T716-E718 PolarHBondContact O-N 2.64Å; E718-K721 PolarHBondContact O-N 2.81Å; E718-F722 WeakPolarHBondContact O-CB 3.23Å; E718-F722 PolarHBondContact O-N 2.9Å
719	L	90.4	Very high	91.2	Very high	65 Å²	65	41.9 Å²	41.9	34%	0.34	21%	0.212	S	C	.	.	H	α-helix	trans	-67.7	-38.8	179	-67.4	175.8	0	0	0	111.2	Y713 T716 K721 F722 W723	Y713-L719 HydrophobicContact CD2-CB 3.64Å; Y713-L719 HydrophobicContact CD2-CD1 3.73Å; Y713-L719 HydrophobicContact CD2-CG 4.32Å; Y713-L719 HydrophobicContact CE2-CB 3.55Å; Y713-L719 HydrophobicContact CE2-CD1 4.47Å; Y713-L719 HydrophobicContact CG-CD1 4.47Å; T716-L719 PolarHBondContact O-N 3.24Å; T716-L719 WeakPolarHBondContact OG1-CB 3.24Å; T716-L719 WeakPolarHBondContact OG1-CG 3.42Å; T716-L719 PolarHBondContact OG1-N 3.4Å; L719-K721 VanDerWaalsContact C-N 3.29Å; L719-K721 PolarHBondContact O-N 2.98Å; L719-F722 WeakPolarHBondContact O-CB 3.49Å; L719-F722 PolarHBondContact O-N 3Å; L719-W723 PolarHBondContact O-N 3.13Å
720	Q	92.4	Very high	91.1	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.019	21%	0.212	C	C	.	.	H	α-helix	trans	-56.4	-46.6	174.3	176.6	60.7	12.5	0	0	111.1	Y713 L715 T716 A724 L788 G791 I792	Y713-Q720 PolarHBondContact OH-OE1 2.67Å; L715-Q720 HydrophobicContact CD1-CB 4.41Å; T716-Q720 VanDerWaalsContact O-CB 3.27Å; T716-Q720 WeakPolarHBondContact O-CB 3.38Å; T716-Q720 PolarHBondContact O-N 2.77Å; Q720-A724 WeakPolarHBondContact O-CB 2.95Å; Q720-A724 PolarHBondContact O-N 2.81Å; Q720-L788 HydrophobicContact CB-CD1 3.79Å; Q720-L788 HydrophobicContact CG-CD1 4.03Å; Q720-G791 PolarHBondContact NE2-O 3.35Å; Q720-I792 HydrophobicContact CG-CG1 4.28Å
721	K	91	Very high	91	Very high	125 Å²	125	42 Å²	42	54%	0.543	21%	0.212	S	C	.	.	H	α-helix	trans	-66.4	-41.3	178	-168.2	179.7	-169.8	-178.9	0	111.9	P717 E718 L719 R725	P717-K721 WeakPolarHBondContact O-CB 3.3Å; P717-K721 PolarHBondContact O-N 2.79Å; E718-K721 PolarHBondContact O-N 2.81Å; L719-K721 VanDerWaalsContact C-N 3.29Å; L719-K721 PolarHBondContact O-N 2.98Å; K721-R725 VanDerWaalsContact CE-NH2 3.31Å; K721-R725 VanDerWaalsContact O-CG 3.31Å; K721-R725 WeakPolarHBondContact O-CG 3.02Å; K721-R725 PolarHBondContact O-N 3.45Å; K721-R725 VanDerWaalsContact O-N 3.13Å
722	F	92.5	Very high	91	Very high	38 Å²	38	44 Å²	44	17%	0.167	22%	0.22	C	C	.	.	H	α-helix	trans	-57.1	-53.2	176.1	174.8	-95.2	0	0	0	111.4	I629 S642 V645 E718 L719 R725	I629-F722 HydrophobicContact CD1-CE1 4.23Å; I629-F722 HydrophobicContact CD1-CZ 4.43Å; S642-F722 WeakPolarHBondContact OG-CE2 3.14Å; V645-F722 HydrophobicContact CG2-CE1 4.44Å; V645-F722 HydrophobicContact CG2-CZ 4.15Å; E718-F722 WeakPolarHBondContact O-CB 3.23Å; E718-F722 PolarHBondContact O-N 2.9Å; L719-F722 WeakPolarHBondContact O-CB 3.49Å; L719-F722 PolarHBondContact O-N 3Å; F722-R725 PolarHBondContact O-N 2.94Å
723	W	93.1	Very high	91.1	Very high	13 Å²	13	42.9 Å²	42.9	5%	0.049	21%	0.211	C	C	.	.	H	α-helix	trans	-71.7	-34.1	-178.5	-65.2	118.6	0	0	0	113.4	I626 I629 V645 V711 Y713 L719 R725 K726 N727 F728 K748	I626-W723 HydrophobicContact CD1-CH2 4.05Å; I626-W723 HydrophobicContact CD1-CZ3 4.23Å; I629-W723 HydrophobicContact CD1-CH2 3.3Å; I629-W723 HydrophobicContact CD1-CZ2 3.8Å; I629-W723 HydrophobicContact CD1-CZ3 4.21Å; I629-W723 HydrophobicContact CG1-CH2 4.35Å; V645-W723 HydrophobicContact CG1-CZ3 4.28Å; V645-W723 HydrophobicContact CG2-CH2 4.42Å; V645-W723 HydrophobicContact CG2-CZ3 4.26Å; V711-W723 HydrophobicContact CB-CH2 4.2Å; V711-W723 HydrophobicContact CB-CZ2 4.09Å; V711-W723 HydrophobicContact CG1-CD2 4.37Å; V711-W723 HydrophobicContact CG1-CE3 4.04Å; V711-W723 HydrophobicContact CG1-CH2 3.47Å; V711-W723 VanDerWaalsContact CG1-CH2 3.47Å; V711-W723 HydrophobicContact CG1-CZ2 3.88Å; V711-W723 HydrophobicContact CG1-CZ3 3.6Å; V711-W723 HydrophobicContact CG2-CD2 4.09Å; V711-W723 HydrophobicContact CG2-CE3 4.4Å; V711-W723 HydrophobicContact CG2-CG 4.41Å; V711-W723 HydrophobicContact CG2-CZ2 4.41Å; Y713-W723 AromaticContact CD1-CD1 3.77Å; Y713-W723 AromaticContact CD1-NE1 3.59Å; Y713-W723 AromaticContact CE1-CD1 3.28Å; Y713-W723 HydrophobicContact CE1-CG 4.09Å; Y713-W723 AromaticContact CE1-NE1 3.63Å; Y713-W723 AromaticContact CE2-CD1 3.94Å; Y713-W723 AromaticContact CG-NE1 3.93Å; Y713-W723 AromaticContact CZ-CD1 3.4Å; L719-W723 PolarHBondContact O-N 3.13Å; W723-R725 VanDerWaalsContact C-N 3.31Å; W723-R725 PolarHBondContact O-N 3.4Å; W723-K726 PolarHBondContact O-N 3.46Å; W723-K726 VanDerWaalsContact O-N 3.1Å; W723-N727 PolarHBondContact O-N 3.29Å; W723-F728 HydrophobicContact CB-CB 4.38Å; W723-F728 AromaticContact CE3-CD2 3.86Å; W723-F728 HydrophobicContact CE3-CD2 3.86Å; W723-F728 AromaticContact CE3-CE2 3.95Å; W723-F728 HydrophobicContact CE3-CE2 3.95Å; W723-F728 HydrophobicContact CE3-CG 4.22Å; W723-F728 HydrophobicContact CE3-CZ 4.4Å; W723-F728 HydrophobicContact CZ3-CD2 4.39Å; W723-F728 HydrophobicContact CZ3-CE2 4.03Å; W723-F728 HydrophobicContact CZ3-CZ 4.16Å; W723-F728 PolarHBondContact O-N 3.1Å; W723-K748 HydrophobicContact CB-CD 3.82Å
724	A	88.5	Confident	91.2	Very high	33 Å²	33	47.5 Å²	47.5	27%	0.273	23%	0.229	S	C	.	.	H	α-helix	trans	-61.6	-39.2	175.4	0	0	0	0	0	111.8	Q720 K726 N727	Q720-A724 WeakPolarHBondContact O-CB 2.95Å; Q720-A724 PolarHBondContact O-N 2.81Å; A724-K726 PolarHBondContact O-N 3.31Å; A724-N727 PolarHBondContact O-N 3.4Å
725	R	89	Confident	91.2	Very high	163 Å²	163	51.4 Å²	51.4	62%	0.615	24%	0.241	S	C	*	.	H	α-helix	trans	-63.6	-21.9	175.1	-72.8	171.8	-179.2	173.5	-4.1	113.7	K721 F722 W723	K721-R725 VanDerWaalsContact CE-NH2 3.31Å; K721-R725 VanDerWaalsContact O-CG 3.31Å; K721-R725 WeakPolarHBondContact O-CG 3.02Å; K721-R725 PolarHBondContact O-N 3.45Å; K721-R725 VanDerWaalsContact O-N 3.13Å; F722-R725 PolarHBondContact O-N 2.94Å; W723-R725 VanDerWaalsContact C-N 3.31Å; W723-R725 PolarHBondContact O-N 3.4Å
726	K	88.6	Confident	91.2	Very high	19 Å²	19	54.7 Å²	54.7	8%	0.083	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	8.9	179.2	-62.6	-52.8	-167.4	-168.6	0	113.6	S642 E646 W723 A724 F728 K750	S642-K726 VanDerWaalsContact CB-NZ 3.33Å; S642-K726 WeakPolarHBondContact O-CE 3.29Å; S642-K726 PolarHBondContact O-NZ 3.46Å; S642-K726 VanDerWaalsContact O-NZ 3.11Å; S642-K726 WeakPolarHBondContact OG-CE 3.44Å; E646-K726 HydrophobicContact CG-CD 4.48Å; E646-K726 IonicContact OE1-NZ 2.7Å; E646-K726 PolarHBondContact OE1-NZ 3.12Å; E646-K726 IonicContact OE2-NZ 2.76Å; W723-K726 PolarHBondContact O-N 3.46Å; W723-K726 VanDerWaalsContact O-N 3.1Å; A724-K726 PolarHBondContact O-N 3.31Å; K726-F728 VanDerWaalsContact C-N 3.3Å; K726-F728 HydrophobicContact CB-CD2 3.69Å; K726-F728 HydrophobicContact CB-CE2 3.84Å; K726-F728 PolarHBondContact O-N 3.36Å; K726-K750 PolarHBondContact O-NZ 2.74Å
727	N	87.9	Confident	91.2	Very high	79 Å²	79	55.4 Å²	55.4	42%	0.422	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	33.1	-179.8	-55	-27.7	0	0	0	113.9	W723 A724 P797	W723-N727 PolarHBondContact O-N 3.29Å; A724-N727 PolarHBondContact O-N 3.4Å; N727-P797 HydrophobicContact CB-CG 4.24Å
728	F	91.9	Very high	90.9	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-81	129.1	169	-78.7	-101.3	0	0	0	110.5	V645 L709 V711 W723 K726 K748 K750	V645-F728 HydrophobicContact CG1-CE2 4.27Å; L709-F728 HydrophobicContact CB-CE1 4.45Å; L709-F728 HydrophobicContact CD2-CE1 4.44Å; L709-F728 HydrophobicContact CD2-CZ 3.97Å; L709-F728 WeakPolarHBondContact O-CE1 3.38Å; V711-F728 HydrophobicContact CG1-CD1 4.06Å; V711-F728 HydrophobicContact CG1-CE1 3.74Å; V711-F728 HydrophobicContact CG1-CZ 4.32Å; V711-F728 HydrophobicContact CG2-CD1 4.34Å; W723-F728 HydrophobicContact CB-CB 4.38Å; W723-F728 AromaticContact CE3-CD2 3.86Å; W723-F728 HydrophobicContact CE3-CD2 3.86Å; W723-F728 AromaticContact CE3-CE2 3.95Å; W723-F728 HydrophobicContact CE3-CE2 3.95Å; W723-F728 HydrophobicContact CE3-CG 4.22Å; W723-F728 HydrophobicContact CE3-CZ 4.4Å; W723-F728 HydrophobicContact CZ3-CD2 4.39Å; W723-F728 HydrophobicContact CZ3-CE2 4.03Å; W723-F728 HydrophobicContact CZ3-CZ 4.16Å; W723-F728 PolarHBondContact O-N 3.1Å; K726-F728 VanDerWaalsContact C-N 3.3Å; K726-F728 HydrophobicContact CB-CD2 3.69Å; K726-F728 HydrophobicContact CB-CE2 3.84Å; K726-F728 PolarHBondContact O-N 3.36Å; F728-K748 HydrophobicContact CB-CB 3.84Å; F728-K748 HydrophobicContact CB-CD 4.03Å; F728-K748 HydrophobicContact CD1-CB 4.5Å; F728-K750 HydrophobicContact CD1-CB 3.81Å; F728-K750 HydrophobicContact CD2-CD 4.33Å; F728-K750 HydrophobicContact CE1-CB 3.8Å; F728-K750 HydrophobicContact CE2-CD 4.1Å; F728-K750 HydrophobicContact CG-CB 4.2Å; F728-K750 HydrophobicContact CZ-CB 4.18Å; F728-K750 HydrophobicContact CZ-CD 4.31Å
729	V	91.7	Very high	90.2	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.024	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	125.5	-176.2	-179.3	0	0	0	0	109.6	K748 I749 L762 W766 Q796	V729-K748 CarbonylContact O-C 3.53Å; V729-K748 WeakPolarHBondContact O-CA 3.41Å; V729-K748 WeakPolarHBondContact O-CB 3.27Å; V729-I749 PolarHBondContact N-O 3.3Å; V729-I749 PolarHBondContact O-N 2.73Å; V729-L762 HydrophobicContact CB-CD1 4.29Å; V729-L762 HydrophobicContact CB-CD2 4.4Å; V729-L762 HydrophobicContact CB-CG 4.5Å; V729-L762 HydrophobicContact CG1-CD1 4.45Å; V729-L762 HydrophobicContact CG2-CD2 4.17Å; V729-W766 HydrophobicContact CG1-CB 3.9Å; V729-W766 HydrophobicContact CG1-CD2 4.05Å; V729-W766 HydrophobicContact CG1-CE3 3.59Å; V729-W766 HydrophobicContact CG1-CG 4.21Å; V729-W766 HydrophobicContact CG1-CZ3 4.49Å; V729-Q796 HydrophobicContact CG1-CG 4.46Å; V729-Q796 HydrophobicContact CG2-CG 4.45Å
730	P	93.7	Very high	89.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	131.7	173.1	-2.6	13.6	0	0	0	111.8	K748 W766 F769 I792	P730-K748 HydrophobicContact CB-CG 4.24Å; P730-W766 HydrophobicContact CB-CZ3 4.18Å; P730-W766 VanDerWaalsContact CD-CZ3 3.48Å; P730-W766 HydrophobicContact CG-CE3 4.42Å; P730-W766 HydrophobicContact CG-CH2 4.46Å; P730-W766 HydrophobicContact CG-CZ3 3.63Å; P730-W766 VanDerWaalsContact O-CE3 3.32Å; P730-F769 HydrophobicContact CB-CD1 4.27Å; P730-F769 HydrophobicContact CB-CE1 3.7Å; P730-F769 HydrophobicContact CB-CZ 3.92Å; P730-F769 HydrophobicContact CG-CE1 4.31Å; P730-F769 WeakPolarHBondContact O-CD1 3.35Å; P730-I792 HydrophobicContact CG-CG2 4.43Å
731	V	93.5	Very high	88.3	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	-30	-179.8	-179.7	0	0	0	0	111.6	L609 F613 I747 I749 L762 Y765 F769	L609-V731 HydrophobicContact CD1-CG1 4.44Å; L609-V731 HydrophobicContact CD2-CB 4.34Å; L609-V731 HydrophobicContact CD2-CG1 3.5Å; L609-V731 VanDerWaalsContact CD2-CG1 3.5Å; F613-V731 HydrophobicContact CE2-CG1 3.56Å; F613-V731 HydrophobicContact CZ-CG1 3.77Å; V731-I747 PolarHBondContact N-O 3.48Å; V731-I749 HydrophobicContact CB-CD1 4.38Å; V731-I749 HydrophobicContact CG2-CB 4.16Å; V731-I749 HydrophobicContact CG2-CD1 4.04Å; V731-I749 HydrophobicContact CG2-CG1 4.06Å; V731-L762 HydrophobicContact CG2-CD1 3.99Å; V731-Y765 HydrophobicContact CG1-CD2 3.89Å; V731-Y765 HydrophobicContact CG1-CG 4.36Å; V731-F769 VanDerWaalsContact C-CD2 3.43Å; V731-F769 WeakPolarHBondContact O-CD2 3.34Å
732	Y	95.1	Very high	87.6	Confident	44 Å²	44	53.5 Å²	53.5	17%	0.173	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	141.3	-178.8	177	-107.5	0	0	0	112	T608 Q612 R734 C746 I747	T608-Y732 HydrophobicContact CG2-CD1 3.76Å; T608-Y732 HydrophobicContact CG2-CE1 3.81Å; T608-Y732 HydrophobicContact CG2-CG 4.27Å; Q612-Y732 VanDerWaalsContact CD-CE2 3.41Å; Q612-Y732 HydrophobicContact CG-CD2 3.72Å; Q612-Y732 HydrophobicContact CG-CE2 3.66Å; Q612-Y732 HydrophobicContact CG-CG 4.49Å; Y732-R734 HydrophobicContact CE1-CB 4Å; Y732-C746 WeakPolarHBondContact O-CA 3.28Å; Y732-I747 HydrophobicContact CD1-CD1 3.89Å; Y732-I747 HydrophobicContact CD1-CG1 4.23Å; Y732-I747 PolarHBondContact N-O 2.86Å; Y732-I747 PolarHBondContact O-N 2.98Å
733	I	95.3	Very high	87.2	Confident	9 Å²	9	53.4 Å²	53.4	5%	0.046	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	124.7	167.7	-63.5	173.8	0	0	0	107.3	L715 F744 S745 C746 F769 F773 F781 I792	L715-I733 HydrophobicContact CD2-CD1 4.32Å; I733-F744 HydrophobicContact CG2-CB 4.16Å; I733-S745 WeakPolarHBondContact CA-O 3.34Å; I733-C746 HydrophobicContact CG1-CB 4.04Å; I733-F769 HydrophobicContact CB-CE2 4.41Å; I733-F769 HydrophobicContact CD1-CE2 4.12Å; I733-F769 HydrophobicContact CD1-CZ 3.75Å; I733-F769 HydrophobicContact CG1-CE2 3.92Å; I733-F769 HydrophobicContact CG1-CZ 4.03Å; I733-F773 HydrophobicContact CD1-CD2 3.96Å; I733-F773 HydrophobicContact CD1-CE2 3.65Å; I733-F781 HydrophobicContact CB-CZ 4.18Å; I733-F781 HydrophobicContact CG2-CE1 3.93Å; I733-F781 HydrophobicContact CG2-CE2 4.42Å; I733-F781 HydrophobicContact CG2-CZ 3.67Å; I733-I792 HydrophobicContact CD1-CD1 3.99Å; I733-I792 HydrophobicContact CD1-CG2 4.2Å
734	R	93.3	Very high	87.2	Confident	122 Å²	122	53.5 Å²	53.5	46%	0.46	27%	0.271	S	S	.	.			trans	-67.4	136.3	176.3	-169.1	175.7	-179.1	-176.5	-2.9	109.5	Y732 T736 F744 S745	Y732-R734 HydrophobicContact CE1-CB 4Å; R734-T736 PolarHBondContact NE-OG1 3.25Å; R734-T736 PolarHBondContact NH2-OG1 3.13Å; R734-F744 VanDerWaalsContact O-CD1 3.32Å; R734-F744 WeakPolarHBondContact O-CD1 3.19Å; R734-S745 PolarHBondContact N-O 3.47Å
735	Q	91.9	Very high	87.4	Confident	102 Å²	102	53.5 Å²	53.5	48%	0.477	27%	0.269	S	S	.	.	S	Bend	trans	-76.4	-28.7	179.1	-64.6	177.8	34.4	0	0	112.9	F744 L776 Q780 F781	Q735-F744 WeakPolarHBondContact O-CE1 3.16Å; Q735-L776 HydrophobicContact CG-CD1 4.32Å; Q735-L776 HydrophobicContact CG-CD2 4.45Å; Q735-Q780 VanDerWaalsContact O-CG 3.22Å; Q735-Q780 WeakPolarHBondContact O-CG 3.29Å; Q735-F781 HydrophobicContact CG-CZ 4.02Å
736	T	91.1	Very high	87.7	Confident	79 Å²	79	45.8 Å²	45.8	49%	0.485	24%	0.24	S	C	.	.	S	Bend	trans	-87.5	121.5	176.1	56.9	0	0	0	0	109.6	R734	R734-T736 PolarHBondContact NE-OG1 3.25Å; R734-T736 PolarHBondContact NH2-OG1 3.13Å
737	A	86.8	Confident	88	Confident	36 Å²	36	45.1 Å²	45.1	30%	0.298	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-61.5	147.4	169.8	0	0	0	0	0	110.3	E739 F744	A737-E739 PolarHBondContact O-N 3.46Å; A737-F744 HydrophobicContact CB-CD1 4.26Å; A737-F744 HydrophobicContact CB-CD2 4.16Å; A737-F744 HydrophobicContact CB-CE1 4.12Å; A737-F744 HydrophobicContact CB-CE2 4.01Å; A737-F744 HydrophobicContact CB-CG 4.33Å; A737-F744 HydrophobicContact CB-CZ 4.01Å
738	N	83	Confident	88.3	Confident	66 Å²	66	41.3 Å²	41.3	35%	0.353	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-68.9	122.9	171.1	-176.9	-5	0	0	0	108.7	L740 T741 G742 E743	N738-L740 PolarHBondContact O-N 3.23Å; N738-L740 VanDerWaalsContact O-N 3.09Å; N738-L740 PolarHBondContact OD1-N 2.97Å; N738-T741 PolarHBondContact O-N 3.31Å; N738-G742 WeakPolarHBondContact O-CA 3.24Å; N738-G742 PolarHBondContact O-N 3.41Å; N738-E743 PolarHBondContact N-O 3.06Å
739	E	73.2	Confident	88.4	Confident	176 Å²	176	41.3 Å²	41.3	82%	0.822	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-35.3	179.8	-67.8	175.8	-176.9	0	0	112.2	P391 A737	P391-E739 WeakPolarHBondContact CG-O 3.28Å; A737-E739 PolarHBondContact O-N 3.46Å
740	L	68.1	Low	88.4	Confident	76 Å²	76	42.5 Å²	42.5	40%	0.398	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-36.1	-174.7	-67.8	169.9	0	0	0	114.4	P391 K539 N738	P391-L740 WeakPolarHBondContact CA-O 3.3Å; P391-L740 WeakPolarHBondContact CB-O 3.35Å; P391-L740 WeakPolarHBondContact CG-O 3.39Å; K539-L740 HydrophobicContact CD-CD1 3.93Å; K539-L740 VanDerWaalsContact NZ-CD1 3.31Å; N738-L740 PolarHBondContact O-N 3.23Å; N738-L740 VanDerWaalsContact O-N 3.09Å; N738-L740 PolarHBondContact OD1-N 2.97Å
741	T	75.2	Confident	88.2	Confident	29 Å²	29	43.1 Å²	43.1	18%	0.178	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-19.5	-176.8	59	0	0	0	0	112.4	N738 E743	N738-T741 PolarHBondContact O-N 3.31Å; T741-E743 PolarHBondContact O-N 2.91Å; T741-E743 WeakPolarHBondContact OG1-CB 3.31Å; T741-E743 PolarHBondContact OG1-N 2.84Å
742	G	76.4	Confident	87.8	Confident	33 Å²	33	43.4 Å²	43.4	34%	0.34	23%	0.228	S	C	.	.	S	Bend	trans	71.3	3.7	-166.9	0	0	0	0	0	113.3	N738	N738-G742 WeakPolarHBondContact O-CA 3.24Å; N738-G742 PolarHBondContact O-N 3.41Å
743	E	84	Confident	86.7	Confident	37 Å²	37	46.3 Å²	46.3	17%	0.173	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-96.7	149.1	-175.6	-59.8	170.4	171.8	0	0	111.2	G714 T716 N738 T741	G714-E743 WeakPolarHBondContact CA-OE2 3.33Å; T716-E743 HydrophobicContact CG2-CG 4.38Å; T716-E743 WeakPolarHBondContact CG2-OE1 3.25Å; N738-E743 PolarHBondContact N-O 3.06Å; T741-E743 PolarHBondContact O-N 2.91Å; T741-E743 WeakPolarHBondContact OG1-CB 3.31Å; T741-E743 PolarHBondContact OG1-N 2.84Å
744	F	92	Very high	85	Confident	15 Å²	15	52.4 Å²	52.4	7%	0.066	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-90.5	132	178	-62.3	-106.2	0	0	0	109.5	L715 I733 R734 Q735 A737 C746 Q780 F781 F784	L715-F744 WeakPolarHBondContact CB-O 3.3Å; L715-F744 PolarHBondContact N-O 2.72Å; I733-F744 HydrophobicContact CG2-CB 4.16Å; R734-F744 VanDerWaalsContact O-CD1 3.32Å; R734-F744 WeakPolarHBondContact O-CD1 3.19Å; Q735-F744 WeakPolarHBondContact O-CE1 3.16Å; A737-F744 HydrophobicContact CB-CD1 4.26Å; A737-F744 HydrophobicContact CB-CD2 4.16Å; A737-F744 HydrophobicContact CB-CE1 4.12Å; A737-F744 HydrophobicContact CB-CE2 4.01Å; A737-F744 HydrophobicContact CB-CG 4.33Å; A737-F744 HydrophobicContact CB-CZ 4.01Å; F744-C746 PolarHBondContact O-N 2.89Å; F744-Q780 HydrophobicContact CE1-CG 3.81Å; F744-Q780 HydrophobicContact CZ-CG 4.17Å; F744-F781 HydrophobicContact CD1-CD1 4.24Å; F744-F781 AromaticContact CD1-CE1 3.8Å; F744-F781 HydrophobicContact CD1-CE1 3.8Å; F744-F781 HydrophobicContact CE1-CD1 4.06Å; F744-F781 AromaticContact CE1-CE1 3.97Å; F744-F781 HydrophobicContact CE1-CE1 3.97Å; F744-F784 HydrophobicContact CB-CE1 4.35Å; F744-F784 HydrophobicContact CB-CZ 4.06Å; F744-F784 HydrophobicContact CD1-CZ 4.22Å; F744-F784 HydrophobicContact CD2-CD1 4.43Å; F744-F784 AromaticContact CD2-CE1 3.29Å; F744-F784 HydrophobicContact CD2-CE1 3.29Å; F744-F784 AromaticContact CD2-CZ 3.7Å; F744-F784 HydrophobicContact CD2-CZ 3.7Å; F744-F784 HydrophobicContact CE2-CD1 4.38Å; F744-F784 AromaticContact CE2-CE1 3.53Å; F744-F784 HydrophobicContact CE2-CE1 3.53Å; F744-F784 HydrophobicContact CE2-CZ 4.08Å; F744-F784 AromaticContact CG-CE1 3.85Å; F744-F784 HydrophobicContact CG-CE1 3.85Å; F744-F784 AromaticContact CG-CZ 3.74Å; F744-F784 HydrophobicContact CG-CZ 3.74Å; F744-F784 HydrophobicContact CZ-CE1 4.26Å; F744-F784 HydrophobicContact CZ-CZ 4.48Å
745	S	93.1	Very high	83.3	Confident	33 Å²	33	52.6 Å²	52.6	23%	0.231	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	127.7	178.3	-54.1	0	0	0	0	110.9	Y713 I733 R734	Y713-S745 WeakPolarHBondContact O-CA 3.27Å; I733-S745 WeakPolarHBondContact CA-O 3.34Å; R734-S745 PolarHBondContact N-O 3.47Å
746	C	94.9	Very high	81.5	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	134.2	177.1	-178.5	0	0	0	0	110.5	C712 Y713 L715 Y732 I733 F744	C712-C746 WeakPolarHBondContact CA-O 3.42Å; Y713-C746 HydrophobicContact CE1-CB 4.47Å; Y713-C746 PolarHBondContact N-O 3.14Å; Y713-C746 PolarHBondContact O-N 3.33Å; L715-C746 HydrophobicContact CB-CB 4.32Å; L715-C746 HydrophobicContact CD1-CB 4.08Å; Y732-C746 WeakPolarHBondContact O-CA 3.28Å; I733-C746 HydrophobicContact CG1-CB 4.04Å; F744-C746 PolarHBondContact O-N 2.89Å
747	I	96	Very high	79.6	Confident	5 Å²	5	60.2 Å²	60.2	3%	0.026	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	125.7	170.9	-57.9	176.6	0	0	0	108.4	I605 T608 V711 C712 V731 Y732 I749	I605-I747 HydrophobicContact CD1-CG2 4.23Å; I605-I747 HydrophobicContact CG1-CD1 4.47Å; I605-I747 HydrophobicContact CG1-CG2 4.07Å; I605-I747 HydrophobicContact CG2-CG2 4.38Å; T608-I747 HydrophobicContact CG2-CD1 3.74Å; V711-I747 VanDerWaalsContact O-CA 3.29Å; V711-I747 WeakPolarHBondContact O-CA 3.06Å; C712-I747 HydrophobicContact CB-CG1 4.38Å; V731-I747 PolarHBondContact N-O 3.48Å; Y732-I747 HydrophobicContact CD1-CD1 3.89Å; Y732-I747 HydrophobicContact CD1-CG1 4.23Å; Y732-I747 PolarHBondContact N-O 2.86Å; Y732-I747 PolarHBondContact O-N 2.98Å; I747-I749 HydrophobicContact CG2-CD1 4.33Å; I747-I749 HydrophobicContact CG2-CG1 4.1Å
748	K	94.5	Very high	78.2	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	147.7	168.2	-51.4	-173.8	159.8	-172.5	0	110.9	G710 V711 Y713 W723 F728 V729 P730	G710-K748 CarbonylContact C-O 3.49Å; G710-K748 VanDerWaalsContact CA-O 3.31Å; G710-K748 WeakPolarHBondContact CA-O 3.19Å; V711-K748 HydrophobicContact CG2-CB 3.75Å; V711-K748 HydrophobicContact CG2-CG 4.34Å; V711-K748 PolarHBondContact N-O 2.8Å; V711-K748 PolarHBondContact O-N 2.92Å; Y713-K748 HydrophobicContact CE1-CD 4.14Å; Y713-K748 HydrophobicContact CE1-CG 4.12Å; Y713-K748 WeakPolarHBondContact OH-CE 3.35Å; W723-K748 HydrophobicContact CB-CD 3.82Å; F728-K748 HydrophobicContact CB-CB 3.84Å; F728-K748 HydrophobicContact CB-CD 4.03Å; F728-K748 HydrophobicContact CD1-CB 4.5Å; V729-K748 CarbonylContact O-C 3.53Å; V729-K748 WeakPolarHBondContact O-CA 3.41Å; V729-K748 WeakPolarHBondContact O-CB 3.27Å; P730-K748 HydrophobicContact CB-CG 4.24Å
749	I	93.5	Very high	77.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	149.3	-174.6	-54.4	-179.3	0	0	0	109.4	I605 L609 F618 W708 L709 V729 V731 I747 W761 L762	I605-I749 HydrophobicContact CG2-CD1 3.93Å; L609-I749 HydrophobicContact CD1-CD1 3.23Å; L609-I749 HydrophobicContact CG-CD1 4.36Å; F618-I749 HydrophobicContact CZ-CD1 4.17Å; W708-I749 HydrophobicContact CB-CG2 3.89Å; W708-I749 HydrophobicContact CD2-CG2 4.44Å; W708-I749 HydrophobicContact CE3-CG2 4.15Å; W708-I749 HydrophobicContact CG-CG2 4.37Å; L709-I749 CarbonylContact O-C 3.56Å; L709-I749 WeakPolarHBondContact O-CA 3.41Å; V729-I749 PolarHBondContact N-O 3.3Å; V729-I749 PolarHBondContact O-N 2.73Å; V731-I749 HydrophobicContact CB-CD1 4.38Å; V731-I749 HydrophobicContact CG2-CB 4.16Å; V731-I749 HydrophobicContact CG2-CD1 4.04Å; V731-I749 HydrophobicContact CG2-CG1 4.06Å; I747-I749 HydrophobicContact CG2-CD1 4.33Å; I747-I749 HydrophobicContact CG2-CG1 4.1Å; I749-W761 HydrophobicContact CG2-CH2 3.98Å; I749-L762 HydrophobicContact CB-CD1 4.27Å; I749-L762 HydrophobicContact CG2-CD1 4.49Å
750	K	91.6	Very high	78	Confident	28 Å²	28	57.5 Å²	57.5	12%	0.122	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	129.9	172.7	-176.2	172.3	-175.8	172.5	0	108.7	Q649 W708 L709 K726 F728	Q649-K750 VanDerWaalsContact NE2-CE 3.28Å; W708-K750 CarbonylContact C-O 3.57Å; W708-K750 WeakPolarHBondContact CA-O 3.33Å; L709-K750 PolarHBondContact N-O 3.19Å; L709-K750 PolarHBondContact O-N 3.2Å; K726-K750 PolarHBondContact O-NZ 2.74Å; F728-K750 HydrophobicContact CD1-CB 3.81Å; F728-K750 HydrophobicContact CD2-CD 4.33Å; F728-K750 HydrophobicContact CE1-CB 3.8Å; F728-K750 HydrophobicContact CE2-CD 4.1Å; F728-K750 HydrophobicContact CG-CB 4.2Å; F728-K750 HydrophobicContact CZ-CB 4.18Å; F728-K750 HydrophobicContact CZ-CD 4.31Å
751	C	90.1	Very high	78.9	Confident	13 Å²	13	56.4 Å²	56.4	9%	0.088	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	138.4	170	-65.9	0	0	0	0	109.6	Q759 W761 L762	C751-Q759 HydrophobicContact CB-CG 4.43Å; C751-W761 WeakPolarHBondContact SG-CZ2 3.29Å; C751-L762 HydrophobicContact CB-CD2 4.49Å; C751-L762 VanDerWaalsContact SG-CD2 3.58Å
752	L	84.5	Confident	79.6	Confident	9 Å²	9	55.1 Å²	55.1	5%	0.047	27%	0.272	C	S	.	.			trans	-95.4	-29.7	176.7	-64.9	170.2	0	0	0	111.8	Q649 E653 L706 D707 L709	Q649-L752 HydrophobicContact CG-CD2 3.8Å; E653-L752 HydrophobicContact CG-CB 4.26Å; E653-L752 HydrophobicContact CG-CD2 4Å; L706-L752 HydrophobicContact CB-CD1 3.75Å; L706-L752 HydrophobicContact CD1-CD1 4.44Å; D707-L752 PolarHBondContact O-N 2.75Å; L709-L752 HydrophobicContact CB-CD1 4.25Å; L709-L752 HydrophobicContact CB-CD2 4.19Å; L709-L752 HydrophobicContact CB-CG 4.27Å
753	R	72.9	Confident	80.1	Confident	104 Å²	104	54.9 Å²	54.9	39%	0.392	26%	0.264	S	S	.	.			trans	-82.2	128.5	177.4	-68.5	-171	-177.1	165.2	15.1	111.5	D707 E755	D707-R753 IonicContact OD1-CZ 3.93Å; D707-R753 IonicContact OD1-NE 3.21Å; D707-R753 PolarHBondContact OD1-NE 3.29Å; D707-R753 IonicContact OD1-NH1 3.1Å; D707-R753 PolarHBondContact OD1-NH1 3.3Å; D707-R753 IonicContact OD1-NH2 2.71Å; D707-R753 PolarHBondContact OD1-NH2 3.09Å; R753-E755 VanDerWaalsContact C-N 3.32Å
754	N	59.8	Low	80.3	Confident	138 Å²	138	55.7 Å²	55.7	74%	0.738	28%	0.278	S	S	*	.			trans	-88.2	10.3	178.7	-90	-18.8	0	0	0	113.8	E756	N754-E756 PolarHBondContact O-N 3.03Å
755	E	57.1	Low	80.3	Confident	126 Å²	126	55.6 Å²	55.6	59%	0.589	28%	0.277	S	S	*	.			trans	-67.5	122.1	170.5	-67.2	-179	-177.9	0	0	108	R753 Q757 S758	R753-E755 VanDerWaalsContact C-N 3.32Å; E755-Q757 PolarHBondContact O-N 2.75Å; E755-S758 WeakPolarHBondContact O-CA 3.45Å; E755-S758 VanDerWaalsContact O-CB 3.25Å; E755-S758 WeakPolarHBondContact O-CB 3.35Å; E755-S758 PolarHBondContact O-N 3.39Å
756	E	53.7	Low	80.2	Confident	179 Å²	179	54.3 Å²	54.3	84%	0.836	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-52.7	-33	-173.4	-67.5	-178.9	156	0	0	112.5	N754 S758 Q759	N754-E756 PolarHBondContact O-N 3.03Å; E756-S758 VanDerWaalsContact C-N 3.31Å; E756-S758 PolarHBondContact O-N 2.82Å; E756-Q759 PolarHBondContact O-N 3.11Å
757	Q	50.5	Low	79.9	Confident	161 Å²	161	59 Å²	59	75%	0.752	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-66.4	-28	175.5	-69.2	-177.1	-12.9	0	0	113.7	E755 Q759	E755-Q757 PolarHBondContact O-N 2.75Å; Q757-Q759 PolarHBondContact O-N 2.82Å
758	S	57.4	Low	79.7	Confident	31 Å²	31	60.1 Å²	60.1	22%	0.217	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-72	-14.4	-178.1	-59.8	0	0	0	0	113.3	E755 E756 W761	E755-S758 WeakPolarHBondContact O-CA 3.45Å; E755-S758 VanDerWaalsContact O-CB 3.25Å; E755-S758 WeakPolarHBondContact O-CB 3.35Å; E755-S758 PolarHBondContact O-N 3.39Å; E756-S758 VanDerWaalsContact C-N 3.31Å; E756-S758 PolarHBondContact O-N 2.82Å; S758-W761 PolarHBondContact O-NE1 3.07Å
759	Q	70.8	Confident	79.6	Confident	51 Å²	51	60.6 Å²	60.6	24%	0.238	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-97.7	-5.1	-175.3	-64.8	-171.4	2.3	0	0	114	C751 E756 Q757 L762 T763 L798	C751-Q759 HydrophobicContact CB-CG 4.43Å; E756-Q759 PolarHBondContact O-N 3.11Å; Q757-Q759 PolarHBondContact O-N 2.82Å; Q759-L762 PolarHBondContact O-N 2.68Å; Q759-T763 PolarHBondContact O-N 3.28Å; Q759-T763 VanDerWaalsContact O-N 3.09Å; Q759-T763 PolarHBondContact O-OG1 2.79Å; Q759-L798 HydrophobicContact CB-CD2 4.36Å
760	E	81.6	Confident	79.5	Confident	140 Å²	140	62 Å²	62	65%	0.654	30%	0.302	S	S	*	.	H	α-helix	trans	-63.6	-45.8	-176.8	-69.7	-169.4	167.7	0	0	112.3	L762 T763 A764	E760-L762 PolarHBondContact O-N 2.98Å; E760-T763 WeakPolarHBondContact O-CB 3.33Å; E760-T763 PolarHBondContact O-N 2.81Å; E760-A764 PolarHBondContact O-N 2.97Å
761	W	87.6	Confident	79.5	Confident	52 Å²	52	68 Å²	68	20%	0.197	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-40.3	179.8	65.9	-94.8	0	0	0	111.8	F618 L621 W708 I749 C751 S758 T763 A764 Y765	F618-W761 HydrophobicContact CD2-CE3 4.1Å; F618-W761 HydrophobicContact CD2-CH2 4.35Å; F618-W761 AromaticContact CD2-CZ3 3.93Å; F618-W761 HydrophobicContact CD2-CZ3 3.93Å; F618-W761 HydrophobicContact CE2-CE3 4.14Å; F618-W761 AromaticContact CE2-CH2 3.65Å; F618-W761 HydrophobicContact CE2-CH2 3.65Å; F618-W761 HydrophobicContact CE2-CZ2 4.39Å; F618-W761 AromaticContact CE2-CZ3 3.5Å; F618-W761 HydrophobicContact CE2-CZ3 3.5Å; L621-W761 HydrophobicContact CD1-CZ2 4.48Å; W708-W761 HydrophobicContact CB-CH2 4.32Å; W708-W761 HydrophobicContact CB-CZ2 4.42Å; I749-W761 HydrophobicContact CG2-CH2 3.98Å; C751-W761 WeakPolarHBondContact SG-CZ2 3.29Å; S758-W761 PolarHBondContact O-NE1 3.07Å; W761-T763 VanDerWaalsContact C-N 3.27Å; W761-T763 PolarHBondContact O-N 2.91Å; W761-A764 PolarHBondContact O-N 3.01Å; W761-Y765 AromaticContact CE3-CD2 3.7Å; W761-Y765 HydrophobicContact CE3-CD2 3.7Å; W761-Y765 AromaticContact CE3-CE2 3.73Å; W761-Y765 HydrophobicContact CE3-CE2 3.73Å; W761-Y765 HydrophobicContact CE3-CG 4.32Å; W761-Y765 AromaticContact CZ3-CD2 3.91Å; W761-Y765 HydrophobicContact CZ3-CD2 3.91Å; W761-Y765 HydrophobicContact CZ3-CE2 4.03Å; W761-Y765 WeakPolarHBondContact O-CB 3.5Å; W761-Y765 WeakPolarHBondContact O-CD1 3.48Å; W761-Y765 PolarHBondContact O-N 3.33Å
762	L	89.2	Confident	79.6	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-65.6	-36.3	178.2	-176.4	63	0	0	0	110.9	V729 V731 I749 C751 Q759 E760 Y765 W766 L798	V729-L762 HydrophobicContact CB-CD1 4.29Å; V729-L762 HydrophobicContact CB-CD2 4.4Å; V729-L762 HydrophobicContact CB-CG 4.5Å; V729-L762 HydrophobicContact CG1-CD1 4.45Å; V729-L762 HydrophobicContact CG2-CD2 4.17Å; V731-L762 HydrophobicContact CG2-CD1 3.99Å; I749-L762 HydrophobicContact CB-CD1 4.27Å; I749-L762 HydrophobicContact CG2-CD1 4.49Å; C751-L762 HydrophobicContact CB-CD2 4.49Å; C751-L762 VanDerWaalsContact SG-CD2 3.58Å; Q759-L762 PolarHBondContact O-N 2.68Å; E760-L762 PolarHBondContact O-N 2.98Å; L762-Y765 PolarHBondContact O-N 3.23Å; L762-W766 WeakPolarHBondContact O-CB 2.96Å; L762-W766 PolarHBondContact O-N 3.16Å; L762-L798 HydrophobicContact CD2-CD2 4.11Å; L762-L798 HydrophobicContact CG-CD2 4.47Å
763	T	87.1	Confident	80.1	Confident	29 Å²	29	71.2 Å²	71.2	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-65.8	-44.2	175	-57.7	0	0	0	0	111.3	Q759 E760 W761 W766 K767 L799	Q759-T763 PolarHBondContact O-N 3.28Å; Q759-T763 VanDerWaalsContact O-N 3.09Å; Q759-T763 PolarHBondContact O-OG1 2.79Å; E760-T763 WeakPolarHBondContact O-CB 3.33Å; E760-T763 PolarHBondContact O-N 2.81Å; W761-T763 VanDerWaalsContact C-N 3.27Å; W761-T763 PolarHBondContact O-N 2.91Å; T763-W766 PolarHBondContact O-N 2.88Å; T763-K767 WeakPolarHBondContact O-CG 3.34Å; T763-K767 PolarHBondContact O-N 2.82Å; T763-L799 HydrophobicContact CG2-CD2 3.69Å
764	A	89.2	Confident	81.1	Confident	54 Å²	54	66.5 Å²	66.5	45%	0.446	32%	0.316	S	S	.	.	H	α-helix	trans	-61.6	-45.9	175.1	0	0	0	0	0	111.6	E760 W761 W766 K767 D768	E760-A764 PolarHBondContact O-N 2.97Å; W761-A764 PolarHBondContact O-N 3.01Å; A764-W766 PolarHBondContact O-N 3.14Å; A764-K767 PolarHBondContact O-N 3.25Å; A764-D768 PolarHBondContact O-N 3.34Å
765	Y	91.7	Very high	82.7	Confident	13 Å²	13	62.3 Å²	62.3	5%	0.051	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-42	177.4	-77.4	13.3	0	0	0	112	L609 F613 D615 F618 V731 W761 L762 D768 F769	L609-Y765 HydrophobicContact CD1-CD2 4.48Å; L609-Y765 HydrophobicContact CD1-CE2 4.1Å; F613-Y765 HydrophobicContact CB-CE1 4.11Å; F613-Y765 AromaticContact CD1-CD1 3.91Å; F613-Y765 HydrophobicContact CD1-CD1 3.91Å; F613-Y765 HydrophobicContact CD1-CE1 4.13Å; F613-Y765 HydrophobicContact CD1-CG 4.4Å; F613-Y765 HydrophobicContact CD2-CD1 4.44Å; F613-Y765 HydrophobicContact CD2-CD2 4.31Å; F613-Y765 HydrophobicContact CD2-CE1 4.34Å; F613-Y765 HydrophobicContact CD2-CE2 4.18Å; F613-Y765 HydrophobicContact CD2-CG 4.43Å; F613-Y765 HydrophobicContact CE1-CD1 4.11Å; F613-Y765 HydrophobicContact CE1-CG 4.21Å; F613-Y765 HydrophobicContact CE2-CD2 4.22Å; F613-Y765 HydrophobicContact CE2-CG 4.28Å; F613-Y765 HydrophobicContact CG-CD1 4.09Å; F613-Y765 AromaticContact CG-CE1 3.91Å; F613-Y765 HydrophobicContact CG-CE1 3.91Å; F613-Y765 HydrophobicContact CZ-CD1 4.48Å; F613-Y765 HydrophobicContact CZ-CG 4.15Å; D615-Y765 WeakPolarHBondContact CB-OH 3.32Å; D615-Y765 VanDerWaalsContact CG-OH 3.26Å; D615-Y765 PolarHBondContact OD2-OH 2.74Å; F618-Y765 WeakPolarHBondContact CB-OH 3.33Å; F618-Y765 AromaticContact CD2-CE2 3.87Å; F618-Y765 HydrophobicContact CD2-CE2 3.87Å; F618-Y765 HydrophobicContact CE2-CE2 4.38Å; F618-Y765 HydrophobicContact CG-CE2 4.33Å; V731-Y765 HydrophobicContact CG1-CD2 3.89Å; V731-Y765 HydrophobicContact CG1-CG 4.36Å; W761-Y765 AromaticContact CE3-CD2 3.7Å; W761-Y765 HydrophobicContact CE3-CD2 3.7Å; W761-Y765 AromaticContact CE3-CE2 3.73Å; W761-Y765 HydrophobicContact CE3-CE2 3.73Å; W761-Y765 HydrophobicContact CE3-CG 4.32Å; W761-Y765 AromaticContact CZ3-CD2 3.91Å; W761-Y765 HydrophobicContact CZ3-CD2 3.91Å; W761-Y765 HydrophobicContact CZ3-CE2 4.03Å; W761-Y765 WeakPolarHBondContact O-CB 3.5Å; W761-Y765 WeakPolarHBondContact O-CD1 3.48Å; W761-Y765 PolarHBondContact O-N 3.33Å; L762-Y765 PolarHBondContact O-N 3.23Å; Y765-D768 PolarHBondContact O-N 3.41Å; Y765-F769 WeakPolarHBondContact O-CB 3.37Å; Y765-F769 PolarHBondContact O-N 3.29Å
766	W	90.3	Very high	84.5	Confident	6 Å²	6	58.2 Å²	58.2	2%	0.023	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-47.2	174.3	168	-93.3	0	0	0	112.1	V729 P730 L762 T763 A764 D768 F769 Q770 I792 Q796 L799	V729-W766 HydrophobicContact CG1-CB 3.9Å; V729-W766 HydrophobicContact CG1-CD2 4.05Å; V729-W766 HydrophobicContact CG1-CE3 3.59Å; V729-W766 HydrophobicContact CG1-CG 4.21Å; V729-W766 HydrophobicContact CG1-CZ3 4.49Å; P730-W766 HydrophobicContact CB-CZ3 4.18Å; P730-W766 VanDerWaalsContact CD-CZ3 3.48Å; P730-W766 HydrophobicContact CG-CE3 4.42Å; P730-W766 HydrophobicContact CG-CH2 4.46Å; P730-W766 HydrophobicContact CG-CZ3 3.63Å; P730-W766 VanDerWaalsContact O-CE3 3.32Å; L762-W766 WeakPolarHBondContact O-CB 2.96Å; L762-W766 PolarHBondContact O-N 3.16Å; T763-W766 PolarHBondContact O-N 2.88Å; A764-W766 PolarHBondContact O-N 3.14Å; W766-D768 VanDerWaalsContact C-N 3.29Å; W766-D768 PolarHBondContact O-N 3.31Å; W766-F769 AromaticContact CE3-CD1 3.83Å; W766-F769 HydrophobicContact CE3-CD1 3.83Å; W766-F769 HydrophobicContact CE3-CE1 4.44Å; W766-F769 AromaticContact CZ3-CD1 3.64Å; W766-F769 HydrophobicContact CZ3-CD1 3.64Å; W766-F769 AromaticContact CZ3-CE1 3.81Å; W766-F769 HydrophobicContact CZ3-CE1 3.81Å; W766-F769 PolarHBondContact O-N 2.84Å; W766-Q770 HydrophobicContact CZ2-CB 4.4Å; W766-Q770 HydrophobicContact CZ2-CG 4.45Å; W766-Q770 VanDerWaalsContact O-CB 3.27Å; W766-Q770 WeakPolarHBondContact O-CB 3.47Å; W766-Q770 PolarHBondContact O-N 3.05Å; W766-I792 WeakPolarHBondContact CH2-O 3.16Å; W766-Q796 HydrophobicContact CD2-CG 4.29Å; W766-Q796 HydrophobicContact CE3-CG 4.36Å; W766-Q796 HydrophobicContact CH2-CG 4.16Å; W766-Q796 HydrophobicContact CZ2-CG 4.08Å; W766-Q796 HydrophobicContact CZ3-CG 4.33Å; W766-L799 HydrophobicContact CD2-CD1 4.37Å; W766-L799 HydrophobicContact CG-CD1 3.89Å
767	K	88.4	Confident	86.4	Confident	99 Å²	99	49.7 Å²	49.7	43%	0.43	24%	0.239	S	C	.	.	H	α-helix	trans	-59.1	-44.4	-179.9	-76.7	178.2	178.9	178	0	111	T763 A764 Q770 R771 D802	T763-K767 WeakPolarHBondContact O-CG 3.34Å; T763-K767 PolarHBondContact O-N 2.82Å; A764-K767 PolarHBondContact O-N 3.25Å; K767-Q770 PolarHBondContact O-N 2.72Å; K767-R771 WeakPolarHBondContact O-CB 3.45Å; K767-R771 PolarHBondContact O-N 2.83Å; K767-D802 WeakPolarHBondContact CE-OD2 3.38Å; K767-D802 IonicContact NZ-OD2 3.12Å; K767-D802 PolarHBondContact NZ-OD2 3.49Å
768	D	91.9	Very high	88.3	Confident	27 Å²	27	43.2 Å²	43.2	14%	0.144	22%	0.216	C	C	.	.	H	α-helix	trans	-69.3	-42.3	178.3	-171.8	54	0	0	0	111.8	F613 A764 Y765 W766 Q770 R771 R772	F613-D768 HydrophobicContact CE1-CB 4.06Å; F613-D768 WeakPolarHBondContact CE1-OD2 3.33Å; A764-D768 PolarHBondContact O-N 3.34Å; Y765-D768 PolarHBondContact O-N 3.41Å; W766-D768 VanDerWaalsContact C-N 3.29Å; W766-D768 PolarHBondContact O-N 3.31Å; D768-Q770 PolarHBondContact O-N 2.91Å; D768-R771 PolarHBondContact O-N 3.33Å; D768-R771 IonicContact OD1-CZ 3.35Å; D768-R771 IonicContact OD1-NE 2.6Å; D768-R771 PolarHBondContact OD1-NE 3.2Å; D768-R771 IonicContact OD1-NH2 3.4Å; D768-R771 PolarHBondContact OD1-NH2 2.99Å; D768-R772 WeakPolarHBondContact O-CB 3.44Å; D768-R772 WeakPolarHBondContact O-CG 3.48Å; D768-R772 PolarHBondContact O-N 2.96Å; D768-R772 IonicContact OD1-NE 3.34Å; D768-R772 IonicContact OD2-CZ 3.06Å; D768-R772 IonicContact OD2-NE 3.47Å; D768-R772 PolarHBondContact OD2-NE 3.11Å; D768-R772 IonicContact OD2-NH2 3.2Å; D768-R772 PolarHBondContact OD2-NH2 3.02Å
769	F	92.9	Very high	90	Very high	10 Å²	10	48.8 Å²	48.8	4%	0.044	24%	0.237	C	C	.	.	H	α-helix	trans	-56.7	-48.2	172.2	169.7	-98.5	0	0	0	111.6	P730 V731 I733 Y765 W766 R771 R772 F773 I792	P730-F769 HydrophobicContact CB-CD1 4.27Å; P730-F769 HydrophobicContact CB-CE1 3.7Å; P730-F769 HydrophobicContact CB-CZ 3.92Å; P730-F769 HydrophobicContact CG-CE1 4.31Å; P730-F769 WeakPolarHBondContact O-CD1 3.35Å; V731-F769 VanDerWaalsContact C-CD2 3.43Å; V731-F769 WeakPolarHBondContact O-CD2 3.34Å; I733-F769 HydrophobicContact CB-CE2 4.41Å; I733-F769 HydrophobicContact CD1-CE2 4.12Å; I733-F769 HydrophobicContact CD1-CZ 3.75Å; I733-F769 HydrophobicContact CG1-CE2 3.92Å; I733-F769 HydrophobicContact CG1-CZ 4.03Å; Y765-F769 WeakPolarHBondContact O-CB 3.37Å; Y765-F769 PolarHBondContact O-N 3.29Å; W766-F769 AromaticContact CE3-CD1 3.83Å; W766-F769 HydrophobicContact CE3-CD1 3.83Å; W766-F769 HydrophobicContact CE3-CE1 4.44Å; W766-F769 AromaticContact CZ3-CD1 3.64Å; W766-F769 HydrophobicContact CZ3-CD1 3.64Å; W766-F769 AromaticContact CZ3-CE1 3.81Å; W766-F769 HydrophobicContact CZ3-CE1 3.81Å; W766-F769 PolarHBondContact O-N 2.84Å; F769-R771 VanDerWaalsContact C-N 3.34Å; F769-R771 PolarHBondContact O-N 3.39Å; F769-R772 PolarHBondContact O-N 3.01Å; F769-F773 HydrophobicContact CE1-CB 4.22Å; F769-F773 HydrophobicContact CE1-CG 4.43Å; F769-F773 HydrophobicContact CE2-CB 4.35Å; F769-F773 HydrophobicContact CE2-CD2 4.43Å; F769-F773 HydrophobicContact CZ-CB 4.06Å; F769-F773 HydrophobicContact CZ-CD2 4.01Å; F769-F773 HydrophobicContact CZ-CG 4.09Å; F769-F773 WeakPolarHBondContact O-CB 3.5Å; F769-F773 PolarHBondContact O-N 3.29Å; F769-I792 HydrophobicContact CE1-CG2 3.95Å; F769-I792 HydrophobicContact CZ-CG2 3.96Å
770	Q	91.3	Very high	90.9	Very high	29 Å²	29	51.1 Å²	51.1	14%	0.136	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-46.3	179.7	-175.5	-178.7	30.3	0	0	110.7	W766 K767 D768 F773 I774 L793 F849	W766-Q770 HydrophobicContact CZ2-CB 4.4Å; W766-Q770 HydrophobicContact CZ2-CG 4.45Å; W766-Q770 VanDerWaalsContact O-CB 3.27Å; W766-Q770 WeakPolarHBondContact O-CB 3.47Å; W766-Q770 PolarHBondContact O-N 3.05Å; K767-Q770 PolarHBondContact O-N 2.72Å; D768-Q770 PolarHBondContact O-N 2.91Å; Q770-F773 PolarHBondContact O-N 2.84Å; Q770-I774 HydrophobicContact CG-CD1 3.94Å; Q770-I774 WeakPolarHBondContact O-CB 3.43Å; Q770-I774 WeakPolarHBondContact O-CD1 3.37Å; Q770-I774 VanDerWaalsContact O-CG1 3.23Å; Q770-I774 WeakPolarHBondContact O-CG1 3.37Å; Q770-I774 PolarHBondContact O-N 2.91Å; Q770-L793 HydrophobicContact CG-CD2 3.87Å; Q770-F849 PolarHBondContact NE2-O 2.88Å
771	R	90.7	Very high	91.4	Very high	154 Å²	154	44.5 Å²	44.5	58%	0.581	22%	0.217	S	C	*	.	H	α-helix	trans	-60.1	-47.9	176.4	-177.7	180	66.9	149.9	-1.1	111.8	K767 D768 F769 S775	K767-R771 WeakPolarHBondContact O-CB 3.45Å; K767-R771 PolarHBondContact O-N 2.83Å; D768-R771 PolarHBondContact O-N 3.33Å; D768-R771 IonicContact OD1-CZ 3.35Å; D768-R771 IonicContact OD1-NE 2.6Å; D768-R771 PolarHBondContact OD1-NE 3.2Å; D768-R771 IonicContact OD1-NH2 3.4Å; D768-R771 PolarHBondContact OD1-NH2 2.99Å; F769-R771 VanDerWaalsContact C-N 3.34Å; F769-R771 PolarHBondContact O-N 3.39Å; R771-S775 PolarHBondContact O-N 3.22Å
772	R	93.8	Very high	91.5	Very high	88 Å²	88	43.3 Å²	43.3	33%	0.332	22%	0.218	S	C	.	.	H	α-helix	trans	-63.6	-45.7	177.8	-69.8	-178.2	-166.1	-163.5	8.6	111.2	Q612 D768 F769 S775 L776	Q612-R772 PolarHBondContact O-NH1 3.19Å; Q612-R772 PolarHBondContact O-NH2 3.08Å; D768-R772 WeakPolarHBondContact O-CB 3.44Å; D768-R772 WeakPolarHBondContact O-CG 3.48Å; D768-R772 PolarHBondContact O-N 2.96Å; D768-R772 IonicContact OD1-NE 3.34Å; D768-R772 IonicContact OD2-CZ 3.06Å; D768-R772 IonicContact OD2-NE 3.47Å; D768-R772 PolarHBondContact OD2-NE 3.11Å; D768-R772 IonicContact OD2-NH2 3.2Å; D768-R772 PolarHBondContact OD2-NH2 3.02Å; F769-R772 PolarHBondContact O-N 3.01Å; R772-S775 CarbonylContact O-C 3.39Å; R772-S775 WeakPolarHBondContact O-CB 3.32Å; R772-S775 PolarHBondContact O-N 3.49Å; R772-S775 VanDerWaalsContact O-N 3.13Å; R772-L776 WeakPolarHBondContact O-CB 3.19Å; R772-L776 VanDerWaalsContact O-CG 3.29Å; R772-L776 WeakPolarHBondContact O-CG 3.31Å; R772-L776 PolarHBondContact O-N 2.96Å
773	F	94.2	Very high	91.5	Very high	3 Å²	3	49.2 Å²	49.2	1%	0.013	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-47.1	-178.4	-174	-103.8	0	0	0	111.7	I733 F769 Q770 S775 L776 L777 F781 F784 I792 L793	I733-F773 HydrophobicContact CD1-CD2 3.96Å; I733-F773 HydrophobicContact CD1-CE2 3.65Å; F769-F773 HydrophobicContact CE1-CB 4.22Å; F769-F773 HydrophobicContact CE1-CG 4.43Å; F769-F773 HydrophobicContact CE2-CB 4.35Å; F769-F773 HydrophobicContact CE2-CD2 4.43Å; F769-F773 HydrophobicContact CZ-CB 4.06Å; F769-F773 HydrophobicContact CZ-CD2 4.01Å; F769-F773 HydrophobicContact CZ-CG 4.09Å; F769-F773 WeakPolarHBondContact O-CB 3.5Å; F769-F773 PolarHBondContact O-N 3.29Å; Q770-F773 PolarHBondContact O-N 2.84Å; F773-S775 PolarHBondContact O-N 2.73Å; F773-L776 PolarHBondContact O-N 3.08Å; F773-L777 HydrophobicContact CD1-CD1 4.17Å; F773-L777 HydrophobicContact CD1-CD2 4.45Å; F773-L777 HydrophobicContact CD1-CG 4.16Å; F773-L777 HydrophobicContact CE1-CD1 3.95Å; F773-L777 HydrophobicContact CE1-CD2 3.71Å; F773-L777 HydrophobicContact CE1-CG 3.89Å; F773-L777 HydrophobicContact CE2-CD2 4.42Å; F773-L777 HydrophobicContact CZ-CD2 3.69Å; F773-L777 HydrophobicContact CZ-CG 4.25Å; F773-L777 WeakPolarHBondContact O-CG 3.42Å; F773-L777 PolarHBondContact O-N 2.92Å; F773-F781 AromaticContact CD2-CD2 3.98Å; F773-F781 HydrophobicContact CD2-CD2 3.98Å; F773-F781 HydrophobicContact CD2-CE2 4.03Å; F773-F781 AromaticContact CE2-CD2 3.88Å; F773-F781 HydrophobicContact CE2-CD2 3.88Å; F773-F781 HydrophobicContact CE2-CE2 4.2Å; F773-F784 HydrophobicContact CE2-CE2 4.21Å; F773-F784 HydrophobicContact CZ-CD2 4.44Å; F773-I792 HydrophobicContact CD1-CG2 4.25Å; F773-I792 HydrophobicContact CE1-CB 4.21Å; F773-I792 HydrophobicContact CE1-CG2 3.9Å; F773-I792 HydrophobicContact CE2-CD1 4.31Å; F773-I792 HydrophobicContact CE2-CG2 4.27Å; F773-I792 HydrophobicContact CZ-CB 4.18Å; F773-I792 HydrophobicContact CZ-CD1 3.87Å; F773-I792 HydrophobicContact CZ-CG2 3.91Å; F773-L793 HydrophobicContact CD1-CD1 4.1Å; F773-L793 HydrophobicContact CD1-CD2 3.85Å; F773-L793 HydrophobicContact CD1-CG 3.8Å; F773-L793 HydrophobicContact CE1-CD1 4.09Å; F773-L793 HydrophobicContact CE1-CD2 4.44Å; F773-L793 HydrophobicContact CE1-CG 3.88Å
774	I	93.3	Very high	91.7	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-55.6	-40.3	174.3	-70.8	167.2	0	0	0	111	Q770 L793 R846 F849 T850 L870	Q770-I774 HydrophobicContact CG-CD1 3.94Å; Q770-I774 WeakPolarHBondContact O-CB 3.43Å; Q770-I774 WeakPolarHBondContact O-CD1 3.37Å; Q770-I774 VanDerWaalsContact O-CG1 3.23Å; Q770-I774 WeakPolarHBondContact O-CG1 3.37Å; Q770-I774 PolarHBondContact O-N 2.91Å; I774-L793 HydrophobicContact CD1-CD2 4.42Å; I774-L793 HydrophobicContact CG1-CD1 4.31Å; I774-L793 HydrophobicContact CG1-CD2 4.03Å; I774-R846 HydrophobicContact CG2-CB 4.32Å; I774-R846 HydrophobicContact CG2-CG 4.1Å; I774-F849 HydrophobicContact CD1-CB 3.65Å; I774-F849 HydrophobicContact CG1-CB 4.28Å; I774-T850 HydrophobicContact CD1-CG2 3.85Å; I774-L870 HydrophobicContact CG1-CD1 4.41Å; I774-L870 HydrophobicContact CG2-CD1 3.93Å; I774-L870 HydrophobicContact CG2-CD2 3.72Å; I774-L870 HydrophobicContact CG2-CG 4.47Å
775	S	93.4	Very high	91.8	Very high	51 Å²	51	48 Å²	48	36%	0.357	24%	0.236	S	C	.	.	H	α-helix	trans	-72.9	-27.8	177.9	-153.8	0	0	0	0	113.8	R771 R772 F773 F779	R771-S775 PolarHBondContact O-N 3.22Å; R772-S775 CarbonylContact O-C 3.39Å; R772-S775 WeakPolarHBondContact O-CB 3.32Å; R772-S775 PolarHBondContact O-N 3.49Å; R772-S775 VanDerWaalsContact O-N 3.13Å; F773-S775 PolarHBondContact O-N 2.73Å; S775-F779 WeakPolarHBondContact O-CD2 3.37Å; S775-F779 WeakPolarHBondContact O-CE2 3.32Å
776	L	94.8	Very high	91.8	Very high	39 Å²	39	47.6 Å²	47.6	20%	0.204	23%	0.234	C	C	.	.	H	α-helix	trans	-87.2	-16.6	-178.8	-71.7	168.9	0	0	0	113.4	Q735 R772 F773 G778 F779 F781	Q735-L776 HydrophobicContact CG-CD1 4.32Å; Q735-L776 HydrophobicContact CG-CD2 4.45Å; R772-L776 WeakPolarHBondContact O-CB 3.19Å; R772-L776 VanDerWaalsContact O-CG 3.29Å; R772-L776 WeakPolarHBondContact O-CG 3.31Å; R772-L776 PolarHBondContact O-N 2.96Å; F773-L776 PolarHBondContact O-N 3.08Å; L776-G778 PolarHBondContact O-N 3.37Å; L776-F779 PolarHBondContact O-N 2.93Å; L776-F781 HydrophobicContact CB-CD2 3.48Å; L776-F781 VanDerWaalsContact CB-CD2 3.48Å; L776-F781 HydrophobicContact CB-CE2 3.59Å; L776-F781 HydrophobicContact CD1-CE2 3.84Å; L776-F781 HydrophobicContact CG-CE2 4.33Å
777	L	93.6	Very high	91.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.8	179.8	-84.1	174	0	0	0	113.8	F773 F779 F781 A782 A789 L793 M866 L870 Q871	F773-L777 HydrophobicContact CD1-CD1 4.17Å; F773-L777 HydrophobicContact CD1-CD2 4.45Å; F773-L777 HydrophobicContact CD1-CG 4.16Å; F773-L777 HydrophobicContact CE1-CD1 3.95Å; F773-L777 HydrophobicContact CE1-CD2 3.71Å; F773-L777 HydrophobicContact CE1-CG 3.89Å; F773-L777 HydrophobicContact CE2-CD2 4.42Å; F773-L777 HydrophobicContact CZ-CD2 3.69Å; F773-L777 HydrophobicContact CZ-CG 4.25Å; F773-L777 WeakPolarHBondContact O-CG 3.42Å; F773-L777 PolarHBondContact O-N 2.92Å; L777-F779 VanDerWaalsContact C-N 3.35Å; L777-F781 HydrophobicContact CD2-CB 4.25Å; L777-F781 CarbonylContact O-C 3.49Å; L777-A782 WeakPolarHBondContact O-CA 3.38Å; L777-A782 PolarHBondContact O-N 3.3Å; L777-A789 HydrophobicContact CD2-CB 4.02Å; L777-L793 HydrophobicContact CD1-CD1 3.9Å; L777-M866 HydrophobicContact CD1-CG 4.18Å; L777-M866 HydrophobicContact CD1-SD 4.31Å; L777-L870 CarbonylContact C-O 3.54Å; L777-L870 VanDerWaalsContact C-O 3.27Å; L777-L870 HydrophobicContact CB-CB 4.12Å; L777-L870 HydrophobicContact CD1-CB 3.98Å; L777-L870 HydrophobicContact CD1-CD1 3.98Å; L777-Q871 HydrophobicContact CB-CG 4.38Å; L777-Q871 HydrophobicContact CD2-CG 4.16Å
778	G	91.1	Very high	92.1	Very high	26 Å²	26	47.6 Å²	47.6	27%	0.268	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-7.9	178.6	0	0	0	0	0	114.7	L776 L870	L776-G778 PolarHBondContact O-N 3.37Å; G778-L870 WeakPolarHBondContact CA-O 3.44Å; G778-L870 PolarHBondContact N-O 2.75Å
779	F	93.2	Very high	92.2	Very high	148 Å²	148	46.3 Å²	46.3	65%	0.649	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-120.7	179.9	-62.8	-81.8	0	0	0	110.1	S775 L776 L777 F781 A782	S775-F779 WeakPolarHBondContact O-CD2 3.37Å; S775-F779 WeakPolarHBondContact O-CE2 3.32Å; L776-F779 PolarHBondContact O-N 2.93Å; L777-F779 VanDerWaalsContact C-N 3.35Å; F779-F781 PolarHBondContact O-N 2.93Å; F779-F781 VanDerWaalsContact O-N 3.12Å; F779-A782 WeakPolarHBondContact O-CB 3.43Å; F779-A782 PolarHBondContact O-N 3.41Å; F779-A782 VanDerWaalsContact O-N 3.14Å
780	Q	89.4	Confident	92.1	Very high	99 Å²	99	47.3 Å²	47.3	46%	0.463	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-64.1	-20.9	-176.1	-162.7	63.2	32	0	0	113.5	Q735 F744	Q735-Q780 VanDerWaalsContact O-CG 3.22Å; Q735-Q780 WeakPolarHBondContact O-CG 3.29Å; F744-Q780 HydrophobicContact CE1-CG 3.81Å; F744-Q780 HydrophobicContact CZ-CG 4.17Å
781	F	91.9	Very high	92.1	Very high	1 Å²	1	47 Å²	47	0%	0.004	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-90.7	3.1	-179.4	-59.9	-23.8	0	0	0	113.7	I733 Q735 F744 F773 L776 L777 F779 I783 F784 Q871	I733-F781 HydrophobicContact CB-CZ 4.18Å; I733-F781 HydrophobicContact CG2-CE1 3.93Å; I733-F781 HydrophobicContact CG2-CE2 4.42Å; I733-F781 HydrophobicContact CG2-CZ 3.67Å; Q735-F781 HydrophobicContact CG-CZ 4.02Å; F744-F781 HydrophobicContact CD1-CD1 4.24Å; F744-F781 AromaticContact CD1-CE1 3.8Å; F744-F781 HydrophobicContact CD1-CE1 3.8Å; F744-F781 HydrophobicContact CE1-CD1 4.06Å; F744-F781 AromaticContact CE1-CE1 3.97Å; F744-F781 HydrophobicContact CE1-CE1 3.97Å; F773-F781 AromaticContact CD2-CD2 3.98Å; F773-F781 HydrophobicContact CD2-CD2 3.98Å; F773-F781 HydrophobicContact CD2-CE2 4.03Å; F773-F781 AromaticContact CE2-CD2 3.88Å; F773-F781 HydrophobicContact CE2-CD2 3.88Å; F773-F781 HydrophobicContact CE2-CE2 4.2Å; L776-F781 HydrophobicContact CB-CD2 3.48Å; L776-F781 VanDerWaalsContact CB-CD2 3.48Å; L776-F781 HydrophobicContact CB-CE2 3.59Å; L776-F781 HydrophobicContact CD1-CE2 3.84Å; L776-F781 HydrophobicContact CG-CE2 4.33Å; L777-F781 HydrophobicContact CD2-CB 4.25Å; L777-F781 CarbonylContact O-C 3.49Å; F779-F781 PolarHBondContact O-N 2.93Å; F779-F781 VanDerWaalsContact O-N 3.12Å; F781-I783 PolarHBondContact O-N 3.39Å; F781-F784 HydrophobicContact CB-CD2 3.6Å; F781-F784 HydrophobicContact CB-CE2 3.57Å; F781-F784 HydrophobicContact CB-CZ 4.48Å; F781-F784 HydrophobicContact CD1-CD2 4.21Å; F781-F784 AromaticContact CD1-CE2 3.31Å; F781-F784 HydrophobicContact CD1-CE2 3.31Å; F781-F784 AromaticContact CD1-CZ 3.53Å; F781-F784 HydrophobicContact CD1-CZ 3.53Å; F781-F784 HydrophobicContact CD2-CE2 4.17Å; F781-F784 HydrophobicContact CE1-CE2 4.01Å; F781-F784 HydrophobicContact CE1-CZ 4Å; F781-F784 HydrophobicContact CG-CD2 4Å; F781-F784 AromaticContact CG-CE2 3.41Å; F781-F784 HydrophobicContact CG-CE2 3.41Å; F781-F784 VanDerWaalsContact CG-CE2 3.41Å; F781-F784 HydrophobicContact CG-CZ 4.14Å; F781-F784 WeakPolarHBondContact O-CB 3.26Å; F781-F784 PolarHBondContact O-N 2.94Å; F781-F784 VanDerWaalsContact O-N 3.11Å; F781-Q871 PolarHBondContact O-NE2 3.34Å
782	A	90.5	Very high	92.1	Very high	27 Å²	27	39.7 Å²	39.7	22%	0.223	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-61.8	-27.1	174.1	0	0	0	0	0	112	L777 F779 F784 K873	L777-A782 WeakPolarHBondContact O-CA 3.38Å; L777-A782 PolarHBondContact O-N 3.3Å; F779-A782 WeakPolarHBondContact O-CB 3.43Å; F779-A782 PolarHBondContact O-N 3.41Å; F779-A782 VanDerWaalsContact O-N 3.14Å; A782-F784 PolarHBondContact O-N 3.49Å; A782-K873 WeakPolarHBondContact O-CE 3.44Å
783	I	88.8	Confident	91.9	Very high	126 Å²	126	36 Å²	36	65%	0.646	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-69.7	-19.3	179.1	-54.4	168	0	0	0	111.8	F781	F781-I783 PolarHBondContact O-N 3.39Å
784	F	90.6	Very high	91.2	Very high	9 Å²	9	38 Å²	38	4%	0.039	22%	0.223	C	C	.	.	S	Bend	trans	-63.9	141.6	-176.3	-70.9	-31.5	0	0	0	112.8	L715 F744 F773 F781 A782 L788 Q871 K873	L715-F784 HydrophobicContact CD2-CE1 4.02Å; L715-F784 HydrophobicContact CD2-CE2 4.18Å; L715-F784 HydrophobicContact CD2-CZ 3.77Å; F744-F784 HydrophobicContact CB-CE1 4.35Å; F744-F784 HydrophobicContact CB-CZ 4.06Å; F744-F784 HydrophobicContact CD1-CZ 4.22Å; F744-F784 HydrophobicContact CD2-CD1 4.43Å; F744-F784 AromaticContact CD2-CE1 3.29Å; F744-F784 HydrophobicContact CD2-CE1 3.29Å; F744-F784 AromaticContact CD2-CZ 3.7Å; F744-F784 HydrophobicContact CD2-CZ 3.7Å; F744-F784 HydrophobicContact CE2-CD1 4.38Å; F744-F784 AromaticContact CE2-CE1 3.53Å; F744-F784 HydrophobicContact CE2-CE1 3.53Å; F744-F784 HydrophobicContact CE2-CZ 4.08Å; F744-F784 AromaticContact CG-CE1 3.85Å; F744-F784 HydrophobicContact CG-CE1 3.85Å; F744-F784 AromaticContact CG-CZ 3.74Å; F744-F784 HydrophobicContact CG-CZ 3.74Å; F744-F784 HydrophobicContact CZ-CE1 4.26Å; F744-F784 HydrophobicContact CZ-CZ 4.48Å; F773-F784 HydrophobicContact CE2-CE2 4.21Å; F773-F784 HydrophobicContact CZ-CD2 4.44Å; F781-F784 HydrophobicContact CB-CD2 3.6Å; F781-F784 HydrophobicContact CB-CE2 3.57Å; F781-F784 HydrophobicContact CB-CZ 4.48Å; F781-F784 HydrophobicContact CD1-CD2 4.21Å; F781-F784 AromaticContact CD1-CE2 3.31Å; F781-F784 HydrophobicContact CD1-CE2 3.31Å; F781-F784 AromaticContact CD1-CZ 3.53Å; F781-F784 HydrophobicContact CD1-CZ 3.53Å; F781-F784 HydrophobicContact CD2-CE2 4.17Å; F781-F784 HydrophobicContact CE1-CE2 4.01Å; F781-F784 HydrophobicContact CE1-CZ 4Å; F781-F784 HydrophobicContact CG-CD2 4Å; F781-F784 AromaticContact CG-CE2 3.41Å; F781-F784 HydrophobicContact CG-CE2 3.41Å; F781-F784 VanDerWaalsContact CG-CE2 3.41Å; F781-F784 HydrophobicContact CG-CZ 4.14Å; F781-F784 WeakPolarHBondContact O-CB 3.26Å; F781-F784 PolarHBondContact O-N 2.94Å; F781-F784 VanDerWaalsContact O-N 3.11Å; A782-F784 PolarHBondContact O-N 3.49Å; F784-L788 HydrophobicContact CB-CD2 4.47Å; F784-L788 HydrophobicContact CD1-CD2 4.09Å; F784-L788 HydrophobicContact CG-CD2 4.33Å; F784-Q871 PolarHBondContact O-NE2 3.22Å; F784-K873 PolarHBondContact O-NZ 3.26Å
785	P	91.9	Very high	90	Very high	50 Å²	50	44.7 Å²	44.7	33%	0.325	25%	0.248	S	C	.	.			trans	-57.7	140.6	168.3	-24	33.4	0	0	0	111.5	T787 L788 A789 E881	P785-T787 PolarHBondContact O-N 2.77Å; P785-L788 HydrophobicContact CB-CB 4.17Å; P785-L788 HydrophobicContact CG-CB 4.48Å; P785-L788 WeakPolarHBondContact O-CB 3.36Å; P785-L788 PolarHBondContact O-N 3.32Å; P785-A789 PolarHBondContact O-N 3.37Å; P785-E881 VanDerWaalsContact C-OE1 3.29Å; P785-E881 WeakPolarHBondContact CA-OE1 3.39Å; P785-E881 WeakPolarHBondContact CB-OE1 3.36Å
786	I	92.7	Very high	88.8	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-55	-43.1	-179.9	-61	167.6	0	0	0	109.9	L788 A789 L790 G863 A867 I878 E881 L882	I786-L788 VanDerWaalsContact C-N 3.32Å; I786-L788 PolarHBondContact O-N 3.14Å; I786-A789 PolarHBondContact O-N 3.12Å; I786-L790 VanDerWaalsContact O-CB 3.23Å; I786-L790 WeakPolarHBondContact O-CB 3.33Å; I786-L790 PolarHBondContact O-N 3.39Å; I786-G863 WeakPolarHBondContact CG2-O 3.23Å; I786-A867 HydrophobicContact CD1-CB 3.76Å; I786-A867 HydrophobicContact CG1-CB 3.91Å; I786-I878 HydrophobicContact CD1-CG1 4.27Å; I786-I878 HydrophobicContact CD1-CG2 4.19Å; I786-E881 HydrophobicContact CD1-CB 4.48Å; I786-E881 PolarHBondContact N-OE1 3.4Å; I786-L882 HydrophobicContact CD1-CD1 4.4Å; I786-L882 HydrophobicContact CD1-CD2 4.39Å; I786-L882 HydrophobicContact CD1-CG 4.19Å
787	T	91.5	Very high	87.2	Confident	96 Å²	96	44.3 Å²	44.3	59%	0.589	25%	0.245	S	C	*	.	H	α-helix	trans	-64.3	-36	178.8	55.3	0	0	0	0	112.7	P785 G791	P785-T787 PolarHBondContact O-N 2.77Å; T787-G791 PolarHBondContact O-N 3.39Å
788	L	92.9	Very high	85.4	Confident	8 Å²	8	47 Å²	47	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-71.8	-49.4	177.9	178.8	69.6	0	0	0	110.9	L715 P717 Q720 F784 P785 I786 L790 G791 I792	L715-L788 HydrophobicContact CD1-CD1 4.2Å; L715-L788 HydrophobicContact CD2-CD2 3.97Å; L715-L788 HydrophobicContact CD2-CG 4.43Å; L715-L788 HydrophobicContact CG-CD1 4.14Å; L715-L788 HydrophobicContact CG-CD2 4.07Å; L715-L788 HydrophobicContact CG-CG 4.46Å; P717-L788 HydrophobicContact CG-CD1 4.41Å; Q720-L788 HydrophobicContact CB-CD1 3.79Å; Q720-L788 HydrophobicContact CG-CD1 4.03Å; F784-L788 HydrophobicContact CB-CD2 4.47Å; F784-L788 HydrophobicContact CD1-CD2 4.09Å; F784-L788 HydrophobicContact CG-CD2 4.33Å; P785-L788 HydrophobicContact CB-CB 4.17Å; P785-L788 HydrophobicContact CG-CB 4.48Å; P785-L788 WeakPolarHBondContact O-CB 3.36Å; P785-L788 PolarHBondContact O-N 3.32Å; I786-L788 VanDerWaalsContact C-N 3.32Å; I786-L788 PolarHBondContact O-N 3.14Å; L788-L790 VanDerWaalsContact C-N 3.28Å; L788-L790 PolarHBondContact O-N 3.03Å; L788-G791 CarbonylContact O-C 3.58Å; L788-G791 PolarHBondContact O-N 2.99Å; L788-G791 VanDerWaalsContact O-N 3.12Å; L788-I792 HydrophobicContact CG-CD1 4.19Å; L788-I792 WeakPolarHBondContact O-CG1 3.1Å; L788-I792 PolarHBondContact O-N 3.39Å
789	A	93.7	Very high	83.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-40.5	178.8	0	0	0	0	0	111.4	L777 P785 I786 I792 L793 M866	L777-A789 HydrophobicContact CD2-CB 4.02Å; P785-A789 PolarHBondContact O-N 3.37Å; I786-A789 PolarHBondContact O-N 3.12Å; A789-I792 PolarHBondContact O-N 2.86Å; A789-L793 PolarHBondContact O-N 2.91Å; A789-L793 VanDerWaalsContact O-N 3.1Å; A789-M866 HydrophobicContact CB-SD 3.41Å; A789-M866 WeakPolarHBondContact CB-SD 3.42Å
790	L	91.6	Very high	81.8	Confident	31 Å²	31	42.3 Å²	42.3	16%	0.162	24%	0.243	C	C	.	.	H	α-helix	trans	-68.4	-38	174	-164.3	141.7	0	0	0	112.9	I786 L788 I792 L793 A794 T859 A862 M866	I786-L790 VanDerWaalsContact O-CB 3.23Å; I786-L790 WeakPolarHBondContact O-CB 3.33Å; I786-L790 PolarHBondContact O-N 3.39Å; L788-L790 VanDerWaalsContact C-N 3.28Å; L788-L790 PolarHBondContact O-N 3.03Å; L790-I792 PolarHBondContact O-N 3.25Å; L790-L793 PolarHBondContact O-N 3.43Å; L790-A794 PolarHBondContact O-N 2.95Å; L790-T859 HydrophobicContact CD1-CG2 4.49Å; L790-T859 WeakPolarHBondContact CD1-O 3.47Å; L790-T859 HydrophobicContact CD2-CG2 3.52Å; L790-A862 HydrophobicContact CD1-CB 3.82Å; L790-M866 HydrophobicContact CB-CE 3.82Å; L790-M866 HydrophobicContact CB-SD 4.48Å; L790-M866 HydrophobicContact CD1-CE 4.25Å; L790-M866 HydrophobicContact CG-CE 4.12Å
791	G	90.4	Very high	79.9	Confident	23 Å²	23	45.3 Å²	45.3	24%	0.237	26%	0.262	C	S	.	.	H	α-helix	trans	-65.1	-23.1	172.8	0	0	0	0	0	114	Q720 T787 L788	Q720-G791 PolarHBondContact NE2-O 3.35Å; T787-G791 PolarHBondContact O-N 3.39Å; L788-G791 CarbonylContact O-C 3.58Å; L788-G791 PolarHBondContact O-N 2.99Å; L788-G791 VanDerWaalsContact O-N 3.12Å
792	I	91.6	Very high	78.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-80	-44.5	173.9	-66.5	160.5	0	0	0	110.5	L715 Q720 P730 I733 W766 F769 F773 L788 A789 L790 A794	L715-I792 HydrophobicContact CD1-CD1 4.12Å; L715-I792 HydrophobicContact CD2-CD1 3.74Å; L715-I792 HydrophobicContact CG-CD1 4.48Å; Q720-I792 HydrophobicContact CG-CG1 4.28Å; P730-I792 HydrophobicContact CG-CG2 4.43Å; I733-I792 HydrophobicContact CD1-CD1 3.99Å; I733-I792 HydrophobicContact CD1-CG2 4.2Å; W766-I792 WeakPolarHBondContact CH2-O 3.16Å; F769-I792 HydrophobicContact CE1-CG2 3.95Å; F769-I792 HydrophobicContact CZ-CG2 3.96Å; F773-I792 HydrophobicContact CD1-CG2 4.25Å; F773-I792 HydrophobicContact CE1-CB 4.21Å; F773-I792 HydrophobicContact CE1-CG2 3.9Å; F773-I792 HydrophobicContact CE2-CD1 4.31Å; F773-I792 HydrophobicContact CE2-CG2 4.27Å; F773-I792 HydrophobicContact CZ-CB 4.18Å; F773-I792 HydrophobicContact CZ-CD1 3.87Å; F773-I792 HydrophobicContact CZ-CG2 3.91Å; L788-I792 HydrophobicContact CG-CD1 4.19Å; L788-I792 WeakPolarHBondContact O-CG1 3.1Å; L788-I792 PolarHBondContact O-N 3.39Å; A789-I792 PolarHBondContact O-N 2.86Å; L790-I792 PolarHBondContact O-N 3.25Å; I792-A794 VanDerWaalsContact C-N 3.26Å; I792-A794 PolarHBondContact O-N 3.35Å
793	L	88.4	Confident	76.5	Confident	12 Å²	12	53 Å²	53	6%	0.063	30%	0.299	C	S	.	.	H	α-helix	trans	-79.2	-2.2	179.5	-75.4	172.4	0	0	0	114.6	Q770 F773 I774 L777 A789 L790 F849 M866	Q770-L793 HydrophobicContact CG-CD2 3.87Å; F773-L793 HydrophobicContact CD1-CD1 4.1Å; F773-L793 HydrophobicContact CD1-CD2 3.85Å; F773-L793 HydrophobicContact CD1-CG 3.8Å; F773-L793 HydrophobicContact CE1-CD1 4.09Å; F773-L793 HydrophobicContact CE1-CD2 4.44Å; F773-L793 HydrophobicContact CE1-CG 3.88Å; I774-L793 HydrophobicContact CD1-CD2 4.42Å; I774-L793 HydrophobicContact CG1-CD1 4.31Å; I774-L793 HydrophobicContact CG1-CD2 4.03Å; L777-L793 HydrophobicContact CD1-CD1 3.9Å; A789-L793 PolarHBondContact O-N 2.91Å; A789-L793 VanDerWaalsContact O-N 3.1Å; L790-L793 PolarHBondContact O-N 3.43Å; L793-F849 HydrophobicContact CB-CD1 4.33Å; L793-F849 HydrophobicContact CD1-CD1 4.05Å; L793-F849 HydrophobicContact CD1-CE1 4.42Å; L793-F849 HydrophobicContact CD1-CG 4.29Å; L793-M866 HydrophobicContact CB-CE 4.35Å; L793-M866 HydrophobicContact CD1-CE 3.6Å; L793-M866 HydrophobicContact CD1-SD 4.26Å
794	A	80.6	Confident	75	Confident	44 Å²	44	48.1 Å²	48.1	36%	0.364	28%	0.279	S	S	.	.	S	Bend	trans	-56.8	146.9	-179.5	0	0	0	0	0	112.2	L790 I792 Q796	L790-A794 PolarHBondContact O-N 2.95Å; I792-A794 VanDerWaalsContact C-N 3.26Å; I792-A794 PolarHBondContact O-N 3.35Å; A794-Q796 PolarHBondContact O-N 3.46Å; A794-Q796 VanDerWaalsContact O-N 3.09Å; A794-Q796 PolarHBondContact O-NE2 3.02Å
795	R	68	Low	73.8	Confident	144 Å²	144	53.3 Å²	53.3	54%	0.543	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-53.6	116.8	179.4	176.3	163.1	-155.8	169.4	1.1	110	A800	R795-A800 PolarHBondContact NH2-O 3.49Å
796	Q	67.9	Low	72.7	Confident	9 Å²	9	52.8 Å²	52.8	4%	0.042	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-77.4	137.2	168.8	-58.4	-58.2	-30.4	0	0	109.2	V729 W766 A794 L798 L799	V729-Q796 HydrophobicContact CG1-CG 4.46Å; V729-Q796 HydrophobicContact CG2-CG 4.45Å; W766-Q796 HydrophobicContact CD2-CG 4.29Å; W766-Q796 HydrophobicContact CE3-CG 4.36Å; W766-Q796 HydrophobicContact CH2-CG 4.16Å; W766-Q796 HydrophobicContact CZ2-CG 4.08Å; W766-Q796 HydrophobicContact CZ3-CG 4.33Å; A794-Q796 PolarHBondContact O-N 3.46Å; A794-Q796 VanDerWaalsContact O-N 3.09Å; A794-Q796 PolarHBondContact O-NE2 3.02Å; Q796-L798 PolarHBondContact O-N 3.27Å; Q796-L799 HydrophobicContact CB-CD1 4.17Å; Q796-L799 PolarHBondContact O-N 2.94Å; Q796-L799 VanDerWaalsContact O-N 3.17Å
797	P	60.4	Low	72.2	Confident	73 Å²	73	53.2 Å²	53.2	47%	0.474	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-60.3	-30.3	-179.9	19.8	-28.5	0	0	0	112.4	N727 L799 A800	N727-P797 HydrophobicContact CB-CG 4.24Å; P797-L799 PolarHBondContact O-N 3.49Å; P797-L799 VanDerWaalsContact O-N 3.13Å; P797-A800 WeakPolarHBondContact O-CB 3.41Å; P797-A800 PolarHBondContact O-N 2.89Å; P797-A800 VanDerWaalsContact O-N 3.07Å
798	L	56.6	Low	71.7	Confident	56 Å²	56	53.5 Å²	53.5	29%	0.293	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-55.4	-30.4	177	-133.4	90	0	0	0	113.3	Q759 L762 Q796 A800	Q759-L798 HydrophobicContact CB-CD2 4.36Å; L762-L798 HydrophobicContact CD2-CD2 4.11Å; L762-L798 HydrophobicContact CG-CD2 4.47Å; Q796-L798 PolarHBondContact O-N 3.27Å; L798-A800 VanDerWaalsContact C-N 3.34Å
799	L	54	Low	71.2	Confident	19 Å²	19	55.3 Å²	55.3	10%	0.099	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-98.3	23.6	-177.4	-62.7	150.8	0	0	0	112.2	T763 W766 Q796 P797 L801 D802	T763-L799 HydrophobicContact CG2-CD2 3.69Å; W766-L799 HydrophobicContact CD2-CD1 4.37Å; W766-L799 HydrophobicContact CG-CD1 3.89Å; Q796-L799 HydrophobicContact CB-CD1 4.17Å; Q796-L799 PolarHBondContact O-N 2.94Å; Q796-L799 VanDerWaalsContact O-N 3.17Å; P797-L799 PolarHBondContact O-N 3.49Å; P797-L799 VanDerWaalsContact O-N 3.13Å; L799-L801 PolarHBondContact O-N 3.46Å; L799-D802 HydrophobicContact CD2-CB 4.4Å
800	A	54.6	Low	70.8	Confident	58 Å²	58	58.5 Å²	58.5	48%	0.479	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-61.6	-30.3	171.1	0	0	0	0	0	111.5	R795 P797 L798	R795-A800 PolarHBondContact NH2-O 3.49Å; P797-A800 WeakPolarHBondContact O-CB 3.41Å; P797-A800 PolarHBondContact O-N 2.89Å; P797-A800 VanDerWaalsContact O-N 3.07Å; L798-A800 VanDerWaalsContact C-N 3.34Å
801	L	49.6	Very low	70.5	Confident	162 Å²	162	60.5 Å²	60.5	85%	0.848	36%	0.357	S	S	*	.	S	Bend	trans	-83.8	-28	-174.5	-70.8	157.9	0	0	0	114	L799 N803	L799-L801 PolarHBondContact O-N 3.46Å; L801-N803 PolarHBondContact O-N 2.95Å
802	D	55.6	Low	70.3	Confident	67 Å²	67	59.5 Å²	59.5	36%	0.358	35%	0.346	S	S	.	.			trans	-85.8	82.8	-175.5	-150.3	-2.2	0	0	0	110.5	K767 L799 G804	K767-D802 WeakPolarHBondContact CE-OD2 3.38Å; K767-D802 IonicContact NZ-OD2 3.12Å; K767-D802 PolarHBondContact NZ-OD2 3.49Å; L799-D802 HydrophobicContact CD2-CB 4.4Å; D802-G804 PolarHBondContact O-N 2.94Å
803	N	54.4	Low	70.1	Confident	122 Å²	122	66.4 Å²	66.4	65%	0.652	37%	0.372	S	S	*	.			trans	-70.4	79.3	170.4	-77.4	-27.3	0	0	0	108.3	L801 T805	L801-N803 PolarHBondContact O-N 2.95Å; N803-T805 PolarHBondContact O-N 3.12Å
804	G	58.1	Low	70.1	Confident	23 Å²	23	72 Å²	72	24%	0.237	40%	0.401	C	S	.	.			trans	-35.2	135.5	-179	0	0	0	0	0	113.1	D802 G806 K854	D802-G804 PolarHBondContact O-N 2.94Å; G804-G806 PolarHBondContact O-N 3.06Å; G804-G806 VanDerWaalsContact O-N 3.17Å; G804-K854 WeakPolarHBondContact O-CE 3.48Å; G804-K854 PolarHBondContact O-NZ 2.79Å
805	T	64.9	Low	70.4	Confident	119 Å²	119	73.7 Å²	73.7	73%	0.73	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-53.2	121.1	178.2	51.2	0	0	0	0	108.2	N803	N803-T805 PolarHBondContact O-N 3.12Å
806	G	69.5	Low	71.4	Confident	39 Å²	39	66.8 Å²	66.8	40%	0.402	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-57.2	155.7	177	0	0	0	0	0	110.7	G804 D808	G804-G806 PolarHBondContact O-N 3.06Å; G804-G806 VanDerWaalsContact O-N 3.17Å; G806-D808 PolarHBondContact O-N 3.21Å
807	I	81.3	Confident	72.5	Confident	12 Å²	12	68.6 Å²	68.6	6%	0.062	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-68	131.1	172.6	-82.3	165.8	0	0	0	109.5	L812 M847 K852 I853 V907	I807-L812 HydrophobicContact CG2-CB 3.75Å; I807-L812 HydrophobicContact CG2-CD1 3.97Å; I807-L812 HydrophobicContact CG2-CG 4.43Å; I807-M847 HydrophobicContact CD1-CB 4.3Å; I807-M847 HydrophobicContact CD1-CE 3.82Å; I807-M847 HydrophobicContact CD1-CG 4.02Å; I807-M847 HydrophobicContact CD1-SD 3.3Å; I807-M847 WeakPolarHBondContact CD1-SD 3.3Å; I807-K852 HydrophobicContact CD1-CB 3.54Å; I807-K852 HydrophobicContact CD1-CD 4.15Å; I807-K852 HydrophobicContact CD1-CG 4.42Å; I807-K852 HydrophobicContact CG1-CB 3.68Å; I807-K852 HydrophobicContact CG1-CD 3.84Å; I807-K852 HydrophobicContact CG1-CG 4.16Å; I807-I853 HydrophobicContact CD1-CG1 4.22Å; I807-V907 HydrophobicContact CG2-CG1 4.38Å; I807-V907 WeakPolarHBondContact O-CG1 3.49Å
808	D	81.9	Confident	73.8	Confident	103 Å²	103	68.4 Å²	68.4	55%	0.551	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-89.2	155.2	166.1	-167.2	12.4	0	0	0	110.7	G806 A810 E811 L812	G806-D808 PolarHBondContact O-N 3.21Å; D808-A810 PolarHBondContact O-N 3.46Å; D808-E811 PolarHBondContact O-N 2.92Å; D808-L812 PolarHBondContact O-N 3.19Å
809	R	83.1	Confident	75.5	Confident	46 Å²	46	74.2 Å²	74.2	17%	0.174	40%	0.402	C	S	.	.	H	α-helix	trans	-61.5	-32	-177.2	-179.2	165	-174.9	144.5	5.9	112.6	L812 R813 D818 C908 A911 I912	R809-L812 PolarHBondContact O-N 2.78Å; R809-R813 PolarHBondContact O-N 3.28Å; R809-D818 IonicContact NH2-OD1 3.1Å; R809-C908 VanDerWaalsContact NH1-CB 3.33Å; R809-C908 PolarHBondContact NH1-O 3.46Å; R809-A911 HydrophobicContact CB-CB 3.46Å; R809-A911 VanDerWaalsContact CB-CB 3.46Å; R809-A911 HydrophobicContact CG-CB 4.04Å; R809-I912 VanDerWaalsContact NH1-CD1 3.29Å
810	A	84.4	Confident	77.3	Confident	67 Å²	67	74.6 Å²	74.6	55%	0.554	40%	0.404	S	S	*	.	H	α-helix	trans	-62.1	-44.8	174.4	0	0	0	0	0	111.6	D808	D808-A810 PolarHBondContact O-N 3.46Å
811	E	85	Confident	79.1	Confident	73 Å²	73	72.6 Å²	72.6	34%	0.341	39%	0.385	S	S	.	.	H	α-helix	trans	-65.8	-40.3	174.1	-69	-163.4	145.8	0	0	111.4	D808 R813 I814 F815 K852	D808-E811 PolarHBondContact O-N 2.92Å; E811-R813 VanDerWaalsContact C-N 3.3Å; E811-R813 PolarHBondContact O-N 2.89Å; E811-I814 WeakPolarHBondContact O-CB 3.44Å; E811-I814 PolarHBondContact O-N 3.5Å; E811-I814 VanDerWaalsContact O-N 3.11Å; E811-F815 VanDerWaalsContact O-CD2 3.24Å; E811-F815 WeakPolarHBondContact O-CD2 3.3Å; E811-K852 IonicContact OE1-NZ 2.79Å; E811-K852 PolarHBondContact OE1-NZ 3.46Å; E811-K852 VanDerWaalsContact OE1-NZ 3.1Å; E811-K852 IonicContact OE2-NZ 3.09Å; E811-K852 PolarHBondContact OE2-NZ 3.37Å
812	L	86.6	Confident	81.1	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.005	37%	0.371	C	S	.	.	H	α-helix	trans	-58.8	-42	-179.4	-168.5	133.5	0	0	0	111.8	I807 D808 R809 I814 F815 F816 L821 L904 V907	I807-L812 HydrophobicContact CG2-CB 3.75Å; I807-L812 HydrophobicContact CG2-CD1 3.97Å; I807-L812 HydrophobicContact CG2-CG 4.43Å; D808-L812 PolarHBondContact O-N 3.19Å; R809-L812 PolarHBondContact O-N 2.78Å; L812-I814 PolarHBondContact O-N 3.14Å; L812-F815 PolarHBondContact O-N 3.01Å; L812-F815 VanDerWaalsContact O-N 3.11Å; L812-F816 PolarHBondContact O-N 3.1Å; L812-L821 HydrophobicContact CD2-CD1 4.25Å; L812-L904 HydrophobicContact CD1-CB 4.3Å; L812-L904 HydrophobicContact CD1-CD2 3.4Å; L812-L904 HydrophobicContact CD1-CG 4.4Å; L812-L904 HydrophobicContact CG-CD2 4.43Å; L812-V907 HydrophobicContact CD1-CG1 4.32Å
813	R	87.5	Confident	82.9	Confident	145 Å²	145	70.3 Å²	70.3	55%	0.547	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-22.3	177.5	-85.6	-175.5	158.6	172.9	-7.1	114.7	R809 E811 F815 F816 D818	R809-R813 PolarHBondContact O-N 3.28Å; E811-R813 VanDerWaalsContact C-N 3.3Å; E811-R813 PolarHBondContact O-N 2.89Å; R813-F815 VanDerWaalsContact C-N 3.29Å; R813-F816 WeakPolarHBondContact CA-O 3.49Å; R813-D818 IonicContact NH2-OD2 3.01Å; R813-D818 PolarHBondContact NH2-OD2 2.85Å
814	I	88	Confident	84.8	Confident	130 Å²	130	64.6 Å²	64.6	67%	0.667	33%	0.333	S	S	*	.	H	α-helix	trans	-69.8	-32.7	175.5	-61.9	171.5	0	0	0	110.4	E811 L812	E811-I814 WeakPolarHBondContact O-CB 3.44Å; E811-I814 PolarHBondContact O-N 3.5Å; E811-I814 VanDerWaalsContact O-N 3.11Å; L812-I814 PolarHBondContact O-N 3.14Å
815	F	86.8	Confident	86.5	Confident	79 Å²	79	67.4 Å²	67.4	35%	0.346	34%	0.34	S	S	.	.	H	α-helix	trans	-104.4	-29.8	-174.3	-61.5	-77.9	0	0	0	113.9	E811 L812 R813 F843 M847	E811-F815 VanDerWaalsContact O-CD2 3.24Å; E811-F815 WeakPolarHBondContact O-CD2 3.3Å; L812-F815 PolarHBondContact O-N 3.01Å; L812-F815 VanDerWaalsContact O-N 3.11Å; R813-F815 VanDerWaalsContact C-N 3.29Å; F815-F843 AromaticContact CD1-CD1 3.91Å; F815-F843 HydrophobicContact CD1-CD1 3.91Å; F815-F843 HydrophobicContact CD1-CE1 4.34Å; F815-M847 HydrophobicContact CB-CE 3.63Å; F815-M847 HydrophobicContact CD1-CE 4.32Å; F815-M847 HydrophobicContact CD2-CE 3.07Å; F815-M847 HydrophobicContact CE2-CE 3.75Å; F815-M847 HydrophobicContact CG-CE 3.42Å; F815-M847 VanDerWaalsContact CG-CE 3.42Å
816	F	89.9	Confident	87.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.322	C	S	.	.			trans	-129.1	121.9	180	-62.4	-77.8	0	0	0	110.1	L812 R813 D820 L821 L824 L840 F843 L844 M847	L812-F816 PolarHBondContact O-N 3.1Å; R813-F816 WeakPolarHBondContact CA-O 3.49Å; F816-D820 HydrophobicContact CB-CB 4.48Å; F816-D820 HydrophobicContact CD1-CB 4.31Å; F816-L821 HydrophobicContact CB-CD2 4.46Å; F816-L824 HydrophobicContact CD1-CD1 4.48Å; F816-L824 HydrophobicContact CE1-CD1 4.41Å; F816-L840 HydrophobicContact CD1-CD2 4.3Å; F816-L840 HydrophobicContact CE1-CB 4.2Å; F816-L840 HydrophobicContact CE1-CD2 4.38Å; F816-F843 HydrophobicContact CE1-CB 4.25Å; F816-F843 HydrophobicContact CE2-CB 4.31Å; F816-F843 HydrophobicContact CZ-CB 3.7Å; F816-L844 HydrophobicContact CE1-CG 4.11Å; F816-L844 HydrophobicContact CZ-CD2 3.97Å; F816-L844 HydrophobicContact CZ-CG 3.74Å; F816-M847 HydrophobicContact CE2-CE 4.27Å; F816-M847 HydrophobicContact CE2-SD 3.8Å
817	S	90.1	Very high	89	Confident	46 Å²	46	63.9 Å²	63.9	32%	0.322	31%	0.305	S	S	.	.			trans	-73.4	162.6	167.2	75	0	0	0	0	110.7	Y819 D820 L821	S817-Y819 PolarHBondContact O-N 2.78Å; S817-Y819 VanDerWaalsContact O-N 3.17Å; S817-Y819 PolarHBondContact OG-N 2.83Å; S817-D820 VanDerWaalsContact CB-OD2 3.28Å; S817-D820 WeakPolarHBondContact CB-OD2 3.42Å; S817-D820 PolarHBondContact N-OD2 3.24Å; S817-D820 WeakPolarHBondContact O-CB 2.98Å; S817-D820 PolarHBondContact O-N 3.2Å; S817-D820 PolarHBondContact OG-N 2.95Å; S817-D820 PolarHBondContact OG-OD2 3.03Å; S817-L821 PolarHBondContact O-N 3.46Å
818	D	87.9	Confident	89.5	Confident	69 Å²	69	63.8 Å²	63.8	37%	0.369	31%	0.306	S	S	.	.	H	α-helix	trans	-61.8	-23.6	174.5	-64.7	-34	0	0	0	111.4	R809 R813 K822	R809-D818 IonicContact NH2-OD1 3.1Å; R813-D818 IonicContact NH2-OD2 3.01Å; R813-D818 PolarHBondContact NH2-OD2 2.85Å; D818-K822 PolarHBondContact O-N 2.92Å
819	Y	92.1	Very high	90.1	Very high	179 Å²	179	63.9 Å²	63.9	70%	0.702	30%	0.303	S	S	*	.	H	α-helix	trans	-75	-33.9	172.8	-59.4	-72.5	0	0	0	112.8	S817 K822 R823	S817-Y819 PolarHBondContact O-N 2.78Å; S817-Y819 VanDerWaalsContact O-N 3.17Å; S817-Y819 PolarHBondContact OG-N 2.83Å; Y819-K822 WeakPolarHBondContact O-CB 3.49Å; Y819-K822 PolarHBondContact O-N 3Å; Y819-R823 WeakPolarHBondContact O-CG 3.4Å; Y819-R823 PolarHBondContact O-N 3.4Å
820	D	92.9	Very high	90.5	Very high	27 Å²	27	67 Å²	67	14%	0.144	32%	0.323	C	S	.	.	H	α-helix	trans	-68.5	-37.2	178.4	-61	-44.5	0	0	0	111.5	F816 S817 K822 R823 L824 L840	F816-D820 HydrophobicContact CB-CB 4.48Å; F816-D820 HydrophobicContact CD1-CB 4.31Å; S817-D820 VanDerWaalsContact CB-OD2 3.28Å; S817-D820 WeakPolarHBondContact CB-OD2 3.42Å; S817-D820 PolarHBondContact N-OD2 3.24Å; S817-D820 WeakPolarHBondContact O-CB 2.98Å; S817-D820 PolarHBondContact O-N 3.2Å; S817-D820 PolarHBondContact OG-N 2.95Å; S817-D820 PolarHBondContact OG-OD2 3.03Å; D820-K822 VanDerWaalsContact C-N 3.33Å; D820-K822 PolarHBondContact O-N 2.99Å; D820-R823 WeakPolarHBondContact O-CB 3.09Å; D820-R823 PolarHBondContact O-N 2.87Å; D820-R823 IonicContact OD1-CZ 3.03Å; D820-R823 IonicContact OD1-NH1 3.58Å; D820-R823 PolarHBondContact OD1-NH1 2.81Å; D820-L824 WeakPolarHBondContact O-CG 3.34Å; D820-L824 PolarHBondContact O-N 3.31Å; D820-L840 HydrophobicContact CB-CD1 3.83Å; D820-L840 HydrophobicContact CB-CD2 3.8Å; D820-L840 HydrophobicContact CB-CG 4.49Å
821	L	91.2	Very high	90.8	Very high	15 Å²	15	69.5 Å²	69.5	8%	0.079	33%	0.327	C	S	.	.	H	α-helix	trans	-60.4	-42.4	171.7	-65.9	178	0	0	0	111.5	L812 F816 S817 R823 L824 E825 L904	L812-L821 HydrophobicContact CD2-CD1 4.25Å; F816-L821 HydrophobicContact CB-CD2 4.46Å; S817-L821 PolarHBondContact O-N 3.46Å; L821-R823 PolarHBondContact O-N 3.43Å; L821-L824 PolarHBondContact O-N 2.85Å; L821-E825 WeakPolarHBondContact O-CB 3.48Å; L821-E825 PolarHBondContact O-N 3Å; L821-L904 HydrophobicContact CD2-CB 4.13Å; L821-L904 HydrophobicContact CD2-CD1 4Å
822	K	92.1	Very high	91.1	Very high	126 Å²	126	68.3 Å²	68.3	55%	0.548	32%	0.324	S	S	.	.	H	α-helix	trans	-63.7	-38.9	174	-72.7	179.3	178.3	178.7	0	112.5	D818 Y819 D820 E825 M826	D818-K822 PolarHBondContact O-N 2.92Å; Y819-K822 WeakPolarHBondContact O-CB 3.49Å; Y819-K822 PolarHBondContact O-N 3Å; D820-K822 VanDerWaalsContact C-N 3.33Å; D820-K822 PolarHBondContact O-N 2.99Å; K822-E825 WeakPolarHBondContact O-CB 3.39Å; K822-E825 PolarHBondContact O-N 2.96Å; K822-M826 WeakPolarHBondContact O-CG 3.4Å; K822-M826 PolarHBondContact O-N 2.95Å
823	R	94.1	Very high	91.3	Very high	55 Å²	55	72.5 Å²	72.5	21%	0.208	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-44.5	175.6	-71	165	63.6	-160.7	7.7	111.5	Y819 D820 L821 E825 M826 Y827 L836 D839 L840	Y819-R823 WeakPolarHBondContact O-CG 3.4Å; Y819-R823 PolarHBondContact O-N 3.4Å; D820-R823 WeakPolarHBondContact O-CB 3.09Å; D820-R823 PolarHBondContact O-N 2.87Å; D820-R823 IonicContact OD1-CZ 3.03Å; D820-R823 IonicContact OD1-NH1 3.58Å; D820-R823 PolarHBondContact OD1-NH1 2.81Å; L821-R823 PolarHBondContact O-N 3.43Å; R823-E825 VanDerWaalsContact C-N 3.28Å; R823-E825 PolarHBondContact O-N 3.4Å; R823-M826 HydrophobicContact CB-CE 4.45Å; R823-M826 HydrophobicContact CG-CE 4.07Å; R823-M826 PolarHBondContact O-N 3.1Å; R823-Y827 PolarHBondContact O-N 2.92Å; R823-Y827 VanDerWaalsContact O-N 3.08Å; R823-L836 PolarHBondContact NE-O 3.29Å; R823-L836 PolarHBondContact NH2-O 2.99Å; R823-D839 IonicContact CZ-OD1 3.32Å; R823-D839 IonicContact CZ-OD2 2.76Å; R823-D839 IonicContact NH1-OD1 3.68Å; R823-D839 IonicContact NH1-OD2 3.43Å; R823-D839 PolarHBondContact NH1-OD2 3.33Å; R823-D839 IonicContact NH2-OD1 2.81Å; R823-D839 PolarHBondContact NH2-OD1 3.4Å; R823-D839 IonicContact NH2-OD2 2.87Å; R823-D839 PolarHBondContact NH2-OD2 2.99Å; R823-L840 HydrophobicContact CB-CD1 4.49Å
824	L	93.4	Very high	91.4	Very high	2 Å²	2	66.9 Å²	66.9	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-39.5	173.5	-70.9	170.7	0	0	0	111.5	F816 D820 L821 Y827 S828 I837 L840 L844 V897 L901 L904	F816-L824 HydrophobicContact CD1-CD1 4.48Å; F816-L824 HydrophobicContact CE1-CD1 4.41Å; D820-L824 WeakPolarHBondContact O-CG 3.34Å; D820-L824 PolarHBondContact O-N 3.31Å; L821-L824 PolarHBondContact O-N 2.85Å; L824-Y827 PolarHBondContact O-N 3.31Å; L824-S828 VanDerWaalsContact O-CB 3.32Å; L824-S828 WeakPolarHBondContact O-CB 3.33Å; L824-S828 PolarHBondContact O-N 3.31Å; L824-I837 HydrophobicContact CD2-CB 4.17Å; L824-I837 HydrophobicContact CD2-CD1 4.32Å; L824-I837 HydrophobicContact CD2-CG2 4.09Å; L824-L840 HydrophobicContact CD1-CD1 4.34Å; L824-L840 HydrophobicContact CD2-CB 4.49Å; L824-L840 HydrophobicContact CD2-CD1 4.09Å; L824-L840 HydrophobicContact CG-CD1 3.84Å; L824-L844 HydrophobicContact CD1-CD1 4.17Å; L824-L844 HydrophobicContact CD2-CD1 3.8Å; L824-V897 HydrophobicContact CB-CG1 4.41Å; L824-V897 HydrophobicContact CD2-CG1 3.94Å; L824-L901 HydrophobicContact CB-CD1 4.07Å; L824-L904 HydrophobicContact CD1-CD1 4.36Å
825	E	93.5	Very high	91.5	Very high	83 Å²	83	67 Å²	67	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-63.1	-48.9	175.5	-171.4	175.9	-168.9	0	0	112.5	L821 K822 R823 Y827 S828 Q829 L901	L821-E825 WeakPolarHBondContact O-CB 3.48Å; L821-E825 PolarHBondContact O-N 3Å; K822-E825 WeakPolarHBondContact O-CB 3.39Å; K822-E825 PolarHBondContact O-N 2.96Å; R823-E825 VanDerWaalsContact C-N 3.28Å; R823-E825 PolarHBondContact O-N 3.4Å; E825-Y827 VanDerWaalsContact C-N 3.29Å; E825-Y827 PolarHBondContact O-N 3.46Å; E825-S828 WeakPolarHBondContact O-CB 3.48Å; E825-S828 PolarHBondContact O-N 3.41Å; E825-S828 PolarHBondContact O-OG 2.96Å; E825-Q829 WeakPolarHBondContact O-CG 3.45Å; E825-Q829 PolarHBondContact O-N 3.08Å; E825-Q829 PolarHBondContact OE1-NE2 3.18Å; E825-L901 VanDerWaalsContact CA-CD2 3.5Å; E825-L901 HydrophobicContact CB-CD2 3.86Å; E825-L901 HydrophobicContact CG-CD2 4.19Å
826	M	94	Very high	91.8	Very high	72 Å²	72	66.4 Å²	66.4	36%	0.355	32%	0.324	S	S	.	.	H	α-helix	trans	-57.9	-41.3	176.7	-69.1	-171.9	-67.9	0	0	111.8	K822 R823 Q829 N830 L831 V832 L836	K822-M826 WeakPolarHBondContact O-CG 3.4Å; K822-M826 PolarHBondContact O-N 2.95Å; R823-M826 HydrophobicContact CB-CE 4.45Å; R823-M826 HydrophobicContact CG-CE 4.07Å; R823-M826 PolarHBondContact O-N 3.1Å; M826-Q829 PolarHBondContact O-N 3.08Å; M826-N830 PolarHBondContact O-N 3.23Å; M826-L831 WeakPolarHBondContact O-CB 3.13Å; M826-L831 PolarHBondContact O-N 3.37Å; M826-V832 VanDerWaalsContact C-CG2 3.45Å; M826-V832 HydrophobicContact CB-CG2 3.54Å; M826-L836 HydrophobicContact CE-CD2 4.25Å
827	Y	93.9	Very high	91.9	Very high	11 Å²	11	66.4 Å²	66.4	4%	0.043	32%	0.324	C	S	.	.	H	α-helix	trans	-65.7	-42.5	174.5	-178.6	-102.5	0	0	0	111.9	R823 L824 E825 Q829 N830 V832 H834 I837 F893 N894 V897	R823-Y827 PolarHBondContact O-N 2.92Å; R823-Y827 VanDerWaalsContact O-N 3.08Å; L824-Y827 PolarHBondContact O-N 3.31Å; E825-Y827 VanDerWaalsContact C-N 3.29Å; E825-Y827 PolarHBondContact O-N 3.46Å; Y827-Q829 PolarHBondContact O-N 3.34Å; Y827-N830 WeakPolarHBondContact O-CA 3.36Å; Y827-N830 PolarHBondContact O-N 3.45Å; Y827-V832 VanDerWaalsContact CD2-O 3.24Å; Y827-V832 WeakPolarHBondContact CD2-O 3.37Å; Y827-H834 HydrophobicContact CE2-CB 3.67Å; Y827-H834 VanDerWaalsContact CE2-N 3.35Å; Y827-I837 HydrophobicContact CD1-CD1 3.29Å; Y827-I837 HydrophobicContact CD1-CG1 4.3Å; Y827-I837 HydrophobicContact CD2-CD1 4.23Å; Y827-I837 HydrophobicContact CD2-CG1 4.44Å; Y827-I837 HydrophobicContact CE1-CD1 3.66Å; Y827-I837 HydrophobicContact CG-CD1 3.61Å; Y827-I837 HydrophobicContact CG-CG1 4.16Å; Y827-I837 HydrophobicContact CG-CG2 4.39Å; Y827-F893 AromaticContact CE1-CD1 3.94Å; Y827-F893 HydrophobicContact CE1-CD1 3.94Å; Y827-F893 AromaticContact CE1-CE1 3.82Å; Y827-F893 HydrophobicContact CE1-CE1 3.82Å; Y827-F893 AromaticContact CZ-CD1 3.87Å; Y827-F893 AromaticContact CZ-CE1 3.88Å; Y827-F893 VanDerWaalsContact OH-CD1 3.23Å; Y827-F893 WeakPolarHBondContact OH-CD1 3.26Å; Y827-N894 HydrophobicContact CE1-CB 4.1Å; Y827-N894 PolarHBondContact O-ND2 2.95Å; Y827-V897 HydrophobicContact CD1-CB 4.1Å; Y827-V897 HydrophobicContact CD1-CG1 4.03Å; Y827-V897 HydrophobicContact CD1-CG2 4Å; Y827-V897 HydrophobicContact CE1-CB 4.33Å; Y827-V897 HydrophobicContact CE1-CG2 3.95Å
828	S	91.5	Very high	92	Very high	11 Å²	11	67.2 Å²	67.2	8%	0.077	33%	0.327	C	S	.	.	H	α-helix	trans	-60.8	-26.7	178.7	87.6	0	0	0	0	113.5	L824 E825 R898	L824-S828 VanDerWaalsContact O-CB 3.32Å; L824-S828 WeakPolarHBondContact O-CB 3.33Å; L824-S828 PolarHBondContact O-N 3.31Å; E825-S828 WeakPolarHBondContact O-CB 3.48Å; E825-S828 PolarHBondContact O-N 3.41Å; E825-S828 PolarHBondContact O-OG 2.96Å; S828-R898 PolarHBondContact O-NH1 3.35Å
829	Q	93.3	Very high	92.2	Very high	105 Å²	105	67.8 Å²	67.8	49%	0.491	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	4.5	175.3	-65.8	177.2	6.5	0	0	113.1	E825 M826 Y827 L831	E825-Q829 WeakPolarHBondContact O-CG 3.45Å; E825-Q829 PolarHBondContact O-N 3.08Å; E825-Q829 PolarHBondContact OE1-NE2 3.18Å; M826-Q829 PolarHBondContact O-N 3.08Å; Y827-Q829 PolarHBondContact O-N 3.34Å; Q829-L831 VanDerWaalsContact C-N 3.25Å; Q829-L831 HydrophobicContact CB-CD1 4.17Å; Q829-L831 HydrophobicContact CB-CG 4.03Å; Q829-L831 PolarHBondContact O-N 3.41Å
830	N	91.3	Very high	92.2	Very high	111 Å²	111	59.5 Å²	59.5	59%	0.594	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	26.6	-176.3	-60.9	-38	0	0	0	114.4	M826 Y827 N894	M826-N830 PolarHBondContact O-N 3.23Å; Y827-N830 WeakPolarHBondContact O-CA 3.36Å; Y827-N830 PolarHBondContact O-N 3.45Å; N830-N894 PolarHBondContact OD1-ND2 2.94Å
831	L	92.2	Very high	92.2	Very high	119 Å²	119	58.4 Å²	58.4	62%	0.623	29%	0.292	S	S	*	.	S	Bend	trans	-83	-19.8	179	-62.8	175	0	0	0	113.1	M826 Q829	M826-L831 WeakPolarHBondContact O-CB 3.13Å; M826-L831 PolarHBondContact O-N 3.37Å; Q829-L831 VanDerWaalsContact C-N 3.25Å; Q829-L831 HydrophobicContact CB-CD1 4.17Å; Q829-L831 HydrophobicContact CB-CG 4.03Å; Q829-L831 PolarHBondContact O-N 3.41Å
832	V	90.8	Very high	92.3	Very high	48 Å²	48	59.4 Å²	59.4	29%	0.291	30%	0.3	S	S	.	.	S	Bend	trans	-139.2	155.8	-174.5	-86.3	0	0	0	0	110	M826 Y827 L836	M826-V832 VanDerWaalsContact C-CG2 3.45Å; M826-V832 HydrophobicContact CB-CG2 3.54Å; Y827-V832 VanDerWaalsContact CD2-O 3.24Å; Y827-V832 WeakPolarHBondContact CD2-O 3.37Å; V832-L836 HydrophobicContact CB-CD2 3.89Å; V832-L836 HydrophobicContact CG1-CD2 3.68Å; V832-L836 HydrophobicContact CG2-CD2 3.93Å
833	D	90.1	Very high	92.3	Very high	90 Å²	90	57.5 Å²	57.5	48%	0.481	29%	0.292	S	S	.	.			trans	-79.8	160.4	176.7	-169.7	15.9	0	0	0	111.7	H835 L836	D833-H835 PolarHBondContact O-N 2.79Å; D833-H835 VanDerWaalsContact O-N 3.16Å; D833-H835 IonicContact OD2-CE1 2.64Å; D833-H835 PolarHBondContact OD2-CE1 3.46Å; D833-H835 IonicContact OD2-CG 3.88Å; D833-H835 IonicContact OD2-ND1 3.44Å; D833-H835 PolarHBondContact OD2-ND1 3.11Å; D833-L836 PolarHBondContact O-N 2.85Å; D833-L836 VanDerWaalsContact O-N 3.15Å
834	H	89.4	Confident	92.2	Very high	27 Å²	27	55 Å²	55	13%	0.125	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-61.2	-26.1	-174.5	76.5	-73.5	0	0	0	113.3	Y827 L836 I837 T838 F893	Y827-H834 HydrophobicContact CE2-CB 3.67Å; Y827-H834 VanDerWaalsContact CE2-N 3.35Å; H834-L836 PolarHBondContact O-N 3.37Å; H834-L836 VanDerWaalsContact O-N 3.12Å; H834-I837 WeakPolarHBondContact O-CG1 3.46Å; H834-I837 PolarHBondContact O-N 2.96Å; H834-T838 PolarHBondContact O-N 3.46Å; H834-T838 PolarHBondContact O-OG1 2.82Å; H834-T838 VanDerWaalsContact O-OG1 3.12Å; H834-F893 HydrophobicContact CB-CD1 4.47Å; H834-F893 HydrophobicContact CB-CE1 3.98Å
835	H	90.7	Very high	92.2	Very high	131 Å²	131	55 Å²	55	61%	0.606	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-54.4	-29.3	175.7	-65.1	100.6	0	0	0	113.2	D833 I837 T838	D833-H835 PolarHBondContact O-N 2.79Å; D833-H835 VanDerWaalsContact O-N 3.16Å; D833-H835 IonicContact OD2-CE1 2.64Å; D833-H835 PolarHBondContact OD2-CE1 3.46Å; D833-H835 IonicContact OD2-CG 3.88Å; D833-H835 IonicContact OD2-ND1 3.44Å; D833-H835 PolarHBondContact OD2-ND1 3.11Å; H835-I837 VanDerWaalsContact C-N 3.26Å; H835-I837 PolarHBondContact O-N 3.48Å; H835-T838 WeakPolarHBondContact CA-OG1 3.43Å
836	L	92.6	Very high	92.1	Very high	68 Å²	68	55.3 Å²	55.3	36%	0.356	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-73.6	-14.9	178.5	-168.1	65.9	0	0	0	113.2	R823 M826 V832 D833 H834	R823-L836 PolarHBondContact NE-O 3.29Å; R823-L836 PolarHBondContact NH2-O 2.99Å; M826-L836 HydrophobicContact CE-CD2 4.25Å; V832-L836 HydrophobicContact CB-CD2 3.89Å; V832-L836 HydrophobicContact CG1-CD2 3.68Å; V832-L836 HydrophobicContact CG2-CD2 3.93Å; D833-L836 PolarHBondContact O-N 2.85Å; D833-L836 VanDerWaalsContact O-N 3.15Å; H834-L836 PolarHBondContact O-N 3.37Å; H834-L836 VanDerWaalsContact O-N 3.12Å
837	I	93	Very high	91.8	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	0.4	-178.6	62.4	160.6	0	0	0	113.1	L824 Y827 H834 H835 D839 L840 L841 F893 V897	L824-I837 HydrophobicContact CD2-CB 4.17Å; L824-I837 HydrophobicContact CD2-CD1 4.32Å; L824-I837 HydrophobicContact CD2-CG2 4.09Å; Y827-I837 HydrophobicContact CD1-CD1 3.29Å; Y827-I837 HydrophobicContact CD1-CG1 4.3Å; Y827-I837 HydrophobicContact CD2-CD1 4.23Å; Y827-I837 HydrophobicContact CD2-CG1 4.44Å; Y827-I837 HydrophobicContact CE1-CD1 3.66Å; Y827-I837 HydrophobicContact CG-CD1 3.61Å; Y827-I837 HydrophobicContact CG-CG1 4.16Å; Y827-I837 HydrophobicContact CG-CG2 4.39Å; H834-I837 WeakPolarHBondContact O-CG1 3.46Å; H834-I837 PolarHBondContact O-N 2.96Å; H835-I837 VanDerWaalsContact C-N 3.26Å; H835-I837 PolarHBondContact O-N 3.48Å; I837-D839 PolarHBondContact O-N 3.01Å; I837-L840 WeakPolarHBondContact O-CB 3.38Å; I837-L840 PolarHBondContact O-N 3Å; I837-L841 HydrophobicContact CD1-CD2 4.19Å; I837-L841 WeakPolarHBondContact O-CG 3.43Å; I837-L841 PolarHBondContact O-N 3.27Å; I837-F893 HydrophobicContact CD1-CE1 3.88Å; I837-F893 HydrophobicContact CD1-CZ 3.92Å; I837-V897 HydrophobicContact CD1-CG1 4.47Å; I837-V897 HydrophobicContact CD1-CG2 3.8Å
838	T	91.4	Very high	91.7	Very high	63 Å²	63	53.2 Å²	53.2	39%	0.387	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-35	-174.6	-53.2	0	0	0	0	112.9	H834 H835 L840 L841 P842	H834-T838 PolarHBondContact O-N 3.46Å; H834-T838 PolarHBondContact O-OG1 2.82Å; H834-T838 VanDerWaalsContact O-OG1 3.12Å; H835-T838 WeakPolarHBondContact CA-OG1 3.43Å; T838-L840 VanDerWaalsContact C-N 3.26Å; T838-L840 PolarHBondContact O-N 2.79Å; T838-L841 PolarHBondContact O-N 3.21Å; T838-P842 WeakPolarHBondContact O-CD 3.43Å
839	D	92.3	Very high	91.5	Very high	80 Å²	80	53.6 Å²	53.6	43%	0.428	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-27.3	174.6	59	-41.3	0	0	0	113.4	R823 I837 P842	R823-D839 IonicContact CZ-OD1 3.32Å; R823-D839 IonicContact CZ-OD2 2.76Å; R823-D839 IonicContact NH1-OD1 3.68Å; R823-D839 IonicContact NH1-OD2 3.43Å; R823-D839 PolarHBondContact NH1-OD2 3.33Å; R823-D839 IonicContact NH2-OD1 2.81Å; R823-D839 PolarHBondContact NH2-OD1 3.4Å; R823-D839 IonicContact NH2-OD2 2.87Å; R823-D839 PolarHBondContact NH2-OD2 2.99Å; I837-D839 PolarHBondContact O-N 3.01Å; D839-P842 WeakPolarHBondContact O-CD 3.5Å
840	L	93.3	Very high	91.2	Very high	5 Å²	5	51 Å²	51	3%	0.026	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-19.5	-177.9	-57.4	179.4	0	0	0	113.1	F816 D820 R823 L824 I837 T838 F843 L844	F816-L840 HydrophobicContact CD1-CD2 4.3Å; F816-L840 HydrophobicContact CE1-CB 4.2Å; F816-L840 HydrophobicContact CE1-CD2 4.38Å; D820-L840 HydrophobicContact CB-CD1 3.83Å; D820-L840 HydrophobicContact CB-CD2 3.8Å; D820-L840 HydrophobicContact CB-CG 4.49Å; R823-L840 HydrophobicContact CB-CD1 4.49Å; L824-L840 HydrophobicContact CD1-CD1 4.34Å; L824-L840 HydrophobicContact CD2-CB 4.49Å; L824-L840 HydrophobicContact CD2-CD1 4.09Å; L824-L840 HydrophobicContact CG-CD1 3.84Å; I837-L840 WeakPolarHBondContact O-CB 3.38Å; I837-L840 PolarHBondContact O-N 3Å; T838-L840 VanDerWaalsContact C-N 3.26Å; T838-L840 PolarHBondContact O-N 2.79Å; L840-F843 PolarHBondContact O-N 2.98Å; L840-L844 PolarHBondContact O-N 3.11Å; L840-L844 VanDerWaalsContact O-N 3.15Å
841	L	92.4	Very high	90.7	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-62.9	-39.7	-175.7	-55.1	-178.8	0	0	0	114.9	I837 T838 F843 L844 A845 L868 F893	I837-L841 HydrophobicContact CD1-CD2 4.19Å; I837-L841 WeakPolarHBondContact O-CG 3.43Å; I837-L841 PolarHBondContact O-N 3.27Å; T838-L841 PolarHBondContact O-N 3.21Å; L841-F843 PolarHBondContact O-N 3.36Å; L841-L844 HydrophobicContact CD2-CD1 4.44Å; L841-L844 PolarHBondContact O-N 3.42Å; L841-A845 VanDerWaalsContact O-CB 3.25Å; L841-A845 WeakPolarHBondContact O-CB 3.49Å; L841-A845 PolarHBondContact O-N 3.01Å; L841-L868 HydrophobicContact CD1-CB 4.18Å; L841-F893 HydrophobicContact CD1-CE2 4.01Å; L841-F893 HydrophobicContact CD1-CZ 3.55Å; L841-F893 HydrophobicContact CD2-CE2 3.8Å; L841-F893 HydrophobicContact CD2-CZ 3.45Å; L841-F893 VanDerWaalsContact CD2-CZ 3.45Å; L841-F893 HydrophobicContact CG-CZ 4.12Å
842	P	93.1	Very high	90.2	Very high	37 Å²	37	46.2 Å²	46.2	24%	0.24	23%	0.228	C	C	.	.	H	α-helix	trans	-60.1	-37.6	178.4	-23.9	35	0	0	0	112.1	T838 D839 R846 G869	T838-P842 WeakPolarHBondContact O-CD 3.43Å; D839-P842 WeakPolarHBondContact O-CD 3.5Å; P842-R846 WeakPolarHBondContact O-CB 3.34Å; P842-R846 PolarHBondContact O-N 2.89Å; P842-G869 WeakPolarHBondContact CA-O 3.33Å
843	F	92	Very high	89.8	Confident	86 Å²	86	44.1 Å²	44.1	38%	0.377	22%	0.215	S	C	.	.	H	α-helix	trans	-71.9	-47.4	178.3	-57	-67.3	0	0	0	111.7	F815 F816 L840 L841 A845 R846 M847	F815-F843 AromaticContact CD1-CD1 3.91Å; F815-F843 HydrophobicContact CD1-CD1 3.91Å; F815-F843 HydrophobicContact CD1-CE1 4.34Å; F816-F843 HydrophobicContact CE1-CB 4.25Å; F816-F843 HydrophobicContact CE2-CB 4.31Å; F816-F843 HydrophobicContact CZ-CB 3.7Å; L840-F843 PolarHBondContact O-N 2.98Å; L841-F843 PolarHBondContact O-N 3.36Å; F843-A845 PolarHBondContact O-N 3.06Å; F843-R846 PolarHBondContact O-N 2.77Å; F843-M847 WeakPolarHBondContact O-CB 3.35Å; F843-M847 WeakPolarHBondContact O-CG 3.36Å; F843-M847 PolarHBondContact O-N 2.86Å
844	L	91.9	Very high	89.4	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-56.8	-49.3	175.7	-84.7	172.7	0	0	0	111.5	F816 L824 L840 L841 M847 F848 I853 C900 L904	F816-L844 HydrophobicContact CE1-CG 4.11Å; F816-L844 HydrophobicContact CZ-CD2 3.97Å; F816-L844 HydrophobicContact CZ-CG 3.74Å; L824-L844 HydrophobicContact CD1-CD1 4.17Å; L824-L844 HydrophobicContact CD2-CD1 3.8Å; L840-L844 PolarHBondContact O-N 3.11Å; L840-L844 VanDerWaalsContact O-N 3.15Å; L841-L844 HydrophobicContact CD2-CD1 4.44Å; L841-L844 PolarHBondContact O-N 3.42Å; L844-M847 PolarHBondContact O-N 3.43Å; L844-F848 WeakPolarHBondContact O-CB 3.2Å; L844-F848 PolarHBondContact O-N 2.98Å; L844-I853 HydrophobicContact CD2-CD1 4.15Å; L844-C900 HydrophobicContact CD2-CB 3.94Å; L844-L904 HydrophobicContact CD2-CD1 3.91Å
845	A	92.9	Very high	89.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66	-43	-179.6	0	0	0	0	0	111.3	L841 F843 M847 F848 F849 L865 L870	L841-A845 VanDerWaalsContact O-CB 3.25Å; L841-A845 WeakPolarHBondContact O-CB 3.49Å; L841-A845 PolarHBondContact O-N 3.01Å; F843-A845 PolarHBondContact O-N 3.06Å; A845-M847 PolarHBondContact O-N 3Å; A845-F848 PolarHBondContact O-N 2.95Å; A845-F849 VanDerWaalsContact O-CD2 3.22Å; A845-F849 WeakPolarHBondContact O-CD2 3.14Å; A845-F849 PolarHBondContact O-N 3.16Å; A845-L865 HydrophobicContact CB-CD1 4.11Å; A845-L865 HydrophobicContact CB-CG 3.95Å; A845-L870 HydrophobicContact CB-CD1 4.28Å; A845-L870 HydrophobicContact CB-CD2 3.88Å; A845-L870 HydrophobicContact CB-CG 3.69Å
846	R	92	Very high	89	Confident	90 Å²	90	46 Å²	46	34%	0.34	23%	0.226	S	C	.	.	H	α-helix	trans	-59.8	-44.9	176.4	-176.4	177.6	-65.2	-101.9	4.1	111.5	I774 P842 F843 T850	I774-R846 HydrophobicContact CG2-CB 4.32Å; I774-R846 HydrophobicContact CG2-CG 4.1Å; P842-R846 WeakPolarHBondContact O-CB 3.34Å; P842-R846 PolarHBondContact O-N 2.89Å; F843-R846 PolarHBondContact O-N 2.77Å; R846-T850 WeakPolarHBondContact O-CB 3.07Å; R846-T850 VanDerWaalsContact O-CG2 3.29Å; R846-T850 WeakPolarHBondContact O-CG2 3.39Å; R846-T850 PolarHBondContact O-N 3.46Å; R846-T850 PolarHBondContact O-OG1 3.01Å
847	M	88.5	Confident	88.7	Confident	7 Å²	7	44.1 Å²	44.1	3%	0.034	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-37.3	177.9	-72.7	-174.2	168.4	0	0	113	I807 F815 F816 F843 L844 A845 T850 R851 K852 I853	I807-M847 HydrophobicContact CD1-CB 4.3Å; I807-M847 HydrophobicContact CD1-CE 3.82Å; I807-M847 HydrophobicContact CD1-CG 4.02Å; I807-M847 HydrophobicContact CD1-SD 3.3Å; I807-M847 WeakPolarHBondContact CD1-SD 3.3Å; F815-M847 HydrophobicContact CB-CE 3.63Å; F815-M847 HydrophobicContact CD1-CE 4.32Å; F815-M847 HydrophobicContact CD2-CE 3.07Å; F815-M847 HydrophobicContact CE2-CE 3.75Å; F815-M847 HydrophobicContact CG-CE 3.42Å; F815-M847 VanDerWaalsContact CG-CE 3.42Å; F816-M847 HydrophobicContact CE2-CE 4.27Å; F816-M847 HydrophobicContact CE2-SD 3.8Å; F843-M847 WeakPolarHBondContact O-CB 3.35Å; F843-M847 WeakPolarHBondContact O-CG 3.36Å; F843-M847 PolarHBondContact O-N 2.86Å; L844-M847 PolarHBondContact O-N 3.43Å; A845-M847 PolarHBondContact O-N 3Å; M847-T850 WeakPolarHBondContact CA-OG1 3.09Å; M847-T850 PolarHBondContact O-OG1 3.09Å; M847-R851 PolarHBondContact O-N 3.3Å; M847-K852 HydrophobicContact CB-CB 4.24Å; M847-K852 PolarHBondContact O-N 3.03Å; M847-I853 HydrophobicContact CB-CD1 3.56Å; M847-I853 HydrophobicContact CB-CG1 3.86Å; M847-I853 PolarHBondContact O-N 3.06Å; M847-I853 HydrophobicContact SD-CD1 4.29Å
848	F	90.3	Very high	88.6	Confident	32 Å²	32	46.8 Å²	46.8	14%	0.14	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-52.4	174.5	177.2	-98.5	0	0	0	111.6	L844 A845 T850 R851 V855 L857 A862 L865	L844-F848 WeakPolarHBondContact O-CB 3.2Å; L844-F848 PolarHBondContact O-N 2.98Å; A845-F848 PolarHBondContact O-N 2.95Å; F848-T850 VanDerWaalsContact C-N 3.35Å; F848-T850 PolarHBondContact O-N 2.9Å; F848-R851 WeakPolarHBondContact O-CA 3.45Å; F848-R851 PolarHBondContact O-N 3.21Å; F848-V855 WeakPolarHBondContact CE2-O 3.39Å; F848-L857 HydrophobicContact CD1-CD1 4.46Å; F848-L857 HydrophobicContact CD2-CD1 3.98Å; F848-L857 HydrophobicContact CD2-CG 4.49Å; F848-L857 HydrophobicContact CE1-CD1 4.06Å; F848-L857 HydrophobicContact CE2-CB 4.21Å; F848-L857 HydrophobicContact CE2-CD1 3.52Å; F848-L857 HydrophobicContact CE2-CG 3.68Å; F848-L857 HydrophobicContact CG-CD1 4.43Å; F848-L857 HydrophobicContact CZ-CB 3.9Å; F848-L857 HydrophobicContact CZ-CD1 3.58Å; F848-L857 HydrophobicContact CZ-CG 3.84Å; F848-A862 HydrophobicContact CE1-CB 4.07Å; F848-A862 HydrophobicContact CZ-CB 4.44Å; F848-L865 HydrophobicContact CB-CD2 3.98Å; F848-L865 HydrophobicContact CD1-CD2 3.88Å; F848-L865 HydrophobicContact CG-CD2 3.87Å
849	F	89.1	Confident	88.5	Confident	19 Å²	19	48.8 Å²	48.8	8%	0.083	25%	0.247	C	C	.	.	H	α-helix	trans	-72.3	-26.5	-176.9	-75.4	-70.5	0	0	0	113.3	Q770 I774 L793 A845 R851 A862 M866 L870	Q770-F849 PolarHBondContact NE2-O 2.88Å; I774-F849 HydrophobicContact CD1-CB 3.65Å; I774-F849 HydrophobicContact CG1-CB 4.28Å; L793-F849 HydrophobicContact CB-CD1 4.33Å; L793-F849 HydrophobicContact CD1-CD1 4.05Å; L793-F849 HydrophobicContact CD1-CE1 4.42Å; L793-F849 HydrophobicContact CD1-CG 4.29Å; A845-F849 VanDerWaalsContact O-CD2 3.22Å; A845-F849 WeakPolarHBondContact O-CD2 3.14Å; A845-F849 PolarHBondContact O-N 3.16Å; F849-R851 PolarHBondContact O-N 3.43Å; F849-A862 HydrophobicContact CZ-CB 4.38Å; F849-A862 WeakPolarHBondContact CZ-O 3.48Å; F849-M866 HydrophobicContact CD1-CE 4.37Å; F849-M866 HydrophobicContact CE1-CE 3.54Å; F849-M866 HydrophobicContact CE2-CB 3.76Å; F849-M866 HydrophobicContact CE2-CE 4.12Å; F849-M866 HydrophobicContact CE2-CG 4.3Å; F849-M866 HydrophobicContact CZ-CB 3.78Å; F849-M866 HydrophobicContact CZ-CE 3.41Å; F849-M866 VanDerWaalsContact CZ-CE 3.41Å; F849-M866 HydrophobicContact CZ-CG 4.38Å; F849-L870 HydrophobicContact CD2-CD1 3.48Å; F849-L870 VanDerWaalsContact CD2-CD1 3.48Å; F849-L870 HydrophobicContact CE2-CD1 3.97Å; F849-L870 HydrophobicContact CG-CD1 4.26Å
850	T	85.1	Confident	88.5	Confident	51 Å²	51	48.2 Å²	48.2	31%	0.313	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	3.1	169.3	55.9	0	0	0	0	113.6	I774 R846 M847 F848 K852	I774-T850 HydrophobicContact CD1-CG2 3.85Å; R846-T850 WeakPolarHBondContact O-CB 3.07Å; R846-T850 VanDerWaalsContact O-CG2 3.29Å; R846-T850 WeakPolarHBondContact O-CG2 3.39Å; R846-T850 PolarHBondContact O-N 3.46Å; R846-T850 PolarHBondContact O-OG1 3.01Å; M847-T850 WeakPolarHBondContact CA-OG1 3.09Å; M847-T850 PolarHBondContact O-OG1 3.09Å; F848-T850 VanDerWaalsContact C-N 3.35Å; F848-T850 PolarHBondContact O-N 2.9Å; T850-K852 PolarHBondContact O-N 2.96Å
851	R	81.3	Confident	88.5	Confident	76 Å²	76	48.4 Å²	48.4	29%	0.287	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	18.6	179.6	-62	-162.3	174.9	168.8	7.4	116.7	M847 F848 F849 I853	M847-R851 PolarHBondContact O-N 3.3Å; F848-R851 WeakPolarHBondContact O-CA 3.45Å; F848-R851 PolarHBondContact O-N 3.21Å; F849-R851 PolarHBondContact O-N 3.43Å; R851-I853 VanDerWaalsContact C-N 3.26Å
852	K	82.1	Confident	88.5	Confident	54 Å²	54	48.7 Å²	48.7	24%	0.235	25%	0.247	C	C	.	.	S	Bend	trans	-67.9	-31.2	168.7	-81.9	-156.8	171.4	-153.6	0	111.7	I807 E811 M847 T850 Y903	I807-K852 HydrophobicContact CD1-CB 3.54Å; I807-K852 HydrophobicContact CD1-CD 4.15Å; I807-K852 HydrophobicContact CD1-CG 4.42Å; I807-K852 HydrophobicContact CG1-CB 3.68Å; I807-K852 HydrophobicContact CG1-CD 3.84Å; I807-K852 HydrophobicContact CG1-CG 4.16Å; E811-K852 IonicContact OE1-NZ 2.79Å; E811-K852 PolarHBondContact OE1-NZ 3.46Å; E811-K852 VanDerWaalsContact OE1-NZ 3.1Å; E811-K852 IonicContact OE2-NZ 3.09Å; E811-K852 PolarHBondContact OE2-NZ 3.37Å; M847-K852 HydrophobicContact CB-CB 4.24Å; M847-K852 PolarHBondContact O-N 3.03Å; T850-K852 PolarHBondContact O-N 2.96Å; K852-Y903 PolarHBondContact O-OH 3.44Å
853	I	82.9	Confident	88.5	Confident	4 Å²	4	47 Å²	47	2%	0.021	24%	0.237	C	C	.	.	S	Bend	trans	-100.7	118.2	170.8	-67	169.9	0	0	0	109.7	I807 L844 M847 R851 V855 Y903 L904	I807-I853 HydrophobicContact CD1-CG1 4.22Å; L844-I853 HydrophobicContact CD2-CD1 4.15Å; M847-I853 HydrophobicContact CB-CD1 3.56Å; M847-I853 HydrophobicContact CB-CG1 3.86Å; M847-I853 PolarHBondContact O-N 3.06Å; M847-I853 HydrophobicContact SD-CD1 4.29Å; R851-I853 VanDerWaalsContact C-N 3.26Å; I853-V855 HydrophobicContact CG2-CB 4.04Å; I853-V855 HydrophobicContact CG2-CG2 3.47Å; I853-V855 VanDerWaalsContact CG2-CG2 3.47Å; I853-V855 PolarHBondContact O-N 2.96Å; I853-Y903 HydrophobicContact CB-CD1 4.25Å; I853-Y903 HydrophobicContact CB-CE1 4.16Å; I853-Y903 HydrophobicContact CG1-CD1 4.11Å; I853-Y903 HydrophobicContact CG1-CE1 4.04Å; I853-Y903 HydrophobicContact CG2-CD1 3.78Å; I853-Y903 HydrophobicContact CG2-CE1 4.15Å; I853-Y903 HydrophobicContact CG2-CG 4.21Å; I853-L904 HydrophobicContact CD1-CD2 4.25Å
854	K	80.9	Confident	88.6	Confident	115 Å²	115	43 Å²	43	50%	0.5	22%	0.219	S	C	.	.			trans	-97	70.6	-178.3	-64.7	-178.4	-177.8	175.4	0	111.1	G804 Y903	G804-K854 WeakPolarHBondContact O-CE 3.48Å; G804-K854 PolarHBondContact O-NZ 2.79Å; K854-Y903 HydrophobicContact CB-CE2 4.04Å
855	V	85	Confident	88.7	Confident	23 Å²	23	43 Å²	43	14%	0.139	22%	0.219	C	C	.	.			trans	-116.7	137.1	-179.9	172.6	0	0	0	0	110.4	F848 I853 L857 K899 Y903	F848-V855 WeakPolarHBondContact CE2-O 3.39Å; I853-V855 HydrophobicContact CG2-CB 4.04Å; I853-V855 HydrophobicContact CG2-CG2 3.47Å; I853-V855 VanDerWaalsContact CG2-CG2 3.47Å; I853-V855 PolarHBondContact O-N 2.96Å; V855-L857 HydrophobicContact CG1-CD2 3.97Å; V855-L857 HydrophobicContact CG1-CG 4.21Å; V855-L857 PolarHBondContact O-N 3.11Å; V855-K899 HydrophobicContact CG1-CB 3.69Å; V855-K899 HydrophobicContact CG1-CD 4.16Å; V855-K899 HydrophobicContact CG1-CG 4.5Å; V855-Y903 HydrophobicContact CG2-CD2 4.29Å; V855-Y903 HydrophobicContact CG2-CG 3.99Å
856	D	86.3	Confident	88.8	Confident	149 Å²	149	43 Å²	43	80%	0.797	22%	0.219	S	C	*	.			trans	-84.1	106	174.7	-67.7	-33.1	0	0	0	111	K899	D856-K899 PolarHBondContact O-NZ 3.36Å
857	L	88	Confident	88.9	Confident	28 Å²	28	38.7 Å²	38.7	15%	0.147	20%	0.203	C	C	.	.			trans	-105	144.1	171.9	-62.7	-176	0	0	0	110.5	F848 V855 Q861 A862 L865 I896 K899	F848-L857 HydrophobicContact CD1-CD1 4.46Å; F848-L857 HydrophobicContact CD2-CD1 3.98Å; F848-L857 HydrophobicContact CD2-CG 4.49Å; F848-L857 HydrophobicContact CE1-CD1 4.06Å; F848-L857 HydrophobicContact CE2-CB 4.21Å; F848-L857 HydrophobicContact CE2-CD1 3.52Å; F848-L857 HydrophobicContact CE2-CG 3.68Å; F848-L857 HydrophobicContact CG-CD1 4.43Å; F848-L857 HydrophobicContact CZ-CB 3.9Å; F848-L857 HydrophobicContact CZ-CD1 3.58Å; F848-L857 HydrophobicContact CZ-CG 3.84Å; V855-L857 HydrophobicContact CG1-CD2 3.97Å; V855-L857 HydrophobicContact CG1-CG 4.21Å; V855-L857 PolarHBondContact O-N 3.11Å; L857-Q861 HydrophobicContact CB-CB 4.06Å; L857-Q861 HydrophobicContact CD2-CB 4.44Å; L857-A862 HydrophobicContact CB-CB 4.4Å; L857-L865 HydrophobicContact CD1-CD2 3.88Å; L857-I896 HydrophobicContact CD1-CG2 3.9Å; L857-I896 HydrophobicContact CD2-CG1 4.27Å; L857-I896 HydrophobicContact CD2-CG2 4.26Å; L857-K899 HydrophobicContact CD2-CD 3.68Å
858	S	90.6	Very high	89.2	Confident	56 Å²	56	39.2 Å²	39.2	39%	0.392	21%	0.206	S	C	.	.			trans	-66.9	159.1	169.4	73.1	0	0	0	0	110.7	L860 Q861 A862	S858-L860 PolarHBondContact O-N 2.93Å; S858-Q861 WeakPolarHBondContact O-CB 3.45Å; S858-Q861 PolarHBondContact O-N 3Å; S858-Q861 WeakPolarHBondContact OG-CB 3.38Å; S858-Q861 VanDerWaalsContact OG-CG 3.31Å; S858-Q861 WeakPolarHBondContact OG-CG 3.46Å; S858-Q861 PolarHBondContact OG-N 3.19Å; S858-A862 PolarHBondContact O-N 2.97Å
859	T	89.7	Confident	89.3	Confident	105 Å²	105	37.7 Å²	37.7	64%	0.644	20%	0.199	S	C	*	.	H	α-helix	trans	-54.6	-40.7	178.8	-43.5	0	0	0	0	112.3	L790 G863	L790-T859 HydrophobicContact CD1-CG2 4.49Å; L790-T859 WeakPolarHBondContact CD1-O 3.47Å; L790-T859 HydrophobicContact CD2-CG2 3.52Å; T859-G863 PolarHBondContact O-N 3.04Å
860	L	91.3	Very high	89.5	Confident	69 Å²	69	37.1 Å²	37.1	36%	0.361	20%	0.197	S	C	.	.	H	α-helix	trans	-66.6	-43.3	176.4	-173	67.6	0	0	0	111.6	S858 G863 I864 L882 L884 L892	S858-L860 PolarHBondContact O-N 2.93Å; L860-G863 PolarHBondContact O-N 3.39Å; L860-I864 HydrophobicContact CG-CD1 4.29Å; L860-I864 WeakPolarHBondContact O-CG1 3.38Å; L860-I864 PolarHBondContact O-N 3.24Å; L860-L882 HydrophobicContact CD1-CD1 3.95Å; L860-L882 HydrophobicContact CD1-CD2 4.19Å; L860-L884 HydrophobicContact CD1-CD1 4.26Å; L860-L884 HydrophobicContact CD2-CD1 4.02Å; L860-L892 HydrophobicContact CD2-CD1 3.63Å; L860-L892 HydrophobicContact CG-CD1 4.26Å
861	Q	93.3	Very high	90	Very high	8 Å²	8	34.9 Å²	34.9	4%	0.037	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-47.9	176.8	-79.4	176.9	-13.6	0	0	111.7	L857 S858 G863 I864 L865 L892 I896	L857-Q861 HydrophobicContact CB-CB 4.06Å; L857-Q861 HydrophobicContact CD2-CB 4.44Å; S858-Q861 WeakPolarHBondContact O-CB 3.45Å; S858-Q861 PolarHBondContact O-N 3Å; S858-Q861 WeakPolarHBondContact OG-CB 3.38Å; S858-Q861 VanDerWaalsContact OG-CG 3.31Å; S858-Q861 WeakPolarHBondContact OG-CG 3.46Å; S858-Q861 PolarHBondContact OG-N 3.19Å; Q861-G863 VanDerWaalsContact C-N 3.25Å; Q861-G863 PolarHBondContact O-N 2.89Å; Q861-I864 PolarHBondContact O-N 3.09Å; Q861-L865 PolarHBondContact O-N 3.41Å; Q861-L892 HydrophobicContact CG-CD2 4.34Å; Q861-I896 HydrophobicContact CB-CD1 3.82Å; Q861-I896 HydrophobicContact CB-CG1 3.77Å; Q861-I896 HydrophobicContact CG-CD1 4.14Å; Q861-I896 HydrophobicContact CG-CG1 3.87Å; Q861-I896 WeakPolarHBondContact O-CD1 3.32Å
862	A	92.6	Very high	90.6	Very high	10 Å²	10	36.7 Å²	36.7	8%	0.083	19%	0.194	C	C	.	.	H	α-helix	trans	-60.5	-37.1	175.1	0	0	0	0	0	111.6	L790 F848 F849 L857 S858 L865 M866	L790-A862 HydrophobicContact CD1-CB 3.82Å; F848-A862 HydrophobicContact CE1-CB 4.07Å; F848-A862 HydrophobicContact CZ-CB 4.44Å; F849-A862 HydrophobicContact CZ-CB 4.38Å; F849-A862 WeakPolarHBondContact CZ-O 3.48Å; L857-A862 HydrophobicContact CB-CB 4.4Å; S858-A862 PolarHBondContact O-N 2.97Å; A862-L865 PolarHBondContact O-N 3.1Å; A862-M866 WeakPolarHBondContact O-CB 3.32Å; A862-M866 PolarHBondContact O-N 3.47Å
863	G	92.9	Very high	91.1	Very high	3 Å²	3	35.4 Å²	35.4	3%	0.031	19%	0.189	C	C	.	.	H	α-helix	trans	-61.8	-46	174.4	0	0	0	0	0	112.8	I786 T859 L860 Q861 M866 A867	I786-G863 WeakPolarHBondContact CG2-O 3.23Å; T859-G863 PolarHBondContact O-N 3.04Å; L860-G863 PolarHBondContact O-N 3.39Å; Q861-G863 VanDerWaalsContact C-N 3.25Å; Q861-G863 PolarHBondContact O-N 2.89Å; G863-M866 PolarHBondContact O-N 3.12Å; G863-A867 WeakPolarHBondContact O-CB 3.36Å; G863-A867 PolarHBondContact O-N 3.44Å
864	I	94.4	Very high	91.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-44.5	176.9	-66.6	165.9	0	0	0	110.9	L860 Q861 M866 A867 L868 L882 I889 L892 F893 I896	L860-I864 HydrophobicContact CG-CD1 4.29Å; L860-I864 WeakPolarHBondContact O-CG1 3.38Å; L860-I864 PolarHBondContact O-N 3.24Å; Q861-I864 PolarHBondContact O-N 3.09Å; I864-M866 VanDerWaalsContact C-N 3.3Å; I864-M866 PolarHBondContact O-N 3.13Å; I864-A867 PolarHBondContact O-N 3.49Å; I864-L868 HydrophobicContact CG2-CD1 3.84Å; I864-L868 PolarHBondContact O-N 3.19Å; I864-L882 HydrophobicContact CG1-CD1 4.13Å; I864-I889 HydrophobicContact CD1-CG2 4.43Å; I864-I889 HydrophobicContact CG2-CG2 4.22Å; I864-L892 HydrophobicContact CD1-CB 3.82Å; I864-L892 HydrophobicContact CD1-CD1 3.74Å; I864-L892 HydrophobicContact CD1-CG 4.45Å; I864-F893 HydrophobicContact CG2-CB 4.21Å; I864-F893 HydrophobicContact CG2-CD2 4.36Å; I864-I896 HydrophobicContact CB-CD1 4.28Å; I864-I896 HydrophobicContact CG2-CD1 4.36Å
865	L	94.4	Very high	92.1	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-60.8	-40.4	177.3	-178.3	61.9	0	0	0	111.9	A845 F848 L857 Q861 A862 G869 I896	A845-L865 HydrophobicContact CB-CD1 4.11Å; A845-L865 HydrophobicContact CB-CG 3.95Å; F848-L865 HydrophobicContact CB-CD2 3.98Å; F848-L865 HydrophobicContact CD1-CD2 3.88Å; F848-L865 HydrophobicContact CG-CD2 3.87Å; L857-L865 HydrophobicContact CD1-CD2 3.88Å; Q861-L865 PolarHBondContact O-N 3.41Å; A862-L865 PolarHBondContact O-N 3.1Å; L865-G869 WeakPolarHBondContact O-CA 3.28Å; L865-G869 PolarHBondContact O-N 2.9Å; L865-I896 HydrophobicContact CB-CD1 4.33Å; L865-I896 HydrophobicContact CB-CG2 4.37Å; L865-I896 HydrophobicContact CD1-CG2 4.17Å; L865-I896 HydrophobicContact CD2-CG2 4.13Å; L865-I896 HydrophobicContact CG-CG2 4.46Å
866	M	94.3	Very high	92.4	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.6	-46.4	175.3	-174.7	-174.2	-56.9	0	0	112	L777 A789 L790 L793 F849 A862 G863 I864 L870 Q871	L777-M866 HydrophobicContact CD1-CG 4.18Å; L777-M866 HydrophobicContact CD1-SD 4.31Å; A789-M866 HydrophobicContact CB-SD 3.41Å; A789-M866 WeakPolarHBondContact CB-SD 3.42Å; L790-M866 HydrophobicContact CB-CE 3.82Å; L790-M866 HydrophobicContact CB-SD 4.48Å; L790-M866 HydrophobicContact CD1-CE 4.25Å; L790-M866 HydrophobicContact CG-CE 4.12Å; L793-M866 HydrophobicContact CB-CE 4.35Å; L793-M866 HydrophobicContact CD1-CE 3.6Å; L793-M866 HydrophobicContact CD1-SD 4.26Å; F849-M866 HydrophobicContact CD1-CE 4.37Å; F849-M866 HydrophobicContact CE1-CE 3.54Å; F849-M866 HydrophobicContact CE2-CB 3.76Å; F849-M866 HydrophobicContact CE2-CE 4.12Å; F849-M866 HydrophobicContact CE2-CG 4.3Å; F849-M866 HydrophobicContact CZ-CB 3.78Å; F849-M866 HydrophobicContact CZ-CE 3.41Å; F849-M866 VanDerWaalsContact CZ-CE 3.41Å; F849-M866 HydrophobicContact CZ-CG 4.38Å; A862-M866 WeakPolarHBondContact O-CB 3.32Å; A862-M866 PolarHBondContact O-N 3.47Å; G863-M866 PolarHBondContact O-N 3.12Å; I864-M866 VanDerWaalsContact C-N 3.3Å; I864-M866 PolarHBondContact O-N 3.13Å; M866-L870 HydrophobicContact CG-CB 4.35Å; M866-L870 HydrophobicContact CG-CD1 4.31Å; M866-L870 CarbonylContact O-C 3.59Å; M866-L870 WeakPolarHBondContact O-CA 3.33Å; M866-L870 WeakPolarHBondContact O-CB 3.28Å; M866-L870 PolarHBondContact O-N 3.45Å; M866-Q871 PolarHBondContact O-N 3.15Å
867	A	94.2	Very high	92.7	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.8	-47.8	-176.4	0	0	0	0	0	111.7	I786 G863 I864 Q871 H872 K873 I878	I786-A867 HydrophobicContact CD1-CB 3.76Å; I786-A867 HydrophobicContact CG1-CB 3.91Å; G863-A867 WeakPolarHBondContact O-CB 3.36Å; G863-A867 PolarHBondContact O-N 3.44Å; I864-A867 PolarHBondContact O-N 3.49Å; A867-Q871 CarbonylContact O-C 3.58Å; A867-H872 PolarHBondContact O-N 2.71Å; A867-H872 VanDerWaalsContact O-N 3.09Å; A867-K873 HydrophobicContact CB-CD 4.42Å; A867-K873 PolarHBondContact O-N 3.47Å; A867-I878 HydrophobicContact CB-CD1 3.62Å; A867-I878 HydrophobicContact CB-CG1 3.82Å
868	L	93.7	Very high	92.9	Very high	18 Å²	18	32.7 Å²	32.7	9%	0.094	18%	0.183	C	C	.	.	H	α-helix	trans	-73.8	-46.8	179	-68.8	170.2	0	0	0	112.1	L841 I864 V875 I878 F893	L841-L868 HydrophobicContact CD1-CB 4.18Å; I864-L868 HydrophobicContact CG2-CD1 3.84Å; I864-L868 PolarHBondContact O-N 3.19Å; L868-V875 HydrophobicContact CD2-CG2 4.19Å; L868-I878 HydrophobicContact CD1-CD1 4.48Å; L868-I878 HydrophobicContact CD2-CD1 3.58Å; L868-I878 HydrophobicContact CG-CD1 3.61Å; L868-F893 HydrophobicContact CD1-CB 4.48Å; L868-F893 HydrophobicContact CD1-CD1 4.34Å; L868-F893 HydrophobicContact CD1-CD2 3.54Å; L868-F893 HydrophobicContact CD1-CE2 3.73Å; L868-F893 HydrophobicContact CD1-CG 3.86Å; L868-F893 HydrophobicContact CD1-CZ 4.22Å
869	G	93.1	Very high	93	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-84.3	-37.4	-170.6	0	0	0	0	0	114.9	P842 L865 H872	P842-G869 WeakPolarHBondContact CA-O 3.33Å; L865-G869 WeakPolarHBondContact O-CA 3.28Å; L865-G869 PolarHBondContact O-N 2.9Å; G869-H872 PolarHBondContact O-CE1 2.65Å
870	L	94.6	Very high	93	Very high	7 Å²	7	34 Å²	34	4%	0.037	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-36.6	-173.1	-61.1	-179.9	0	0	0	114	I774 L777 G778 A845 F849 M866	I774-L870 HydrophobicContact CG1-CD1 4.41Å; I774-L870 HydrophobicContact CG2-CD1 3.93Å; I774-L870 HydrophobicContact CG2-CD2 3.72Å; I774-L870 HydrophobicContact CG2-CG 4.47Å; L777-L870 CarbonylContact C-O 3.54Å; L777-L870 VanDerWaalsContact C-O 3.27Å; L777-L870 HydrophobicContact CB-CB 4.12Å; L777-L870 HydrophobicContact CD1-CB 3.98Å; L777-L870 HydrophobicContact CD1-CD1 3.98Å; G778-L870 WeakPolarHBondContact CA-O 3.44Å; G778-L870 PolarHBondContact N-O 2.75Å; A845-L870 HydrophobicContact CB-CD1 4.28Å; A845-L870 HydrophobicContact CB-CD2 3.88Å; A845-L870 HydrophobicContact CB-CG 3.69Å; F849-L870 HydrophobicContact CD2-CD1 3.48Å; F849-L870 VanDerWaalsContact CD2-CD1 3.48Å; F849-L870 HydrophobicContact CE2-CD1 3.97Å; F849-L870 HydrophobicContact CG-CD1 4.26Å; M866-L870 HydrophobicContact CG-CB 4.35Å; M866-L870 HydrophobicContact CG-CD1 4.31Å; M866-L870 CarbonylContact O-C 3.59Å; M866-L870 WeakPolarHBondContact O-CA 3.33Å; M866-L870 WeakPolarHBondContact O-CB 3.28Å; M866-L870 PolarHBondContact O-N 3.45Å
871	Q	95	Very high	93	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.019	17%	0.173	C	C	.	.	S	Bend	trans	-88.8	-12.3	176.3	-63.4	-171.2	-58.1	0	0	113.1	L777 F781 F784 M866 A867 K873	L777-Q871 HydrophobicContact CB-CG 4.38Å; L777-Q871 HydrophobicContact CD2-CG 4.16Å; F781-Q871 PolarHBondContact O-NE2 3.34Å; F784-Q871 PolarHBondContact O-NE2 3.22Å; M866-Q871 PolarHBondContact O-N 3.15Å; A867-Q871 CarbonylContact O-C 3.58Å; Q871-K873 HydrophobicContact CB-CD 4.4Å; Q871-K873 HydrophobicContact CB-CG 4.04Å; Q871-K873 PolarHBondContact O-N 3.03Å
872	H	93.6	Very high	92.8	Very high	114 Å²	114	35.3 Å²	35.3	53%	0.528	18%	0.181	S	C	.	.			trans	54.1	35.4	-176.5	-50	-55.8	0	0	0	113.6	A867 G869	A867-H872 PolarHBondContact O-N 2.71Å; A867-H872 VanDerWaalsContact O-N 3.09Å; G869-H872 PolarHBondContact O-CE1 2.65Å
873	K	92.5	Very high	92.7	Very high	27 Å²	27	41.6 Å²	41.6	12%	0.117	21%	0.213	C	C	.	.			trans	-73.6	148.1	174.9	-72.8	-178	175	171.8	0	110.8	A782 F784 A867 Q871 D877 I878 E881	A782-K873 WeakPolarHBondContact O-CE 3.44Å; F784-K873 PolarHBondContact O-NZ 3.26Å; A867-K873 HydrophobicContact CB-CD 4.42Å; A867-K873 PolarHBondContact O-N 3.47Å; Q871-K873 HydrophobicContact CB-CD 4.4Å; Q871-K873 HydrophobicContact CB-CG 4.04Å; Q871-K873 PolarHBondContact O-N 3.03Å; K873-D877 HydrophobicContact CB-CB 4.36Å; K873-I878 HydrophobicContact CB-CD1 4.49Å; K873-I878 HydrophobicContact CB-CG1 4.16Å; K873-E881 IonicContact NZ-OE2 2.55Å; K873-E881 PolarHBondContact NZ-OE2 2.88Å
874	T	92.3	Very high	92.6	Very high	74 Å²	74	43.4 Å²	43.4	45%	0.454	22%	0.222	S	C	.	.			trans	-74.7	160.4	172.2	69.6	0	0	0	0	110.8	D876 D877 I878	T874-D876 PolarHBondContact O-N 3.48Å; T874-D877 PolarHBondContact N-OD2 2.99Å; T874-D877 PolarHBondContact O-N 3.14Å; T874-D877 PolarHBondContact OG1-N 2.85Å; T874-D877 PolarHBondContact OG1-OD2 3.02Å; T874-I878 WeakPolarHBondContact O-CG1 3.47Å; T874-I878 PolarHBondContact O-N 3.22Å
875	V	91.6	Very high	92.5	Very high	20 Å²	20	46.4 Å²	46.4	12%	0.121	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-37.5	176	-178.9	0	0	0	0	110.7	L868 D877 I878 V879 I889 L890	L868-V875 HydrophobicContact CD2-CG2 4.19Å; V875-D877 PolarHBondContact O-N 3.43Å; V875-I878 WeakPolarHBondContact O-CB 3.46Å; V875-I878 PolarHBondContact O-N 3.34Å; V875-V879 HydrophobicContact CG1-CG2 4.4Å; V875-V879 VanDerWaalsContact O-CG2 3.28Å; V875-V879 WeakPolarHBondContact O-CG2 3.2Å; V875-V879 PolarHBondContact O-N 3.05Å; V875-I889 HydrophobicContact CG1-CG2 4.33Å; V875-L890 HydrophobicContact CG2-CD2 4.33Å
876	D	92.4	Very high	92.4	Very high	103 Å²	103	49.1 Å²	49.1	55%	0.551	26%	0.26	S	S	*	.	H	α-helix	trans	-66.6	-35.4	179.3	-64.9	-28.5	0	0	0	112.8	T874 I878 V879 K880	T874-D876 PolarHBondContact O-N 3.48Å; D876-I878 VanDerWaalsContact C-N 3.32Å; D876-V879 WeakPolarHBondContact O-CB 3.34Å; D876-V879 PolarHBondContact O-N 3.2Å; D876-K880 WeakPolarHBondContact O-CG 3.48Å; D876-K880 PolarHBondContact O-N 3.37Å
877	D	91.7	Very high	92.3	Very high	66 Å²	66	52.9 Å²	52.9	35%	0.353	29%	0.287	S	S	.	.	H	α-helix	trans	-66	-40	173.9	-60.5	-39.6	0	0	0	110.7	K873 T874 V875 K880 E881	K873-D877 HydrophobicContact CB-CB 4.36Å; T874-D877 PolarHBondContact N-OD2 2.99Å; T874-D877 PolarHBondContact O-N 3.14Å; T874-D877 PolarHBondContact OG1-N 2.85Å; T874-D877 PolarHBondContact OG1-OD2 3.02Å; V875-D877 PolarHBondContact O-N 3.43Å; D877-K880 PolarHBondContact O-N 3.35Å; D877-E881 WeakPolarHBondContact O-CB 3.39Å; D877-E881 PolarHBondContact O-N 2.91Å
878	I	92.5	Very high	92.2	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-67	-38.8	176.6	-60.4	168.3	0	0	0	110.8	I786 A867 L868 K873 T874 V875 D876 E881 L882 I889	I786-I878 HydrophobicContact CD1-CG1 4.27Å; I786-I878 HydrophobicContact CD1-CG2 4.19Å; A867-I878 HydrophobicContact CB-CD1 3.62Å; A867-I878 HydrophobicContact CB-CG1 3.82Å; L868-I878 HydrophobicContact CD1-CD1 4.48Å; L868-I878 HydrophobicContact CD2-CD1 3.58Å; L868-I878 HydrophobicContact CG-CD1 3.61Å; K873-I878 HydrophobicContact CB-CD1 4.49Å; K873-I878 HydrophobicContact CB-CG1 4.16Å; T874-I878 WeakPolarHBondContact O-CG1 3.47Å; T874-I878 PolarHBondContact O-N 3.22Å; V875-I878 WeakPolarHBondContact O-CB 3.46Å; V875-I878 PolarHBondContact O-N 3.34Å; D876-I878 VanDerWaalsContact C-N 3.32Å; I878-E881 PolarHBondContact O-N 3.44Å; I878-L882 HydrophobicContact CG2-CD1 3.49Å; I878-L882 VanDerWaalsContact CG2-CD1 3.49Å; I878-L882 HydrophobicContact CG2-CG 4.11Å; I878-L882 WeakPolarHBondContact O-CB 3.5Å; I878-L882 PolarHBondContact O-N 2.92Å; I878-I889 HydrophobicContact CB-CD1 4.33Å; I878-I889 HydrophobicContact CG2-CD1 3.81Å; I878-I889 HydrophobicContact CG2-CG1 4.34Å; I878-I889 HydrophobicContact CG2-CG2 4.18Å
879	V	93.5	Very high	92.2	Very high	37 Å²	37	56.9 Å²	56.9	22%	0.224	31%	0.305	C	S	.	.	H	α-helix	trans	-57	-50.2	174	165.6	0	0	0	0	110.5	V875 D876 E881 N883 L884 I889	V875-V879 HydrophobicContact CG1-CG2 4.4Å; V875-V879 VanDerWaalsContact O-CG2 3.28Å; V875-V879 WeakPolarHBondContact O-CG2 3.2Å; V875-V879 PolarHBondContact O-N 3.05Å; D876-V879 WeakPolarHBondContact O-CB 3.34Å; D876-V879 PolarHBondContact O-N 3.2Å; V879-E881 VanDerWaalsContact C-N 3.33Å; V879-E881 PolarHBondContact O-N 3.39Å; V879-N883 VanDerWaalsContact O-CA 3.3Å; V879-N883 WeakPolarHBondContact O-CA 3.5Å; V879-N883 PolarHBondContact O-N 3.09Å; V879-L884 WeakPolarHBondContact CA-O 3.31Å; V879-L884 WeakPolarHBondContact CG1-O 3.32Å; V879-L884 WeakPolarHBondContact CG2-O 3.49Å; V879-L884 PolarHBondContact O-N 3.3Å; V879-I889 HydrophobicContact CB-CD1 4.21Å; V879-I889 HydrophobicContact CG2-CD1 3.51Å
880	K	90.3	Very high	92.2	Very high	151 Å²	151	59.4 Å²	59.4	66%	0.657	32%	0.318	S	S	*	.	H	α-helix	trans	-63.6	-38.1	179.4	-70.1	169.6	-171.4	166.8	0	112.3	D876 D877 N883	D876-K880 WeakPolarHBondContact O-CG 3.48Å; D876-K880 PolarHBondContact O-N 3.37Å; D877-K880 PolarHBondContact O-N 3.35Å; K880-N883 PolarHBondContact O-OD1 2.71Å
881	E	90.6	Very high	92	Very high	67 Å²	67	62 Å²	62	31%	0.313	34%	0.34	S	S	.	.	H	α-helix	trans	-80.9	-39	-174.5	-156.5	-171.8	141.6	0	0	113	P785 I786 K873 D877 I878 V879	P785-E881 VanDerWaalsContact C-OE1 3.29Å; P785-E881 WeakPolarHBondContact CA-OE1 3.39Å; P785-E881 WeakPolarHBondContact CB-OE1 3.36Å; I786-E881 HydrophobicContact CD1-CB 4.48Å; I786-E881 PolarHBondContact N-OE1 3.4Å; K873-E881 IonicContact NZ-OE2 2.55Å; K873-E881 PolarHBondContact NZ-OE2 2.88Å; D877-E881 WeakPolarHBondContact O-CB 3.39Å; D877-E881 PolarHBondContact O-N 2.91Å; I878-E881 PolarHBondContact O-N 3.44Å; V879-E881 VanDerWaalsContact C-N 3.33Å; V879-E881 PolarHBondContact O-N 3.39Å
882	L	89.3	Confident	92	Very high	38 Å²	38	63.7 Å²	63.7	20%	0.199	35%	0.349	C	S	.	.	H	α-helix	trans	-89	-9.4	179.6	-64.2	178.2	0	0	0	113.2	I786 L860 I864 I878 L884	I786-L882 HydrophobicContact CD1-CD1 4.4Å; I786-L882 HydrophobicContact CD1-CD2 4.39Å; I786-L882 HydrophobicContact CD1-CG 4.19Å; L860-L882 HydrophobicContact CD1-CD1 3.95Å; L860-L882 HydrophobicContact CD1-CD2 4.19Å; I864-L882 HydrophobicContact CG1-CD1 4.13Å; I878-L882 HydrophobicContact CG2-CD1 3.49Å; I878-L882 VanDerWaalsContact CG2-CD1 3.49Å; I878-L882 HydrophobicContact CG2-CG 4.11Å; I878-L882 WeakPolarHBondContact O-CB 3.5Å; I878-L882 PolarHBondContact O-N 2.92Å; L882-L884 HydrophobicContact CB-CB 4.43Å; L882-L884 HydrophobicContact CB-CD1 4.17Å; L882-L884 HydrophobicContact CB-CG 4.23Å; L882-L884 PolarHBondContact O-N 3.3Å
883	N	90.2	Very high	92	Very high	141 Å²	141	58.3 Å²	58.3	75%	0.754	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	42	-171.6	-69.4	-34.8	0	0	0	112.3	V879 K880	V879-N883 VanDerWaalsContact O-CA 3.3Å; V879-N883 WeakPolarHBondContact O-CA 3.5Å; V879-N883 PolarHBondContact O-N 3.09Å; K880-N883 PolarHBondContact O-OD1 2.71Å
884	L	90.2	Very high	92	Very high	42 Å²	42	57.2 Å²	57.2	22%	0.22	32%	0.32	C	S	.	.			trans	-120.6	141.8	178.2	-69.6	175	0	0	0	110.3	L860 V879 L882 I889	L860-L884 HydrophobicContact CD1-CD1 4.26Å; L860-L884 HydrophobicContact CD2-CD1 4.02Å; V879-L884 WeakPolarHBondContact CA-O 3.31Å; V879-L884 WeakPolarHBondContact CG1-O 3.32Å; V879-L884 WeakPolarHBondContact CG2-O 3.49Å; V879-L884 PolarHBondContact O-N 3.3Å; L882-L884 HydrophobicContact CB-CB 4.43Å; L882-L884 HydrophobicContact CB-CD1 4.17Å; L882-L884 HydrophobicContact CB-CG 4.23Å; L882-L884 PolarHBondContact O-N 3.3Å; L884-I889 HydrophobicContact CB-CD1 4.26Å; L884-I889 HydrophobicContact CB-CG1 4.19Å
885	P	92.7	Very high	92.1	Very high	62 Å²	62	60.9 Å²	60.9	40%	0.403	33%	0.326	S	S	.	.			trans	-65	148.2	177.7	27.3	-33.8	0	0	0	111.5	S887 Q888 I889	P885-S887 VanDerWaalsContact C-N 3.26Å; P885-S887 PolarHBondContact O-N 3.26Å; P885-Q888 HydrophobicContact CG-CB 4.16Å; P885-Q888 HydrophobicContact CG-CG 3.78Å; P885-Q888 PolarHBondContact O-N 3Å; P885-I889 PolarHBondContact O-N 3.45Å
886	S	91.8	Very high	92.2	Very high	60 Å²	60	60 Å²	60	42%	0.42	32%	0.32	S	S	.	.	H	α-helix	trans	-55.4	-38.3	-175.7	54.6	0	0	0	0	113.2	Q888 I889 L890	S886-Q888 VanDerWaalsContact C-N 3.33Å; S886-Q888 PolarHBondContact O-N 2.78Å; S886-I889 PolarHBondContact O-N 3.08Å; S886-L890 PolarHBondContact O-N 3.24Å
887	S	91.9	Very high	92.3	Very high	80 Å²	80	55.3 Å²	55.3	56%	0.559	30%	0.295	S	S	*	.	H	α-helix	trans	-60.8	-38.5	178.1	59	0	0	0	0	113.1	P885 A891	P885-S887 VanDerWaalsContact C-N 3.26Å; P885-S887 PolarHBondContact O-N 3.26Å; S887-A891 WeakPolarHBondContact O-CB 3.25Å; S887-A891 PolarHBondContact O-N 3.46Å
888	Q	93.4	Very high	92.4	Very high	101 Å²	101	57.5 Å²	57.5	47%	0.472	30%	0.298	S	S	.	.	H	α-helix	trans	-71.6	-38.3	177.9	-71.9	179.6	13.2	0	0	111.7	P885 S886 A891 L892	P885-Q888 HydrophobicContact CG-CB 4.16Å; P885-Q888 HydrophobicContact CG-CG 3.78Å; P885-Q888 PolarHBondContact O-N 3Å; S886-Q888 VanDerWaalsContact C-N 3.33Å; S886-Q888 PolarHBondContact O-N 2.78Å; Q888-A891 PolarHBondContact O-N 2.61Å; Q888-L892 WeakPolarHBondContact O-CB 3.38Å; Q888-L892 WeakPolarHBondContact O-CG 3.38Å; Q888-L892 PolarHBondContact O-N 2.88Å
889	I	92.9	Very high	92.4	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-63.1	-47.3	177.1	-68.1	162.7	0	0	0	110.1	I864 V875 I878 V879 L884 P885 S886 A891 L892 F893	I864-I889 HydrophobicContact CD1-CG2 4.43Å; I864-I889 HydrophobicContact CG2-CG2 4.22Å; V875-I889 HydrophobicContact CG1-CG2 4.33Å; I878-I889 HydrophobicContact CB-CD1 4.33Å; I878-I889 HydrophobicContact CG2-CD1 3.81Å; I878-I889 HydrophobicContact CG2-CG1 4.34Å; I878-I889 HydrophobicContact CG2-CG2 4.18Å; V879-I889 HydrophobicContact CB-CD1 4.21Å; V879-I889 HydrophobicContact CG2-CD1 3.51Å; L884-I889 HydrophobicContact CB-CD1 4.26Å; L884-I889 HydrophobicContact CB-CG1 4.19Å; P885-I889 PolarHBondContact O-N 3.45Å; S886-I889 PolarHBondContact O-N 3.08Å; I889-A891 PolarHBondContact O-N 3.14Å; I889-L892 PolarHBondContact O-N 2.89Å; I889-F893 VanDerWaalsContact O-CB 3.28Å; I889-F893 WeakPolarHBondContact O-CB 3.32Å; I889-F893 PolarHBondContact O-N 3.33Å
890	L	92.6	Very high	92.3	Very high	53 Å²	53	59.1 Å²	59.1	28%	0.277	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-38.3	177.5	-70	173.8	0	0	0	112.3	V875 S886 F893 N894	V875-L890 HydrophobicContact CG2-CD2 4.33Å; S886-L890 PolarHBondContact O-N 3.24Å; L890-F893 PolarHBondContact O-N 2.92Å; L890-N894 WeakPolarHBondContact O-CB 3.44Å; L890-N894 PolarHBondContact O-N 3.07Å
891	A	92.1	Very high	92.4	Very high	61 Å²	61	52.4 Å²	52.4	50%	0.504	27%	0.274	S	S	.	.	H	α-helix	trans	-63.9	-43.1	175.4	0	0	0	0	0	112.3	S887 Q888 I889 F893 R895	S887-A891 WeakPolarHBondContact O-CB 3.25Å; S887-A891 PolarHBondContact O-N 3.46Å; Q888-A891 PolarHBondContact O-N 2.61Å; I889-A891 PolarHBondContact O-N 3.14Å; A891-F893 VanDerWaalsContact C-N 3.34Å; A891-R895 PolarHBondContact O-N 3.19Å; A891-R895 VanDerWaalsContact O-N 3.16Å
892	L	93.7	Very high	92.5	Very high	39 Å²	39	53 Å²	53	20%	0.204	29%	0.285	C	S	.	.	H	α-helix	trans	-64.6	-41.6	174.4	-74.5	172.2	0	0	0	111.2	L860 Q861 I864 Q888 I889 R895 I896	L860-L892 HydrophobicContact CD2-CD1 3.63Å; L860-L892 HydrophobicContact CG-CD1 4.26Å; Q861-L892 HydrophobicContact CG-CD2 4.34Å; I864-L892 HydrophobicContact CD1-CB 3.82Å; I864-L892 HydrophobicContact CD1-CD1 3.74Å; I864-L892 HydrophobicContact CD1-CG 4.45Å; Q888-L892 WeakPolarHBondContact O-CB 3.38Å; Q888-L892 WeakPolarHBondContact O-CG 3.38Å; Q888-L892 PolarHBondContact O-N 2.88Å; I889-L892 PolarHBondContact O-N 2.89Å; L892-R895 WeakPolarHBondContact O-CB 3.32Å; L892-R895 PolarHBondContact O-N 3.49Å; L892-I896 WeakPolarHBondContact O-CG1 3.41Å; L892-I896 PolarHBondContact O-N 2.9Å
893	F	93.9	Very high	92.6	Very high	1 Å²	1	52.7 Å²	52.7	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-45	177.6	178.6	-116	0	0	0	112.3	Y827 H834 I837 L841 I864 L868 I889 L890 A891 R895 I896 V897	Y827-F893 AromaticContact CE1-CD1 3.94Å; Y827-F893 HydrophobicContact CE1-CD1 3.94Å; Y827-F893 AromaticContact CE1-CE1 3.82Å; Y827-F893 HydrophobicContact CE1-CE1 3.82Å; Y827-F893 AromaticContact CZ-CD1 3.87Å; Y827-F893 AromaticContact CZ-CE1 3.88Å; Y827-F893 VanDerWaalsContact OH-CD1 3.23Å; Y827-F893 WeakPolarHBondContact OH-CD1 3.26Å; H834-F893 HydrophobicContact CB-CD1 4.47Å; H834-F893 HydrophobicContact CB-CE1 3.98Å; I837-F893 HydrophobicContact CD1-CE1 3.88Å; I837-F893 HydrophobicContact CD1-CZ 3.92Å; L841-F893 HydrophobicContact CD1-CE2 4.01Å; L841-F893 HydrophobicContact CD1-CZ 3.55Å; L841-F893 HydrophobicContact CD2-CE2 3.8Å; L841-F893 HydrophobicContact CD2-CZ 3.45Å; L841-F893 VanDerWaalsContact CD2-CZ 3.45Å; L841-F893 HydrophobicContact CG-CZ 4.12Å; I864-F893 HydrophobicContact CG2-CB 4.21Å; I864-F893 HydrophobicContact CG2-CD2 4.36Å; L868-F893 HydrophobicContact CD1-CB 4.48Å; L868-F893 HydrophobicContact CD1-CD1 4.34Å; L868-F893 HydrophobicContact CD1-CD2 3.54Å; L868-F893 HydrophobicContact CD1-CE2 3.73Å; L868-F893 HydrophobicContact CD1-CG 3.86Å; L868-F893 HydrophobicContact CD1-CZ 4.22Å; I889-F893 VanDerWaalsContact O-CB 3.28Å; I889-F893 WeakPolarHBondContact O-CB 3.32Å; I889-F893 PolarHBondContact O-N 3.33Å; L890-F893 PolarHBondContact O-N 2.92Å; A891-F893 VanDerWaalsContact C-N 3.34Å; F893-R895 VanDerWaalsContact C-N 3.27Å; F893-R895 PolarHBondContact O-N 3.45Å; F893-I896 WeakPolarHBondContact O-CA 3.5Å; F893-I896 WeakPolarHBondContact O-CB 3.48Å; F893-I896 PolarHBondContact O-N 3.33Å; F893-V897 HydrophobicContact CE1-CG2 4.38Å; F893-V897 HydrophobicContact CE2-CG2 4.27Å; F893-V897 HydrophobicContact CZ-CG2 4.12Å; F893-V897 PolarHBondContact O-N 3.48Å
894	N	93.6	Very high	92.6	Very high	4 Å²	4	46 Å²	46	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-38.3	173.7	-168.9	-72.9	0	0	0	112.4	Y827 N830 L890 I896 V897 R898	Y827-N894 HydrophobicContact CE1-CB 4.1Å; Y827-N894 PolarHBondContact O-ND2 2.95Å; N830-N894 PolarHBondContact OD1-ND2 2.94Å; L890-N894 WeakPolarHBondContact O-CB 3.44Å; L890-N894 PolarHBondContact O-N 3.07Å; N894-I896 VanDerWaalsContact C-N 3.32Å; N894-I896 PolarHBondContact O-N 3.32Å; N894-V897 PolarHBondContact O-N 3.45Å; N894-R898 PolarHBondContact O-N 2.92Å; N894-R898 PolarHBondContact OD1-NE 3.28Å; N894-R898 VanDerWaalsContact OD1-NE 3.09Å; N894-R898 PolarHBondContact OD1-NH1 3.43Å; N894-R898 PolarHBondContact OD1-NH2 2.76Å
895	R	94	Very high	92.6	Very high	152 Å²	152	46.5 Å²	46.5	57%	0.574	25%	0.249	S	C	*	.	H	α-helix	trans	-65.4	-32.9	174.2	-165.2	171.5	-176.4	174.2	2.4	112.9	A891 L892 F893 K899	A891-R895 PolarHBondContact O-N 3.19Å; A891-R895 VanDerWaalsContact O-N 3.16Å; L892-R895 WeakPolarHBondContact O-CB 3.32Å; L892-R895 PolarHBondContact O-N 3.49Å; F893-R895 VanDerWaalsContact C-N 3.27Å; F893-R895 PolarHBondContact O-N 3.45Å; R895-K899 WeakPolarHBondContact O-CG 3.42Å; R895-K899 PolarHBondContact O-N 2.73Å
896	I	93.8	Very high	92.5	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-49	173.6	-63.7	163.6	0	0	0	110	L857 Q861 I864 L865 L892 F893 N894 R898 K899 C900	L857-I896 HydrophobicContact CD1-CG2 3.9Å; L857-I896 HydrophobicContact CD2-CG1 4.27Å; L857-I896 HydrophobicContact CD2-CG2 4.26Å; Q861-I896 HydrophobicContact CB-CD1 3.82Å; Q861-I896 HydrophobicContact CB-CG1 3.77Å; Q861-I896 HydrophobicContact CG-CD1 4.14Å; Q861-I896 HydrophobicContact CG-CG1 3.87Å; Q861-I896 WeakPolarHBondContact O-CD1 3.32Å; I864-I896 HydrophobicContact CB-CD1 4.28Å; I864-I896 HydrophobicContact CG2-CD1 4.36Å; L865-I896 HydrophobicContact CB-CD1 4.33Å; L865-I896 HydrophobicContact CB-CG2 4.37Å; L865-I896 HydrophobicContact CD1-CG2 4.17Å; L865-I896 HydrophobicContact CD2-CG2 4.13Å; L865-I896 HydrophobicContact CG-CG2 4.46Å; L892-I896 WeakPolarHBondContact O-CG1 3.41Å; L892-I896 PolarHBondContact O-N 2.9Å; F893-I896 WeakPolarHBondContact O-CA 3.5Å; F893-I896 WeakPolarHBondContact O-CB 3.48Å; F893-I896 PolarHBondContact O-N 3.33Å; N894-I896 VanDerWaalsContact C-N 3.32Å; N894-I896 PolarHBondContact O-N 3.32Å; I896-R898 VanDerWaalsContact C-N 3.33Å; I896-R898 PolarHBondContact O-N 3.36Å; I896-K899 PolarHBondContact O-N 2.91Å; I896-K899 VanDerWaalsContact O-N 3.17Å; I896-C900 PolarHBondContact O-N 2.94Å; I896-C900 PolarHBondContact O-SG 2.92Å
897	V	93.3	Very high	92.3	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.024	24%	0.237	C	C	.	.	H	α-helix	trans	-59.5	-44.4	180	177	0	0	0	0	110.7	L824 Y827 I837 F893 N894 K899 C900 L901	L824-V897 HydrophobicContact CB-CG1 4.41Å; L824-V897 HydrophobicContact CD2-CG1 3.94Å; Y827-V897 HydrophobicContact CD1-CB 4.1Å; Y827-V897 HydrophobicContact CD1-CG1 4.03Å; Y827-V897 HydrophobicContact CD1-CG2 4Å; Y827-V897 HydrophobicContact CE1-CB 4.33Å; Y827-V897 HydrophobicContact CE1-CG2 3.95Å; I837-V897 HydrophobicContact CD1-CG1 4.47Å; I837-V897 HydrophobicContact CD1-CG2 3.8Å; F893-V897 HydrophobicContact CE1-CG2 4.38Å; F893-V897 HydrophobicContact CE2-CG2 4.27Å; F893-V897 HydrophobicContact CZ-CG2 4.12Å; F893-V897 PolarHBondContact O-N 3.48Å; N894-V897 PolarHBondContact O-N 3.45Å; V897-K899 PolarHBondContact O-N 3.28Å; V897-C900 PolarHBondContact O-N 3.23Å; V897-L901 VanDerWaalsContact O-CB 3.28Å; V897-L901 WeakPolarHBondContact O-CB 3.21Å; V897-L901 PolarHBondContact O-N 3.04Å
898	R	93.5	Very high	92	Very high	112 Å²	112	43 Å²	43	42%	0.423	21%	0.214	S	C	.	.	H	α-helix	trans	-55.4	-46	174.4	-86.7	-173.5	-85.6	-131.5	7.9	113.4	S828 N894 I896 S902	S828-R898 PolarHBondContact O-NH1 3.35Å; N894-R898 PolarHBondContact O-N 2.92Å; N894-R898 PolarHBondContact OD1-NE 3.28Å; N894-R898 VanDerWaalsContact OD1-NE 3.09Å; N894-R898 PolarHBondContact OD1-NH1 3.43Å; N894-R898 PolarHBondContact OD1-NH2 2.76Å; I896-R898 VanDerWaalsContact C-N 3.33Å; I896-R898 PolarHBondContact O-N 3.36Å; R898-S902 WeakPolarHBondContact O-CB 3.38Å; R898-S902 PolarHBondContact O-N 3.44Å
899	K	93.3	Very high	91.7	Very high	69 Å²	69	43.5 Å²	43.5	30%	0.3	22%	0.216	S	C	.	.	H	α-helix	trans	-66.2	-42.2	178.6	-72.6	179	169.8	-173.7	0	112.2	V855 D856 L857 R895 I896 V897 S902 Y903	V855-K899 HydrophobicContact CG1-CB 3.69Å; V855-K899 HydrophobicContact CG1-CD 4.16Å; V855-K899 HydrophobicContact CG1-CG 4.5Å; D856-K899 PolarHBondContact O-NZ 3.36Å; L857-K899 HydrophobicContact CD2-CD 3.68Å; R895-K899 WeakPolarHBondContact O-CG 3.42Å; R895-K899 PolarHBondContact O-N 2.73Å; I896-K899 PolarHBondContact O-N 2.91Å; I896-K899 VanDerWaalsContact O-N 3.17Å; V897-K899 PolarHBondContact O-N 3.28Å; K899-S902 PolarHBondContact O-N 3.39Å; K899-Y903 PolarHBondContact O-N 2.92Å
900	C	91.9	Very high	91.4	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.014	24%	0.237	C	C	.	.	H	α-helix	trans	-65.2	-45.5	177.8	-62.3	0	0	0	0	110.8	L844 I896 V897 S902 Y903 L904	L844-C900 HydrophobicContact CD2-CB 3.94Å; I896-C900 PolarHBondContact O-N 2.94Å; I896-C900 PolarHBondContact O-SG 2.92Å; V897-C900 PolarHBondContact O-N 3.23Å; C900-S902 VanDerWaalsContact C-N 3.34Å; C900-S902 PolarHBondContact O-N 2.93Å; C900-Y903 PolarHBondContact O-N 3.16Å; C900-Y903 VanDerWaalsContact O-N 3.15Å; C900-L904 VanDerWaalsContact O-CG 3.32Å; C900-L904 WeakPolarHBondContact O-CG 3.41Å; C900-L904 PolarHBondContact O-N 2.91Å
901	L	92.2	Very high	90.9	Very high	10 Å²	10	45.3 Å²	45.3	5%	0.052	23%	0.228	C	C	.	.	H	α-helix	trans	-59.8	-43.5	177.4	-177.2	67	0	0	0	111.8	L824 E825 V897 Y903 L904 N905	L824-L901 HydrophobicContact CB-CD1 4.07Å; E825-L901 VanDerWaalsContact CA-CD2 3.5Å; E825-L901 HydrophobicContact CB-CD2 3.86Å; E825-L901 HydrophobicContact CG-CD2 4.19Å; V897-L901 VanDerWaalsContact O-CB 3.28Å; V897-L901 WeakPolarHBondContact O-CB 3.21Å; V897-L901 PolarHBondContact O-N 3.04Å; L901-Y903 VanDerWaalsContact C-N 3.27Å; L901-Y903 PolarHBondContact O-N 2.85Å; L901-L904 PolarHBondContact O-N 2.96Å; L901-N905 WeakPolarHBondContact O-CB 3.24Å; L901-N905 PolarHBondContact O-N 3.29Å
902	S	92.5	Very high	90.4	Very high	79 Å²	79	46.3 Å²	46.3	55%	0.552	22%	0.224	S	C	*	.	H	α-helix	trans	-57	-41.1	175.4	179.6	0	0	0	0	112.2	R898 K899 C900 Q906	R898-S902 WeakPolarHBondContact O-CB 3.38Å; R898-S902 PolarHBondContact O-N 3.44Å; K899-S902 PolarHBondContact O-N 3.39Å; C900-S902 VanDerWaalsContact C-N 3.34Å; C900-S902 PolarHBondContact O-N 2.93Å; S902-Q906 WeakPolarHBondContact O-CB 3.41Å; S902-Q906 PolarHBondContact O-N 3.14Å; S902-Q906 VanDerWaalsContact O-N 3.08Å
903	Y	91.2	Very high	89.9	Confident	33 Å²	33	48.6 Å²	48.6	13%	0.129	23%	0.233	C	C	.	.	H	α-helix	trans	-69.5	-43.5	175.9	178.9	-92.1	0	0	0	112.4	K852 I853 K854 V855 K899 C900 L901 N905 Q906 V907	K852-Y903 PolarHBondContact O-OH 3.44Å; I853-Y903 HydrophobicContact CB-CD1 4.25Å; I853-Y903 HydrophobicContact CB-CE1 4.16Å; I853-Y903 HydrophobicContact CG1-CD1 4.11Å; I853-Y903 HydrophobicContact CG1-CE1 4.04Å; I853-Y903 HydrophobicContact CG2-CD1 3.78Å; I853-Y903 HydrophobicContact CG2-CE1 4.15Å; I853-Y903 HydrophobicContact CG2-CG 4.21Å; K854-Y903 HydrophobicContact CB-CE2 4.04Å; V855-Y903 HydrophobicContact CG2-CD2 4.29Å; V855-Y903 HydrophobicContact CG2-CG 3.99Å; K899-Y903 PolarHBondContact O-N 2.92Å; C900-Y903 PolarHBondContact O-N 3.16Å; C900-Y903 VanDerWaalsContact O-N 3.15Å; L901-Y903 VanDerWaalsContact C-N 3.27Å; L901-Y903 PolarHBondContact O-N 2.85Å; Y903-N905 VanDerWaalsContact C-N 3.32Å; Y903-N905 PolarHBondContact O-N 3.14Å; Y903-Q906 WeakPolarHBondContact O-CB 3.39Å; Y903-Q906 PolarHBondContact O-N 3.07Å; Y903-V907 HydrophobicContact CD1-CG2 4.27Å; Y903-V907 HydrophobicContact CE1-CG2 3.87Å; Y903-V907 WeakPolarHBondContact O-CG2 3.31Å; Y903-V907 PolarHBondContact O-N 3.46Å
904	L	90.3	Very high	89.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-40	178.5	-63.4	171.9	0	0	0	111.4	L812 L821 L824 L844 I853 C900 L901 V907 C908	L812-L904 HydrophobicContact CD1-CB 4.3Å; L812-L904 HydrophobicContact CD1-CD2 3.4Å; L812-L904 HydrophobicContact CD1-CG 4.4Å; L812-L904 HydrophobicContact CG-CD2 4.43Å; L821-L904 HydrophobicContact CD2-CB 4.13Å; L821-L904 HydrophobicContact CD2-CD1 4Å; L824-L904 HydrophobicContact CD1-CD1 4.36Å; L844-L904 HydrophobicContact CD2-CD1 3.91Å; I853-L904 HydrophobicContact CD1-CD2 4.25Å; C900-L904 VanDerWaalsContact O-CG 3.32Å; C900-L904 WeakPolarHBondContact O-CG 3.41Å; C900-L904 PolarHBondContact O-N 2.91Å; L901-L904 PolarHBondContact O-N 2.96Å; L904-V907 PolarHBondContact O-N 3.1Å; L904-C908 PolarHBondContact O-N 3.37Å; L904-C908 PolarHBondContact O-SG 2.92Å
905	N	90.6	Very high	88.4	Confident	52 Å²	52	59.9 Å²	59.9	28%	0.278	29%	0.293	S	S	.	.	H	α-helix	trans	-64.4	-42.1	174.6	-73.9	-8.5	0	0	0	111.3	L901 Y903 V907 C908 E909	L901-N905 WeakPolarHBondContact O-CB 3.24Å; L901-N905 PolarHBondContact O-N 3.29Å; Y903-N905 VanDerWaalsContact C-N 3.32Å; Y903-N905 PolarHBondContact O-N 3.14Å; N905-V907 VanDerWaalsContact C-N 3.32Å; N905-V907 PolarHBondContact O-N 3.11Å; N905-C908 CarbonylContact O-C 3.54Å; N905-C908 WeakPolarHBondContact O-CA 3.37Å; N905-C908 WeakPolarHBondContact O-CB 3.41Å; N905-C908 PolarHBondContact O-N 2.99Å; N905-C908 VanDerWaalsContact O-N 3.08Å; N905-E909 WeakPolarHBondContact O-CB 3.4Å; N905-E909 WeakPolarHBondContact O-CG 3.39Å; N905-E909 PolarHBondContact O-N 3.24Å
906	Q	89.8	Confident	87.5	Confident	103 Å²	103	58.3 Å²	58.3	48%	0.481	30%	0.295	S	S	.	.	H	α-helix	trans	-60.5	-40.2	175.5	-169.3	176.1	17.2	0	0	112.2	S902 Y903 C908 E909 N910	S902-Q906 WeakPolarHBondContact O-CB 3.41Å; S902-Q906 PolarHBondContact O-N 3.14Å; S902-Q906 VanDerWaalsContact O-N 3.08Å; Y903-Q906 WeakPolarHBondContact O-CB 3.39Å; Y903-Q906 PolarHBondContact O-N 3.07Å; Q906-C908 VanDerWaalsContact C-N 3.34Å; Q906-E909 PolarHBondContact O-N 3.06Å; Q906-N910 WeakPolarHBondContact O-CB 3.19Å; Q906-N910 PolarHBondContact O-N 3.2Å; Q906-N910 PolarHBondContact O-ND2 3.35Å; Q906-N910 PolarHBondContact O-OD1 2.66Å
907	V	87.4	Confident	85.9	Confident	17 Å²	17	59.8 Å²	59.8	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-41.6	173.6	174	0	0	0	0	111	I807 L812 Y903 L904 N905 A911	I807-V907 HydrophobicContact CG2-CG1 4.38Å; I807-V907 WeakPolarHBondContact O-CG1 3.49Å; L812-V907 HydrophobicContact CD1-CG1 4.32Å; Y903-V907 HydrophobicContact CD1-CG2 4.27Å; Y903-V907 HydrophobicContact CE1-CG2 3.87Å; Y903-V907 WeakPolarHBondContact O-CG2 3.31Å; Y903-V907 PolarHBondContact O-N 3.46Å; L904-V907 PolarHBondContact O-N 3.1Å; N905-V907 VanDerWaalsContact C-N 3.32Å; N905-V907 PolarHBondContact O-N 3.11Å; V907-A911 WeakPolarHBondContact O-CB 3.45Å; V907-A911 PolarHBondContact O-N 3.32Å; V907-A911 VanDerWaalsContact O-N 3.1Å
908	C	86.5	Confident	84.2	Confident	10 Å²	10	63.7 Å²	63.7	7%	0.068	33%	0.33	C	S	.	.	H	α-helix	trans	-62.8	-44	176.1	-78.3	0	0	0	0	112.5	R809 L904 N905 Q906 A911 I912	R809-C908 VanDerWaalsContact NH1-CB 3.33Å; R809-C908 PolarHBondContact NH1-O 3.46Å; L904-C908 PolarHBondContact O-N 3.37Å; L904-C908 PolarHBondContact O-SG 2.92Å; N905-C908 CarbonylContact O-C 3.54Å; N905-C908 WeakPolarHBondContact O-CA 3.37Å; N905-C908 WeakPolarHBondContact O-CB 3.41Å; N905-C908 PolarHBondContact O-N 2.99Å; N905-C908 VanDerWaalsContact O-N 3.08Å; Q906-C908 VanDerWaalsContact C-N 3.34Å; C908-A911 PolarHBondContact O-N 3.37Å; C908-I912 WeakPolarHBondContact O-CG1 3.3Å; C908-I912 PolarHBondContact O-N 3.45Å
909	E	87.1	Confident	82.1	Confident	110 Å²	110	62.9 Å²	62.9	51%	0.514	33%	0.334	S	S	.	.	H	α-helix	trans	-62.3	-52.7	177.2	-74.9	167.8	-172.7	0	0	110.8	N905 Q906 A911 I912 E913	N905-E909 WeakPolarHBondContact O-CB 3.4Å; N905-E909 WeakPolarHBondContact O-CG 3.39Å; N905-E909 PolarHBondContact O-N 3.24Å; Q906-E909 PolarHBondContact O-N 3.06Å; E909-A911 PolarHBondContact O-N 3.26Å; E909-I912 CarbonylContact O-C 3.49Å; E909-I912 WeakPolarHBondContact O-CA 3.36Å; E909-I912 WeakPolarHBondContact O-CB 3.34Å; E909-I912 PolarHBondContact O-N 3.48Å; E909-E913 WeakPolarHBondContact O-CG 3.44Å; E909-E913 PolarHBondContact O-N 3.03Å
910	N	85.9	Confident	79.8	Confident	82 Å²	82	68.4 Å²	68.4	44%	0.439	36%	0.361	S	S	.	.	H	α-helix	trans	-55.6	-39.9	177.6	-67.7	-9.4	0	0	0	112	Q906 E913 S914	Q906-N910 WeakPolarHBondContact O-CB 3.19Å; Q906-N910 PolarHBondContact O-N 3.2Å; Q906-N910 PolarHBondContact O-ND2 3.35Å; Q906-N910 PolarHBondContact O-OD1 2.66Å; N910-E913 PolarHBondContact O-N 3.19Å; N910-S914 WeakPolarHBondContact O-CB 3.35Å; N910-S914 PolarHBondContact O-N 3.22Å; N910-S914 PolarHBondContact O-OG 3.22Å
911	A	82.6	Confident	77.5	Confident	11 Å²	11	78.3 Å²	78.3	9%	0.091	40%	0.398	C	S	.	.	H	α-helix	trans	-68.9	-36.5	177.1	0	0	0	0	0	112.5	R809 V907 C908 E909 S914 H915	R809-A911 HydrophobicContact CB-CB 3.46Å; R809-A911 VanDerWaalsContact CB-CB 3.46Å; R809-A911 HydrophobicContact CG-CB 4.04Å; V907-A911 WeakPolarHBondContact O-CB 3.45Å; V907-A911 PolarHBondContact O-N 3.32Å; V907-A911 VanDerWaalsContact O-N 3.1Å; C908-A911 PolarHBondContact O-N 3.37Å; E909-A911 PolarHBondContact O-N 3.26Å; A911-S914 WeakPolarHBondContact CA-OG 3.29Å; A911-S914 PolarHBondContact O-N 2.96Å; A911-S914 PolarHBondContact O-OG 3.37Å; A911-H915 WeakPolarHBondContact O-CB 3.41Å; A911-H915 PolarHBondContact O-N 3.34Å
912	I	82.5	Confident	75	Confident	82 Å²	82	85.5 Å²	85.5	42%	0.421	43%	0.431	S	S	.	.	H	α-helix	trans	-66.9	-43.8	173.5	-70.2	162.5	0	0	0	110.3	R809 C908 E909 S914 H915 L916	R809-I912 VanDerWaalsContact NH1-CD1 3.29Å; C908-I912 WeakPolarHBondContact O-CG1 3.3Å; C908-I912 PolarHBondContact O-N 3.45Å; E909-I912 CarbonylContact O-C 3.49Å; E909-I912 WeakPolarHBondContact O-CA 3.36Å; E909-I912 WeakPolarHBondContact O-CB 3.34Å; E909-I912 PolarHBondContact O-N 3.48Å; I912-S914 VanDerWaalsContact C-N 3.3Å; I912-S914 PolarHBondContact O-N 2.94Å; I912-H915 PolarHBondContact O-N 3.33Å; I912-H915 VanDerWaalsContact O-N 3.16Å; I912-L916 HydrophobicContact CG2-CD1 3.47Å; I912-L916 VanDerWaalsContact CG2-CD1 3.47Å; I912-L916 HydrophobicContact CG2-CG 4.11Å; I912-L916 WeakPolarHBondContact O-CB 3.39Å; I912-L916 VanDerWaalsContact O-CG 3.3Å; I912-L916 WeakPolarHBondContact O-CG 3.42Å; I912-L916 PolarHBondContact O-N 3.17Å
913	E	81.2	Confident	72.4	Confident	86 Å²	86	90.4 Å²	90.4	40%	0.402	44%	0.443	S	S	.	.	H	α-helix	trans	-58.6	-42.2	175.7	-72	-178.3	167.6	0	0	111.7	E909 N910 L916 G917 I918	E909-E913 WeakPolarHBondContact O-CG 3.44Å; E909-E913 PolarHBondContact O-N 3.03Å; N910-E913 PolarHBondContact O-N 3.19Å; E913-L916 PolarHBondContact O-N 3.26Å; E913-G917 PolarHBondContact O-N 3.17Å; E913-I918 PolarHBondContact O-N 3.28Å; E913-I918 VanDerWaalsContact O-N 3.1Å
914	S	79.6	Confident	69.9	Low	67 Å²	67	93.3 Å²	93.3	47%	0.469	46%	0.464	S	S	.	.	H	α-helix	trans	-65	-40.8	175.2	75.6	0	0	0	0	112.3	N910 A911 I912 G917	N910-S914 WeakPolarHBondContact O-CB 3.35Å; N910-S914 PolarHBondContact O-N 3.22Å; N910-S914 PolarHBondContact O-OG 3.22Å; A911-S914 WeakPolarHBondContact CA-OG 3.29Å; A911-S914 PolarHBondContact O-N 2.96Å; A911-S914 PolarHBondContact O-OG 3.37Å; I912-S914 VanDerWaalsContact C-N 3.3Å; I912-S914 PolarHBondContact O-N 2.94Å; S914-G917 PolarHBondContact O-N 3.23Å
915	H	76.8	Confident	67.3	Low	176 Å²	176	98.3 Å²	98.3	82%	0.815	49%	0.494	S	S	*	.	H	α-helix	trans	-70	-33.5	177.1	-109.9	-69.3	0	0	0	113.2	A911 I912 G917	A911-H915 WeakPolarHBondContact O-CB 3.41Å; A911-H915 PolarHBondContact O-N 3.34Å; I912-H915 PolarHBondContact O-N 3.33Å; I912-H915 VanDerWaalsContact O-N 3.16Å; H915-G917 PolarHBondContact O-N 3.2Å
916	L	75	Confident	64.7	Low	119 Å²	119	101.1 Å²	101.1	62%	0.623	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-4.8	175.3	-71.8	168.9	0	0	0	112.4	I912 E913 I918	I912-L916 HydrophobicContact CG2-CD1 3.47Å; I912-L916 VanDerWaalsContact CG2-CD1 3.47Å; I912-L916 HydrophobicContact CG2-CG 4.11Å; I912-L916 WeakPolarHBondContact O-CB 3.39Å; I912-L916 VanDerWaalsContact O-CG 3.3Å; I912-L916 WeakPolarHBondContact O-CG 3.42Å; I912-L916 PolarHBondContact O-N 3.17Å; E913-L916 PolarHBondContact O-N 3.26Å; L916-I918 VanDerWaalsContact C-N 3.25Å; L916-I918 HydrophobicContact CB-CD1 3.95Å; L916-I918 HydrophobicContact CB-CG1 3.87Å; L916-I918 HydrophobicContact CD1-CD1 4.11Å; L916-I918 PolarHBondContact O-N 3.01Å
917	G	60.7	Low	62.4	Low	31 Å²	31	104.8 Å²	104.8	32%	0.32	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	21.7	178.4	0	0	0	0	0	113.9	E913 S914 H915 D919 Q920	E913-G917 PolarHBondContact O-N 3.17Å; S914-G917 PolarHBondContact O-N 3.23Å; H915-G917 PolarHBondContact O-N 3.2Å; G917-D919 PolarHBondContact O-N 3.36Å; G917-Q920 PolarHBondContact O-N 2.93Å
918	I	57.9	Low	59.8	Low	87 Å²	87	110.9 Å²	110.9	45%	0.446	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-68.2	-28	-177.3	-59.1	175.1	0	0	0	110.5	E913 L916 Q920 R921	E913-I918 PolarHBondContact O-N 3.28Å; E913-I918 VanDerWaalsContact O-N 3.1Å; L916-I918 VanDerWaalsContact C-N 3.25Å; L916-I918 HydrophobicContact CB-CD1 3.95Å; L916-I918 HydrophobicContact CB-CG1 3.87Å; L916-I918 HydrophobicContact CD1-CD1 4.11Å; L916-I918 PolarHBondContact O-N 3.01Å; I918-Q920 PolarHBondContact O-N 3.03Å; I918-R921 PolarHBondContact O-N 3.37Å
919	D	49.3	Very low	57.6	Low	94 Å²	94	118.2 Å²	118.2	50%	0.503	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-66.9	-17.5	174.9	-90.6	-28	0	0	0	114.8	G917	G917-D919 PolarHBondContact O-N 3.36Å
920	Q	45.9	Very low	55.7	Low	186 Å²	186	118.3 Å²	118.3	87%	0.869	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-88.6	-8.2	171.2	-69.8	-168.9	6.4	0	0	113.1	G917 I918	G917-Q920 PolarHBondContact O-N 2.93Å; I918-Q920 PolarHBondContact O-N 3.03Å
921	R	41.8	Very low	54	Low	209 Å²	209	120.7 Å²	120.7	79%	0.789	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-15.6	-178.8	-78	-174.3	174.1	175.6	-0.7	115.6	I918	I918-R921 PolarHBondContact O-N 3.37Å
922	H	40.8	Very low	52.6	Low	161 Å²	161	124 Å²	124	75%	0.745	64%	0.639	S	S	*	*			trans	-148.8	66.7	172.4	-76.5	-70.8	0	0	0	113.8
923	K	38.5	Very low	51.7	Low	182 Å²	182	126.2 Å²	126.2	79%	0.791	65%	0.651	S	S	*	*			trans	-108.2	44.9	144.7	-91.9	179.7	-178	165	0	109.9	T925	K923-T925 PolarHBondContact O-N 2.82Å
924	V	36.8	Very low	51	Low	95 Å²	95	129.2 Å²	129.2	58%	0.576	67%	0.665	S	S	*	*	S	Bend	trans	-68.1	110.8	147.2	179.4	0	0	0	0	104.1	A926	V924-A926 PolarHBondContact O-N 3.04Å
925	T	36.1	Very low	50.5	Low	104 Å²	104	130.8 Å²	130.8	64%	0.638	67%	0.665	S	S	*	*			trans	-21	118.2	164.4	10.8	0	0	0	0	111.2	K923 K927	K923-T925 PolarHBondContact O-N 2.82Å; T925-K927 PolarHBondContact O-N 3.3Å
926	A	37.1	Very low	49.9	Very low	111 Å²	111	127.4 Å²	127.4	92%	0.917	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	62.4	163.7	0	0	0	0	0	109.7	V924	V924-A926 PolarHBondContact O-N 3.04Å
927	K	40.5	Very low	49.8	Very low	181 Å²	181	127 Å²	127	79%	0.787	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.7	1	172.1	-129.3	-178.8	-175	-177.1	0	111	T925	T925-K927 PolarHBondContact O-N 3.3Å
928	E	34.3	Very low	50.5	Low	145 Å²	145	130.5 Å²	130.5	68%	0.678	66%	0.659	S	S	*	*	S	Bend	trans	-129.5	0.8	-177.1	-71.1	-172.5	160.8	0	0	116.1	S930	E928-S930 PolarHBondContact O-N 2.99Å
929	I	38.7	Very low	51.3	Low	163 Å²	163	131.5 Å²	131.5	84%	0.836	66%	0.662	S	S	*	*			trans	-104.8	64.8	170.3	-46.6	176.6	0	0	0	109.6
930	S	47.1	Very low	52.4	Low	113 Å²	113	134.9 Å²	134.9	79%	0.79	67%	0.669	S	S	*	*			trans	-131.4	35.7	156.1	75.2	0	0	0	0	110.1	E928	E928-S930 PolarHBondContact O-N 2.99Å
931	R	50.6	Low	53.9	Low	132 Å²	132	128.4 Å²	128.4	50%	0.498	65%	0.647	S	S	.	*	S	Bend	trans	-102.5	125.3	166.4	-70	-172.2	-179.1	-173.7	-1.7	107.6	E935 E939	R931-E935 HydrophobicContact CB-CB 4.41Å; R931-E939 IonicContact NH1-OE1 3.32Å; R931-E939 PolarHBondContact NH1-OE1 3.22Å; R931-E939 IonicContact NH1-OE2 3.02Å; R931-E939 PolarHBondContact NH1-OE2 2.89Å; R931-E939 VanDerWaalsContact NH1-OE2 3.1Å
932	P	54.4	Low	55.6	Low	79 Å²	79	121.8 Å²	121.8	51%	0.513	63%	0.633	S	S	.	*			trans	-62.3	146.4	175.7	25.8	-31.4	0	0	0	109.6	E934 E935	P932-E934 PolarHBondContact O-N 3.29Å; P932-E935 PolarHBondContact O-N 2.95Å
933	L	62.6	Low	57.3	Low	129 Å²	129	119.1 Å²	119.1	68%	0.675	62%	0.621	S	S	*	*	H	α-helix	trans	-47.9	-26.7	-177.6	-162.7	76.8	0	0	0	114.1	L937	L933-L937 HydrophobicContact CG-CD1 4.28Å; L933-L937 WeakPolarHBondContact O-CB 3.34Å; L933-L937 WeakPolarHBondContact O-CD1 3.34Å; L933-L937 PolarHBondContact O-N 3.48Å
934	E	66.4	Low	59.2	Low	149 Å²	149	114.7 Å²	114.7	70%	0.696	61%	0.609	S	S	*	*	H	α-helix	trans	-67.6	-31.1	175	-73.6	177.2	155.5	0	0	114.1	P932 N938	P932-E934 PolarHBondContact O-N 3.29Å; E934-N938 WeakPolarHBondContact O-CB 3.46Å; E934-N938 VanDerWaalsContact O-CG 3.28Å; E934-N938 PolarHBondContact O-N 3.12Å; E934-N938 VanDerWaalsContact O-N 3.09Å; E934-N938 PolarHBondContact O-ND2 3.48Å
935	E	68.5	Low	61	Low	100 Å²	100	116.5 Å²	116.5	47%	0.467	61%	0.611	S	S	.	*	H	α-helix	trans	-74.3	-39.6	175.9	-90.1	-178.1	164	0	0	111.6	R931 P932 N938 E939	R931-E935 HydrophobicContact CB-CB 4.41Å; P932-E935 PolarHBondContact O-N 2.95Å; E935-N938 PolarHBondContact O-N 2.95Å; E935-E939 PolarHBondContact O-N 3.48Å
936	E	64.3	Low	62.8	Low	106 Å²	106	120.4 Å²	120.4	50%	0.495	61%	0.614	S	S	.	*	H	α-helix	trans	-65.7	-40.8	173.3	-85.6	-173.6	156.6	0	0	111.9	N938 E939 Y940	E936-N938 VanDerWaalsContact C-N 3.31Å; E936-N938 PolarHBondContact O-N 3.28Å; E936-E939 PolarHBondContact O-N 3.34Å; E936-Y940 WeakPolarHBondContact O-CB 3.48Å; E936-Y940 PolarHBondContact O-N 2.97Å
937	L	74.2	Confident	64.5	Low	109 Å²	109	122.1 Å²	122.1	57%	0.571	60%	0.601	S	S	*	*	H	α-helix	trans	-62.5	-37.7	174.7	-88.9	156.7	0	0	0	112	L933 A941	L933-L937 HydrophobicContact CG-CD1 4.28Å; L933-L937 WeakPolarHBondContact O-CB 3.34Å; L933-L937 WeakPolarHBondContact O-CD1 3.34Å; L933-L937 PolarHBondContact O-N 3.48Å; L937-A941 VanDerWaalsContact O-CB 3.22Å; L937-A941 WeakPolarHBondContact O-CB 3.5Å; L937-A941 PolarHBondContact O-N 2.74Å
938	N	75.4	Confident	65.9	Low	106 Å²	106	116.2 Å²	116.2	57%	0.567	59%	0.586	S	S	*	*	H	α-helix	trans	-75.8	-36.1	177.8	-78	-33.8	0	0	0	113.1	E934 E935 E936 A941 S942	E934-N938 WeakPolarHBondContact O-CB 3.46Å; E934-N938 VanDerWaalsContact O-CG 3.28Å; E934-N938 PolarHBondContact O-N 3.12Å; E934-N938 VanDerWaalsContact O-N 3.09Å; E934-N938 PolarHBondContact O-ND2 3.48Å; E935-N938 PolarHBondContact O-N 2.95Å; E936-N938 VanDerWaalsContact C-N 3.31Å; E936-N938 PolarHBondContact O-N 3.28Å; N938-A941 PolarHBondContact O-N 2.89Å; N938-S942 VanDerWaalsContact O-CB 3.31Å; N938-S942 WeakPolarHBondContact O-CB 3.49Å; N938-S942 PolarHBondContact O-N 2.63Å; N938-S942 PolarHBondContact O-OG 2.93Å
939	E	74.7	Confident	67.5	Low	108 Å²	108	115.8 Å²	115.8	51%	0.505	58%	0.584	S	S	.	*	H	α-helix	trans	-64.2	-46	171.3	-90.4	178.5	158.5	0	0	110.3	R931 E935 E936 A941 S942 E943	R931-E939 IonicContact NH1-OE1 3.32Å; R931-E939 PolarHBondContact NH1-OE1 3.22Å; R931-E939 IonicContact NH1-OE2 3.02Å; R931-E939 PolarHBondContact NH1-OE2 2.89Å; R931-E939 VanDerWaalsContact NH1-OE2 3.1Å; E935-E939 PolarHBondContact O-N 3.48Å; E936-E939 PolarHBondContact O-N 3.34Å; E939-A941 PolarHBondContact O-N 3.01Å; E939-S942 PolarHBondContact O-N 2.98Å; E939-E943 WeakPolarHBondContact O-CB 3.43Å; E939-E943 PolarHBondContact O-N 3.42Å
940	Y	72.8	Confident	68.9	Low	165 Å²	165	110 Å²	110	65%	0.647	56%	0.564	S	S	*	*	H	α-helix	trans	-62.3	-42.2	174.5	-105.7	-87.1	0	0	0	112.6	E936 S942 E943 V944	E936-Y940 WeakPolarHBondContact O-CB 3.48Å; E936-Y940 PolarHBondContact O-N 2.97Å; Y940-S942 VanDerWaalsContact C-N 3.31Å; Y940-S942 PolarHBondContact O-N 3.41Å; Y940-E943 PolarHBondContact O-N 2.86Å; Y940-V944 WeakPolarHBondContact O-CB 3.44Å; Y940-V944 VanDerWaalsContact O-CG2 3.25Å; Y940-V944 WeakPolarHBondContact O-CG2 3.41Å; Y940-V944 PolarHBondContact O-N 3.25Å
941	A	76.7	Confident	69.7	Low	50 Å²	50	109.8 Å²	109.8	41%	0.413	55%	0.554	S	S	.	*	H	α-helix	trans	-62.7	-39.2	176.1	0	0	0	0	0	111.9	L937 N938 E939 Q945	L937-A941 VanDerWaalsContact O-CB 3.22Å; L937-A941 WeakPolarHBondContact O-CB 3.5Å; L937-A941 PolarHBondContact O-N 2.74Å; N938-A941 PolarHBondContact O-N 2.89Å; E939-A941 PolarHBondContact O-N 3.01Å; A941-Q945 WeakPolarHBondContact O-CB 3.3Å; A941-Q945 PolarHBondContact O-N 3.02Å
942	S	77.5	Confident	69.9	Low	69 Å²	69	108.5 Å²	108.5	48%	0.483	56%	0.557	S	S	.	*	H	α-helix	trans	-69.2	-37.1	176.8	-57.2	0	0	0	0	111.8	N938 E939 Y940 Q945 R946	N938-S942 VanDerWaalsContact O-CB 3.31Å; N938-S942 WeakPolarHBondContact O-CB 3.49Å; N938-S942 PolarHBondContact O-N 2.63Å; N938-S942 PolarHBondContact O-OG 2.93Å; E939-S942 PolarHBondContact O-N 2.98Å; Y940-S942 VanDerWaalsContact C-N 3.31Å; Y940-S942 PolarHBondContact O-N 3.41Å; S942-Q945 PolarHBondContact O-N 3.38Å; S942-R946 WeakPolarHBondContact O-CB 3.41Å; S942-R946 PolarHBondContact O-N 3.27Å
943	E	76.9	Confident	70	Confident	105 Å²	105	114.1 Å²	114.1	49%	0.491	57%	0.568	S	S	.	*	H	α-helix	trans	-75	-36.1	179.8	-152.3	169.1	-147.2	0	0	112	E939 Y940 R946 K947	E939-E943 WeakPolarHBondContact O-CB 3.43Å; E939-E943 PolarHBondContact O-N 3.42Å; Y940-E943 PolarHBondContact O-N 2.86Å; E943-R946 PolarHBondContact O-N 2.93Å; E943-K947 PolarHBondContact O-N 2.83Å
944	V	78	Confident	69.7	Low	89 Å²	89	110 Å²	110	54%	0.539	56%	0.556	S	S	.	*	H	α-helix	trans	-66.2	-41.1	168.7	172.3	0	0	0	0	110.7	Y940 R946 K947 A948	Y940-V944 WeakPolarHBondContact O-CB 3.44Å; Y940-V944 VanDerWaalsContact O-CG2 3.25Å; Y940-V944 WeakPolarHBondContact O-CG2 3.41Å; Y940-V944 PolarHBondContact O-N 3.25Å; V944-R946 VanDerWaalsContact C-N 3.32Å; V944-R946 PolarHBondContact O-N 3.34Å; V944-K947 PolarHBondContact O-N 2.88Å; V944-A948 VanDerWaalsContact O-CB 3.25Å; V944-A948 WeakPolarHBondContact O-CB 3.36Å; V944-A948 PolarHBondContact O-N 2.84Å
945	Q	73.8	Confident	69	Low	134 Å²	134	109.8 Å²	109.8	63%	0.626	56%	0.559	S	S	*	*	H	α-helix	trans	-63.1	-37.2	171.6	-92.3	-176.1	-18.4	0	0	112.4	A941 S942 A948 Q949	A941-Q945 WeakPolarHBondContact O-CB 3.3Å; A941-Q945 PolarHBondContact O-N 3.02Å; S942-Q945 PolarHBondContact O-N 3.38Å; Q945-A948 PolarHBondContact O-N 3.35Å; Q945-Q949 VanDerWaalsContact O-CB 3.31Å; Q945-Q949 WeakPolarHBondContact O-CB 3.49Å; Q945-Q949 WeakPolarHBondContact O-CG 3.36Å; Q945-Q949 PolarHBondContact O-N 3.12Å
946	R	75.1	Confident	68.3	Low	185 Å²	185	109.6 Å²	109.6	70%	0.698	56%	0.56	S	S	*	*	H	α-helix	trans	-72.5	-35.7	178.4	-154.1	-179.1	82.7	164.1	3.7	112.1	S942 E943 V944 G950	S942-R946 WeakPolarHBondContact O-CB 3.41Å; S942-R946 PolarHBondContact O-N 3.27Å; E943-R946 PolarHBondContact O-N 2.93Å; V944-R946 VanDerWaalsContact C-N 3.32Å; V944-R946 PolarHBondContact O-N 3.34Å; R946-G950 PolarHBondContact O-N 3.28Å
947	K	73	Confident	67.4	Low	147 Å²	147	109 Å²	109	64%	0.639	57%	0.567	S	S	*	*	H	α-helix	trans	-67.2	-45.6	169.6	-82.5	-177.9	176.1	174	0	111.2	E943 V944 Q949 G950 D951	E943-K947 PolarHBondContact O-N 2.83Å; V944-K947 PolarHBondContact O-N 2.88Å; K947-Q949 VanDerWaalsContact C-N 3.32Å; K947-Q949 PolarHBondContact O-N 3.38Å; K947-G950 CarbonylContact O-C 2.83Å; K947-G950 WeakPolarHBondContact O-CA 3.45Å; K947-G950 PolarHBondContact O-N 3.49Å; K947-D951 WeakPolarHBondContact O-CB 3.43Å; K947-D951 VanDerWaalsContact O-CG 3.27Å; K947-D951 PolarHBondContact O-N 2.86Å
948	A	69.5	Low	65.9	Low	57 Å²	57	111.6 Å²	111.6	47%	0.471	58%	0.577	S	S	.	*	H	α-helix	trans	-61.4	-39.2	174.8	0	0	0	0	0	112.1	V944 Q945 L952	V944-A948 VanDerWaalsContact O-CB 3.25Å; V944-A948 WeakPolarHBondContact O-CB 3.36Å; V944-A948 PolarHBondContact O-N 2.84Å; Q945-A948 PolarHBondContact O-N 3.35Å; A948-L952 WeakPolarHBondContact O-CB 3.43Å; A948-L952 PolarHBondContact O-N 3.46Å
949	Q	67.6	Low	64.5	Low	136 Å²	136	111.3 Å²	111.3	64%	0.636	58%	0.583	S	S	*	*	H	α-helix	trans	-71.1	-33.2	171.9	-83.3	-175.8	-12.7	0	0	112.6	Q945 K947 R953	Q945-Q949 VanDerWaalsContact O-CB 3.31Å; Q945-Q949 WeakPolarHBondContact O-CB 3.49Å; Q945-Q949 WeakPolarHBondContact O-CG 3.36Å; Q945-Q949 PolarHBondContact O-N 3.12Å; K947-Q949 VanDerWaalsContact C-N 3.32Å; K947-Q949 PolarHBondContact O-N 3.38Å; Q949-R953 WeakPolarHBondContact O-CB 3.46Å; Q949-R953 PolarHBondContact O-N 3.1Å
950	G	67.3	Low	63.1	Low	41 Å²	41	112.7 Å²	112.7	42%	0.423	59%	0.594	S	S	.	*	H	α-helix	trans	-67.4	-43.3	174.7	0	0	0	0	0	112.1	R946 K947 R953 G954	R946-G950 PolarHBondContact O-N 3.28Å; K947-G950 CarbonylContact O-C 2.83Å; K947-G950 WeakPolarHBondContact O-CA 3.45Å; K947-G950 PolarHBondContact O-N 3.49Å; G950-R953 PolarHBondContact O-N 3.1Å; G950-G954 PolarHBondContact O-N 3.41Å
951	D	64.3	Low	61.9	Low	110 Å²	110	110.5 Å²	110.5	59%	0.588	59%	0.593	S	S	*	*	H	α-helix	trans	-68.6	-42	175.1	-65.8	-21	0	0	0	110.3	K947 R953 G954 L955	K947-D951 WeakPolarHBondContact O-CB 3.43Å; K947-D951 VanDerWaalsContact O-CG 3.27Å; K947-D951 PolarHBondContact O-N 2.86Å; D951-R953 VanDerWaalsContact C-N 3.33Å; D951-R953 PolarHBondContact O-N 2.79Å; D951-G954 PolarHBondContact O-N 3.45Å; D951-L955 WeakPolarHBondContact O-CB 3.32Å; D951-L955 WeakPolarHBondContact O-CD1 3.45Å; D951-L955 PolarHBondContact O-N 3.28Å
952	L	55.5	Low	60.5	Low	105 Å²	105	112.9 Å²	112.9	55%	0.55	61%	0.612	S	S	.	*	H	α-helix	trans	-63.3	-37.8	172.6	-163.3	80.3	0	0	0	111.5	A948 L955 I956	A948-L952 WeakPolarHBondContact O-CB 3.43Å; A948-L952 PolarHBondContact O-N 3.46Å; L952-L955 PolarHBondContact O-N 2.9Å; L952-I956 HydrophobicContact CD2-CD1 4.12Å; L952-I956 HydrophobicContact CG-CD1 3.77Å; L952-I956 VanDerWaalsContact O-CB 3.27Å; L952-I956 WeakPolarHBondContact O-CB 3.35Å; L952-I956 VanDerWaalsContact O-CD1 3.29Å; L952-I956 WeakPolarHBondContact O-CD1 3.39Å; L952-I956 WeakPolarHBondContact O-CG1 3.29Å; L952-I956 PolarHBondContact O-N 3.33Å
953	R	55.8	Low	59.2	Low	197 Å²	197	118.4 Å²	118.4	74%	0.743	63%	0.628	S	S	*	*	H	α-helix	trans	-75.7	-30	178.6	-160.1	176.4	-163.9	-170.9	3.8	112.2	Q949 G950 D951 I956 S957	Q949-R953 WeakPolarHBondContact O-CB 3.46Å; Q949-R953 PolarHBondContact O-N 3.1Å; G950-R953 PolarHBondContact O-N 3.1Å; D951-R953 VanDerWaalsContact C-N 3.33Å; D951-R953 PolarHBondContact O-N 2.79Å; R953-I956 PolarHBondContact O-N 3.31Å; R953-S957 VanDerWaalsContact O-CB 3.32Å; R953-S957 WeakPolarHBondContact O-CB 3.46Å; R953-S957 PolarHBondContact O-N 3.41Å; R953-S957 VanDerWaalsContact O-N 3.15Å; R953-S957 PolarHBondContact O-OG 3.28Å
954	G	56	Low	58.1	Low	41 Å²	41	122.1 Å²	122.1	42%	0.423	64%	0.639	S	S	.	*	H	α-helix	trans	-64.7	-46.5	168.3	0	0	0	0	0	111.4	G950 D951 I956 S957	G950-G954 PolarHBondContact O-N 3.41Å; D951-G954 PolarHBondContact O-N 3.45Å; G954-I956 VanDerWaalsContact C-N 3.28Å; G954-I956 PolarHBondContact O-N 3.01Å; G954-S957 PolarHBondContact O-N 2.87Å; G954-S957 PolarHBondContact O-OG 2.88Å
955	L	52.2	Low	56.4	Low	146 Å²	146	128.7 Å²	128.7	76%	0.764	65%	0.654	S	S	*	*	H	α-helix	trans	-66.8	-22.6	173.6	-91.6	133.5	0	0	0	114.1	D951 L952	D951-L955 WeakPolarHBondContact O-CB 3.32Å; D951-L955 WeakPolarHBondContact O-CD1 3.45Å; D951-L955 PolarHBondContact O-N 3.28Å; L952-L955 PolarHBondContact O-N 2.9Å
956	I	52.8	Low	55.1	Low	96 Å²	96	129.6 Å²	129.6	49%	0.492	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.7	-8.6	177.5	-71.1	166.7	0	0	0	112.3	L952 R953 G954 L961	L952-I956 HydrophobicContact CD2-CD1 4.12Å; L952-I956 HydrophobicContact CG-CD1 3.77Å; L952-I956 VanDerWaalsContact O-CB 3.27Å; L952-I956 WeakPolarHBondContact O-CB 3.35Å; L952-I956 VanDerWaalsContact O-CD1 3.29Å; L952-I956 WeakPolarHBondContact O-CD1 3.39Å; L952-I956 WeakPolarHBondContact O-CG1 3.29Å; L952-I956 PolarHBondContact O-N 3.33Å; R953-I956 PolarHBondContact O-N 3.31Å; G954-I956 VanDerWaalsContact C-N 3.28Å; G954-I956 PolarHBondContact O-N 3.01Å; I956-L961 HydrophobicContact CG2-CD1 4.16Å
957	S	46.1	Very low	53.3	Low	92 Å²	92	131.6 Å²	131.6	64%	0.643	67%	0.669	S	S	*	*	S	Bend	trans	-96.9	-0.1	-174.5	70.1	0	0	0	0	116.1	R953 G954	R953-S957 VanDerWaalsContact O-CB 3.32Å; R953-S957 WeakPolarHBondContact O-CB 3.46Å; R953-S957 PolarHBondContact O-N 3.41Å; R953-S957 VanDerWaalsContact O-N 3.15Å; R953-S957 PolarHBondContact O-OG 3.28Å; G954-S957 PolarHBondContact O-N 2.87Å; G954-S957 PolarHBondContact O-OG 2.88Å
958	E	43.4	Very low	51.8	Low	164 Å²	164	129 Å²	129	77%	0.766	68%	0.675	S	S	*	*	S	Bend	trans	-107	103.1	168	-72	-176.1	164.4	0	0	109.4
959	S	44.9	Very low	50.2	Low	100 Å²	100	133.5 Å²	133.5	70%	0.699	69%	0.691	S	S	*	*	S	Bend	trans	33.1	99.9	155.4	53.1	0	0	0	0	118.2
960	D	46	Very low	48.7	Very low	138 Å²	138	135.7 Å²	135.7	74%	0.738	70%	0.701	S	S	*	*			trans	166.3	9.2	133.4	-88.2	-15.6	0	0	0	117.4	A962	D960-A962 VanDerWaalsContact C-N 3.35Å; D960-A962 PolarHBondContact O-N 3.16Å
961	L	47	Very low	47.3	Very low	118 Å²	118	141.3 Å²	141.3	62%	0.618	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-84.9	7.9	-176.6	-75.1	163.1	0	0	0	116.6	I956 K963 Y964	I956-L961 HydrophobicContact CG2-CD1 4.16Å; L961-K963 PolarHBondContact O-N 3.19Å; L961-Y964 HydrophobicContact CD2-CD2 4.3Å
962	A	47.8	Very low	46.1	Very low	100 Å²	100	144.5 Å²	144.5	83%	0.826	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-70.4	-13.3	172.3	0	0	0	0	0	113.7	D960	D960-A962 VanDerWaalsContact C-N 3.35Å; D960-A962 PolarHBondContact O-N 3.16Å
963	K	50	Low	45.4	Very low	185 Å²	185	145.7 Å²	145.7	80%	0.804	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-87.5	-3.4	-179.3	-85.6	178.3	177.7	170.7	0	115.6	L961	L961-K963 PolarHBondContact O-N 3.19Å
964	Y	53	Low	44.6	Very low	184 Å²	184	145 Å²	145	72%	0.722	75%	0.75	S	S	*	*			trans	-122.8	19.7	-174.1	-66.8	-77.3	0	0	0	115.1	L961 I966	L961-Y964 HydrophobicContact CD2-CD2 4.3Å; Y964-I966 PolarHBondContact O-N 3Å
965	R	43.3	Very low	44	Very low	227 Å²	227	151.3 Å²	151.3	86%	0.857	77%	0.766	S	S	*	*			trans	-79.1	91.9	174.6	-166.4	175	-177.8	174.3	0.3	110.5	R967	R965-R967 PolarHBondContact O-N 3.15Å
966	I	47.2	Very low	43.5	Very low	153 Å²	153	150.8 Å²	150.8	79%	0.785	76%	0.763	S	S	*	*			trans	-67.9	119.2	165.4	-61.1	173.2	0	0	0	107.3	Y964	Y964-I966 PolarHBondContact O-N 3Å
967	R	37.6	Very low	43.1	Very low	227 Å²	227	152.7 Å²	152.7	86%	0.857	77%	0.774	S	S	*	*			trans	-76.2	118.2	163.3	-75.9	179.3	174.7	172.1	-3	106.5	R965	R965-R967 PolarHBondContact O-N 3.15Å
968	A	40	Very low	42.9	Very low	92 Å²	92	155 Å²	155	76%	0.76	78%	0.78	S	S	*	*			trans	-124.7	125.8	164.4	0	0	0	0	0	107.2
969	D	36.8	Very low	42.8	Very low	152 Å²	152	154.8 Å²	154.8	81%	0.813	78%	0.776	S	S	*	*			trans	-68.9	162.4	-164	-64.4	-49.5	0	0	0	114
970	E	35.2	Very low	42.5	Very low	181 Å²	181	157.4 Å²	157.4	85%	0.846	78%	0.782	S	S	*	*	S	Bend	trans	-48.6	122.6	173.3	-61.5	164.2	164.7	0	0	110.9
971	D	38.7	Very low	42.1	Very low	160 Å²	160	154.9 Å²	154.9	86%	0.856	78%	0.779	S	S	*	*			trans	173.9	6.9	149.5	-87.7	-17.3	0	0	0	117.1
972	E	39.9	Very low	41.6	Very low	176 Å²	176	153.7 Å²	153.7	82%	0.822	78%	0.781	S	S	*	*			trans	-120	27.7	178.1	-72.5	-162	158	0	0	115.8
973	T	40.4	Very low	41	Very low	131 Å²	131	154.3 Å²	154.3	80%	0.804	78%	0.78	S	S	*	*	S	Bend	trans	-95.3	14.5	-179.7	51.4	0	0	0	0	116
974	E	39.2	Very low	40.3	Very low	182 Å²	182	155.5 Å²	155.5	85%	0.85	79%	0.785	S	S	*	*	S	Bend	trans	-113.7	-5.5	175.3	-91.4	-173.6	158.9	0	0	115.9
975	F	43	Very low	39.2	Very low	173 Å²	173	156.2 Å²	156.2	76%	0.759	79%	0.791	S	S	*	*	S	Bend	trans	-101	-9.8	-176	-147.6	-102	0	0	0	115.5
976	L	42.1	Very low	38.6	Very low	135 Å²	135	150.6 Å²	150.6	71%	0.707	79%	0.787	S	S	*	*	S	Bend	trans	-102.4	-14.1	-175.9	-81.5	160.4	0	0	0	114.9
977	N	43.9	Very low	38	Very low	137 Å²	137	153.2 Å²	153.2	73%	0.733	79%	0.793	S	S	*	*	S	Bend	trans	-84.2	-16.2	178	-86.4	-20.9	0	0	0	114.5
978	D	41.2	Very low	37.6	Very low	141 Å²	141	152.7 Å²	152.7	75%	0.754	80%	0.797	S	S	*	*	S	Bend	trans	-88.6	-9.2	-179.2	-107.1	-6	0	0	0	114.9
979	K	40.9	Very low	37	Very low	159 Å²	159	159 Å²	159	69%	0.691	80%	0.801	S	S	*	*	S	Bend	trans	-92.2	-9.7	176.8	-92.7	-179.1	178.8	174.3	0	115.2
980	L	40.3	Very low	37	Very low	155 Å²	155	159.9 Å²	159.9	81%	0.812	81%	0.805	S	S	*	*	S	Bend	trans	-88.5	-8.8	175.7	-96	108.5	0	0	0	114.4
981	A	37.1	Very low	36.7	Very low	84 Å²	84	161.4 Å²	161.4	69%	0.694	81%	0.809	S	S	*	*	S	Bend	trans	-88.9	-8.7	179.5	0	0	0	0	0	114.9
982	S	35.9	Very low	36.3	Very low	94 Å²	94	163.4 Å²	163.4	66%	0.657	81%	0.81	S	S	*	*	S	Bend	trans	-103.2	-2.6	-171.6	63.5	0	0	0	0	116.4
983	S	36.1	Very low	36.1	Very low	113 Å²	113	163.2 Å²	163.2	79%	0.79	81%	0.811	S	S	*	*	S	Bend	trans	-106.3	18.8	-178.7	-150.3	0	0	0	0	115.3
984	K	34.5	Very low	35.9	Very low	210 Å²	210	165.4 Å²	165.4	91%	0.913	81%	0.812	S	S	*	*	S	Bend	trans	-90.7	15.4	169.7	-93.8	-179	178.9	172.9	0	114.3
985	K	30	Very low	35.4	Very low	198 Å²	198	160.3 Å²	160.3	86%	0.861	81%	0.807	S	S	*	*	S	Bend	trans	-132.2	52.3	-177	-90.8	-175.3	177.8	174.4	0	114.1
986	S	30.3	Very low	34.9	Very low	110 Å²	110	156.1 Å²	156.1	77%	0.769	81%	0.813	S	S	*	*	S	Bend	trans	-171.1	73.4	155.2	-129.4	0	0	0	0	114.1
987	K	34	Very low	34.5	Very low	208 Å²	208	153.6 Å²	153.6	90%	0.904	82%	0.82	S	S	*	*			trans	-167.2	49.2	149.8	-106.7	168.9	-173.6	180	0	109.9
988	K	29.7	Very low	34	Very low	216 Å²	216	151.2 Å²	151.2	94%	0.939	83%	0.827	S	S	*	*			trans	-109.9	61.5	158.7	-143.7	179.6	-168.4	178.9	0	106
989	R	28.6	Very low	33.7	Very low	225 Å²	225	148.7 Å²	148.7	85%	0.849	84%	0.835	S	S	*	*			trans	-154	127.8	179.5	-130.6	173.5	163.5	-174.5	-6.6	107.2
990	L	35.3	Very low	33.5	Very low	169 Å²	169	144.8 Å²	144.8	89%	0.885	84%	0.84	S	S	*	*	S	Bend	trans	78.5	59.7	-170.1	-73.1	91.8	0	0	0	117.4
991	K	30.1	Very low	33.5	Very low	214 Å²	214	147 Å²	147	93%	0.93	84%	0.843	S	S	*	*	S	Bend	trans	-136.5	66.9	141.2	-132.1	-179.2	-170.4	178.8	0	107.6
992	K	30.2	Very low	33.8	Very low	202 Å²	202	152.9 Å²	152.9	88%	0.878	85%	0.853	S	S	*	*			trans	175	106.3	166.8	-106.9	179.6	-179.1	-177.9	0	109.1
993	M	34.6	Very low	34.2	Very low	172 Å²	172	158.2 Å²	158.2	85%	0.847	86%	0.859	S	S	*	*			trans	165.5	98.6	151.5	-93.6	-179.8	110	0	0	105.5
994	H	36.7	Very low	34.8	Very low	177 Å²	177	162.5 Å²	162.5	82%	0.819	86%	0.857	S	S	*	*				72.2	114.9	116.1	-80.8	39.5	0	0	0	112.1
995	G	28.2	Very low	35.1	Very low	74 Å²	74	167.6 Å²	167.6	76%	0.763	87%	0.871	S	S	*	*			cis	70.2	96.3	33.8	0	0	0	0	0	110.1
996	G	32.5	Very low	35.3	Very low	85 Å²	85	166.1 Å²	166.1	88%	0.876	87%	0.871	S	S	*	*			trans	106	127.7	174.6	0	0	0	0	0	112.8
997	G	34	Very low	35.6	Very low	83 Å²	83	169.1 Å²	169.1	86%	0.856	88%	0.877	S	S	*	*			cis	-178.5	166.4	3.5	0	0	0	0	0	107.1
998	G	33.1	Very low	35.7	Very low	86 Å²	86	166.9 Å²	166.9	89%	0.887	88%	0.875	S	S	*	*			cis	180	-164.5	9.9	0	0	0	0	0	113.1
999	G	34.7	Very low	36	Very low	88 Å²	88	164 Å²	164	91%	0.907	87%	0.871	S	S	*	*			trans	125.6	92.9	165.6	0	0	0	0	0	114.9
1000	G	37.6	Very low	36.5	Very low	77 Å²	77	160.2 Å²	160.2	79%	0.794	87%	0.873	S	S	*	*			trans	160.3	78	166.8	0	0	0	0	0	117.9
1001	K	39.6	Very low	36.6	Very low	201 Å²	201	159.6 Å²	159.6	87%	0.874	87%	0.872	S	S	*	*			trans	36.8	106.7	146.4	-76.3	178.1	176.2	172.8	0	120.4
1002	K	44.6	Very low	37	Very low	209 Å²	209	155.7 Å²	155.7	91%	0.909	87%	0.868	S	S	*	*				162.5	109.4	99.1	-100.5	-179.1	177	-178.3	0	111.4
1003	R	43.5	Very low	37.6	Very low	206 Å²	206	152.2 Å²	152.2	78%	0.777	87%	0.867	S	S	*	*			trans	-75.9	163.8	149.3	-87	176.2	149.6	179.3	-4.5	107.6
1004	R	48.8	Very low	37.8	Very low	202 Å²	202	150.5 Å²	150.5	76%	0.762	87%	0.869	S	S	*	*			cis	-157.1	162.1	2.9	-128.3	172	173.8	-179.8	-5.5	104.7
1005	R	40.6	Very low	37.9	Very low	318 Å²	318	148.1 Å²	148.1	100%	1.2	87%	0.873	S	S	*	*			trans	-41	0	162.8	-72.9	177.9	171.1	175.6	-4.3	113.6

Retrieved 1,005 of 1,005 residues in 2593.7 ms (Link to these results)

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