A0A077ZFS1_TRITR Loading...

Arm and fn3 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZFS1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 859 aa.

						>A0A077ZFS1_TRITR|A0A077ZFS1
MFDSFYCALPSAPGCPHILAYDDSSVTLSWTPPDRCGDCSSIDGYQVQYRKVSVPELWQSAFDALVPLPECTVTNLEPGEQYVFCVIAKSATGFGQRSTFSPVVQLKRTSLLSDRRELHSVPFPPEDLIVAEQDEKGISLCWAPPVHSGTDGSLISYEIQCRPSGKMAWLPIGESTSSFYRVTGLRAQGSYEFRVLAKNALGLSAPSCRLVYQHPVFCRGPLEGSMTPSPPVNLQISDVDSTRCTLSWTPPPNQVPTSIWYVVQFREIGDPQWCSATLDPMLSTELTVINLHPNSTYEFRVFSCGPSGDLSQQCLISDIVQLRPALLSTCGYVKTIPACPSAPNVTEIRGNCINLTWDEVEAVQGYQVEFCDLSLSPGVWNPLNQILTSVNRMNVGDLDPGHSYAFRVLAKNAIGYSKPSEASLSLPAEMREAKESPPITDNDESPPPLRRLTTQSQTGGIHYRDPTLPEVIDYLSSPDNSIQMNAAGYLQHLAYNDDDVKQRVRALGGINKLVSLLSIDIPEVQRNAAGCLRNLCYGRDDNKRAIMQANGLVALANLLKSTPEVLIVEEVTGALWNLSSCHDIKSPIFELCSDHLVQQIIIPHCNLCTMSTGHPAVQPPLIFRNATGIVLNISTANDASRKLLRDKDGLAQSLVTYLQSAFEKKDFDSKTVVNVVCLLRNLSYRLQELEDPRYDRSTLNLRERSKSAPSGSPKAAWKMGLRKKRDFHEIQMPYIERPELRNIAPLFKTDTVRLYTALLQNSTNPDVLEASAGAVQNLCACYWQPSMNVRTAVRKEKALPVFVELLRTDTDKVKRAAATALRNLALDVQNRELIVRTVPLEIHLEDARKPSSPFVSFLY
					

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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	33.3	Very low	53	Low	232 Å²	232	117.5 Å²	117.5	100%	1.143	60%	0.601	S	S	*	*				0	71.2	0	-173.3	-178.1	-75.1	0	0	108.9
2	F	26.3	Very low	56.3	Low	204 Å²	204	110.2 Å²	110.2	90%	0.895	57%	0.572	S	S	*	*			trans	-169.3	110.7	164	-99.2	-67.3	0	0	0	102	S4	F2-S4 PolarHBondContact O-N 2.94Å
3	D	28.1	Very low	59.3	Low	144 Å²	144	102.2 Å²	102.2	77%	0.77	53%	0.531	S	S	*	.			trans	-76.3	111.2	-175.4	-55.4	-62.8	0	0	0	108.5	F5	D3-F5 WeakPolarHBondContact O-CD2 3.29Å; D3-F5 WeakPolarHBondContact O-CE2 3.21Å; D3-F5 PolarHBondContact O-N 3.14Å
4	S	30.8	Very low	61.5	Low	113 Å²	113	96 Å²	96	79%	0.79	51%	0.505	S	S	*	.			trans	-82.7	95.2	179.5	49.7	0	0	0	0	109.6	F2	F2-S4 PolarHBondContact O-N 2.94Å
5	F	37.5	Very low	63.5	Low	165 Å²	165	92.3 Å²	92.3	72%	0.724	49%	0.489	S	S	*	.			trans	-52.6	133.9	-176.3	-70.7	-104	0	0	0	113	D3 C7	D3-F5 WeakPolarHBondContact O-CD2 3.29Å; D3-F5 WeakPolarHBondContact O-CE2 3.21Å; D3-F5 PolarHBondContact O-N 3.14Å; F5-C7 VanDerWaalsContact C-N 3.32Å; F5-C7 PolarHBondContact O-N 2.97Å
6	Y	41.4	Very low	65.5	Low	207 Å²	207	86.5 Å²	86.5	81%	0.812	46%	0.459	S	S	*	.			trans	-64.7	88.3	172.2	-110.4	-74.9	0	0	0	110.3	A8	Y6-A8 PolarHBondContact O-N 2.96Å
7	C	49.7	Very low	67.2	Low	80 Å²	80	87.5 Å²	87.5	54%	0.541	46%	0.46	S	S	.	.			trans	-61.5	106.8	-176.3	-77.7	0	0	0	0	111.8	F5 D38 T92	F5-C7 VanDerWaalsContact C-N 3.32Å; F5-C7 PolarHBondContact O-N 2.97Å; C7-D38 HydrophobicContact CB-CB 4.41Å; C7-T92 HydrophobicContact CB-CG2 3.68Å
8	A	73.4	Confident	68.7	Low	45 Å²	45	85.1 Å²	85.1	37%	0.372	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-65.6	148.8	176.7	0	0	0	0	0	111.5	Y6 G37 D38 T92	Y6-A8 PolarHBondContact O-N 2.96Å; A8-G37 CarbonylContact O-C 3.42Å; A8-G37 WeakPolarHBondContact O-CA 3.13Å; A8-D38 WeakPolarHBondContact CB-OD1 3.49Å; A8-D38 VanDerWaalsContact N-CG 3.31Å; A8-D38 PolarHBondContact N-OD1 2.66Å; A8-D38 PolarHBondContact O-N 2.63Å; A8-D38 VanDerWaalsContact O-N 3.09Å; A8-T92 WeakPolarHBondContact O-CB 3.24Å; A8-T92 PolarHBondContact O-OG1 2.85Å
9	L	85.1	Confident	69.9	Low	81 Å²	81	85.9 Å²	85.9	42%	0.424	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-89.6	160.7	169.1	-67.5	170.2	0	0	0	110.6	G37 T92	L9-G37 WeakPolarHBondContact O-CA 3.41Å; L9-T92 VanDerWaalsContact CD2-O 3.27Å; L9-T92 WeakPolarHBondContact CD2-O 3.45Å
10	P	87.9	Confident	70.8	Confident	4 Å²	4	84.2 Å²	84.2	3%	0.026	45%	0.45	C	S	.	.	B	Isolated β-bridge	trans	-55.8	144	172.8	-25	33.5	0	0	0	113.2	P33 R35 I42 A88 S90 G95 Q96	P10-P33 HydrophobicContact CB-CG 4.38Å; P10-R35 WeakPolarHBondContact CA-O 3.23Å; P10-I42 HydrophobicContact CB-CD1 3.82Å; P10-I42 HydrophobicContact CG-CD1 3.8Å; P10-A88 HydrophobicContact CB-CB 4.03Å; P10-S90 WeakPolarHBondContact CD-OG 3.3Å; P10-S90 WeakPolarHBondContact CG-OG 3.38Å; P10-G95 WeakPolarHBondContact O-CA 3.4Å; P10-Q96 PolarHBondContact O-N 3.06Å
11	S	90	Very high	71.9	Confident	17 Å²	17	85 Å²	85	12%	0.119	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-69.9	172.1	167.1	64.3	0	0	0	0	111	P33 D34 R35	S11-P33 WeakPolarHBondContact O-CB 3.2Å; S11-P33 VanDerWaalsContact O-CG 3.31Å; S11-P33 WeakPolarHBondContact O-CG 3.18Å; S11-P33 WeakPolarHBondContact OG-CB 3.5Å; S11-D34 PolarHBondContact OG-N 2.63Å; S11-R35 PolarHBondContact N-O 2.93Å; S11-R35 PolarHBondContact OG-N 2.76Å
12	A	92	Very high	74.5	Confident	30 Å²	30	76.8 Å²	76.8	25%	0.248	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-60.2	139.3	175.1	0	0	0	0	0	111.4	Q96	A12-Q96 WeakPolarHBondContact CA-O 3.44Å; A12-Q96 HydrophobicContact CB-CB 4.01Å; A12-Q96 HydrophobicContact CB-CG 4.16Å
13	P	95.1	Very high	77.5	Confident	6 Å²	6	69.3 Å²	69.3	4%	0.039	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-64	161.9	160.7	-17.9	31.2	0	0	0	111.4	P33 Y45 V86 A88 Q96 S98	P13-P33 HydrophobicContact CG-CG 4.25Å; P13-Y45 HydrophobicContact CG-CD1 4.28Å; P13-Y45 HydrophobicContact CG-CE1 4.41Å; P13-V86 HydrophobicContact CB-CB 4.46Å; P13-V86 HydrophobicContact CB-CG1 4.46Å; P13-V86 HydrophobicContact CG-CB 4.37Å; P13-V86 HydrophobicContact CG-CG1 4.14Å; P13-A88 HydrophobicContact CG-CB 3.94Å; P13-Q96 WeakPolarHBondContact CD-O 3.48Å; P13-S98 VanDerWaalsContact O-CB 3.29Å; P13-S98 WeakPolarHBondContact O-CB 3.33Å
14	G	90.4	Very high	80.4	Confident	16 Å²	16	64.8 Å²	64.8	17%	0.165	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-62	167	172.4	0	0	0	0	0	113.7	P16 T31 S98	G14-P16 WeakPolarHBondContact O-CD 3.48Å; G14-T31 VanDerWaalsContact CA-OG1 3.29Å; G14-T31 WeakPolarHBondContact CA-OG1 3.37Å; G14-T31 PolarHBondContact N-O 3.45Å; G14-T31 PolarHBondContact N-OG1 2.77Å; G14-S98 WeakPolarHBondContact O-CB 3.45Å
15	C	91.7	Very high	83.4	Confident	40 Å²	40	60.1 Å²	60.1	27%	0.27	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-57.3	127.8	173.4	-178.2	0	0	0	0	110.3	H17 T99 F100	C15-H17 PolarHBondContact O-CD2 3.06Å; C15-H17 PolarHBondContact O-N 3.09Å; C15-T99 WeakPolarHBondContact CB-OG1 3.33Å; C15-F100 PolarHBondContact SG-O 3.32Å; C15-F100 VanDerWaalsContact SG-O 3.35Å
16	P	95.5	Very high	86.1	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.			trans	-69.6	114.4	177.1	-20.5	34.1	0	0	0	111.3	G14 V86 T99 S101	G14-P16 WeakPolarHBondContact O-CD 3.48Å; P16-V86 HydrophobicContact CB-CG2 4.42Å; P16-V86 HydrophobicContact CG-CB 4.48Å; P16-V86 HydrophobicContact CG-CG2 3.72Å; P16-T99 WeakPolarHBondContact CD-O 3.47Å; P16-S101 WeakPolarHBondContact O-CA 3.07Å; P16-S101 WeakPolarHBondContact O-CB 3.4Å
17	H	93.8	Very high	88.7	Confident	103 Å²	103	43.6 Å²	43.6	48%	0.477	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	132.8	174.1	-57	-63.4	0	0	0	110.1	C15 L28 S29	C15-H17 PolarHBondContact O-CD2 3.06Å; C15-H17 PolarHBondContact O-N 3.09Å; H17-L28 CarbonylContact O-C 3.52Å; H17-L28 VanDerWaalsContact O-CA 3.31Å; H17-L28 WeakPolarHBondContact O-CA 3.39Å; H17-S29 PolarHBondContact N-O 3.03Å; H17-S29 PolarHBondContact O-N 3.32Å
18	I	93.9	Very high	90.9	Very high	45 Å²	45	39.8 Å²	39.8	23%	0.231	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	118.4	174.3	-64	142.8	0	0	0	108.4	Y21 V26 L28 P102 V104	I18-Y21 HydrophobicContact CG2-CD1 3.81Å; I18-Y21 HydrophobicContact CG2-CE1 4.46Å; I18-V26 HydrophobicContact CG1-CG1 4.13Å; I18-V26 HydrophobicContact CG2-CG1 3.98Å; I18-L28 HydrophobicContact CB-CD2 4.49Å; I18-L28 HydrophobicContact CG1-CD2 3.68Å; I18-P102 HydrophobicContact CD1-CB 4.18Å; I18-P102 WeakPolarHBondContact CD1-O 3.34Å; I18-V104 HydrophobicContact CD1-CB 3.84Å; I18-V104 HydrophobicContact CG2-CG2 4.41Å
19	L	91.7	Very high	92	Very high	100 Å²	100	39 Å²	39	52%	0.524	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-41.8	180	-63.1	-175.3	0	0	0	112.3	T27	L19-T27 HydrophobicContact CB-CG2 4.15Å; L19-T27 HydrophobicContact CD1-CG2 4.26Å; L19-T27 PolarHBondContact N-O 2.82Å
20	A	88.6	Confident	92.5	Very high	52 Å²	52	35.8 Å²	35.8	43%	0.43	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	155.9	-179.1	0	0	0	0	0	110.3	T27	A20-T27 PolarHBondContact O-N 3.36Å
21	Y	92.8	Very high	92.8	Very high	102 Å²	102	39.5 Å²	39.5	40%	0.4	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	156.3	171	63.2	-83.9	0	0	0	111.4	I18 S25 V104 Q105 L106 K107	I18-Y21 HydrophobicContact CG2-CD1 3.81Å; I18-Y21 HydrophobicContact CG2-CE1 4.46Å; Y21-S25 WeakPolarHBondContact CA-O 3.49Å; Y21-S25 VanDerWaalsContact CB-O 3.23Å; Y21-S25 WeakPolarHBondContact CB-O 3.22Å; Y21-V104 HydrophobicContact CD1-CG2 3.62Å; Y21-V104 HydrophobicContact CD2-CG2 3.68Å; Y21-V104 HydrophobicContact CE1-CG2 3.88Å; Y21-V104 HydrophobicContact CE2-CG2 3.92Å; Y21-V104 HydrophobicContact CG-CG2 3.52Å; Y21-Q105 WeakPolarHBondContact CE2-O 3.49Å; Y21-L106 HydrophobicContact CD2-CD2 4.05Å; Y21-L106 HydrophobicContact CG-CD2 4.46Å; Y21-K107 WeakPolarHBondContact O-CE 3.36Å; Y21-K107 PolarHBondContact O-NZ 2.85Å
22	D	88.2	Confident	92.9	Very high	59 Å²	59	41.8 Å²	41.8	32%	0.316	24%	0.244	S	C	.	.			trans	-122.7	-131.4	176.7	53	44.9	0	0	0	111.4	S24 S25 K107	D22-S24 PolarHBondContact OD1-N 3.01Å; D22-S25 VanDerWaalsContact CG-OG 3.25Å; D22-S25 PolarHBondContact N-O 3.44Å; D22-S25 VanDerWaalsContact N-O 3.17Å; D22-S25 PolarHBondContact OD1-N 2.99Å; D22-S25 PolarHBondContact OD1-OG 2.84Å; D22-S25 PolarHBondContact OD2-OG 2.9Å; D22-K107 WeakPolarHBondContact O-CB 3.35Å; D22-K107 WeakPolarHBondContact O-CG 3.44Å; D22-K107 PolarHBondContact O-N 3.06Å
23	D	89.7	Confident	92.8	Very high	47 Å²	47	41.1 Å²	41.1	25%	0.251	24%	0.237	S	C	.	.	S	Bend	trans	-101.1	-8.2	171.1	59.5	-17.6	0	0	0	113.6	P78 K107 T109	D23-P78 HydrophobicContact CB-CB 4.14Å; D23-P78 HydrophobicContact CB-CG 4.28Å; D23-P78 WeakPolarHBondContact O-CA 3.49Å; D23-P78 WeakPolarHBondContact O-CD 3.39Å; D23-P78 VanDerWaalsContact O-CG 3.3Å; D23-P78 WeakPolarHBondContact O-CG 3.35Å; D23-K107 WeakPolarHBondContact CA-O 3.19Å; D23-K107 HydrophobicContact CB-CB 4.04Å; D23-K107 WeakPolarHBondContact CB-O 3Å; D23-T109 WeakPolarHBondContact OD2-CB 3.47Å; D23-T109 WeakPolarHBondContact OD2-CG2 3.28Å; D23-T109 PolarHBondContact OD2-OG1 3.36Å
24	S	90.3	Very high	92.4	Very high	48 Å²	48	47.9 Å²	47.9	34%	0.336	27%	0.273	S	S	.	.	S	Bend	trans	-140	-4.4	-178.7	63.5	0	0	0	0	115.7	D22 T74 N75 L76	D22-S24 PolarHBondContact OD1-N 3.01Å; S24-T74 CarbonylContact O-C 3.58Å; S24-N75 PolarHBondContact O-N 3.3Å; S24-N75 VanDerWaalsContact O-N 3.1Å; S24-L76 WeakPolarHBondContact CA-O 3.36Å; S24-L76 WeakPolarHBondContact O-CB 3.19Å; S24-L76 PolarHBondContact O-N 2.96Å
25	S	91.9	Very high	92	Very high	16 Å²	16	55.1 Å²	55.1	11%	0.112	30%	0.295	C	S	.	.			trans	-135.6	154.8	-178.3	85.4	0	0	0	0	114.4	Y21 D22 V73	Y21-S25 WeakPolarHBondContact CA-O 3.49Å; Y21-S25 VanDerWaalsContact CB-O 3.23Å; Y21-S25 WeakPolarHBondContact CB-O 3.22Å; D22-S25 VanDerWaalsContact CG-OG 3.25Å; D22-S25 PolarHBondContact N-O 3.44Å; D22-S25 VanDerWaalsContact N-O 3.17Å; D22-S25 PolarHBondContact OD1-N 2.99Å; D22-S25 PolarHBondContact OD1-OG 2.84Å; D22-S25 PolarHBondContact OD2-OG 2.9Å; S25-V73 CarbonylContact C-O 3.51Å; S25-V73 WeakPolarHBondContact CA-O 3.46Å
26	V	94.8	Very high	91.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	118.2	174.8	-176	0	0	0	0	109.7	I18 L28 T72 V73 L76 F84 V104 L106	I18-V26 HydrophobicContact CG1-CG1 4.13Å; I18-V26 HydrophobicContact CG2-CG1 3.98Å; V26-L28 HydrophobicContact CG1-CD2 3.73Å; V26-L28 HydrophobicContact CG1-CG 4.02Å; V26-T72 CarbonylContact O-C 3.45Å; V26-T72 WeakPolarHBondContact O-CA 3.46Å; V26-V73 PolarHBondContact N-O 3.04Å; V26-V73 PolarHBondContact O-N 2.93Å; V26-L76 HydrophobicContact CB-CD1 4.13Å; V26-L76 HydrophobicContact CG2-CD1 3.54Å; V26-F84 HydrophobicContact CB-CE2 4.22Å; V26-F84 HydrophobicContact CB-CZ 3.94Å; V26-F84 HydrophobicContact CG1-CE2 3.94Å; V26-F84 HydrophobicContact CG1-CZ 4.15Å; V26-F84 HydrophobicContact CG2-CE2 4.11Å; V26-F84 HydrophobicContact CG2-CZ 3.87Å; V26-V104 HydrophobicContact CG1-CG1 4.49Å; V26-V104 HydrophobicContact CG2-CG1 3.83Å; V26-V104 HydrophobicContact CG2-CG2 4.46Å; V26-L106 HydrophobicContact CG2-CD2 3.67Å
27	T	95.7	Very high	90.1	Very high	25 Å²	25	56 Å²	56	15%	0.153	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	129	170	-54.6	0	0	0	0	110.1	L19 A20 C71 T72	L19-T27 HydrophobicContact CB-CG2 4.15Å; L19-T27 HydrophobicContact CD1-CG2 4.26Å; L19-T27 PolarHBondContact N-O 2.82Å; A20-T27 PolarHBondContact O-N 3.36Å; T27-C71 CarbonylContact C-O 3.58Å; T27-C71 WeakPolarHBondContact CA-O 3.38Å; T27-T72 PolarHBondContact OG1-OG1 2.73Å
28	L	96.4	Very high	88.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	141.8	-173.9	-61.9	168.3	0	0	0	110.4	H17 I18 V26 W30 V47 E70 C71 V73 F84	H17-L28 CarbonylContact O-C 3.52Å; H17-L28 VanDerWaalsContact O-CA 3.31Å; H17-L28 WeakPolarHBondContact O-CA 3.39Å; I18-L28 HydrophobicContact CB-CD2 4.49Å; I18-L28 HydrophobicContact CG1-CD2 3.68Å; V26-L28 HydrophobicContact CG1-CD2 3.73Å; V26-L28 HydrophobicContact CG1-CG 4.02Å; L28-W30 HydrophobicContact CB-CE3 4.32Å; L28-W30 HydrophobicContact CB-CZ3 3.95Å; L28-V47 HydrophobicContact CD1-CG1 4.1Å; L28-E70 CarbonylContact O-C 3.59Å; L28-E70 VanDerWaalsContact O-CA 3.23Å; L28-E70 WeakPolarHBondContact O-CA 3.31Å; L28-E70 WeakPolarHBondContact O-CG 3.5Å; L28-C71 PolarHBondContact N-O 3.2Å; L28-C71 PolarHBondContact O-N 3.44Å; L28-V73 HydrophobicContact CD1-CG2 3.91Å; L28-F84 HydrophobicContact CD1-CB 3.77Å; L28-F84 HydrophobicContact CD1-CD1 3.42Å; L28-F84 VanDerWaalsContact CD1-CD1 3.42Å; L28-F84 HydrophobicContact CD1-CD2 4.15Å; L28-F84 HydrophobicContact CD1-CE1 4.04Å; L28-F84 HydrophobicContact CD1-CG 3.5Å; L28-F84 VanDerWaalsContact CD1-CG 3.5Å; L28-F84 HydrophobicContact CD2-CB 4.34Å; L28-F84 HydrophobicContact CD2-CD2 3.98Å; L28-F84 HydrophobicContact CD2-CG 4.09Å; L28-F84 HydrophobicContact CG-CG 4.42Å
29	S	95.8	Very high	87.5	Confident	28 Å²	28	54.3 Å²	54.3	20%	0.196	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.2	168	65.6	0	0	0	0	111.2	H17 P69	H17-S29 PolarHBondContact N-O 3.03Å; H17-S29 PolarHBondContact O-N 3.32Å; S29-P69 WeakPolarHBondContact CA-O 3.19Å
30	W	96.4	Very high	86.7	Confident	13 Å²	13	55.5 Å²	55.5	5%	0.049	32%	0.318	C	S	.	.			trans	-140.1	170.6	179.1	50.2	94.2	0	0	0	110.5	L28 Y45 V47 P69 C71 V86	L28-W30 HydrophobicContact CB-CE3 4.32Å; L28-W30 HydrophobicContact CB-CZ3 3.95Å; W30-Y45 AromaticContact CE2-CG 3.98Å; W30-Y45 HydrophobicContact CZ2-CD1 4.45Å; W30-Y45 HydrophobicContact CZ2-CD2 4.05Å; W30-Y45 AromaticContact CZ2-CG 3.84Å; W30-Y45 HydrophobicContact CZ2-CG 3.84Å; W30-Y45 AromaticContact NE1-CD1 3.26Å; W30-Y45 VanDerWaalsContact NE1-CD1 3.26Å; W30-Y45 AromaticContact NE1-CD2 3.89Å; W30-Y45 AromaticContact NE1-CE1 3.47Å; W30-Y45 AromaticContact NE1-CG 3.5Å; W30-Y45 AromaticContact NE1-CZ 3.91Å; W30-V47 HydrophobicContact CH2-CG2 3.47Å; W30-V47 VanDerWaalsContact CH2-CG2 3.47Å; W30-V47 HydrophobicContact CZ2-CG2 4Å; W30-V47 HydrophobicContact CZ3-CG2 4.09Å; W30-P69 VanDerWaalsContact CE2-C 3.44Å; W30-P69 HydrophobicContact CG-CB 4.38Å; W30-P69 PolarHBondContact N-O 3.16Å; W30-P69 WeakPolarHBondContact O-CB 3.49Å; W30-C71 HydrophobicContact CH2-CB 4.15Å; W30-V86 HydrophobicContact CD2-CB 4.4Å; W30-V86 HydrophobicContact CD2-CG1 4.23Å; W30-V86 HydrophobicContact CD2-CG2 3.84Å; W30-V86 HydrophobicContact CE3-CG2 3.84Å; W30-V86 HydrophobicContact CG-CG2 4.41Å; W30-V86 HydrophobicContact CH2-CG2 4.38Å; W30-V86 HydrophobicContact CZ2-CG1 3.98Å; W30-V86 HydrophobicContact CZ2-CG2 4.35Å; W30-V86 HydrophobicContact CZ3-CG2 4.13Å
31	T	94.3	Very high	86.5	Confident	82 Å²	82	56 Å²	56	50%	0.503	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-85	142.2	166.6	59.6	0	0	0	0	110.2	G14	G14-T31 VanDerWaalsContact CA-OG1 3.29Å; G14-T31 WeakPolarHBondContact CA-OG1 3.37Å; G14-T31 PolarHBondContact N-O 3.45Å; G14-T31 PolarHBondContact N-OG1 2.77Å
32	P	92.1	Very high	86.3	Confident	65 Å²	65	53.1 Å²	53.1	42%	0.422	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-54.3	157.5	165.6	-27.1	36.3	0	0	0	112.8	Y45 P69	P32-Y45 WeakPolarHBondContact CB-OH 3.2Å; P32-P69 HydrophobicContact CG-CB 4.18Å; P32-P69 HydrophobicContact CG-CG 4.15Å
33	P	90.6	Very high	86.3	Confident	16 Å²	16	53.1 Å²	53.1	10%	0.104	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-54.2	139	167.2	-28.1	34.3	0	0	0	113.4	P10 S11 P13 R35 I42 A88	P10-P33 HydrophobicContact CB-CG 4.38Å; S11-P33 WeakPolarHBondContact O-CB 3.2Å; S11-P33 VanDerWaalsContact O-CG 3.31Å; S11-P33 WeakPolarHBondContact O-CG 3.18Å; S11-P33 WeakPolarHBondContact OG-CB 3.5Å; P13-P33 HydrophobicContact CG-CG 4.25Å; P33-R35 VanDerWaalsContact CB-O 3.3Å; P33-R35 WeakPolarHBondContact CB-O 3.45Å; P33-R35 PolarHBondContact O-N 2.76Å; P33-I42 HydrophobicContact CG-CD1 4.2Å; P33-I42 HydrophobicContact CG-CG1 4.47Å; P33-A88 HydrophobicContact CG-CB 3.38Å
34	D	84.8	Confident	86.5	Confident	149 Å²	149	50.9 Å²	50.9	80%	0.797	30%	0.297	S	S	*	.	S	Bend	trans	-61.4	-23	170.6	-58.2	-37.2	0	0	0	113	S11	S11-D34 PolarHBondContact OG-N 2.63Å
35	R	82.8	Confident	86.8	Confident	167 Å²	167	49.1 Å²	49.1	63%	0.63	28%	0.283	S	S	*	.			trans	-135.5	133.6	173.9	-65	-173.8	-62.2	-73.9	2.4	110.7	P10 S11 P33 G37	P10-R35 WeakPolarHBondContact CA-O 3.23Å; S11-R35 PolarHBondContact N-O 2.93Å; S11-R35 PolarHBondContact OG-N 2.76Å; P33-R35 VanDerWaalsContact CB-O 3.3Å; P33-R35 WeakPolarHBondContact CB-O 3.45Å; P33-R35 PolarHBondContact O-N 2.76Å; R35-G37 VanDerWaalsContact C-N 3.28Å; R35-G37 PolarHBondContact O-N 3.1Å
36	C	77.5	Confident	87	Confident	40 Å²	40	50.3 Å²	50.3	27%	0.27	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-89	13.1	177.5	33.7	0	0	0	0	114.1	C39 I42 S90	C36-C39 PolarHBondContact SG-O 2.98Å; C36-I42 HydrophobicContact CB-CD1 3.61Å; C36-I42 HydrophobicContact CB-CG1 4.03Å; C36-S90 WeakPolarHBondContact O-CB 3.3Å; C36-S90 PolarHBondContact O-OG 2.78Å
37	G	69.6	Low	87.1	Confident	18 Å²	18	50.3 Å²	50.3	19%	0.186	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	-152.9	-167.3	0	0	0	0	0	111.2	A8 L9 R35 C39	A8-G37 CarbonylContact O-C 3.42Å; A8-G37 WeakPolarHBondContact O-CA 3.13Å; L9-G37 WeakPolarHBondContact O-CA 3.41Å; R35-G37 VanDerWaalsContact C-N 3.28Å; R35-G37 PolarHBondContact O-N 3.1Å; G37-C39 PolarHBondContact O-N 2.86Å
38	D	66.2	Low	87.1	Confident	88 Å²	88	50.4 Å²	50.4	47%	0.471	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	4.2	172.6	-78.6	37.8	0	0	0	112.7	C7 A8 T92	C7-D38 HydrophobicContact CB-CB 4.41Å; A8-D38 WeakPolarHBondContact CB-OD1 3.49Å; A8-D38 VanDerWaalsContact N-CG 3.31Å; A8-D38 PolarHBondContact N-OD1 2.66Å; A8-D38 PolarHBondContact O-N 2.63Å; A8-D38 VanDerWaalsContact O-N 3.09Å; D38-T92 HydrophobicContact CB-CG2 4.39Å
39	C	68.1	Low	87.1	Confident	26 Å²	26	51.8 Å²	51.8	18%	0.176	29%	0.291	C	S	.	.	S	Bend	trans	-83.9	155.7	172.4	-67	0	0	0	0	111.9	C36 G37 S41 A91 T92	C36-C39 PolarHBondContact SG-O 2.98Å; G37-C39 PolarHBondContact O-N 2.86Å; C39-S41 VanDerWaalsContact C-N 3.3Å; C39-A91 PolarHBondContact SG-N 2.77Å; C39-A91 VanDerWaalsContact SG-N 3.39Å; C39-T92 PolarHBondContact SG-N 3.36Å; C39-T92 VanDerWaalsContact SG-N 3.37Å
40	S	74.3	Confident	87.1	Confident	125 Å²	125	52.1 Å²	52.1	87%	0.874	29%	0.288	S	S	*	.	S	Bend	trans	-78.6	-8.7	170.5	52.6	0	0	0	0	114.4
41	S	83.6	Confident	86.9	Confident	63 Å²	63	52.5 Å²	52.5	44%	0.441	29%	0.29	S	S	.	.	S	Bend	trans	-154.7	160	-175.5	57.4	0	0	0	0	113.5	C39 S90	C39-S41 VanDerWaalsContact C-N 3.3Å; S41-S90 WeakPolarHBondContact O-CB 3.34Å
42	I	88.9	Confident	86.6	Confident	40 Å²	40	50.7 Å²	50.7	21%	0.205	28%	0.279	C	S	.	.			trans	-88	127.2	163.8	-62.4	-56.2	0	0	0	108.4	P10 P33 C36 G44 Y45 A88 K89	P10-I42 HydrophobicContact CB-CD1 3.82Å; P10-I42 HydrophobicContact CG-CD1 3.8Å; P33-I42 HydrophobicContact CG-CD1 4.2Å; P33-I42 HydrophobicContact CG-CG1 4.47Å; C36-I42 HydrophobicContact CB-CD1 3.61Å; C36-I42 HydrophobicContact CB-CG1 4.03Å; I42-G44 VanDerWaalsContact C-N 3.28Å; I42-G44 VanDerWaalsContact CG2-O 3.26Å; I42-G44 WeakPolarHBondContact CG2-O 3.45Å; I42-Y45 HydrophobicContact CG2-CE1 4.06Å; I42-Y45 HydrophobicContact CG2-CE2 4.17Å; I42-A88 HydrophobicContact CD1-CB 4.11Å; I42-A88 HydrophobicContact CG2-CB 4.15Å; I42-K89 CarbonylContact C-O 3.58Å; I42-K89 WeakPolarHBondContact CG2-O 3.11Å
43	D	89.2	Confident	86	Confident	59 Å²	59	48.8 Å²	48.8	32%	0.316	27%	0.267	S	S	.	.			trans	-71.3	-27.4	176.3	-58.9	-7.5	0	0	0	111.8	L65 K89 A91	D43-L65 HydrophobicContact CB-CD1 3.9Å; D43-K89 PolarHBondContact N-O 2.78Å; D43-A91 PolarHBondContact OD1-N 2.83Å; D43-A91 PolarHBondContact OD2-N 2.94Å
44	G	93.4	Very high	85.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.2	-162.3	172.6	0	0	0	0	0	112.6	I42 V66 K89	I42-G44 VanDerWaalsContact C-N 3.28Å; I42-G44 VanDerWaalsContact CG2-O 3.26Å; I42-G44 WeakPolarHBondContact CG2-O 3.45Å; G44-V66 CarbonylContact C-O 3.54Å; G44-V66 WeakPolarHBondContact CA-O 3.46Å; G44-K89 PolarHBondContact N-O 3.38Å; G44-K89 PolarHBondContact O-N 2.76Å
45	Y	96.4	Very high	85.4	Confident	11 Å²	11	45.5 Å²	45.5	4%	0.043	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	127.9	-170.1	-57.9	-83.4	0	0	0	110.8	P13 W30 P32 I42 V66 L68 P69 V86 I87 A88	P13-Y45 HydrophobicContact CG-CD1 4.28Å; P13-Y45 HydrophobicContact CG-CE1 4.41Å; W30-Y45 AromaticContact CE2-CG 3.98Å; W30-Y45 HydrophobicContact CZ2-CD1 4.45Å; W30-Y45 HydrophobicContact CZ2-CD2 4.05Å; W30-Y45 AromaticContact CZ2-CG 3.84Å; W30-Y45 HydrophobicContact CZ2-CG 3.84Å; W30-Y45 AromaticContact NE1-CD1 3.26Å; W30-Y45 VanDerWaalsContact NE1-CD1 3.26Å; W30-Y45 AromaticContact NE1-CD2 3.89Å; W30-Y45 AromaticContact NE1-CE1 3.47Å; W30-Y45 AromaticContact NE1-CG 3.5Å; W30-Y45 AromaticContact NE1-CZ 3.91Å; P32-Y45 WeakPolarHBondContact CB-OH 3.2Å; I42-Y45 HydrophobicContact CG2-CE1 4.06Å; I42-Y45 HydrophobicContact CG2-CE2 4.17Å; Y45-V66 WeakPolarHBondContact CD2-O 3.42Å; Y45-V66 PolarHBondContact N-O 3.11Å; Y45-V66 PolarHBondContact O-N 2.85Å; Y45-L68 VanDerWaalsContact CD2-O 3.3Å; Y45-L68 WeakPolarHBondContact CD2-O 3.33Å; Y45-P69 HydrophobicContact CE2-CB 4.03Å; Y45-V86 HydrophobicContact CD1-CG1 3.87Å; Y45-V86 HydrophobicContact CG-CG1 4.13Å; Y45-I87 CarbonylContact C-O 3.53Å; Y45-I87 WeakPolarHBondContact CA-O 3.33Å; Y45-A88 HydrophobicContact CD1-CB 3.89Å; Y45-A88 HydrophobicContact CE1-CB 3.87Å
46	Q	96.3	Very high	85.3	Confident	41 Å²	41	44.1 Å²	44.1	19%	0.192	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	113.7	163.7	-175.2	178.1	70.9	0	0	108.4	Q48 S60 L65 V86 I87 F94	Q46-Q48 HydrophobicContact CG-CG 4.1Å; Q46-S60 PolarHBondContact NE2-OG 3.16Å; Q46-L65 HydrophobicContact CB-CD2 4.31Å; Q46-V86 WeakPolarHBondContact O-CA 3.28Å; Q46-I87 PolarHBondContact N-O 3.37Å; Q46-I87 PolarHBondContact O-N 2.89Å; Q46-F94 HydrophobicContact CB-CE1 3.88Å
47	V	96.3	Very high	85.5	Confident	1 Å²	1	47 Å²	47	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	126.2	173.6	-177.3	0	0	0	0	107.6	L28 W30 A61 F62 V66 V73 V86	L28-V47 HydrophobicContact CD1-CG1 4.1Å; W30-V47 HydrophobicContact CH2-CG2 3.47Å; W30-V47 VanDerWaalsContact CH2-CG2 3.47Å; W30-V47 HydrophobicContact CZ2-CG2 4Å; W30-V47 HydrophobicContact CZ3-CG2 4.09Å; V47-A61 HydrophobicContact CB-CB 4.15Å; V47-A61 HydrophobicContact CG1-CB 4.1Å; V47-A61 PolarHBondContact O-N 3.02Å; V47-F62 HydrophobicContact CB-CD2 4.25Å; V47-F62 HydrophobicContact CB-CE2 4.09Å; V47-F62 HydrophobicContact CG2-CE2 4.25Å; V47-V66 HydrophobicContact CG2-CG2 3.79Å; V47-V73 HydrophobicContact CG1-CG2 4.3Å; V47-V86 HydrophobicContact CB-CG2 4.44Å; V47-V86 HydrophobicContact CG1-CG2 4.27Å; V47-V86 HydrophobicContact CG2-CG1 4.37Å; V47-V86 HydrophobicContact CG2-CG2 4.03Å
48	Q	96.5	Very high	86.5	Confident	26 Å²	26	49 Å²	49	12%	0.121	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	144.5	177.3	-64.1	179.1	-25.5	0	0	110	Q46 W58 Q59 F84 C85	Q46-Q48 HydrophobicContact CG-CG 4.1Å; Q48-W58 HydrophobicContact CB-CE3 3.95Å; Q48-Q59 CarbonylContact C-O 3.58Å; Q48-Q59 VanDerWaalsContact CA-O 3.22Å; Q48-Q59 WeakPolarHBondContact CA-O 3.49Å; Q48-F84 CarbonylContact O-C 3.51Å; Q48-F84 WeakPolarHBondContact O-CA 3.32Å; Q48-C85 PolarHBondContact N-O 2.91Å; Q48-C85 PolarHBondContact O-N 2.76Å; Q48-C85 VanDerWaalsContact O-O 3.11Å
49	Y	96.4	Very high	87.7	Confident	29 Å²	29	48.2 Å²	48.2	11%	0.114	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	159.6	-178.2	74.3	-78.3	0	0	0	111.1	W58 Q59 A61 V73 L76 Y82 V83 F84	Y49-W58 WeakPolarHBondContact O-CA 3.26Å; Y49-Q59 HydrophobicContact CD1-CB 3.99Å; Y49-Q59 VanDerWaalsContact CD1-O 3.3Å; Y49-Q59 WeakPolarHBondContact CD1-O 3.4Å; Y49-Q59 HydrophobicContact CE1-CB 3.54Å; Y49-Q59 HydrophobicContact CE2-CB 4.37Å; Y49-Q59 PolarHBondContact N-O 2.81Å; Y49-Q59 PolarHBondContact O-N 3.21Å; Y49-Q59 PolarHBondContact OH-OE1 2.85Å; Y49-Q59 VanDerWaalsContact OH-OE1 3.07Å; Y49-A61 HydrophobicContact CD1-CB 3.96Å; Y49-A61 HydrophobicContact CE1-CB 4.31Å; Y49-V73 HydrophobicContact CD1-CG1 4.47Å; Y49-L76 HydrophobicContact CD2-CD2 3.67Å; Y49-L76 HydrophobicContact CE2-CD2 3.35Å; Y49-Y82 AromaticContact CD2-CD1 3.74Å; Y49-Y82 HydrophobicContact CD2-CD1 3.74Å; Y49-Y82 AromaticContact CD2-CE1 3.79Å; Y49-Y82 HydrophobicContact CD2-CE1 3.79Å; Y49-Y82 HydrophobicContact CE2-CD1 4.26Å; Y49-Y82 AromaticContact CE2-CE1 3.82Å; Y49-Y82 HydrophobicContact CE2-CE1 3.82Å; Y49-V83 WeakPolarHBondContact CA-O 3.39Å; Y49-F84 HydrophobicContact CG-CD1 4.42Å; Y49-F84 HydrophobicContact CG-CE1 4.08Å
50	R	94.7	Very high	88.8	Confident	35 Å²	35	49.3 Å²	49.3	13%	0.132	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	155.6	168	61.4	170.5	-173.5	80.7	-8	110.7	P55 L57 W58 Y82 V83	R50-P55 WeakPolarHBondContact CD-O 3.3Å; R50-P55 PolarHBondContact NE-O 3.27Å; R50-L57 VanDerWaalsContact CB-O 3.28Å; R50-L57 WeakPolarHBondContact CB-O 3.31Å; R50-W58 HydrophobicContact CB-CD2 4.27Å; R50-W58 HydrophobicContact CB-CE3 4.19Å; R50-W58 HydrophobicContact CG-CD2 4.09Å; R50-W58 HydrophobicContact CG-CE3 4.02Å; R50-W58 HydrophobicContact CG-CH2 4.05Å; R50-W58 HydrophobicContact CG-CZ2 4.1Å; R50-W58 HydrophobicContact CG-CZ3 3.99Å; R50-Y82 WeakPolarHBondContact O-CA 3.32Å; R50-V83 HydrophobicContact CG-CG2 3.65Å; R50-V83 PolarHBondContact N-O 2.8Å; R50-V83 PolarHBondContact O-N 2.86Å
51	K	92.6	Very high	89.7	Confident	21 Å²	21	44.4 Å²	44.4	9%	0.091	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	149.6	165.4	-62.5	-178.6	-178.2	-177.2	0	109.6	S53 V54 E77 E80 Q81 Y82	K51-S53 VanDerWaalsContact C-N 3.28Å; K51-S53 WeakPolarHBondContact CB-OG 3.12Å; K51-V54 HydrophobicContact CB-CB 4.33Å; K51-V54 HydrophobicContact CB-CG2 4.23Å; K51-V54 HydrophobicContact CD-CG2 4.27Å; K51-V54 CarbonylContact O-C 3.55Å; K51-V54 PolarHBondContact O-N 3.1Å; K51-E77 VanDerWaalsContact CE-OE1 3.24Å; K51-E77 WeakPolarHBondContact CE-OE1 3.46Å; K51-E77 IonicContact NZ-OE1 2.73Å; K51-E77 PolarHBondContact NZ-OE1 2.7Å; K51-E77 IonicContact NZ-OE2 3.7Å; K51-E77 PolarHBondContact NZ-OE2 2.86Å; K51-E80 HydrophobicContact CD-CG 4.24Å; K51-Q81 CarbonylContact C-O 3.47Å; K51-Q81 VanDerWaalsContact CA-O 3.3Å; K51-Q81 WeakPolarHBondContact CA-O 3.36Å; K51-Y82 HydrophobicContact CB-CE1 4.48Å; K51-Y82 HydrophobicContact CG-CD1 4.08Å; K51-Y82 HydrophobicContact CG-CE1 3.52Å
52	V	88.6	Confident	90.1	Very high	45 Å²	45	44.1 Å²	44.1	27%	0.273	23%	0.228	S	C	.	.	S	Bend	trans	-68.7	-34.8	170.4	175.9	0	0	0	0	110.2	V54 Q81 V83 V103	V52-V54 PolarHBondContact O-N 3.03Å; V52-Q81 HydrophobicContact CB-CB 3.86Å; V52-Q81 HydrophobicContact CG2-CB 3.79Å; V52-Q81 PolarHBondContact N-O 3.37Å; V52-V83 HydrophobicContact CG2-CG1 4.16Å; V52-V103 HydrophobicContact CG2-CG1 3.82Å; V52-V103 HydrophobicContact CG2-CG2 4.04Å
53	S	79.7	Confident	89.8	Confident	25 Å²	25	47.9 Å²	47.9	18%	0.175	25%	0.248	C	C	.	.	S	Bend	trans	-66.3	-16.4	174.1	53.1	0	0	0	0	114.6	K51 E80 G613	K51-S53 VanDerWaalsContact C-N 3.28Å; K51-S53 WeakPolarHBondContact CB-OG 3.12Å; S53-E80 PolarHBondContact OG-OE2 2.85Å; S53-G613 CarbonylContact O-C 3.53Å; S53-G613 VanDerWaalsContact O-CA 3.28Å; S53-G613 WeakPolarHBondContact O-CA 3.15Å
54	V	84.6	Confident	89.7	Confident	34 Å²	34	46.3 Å²	46.3	21%	0.206	24%	0.243	C	C	.	.			trans	-132.8	76.4	-179.3	-163.4	0	0	0	0	110.2	K51 V52 E56 L57	K51-V54 HydrophobicContact CB-CB 4.33Å; K51-V54 HydrophobicContact CB-CG2 4.23Å; K51-V54 HydrophobicContact CD-CG2 4.27Å; K51-V54 CarbonylContact O-C 3.55Å; K51-V54 PolarHBondContact O-N 3.1Å; V52-V54 PolarHBondContact O-N 3.03Å; V54-E56 VanDerWaalsContact C-N 3.3Å; V54-E56 PolarHBondContact O-N 3.17Å; V54-L57 HydrophobicContact CB-CB 4.4Å; V54-L57 HydrophobicContact CG1-CB 3.54Å; V54-L57 HydrophobicContact CG1-CD2 4.35Å; V54-L57 PolarHBondContact O-N 2.95Å
55	P	78.8	Confident	89.7	Confident	62 Å²	62	47.9 Å²	47.9	40%	0.403	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-19	-165.5	26.4	-35.3	0	0	0	116.1	R50	R50-P55 WeakPolarHBondContact CD-O 3.3Å; R50-P55 PolarHBondContact NE-O 3.27Å
56	E	79	Confident	89.6	Confident	138 Å²	138	48.1 Å²	48.1	65%	0.645	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-27.7	-179.2	-68.5	158.9	-139.6	0	0	112.6	V54 W58	V54-E56 VanDerWaalsContact C-N 3.3Å; V54-E56 PolarHBondContact O-N 3.17Å; E56-W58 PolarHBondContact O-N 2.99Å; E56-W58 VanDerWaalsContact O-N 3.1Å
57	L	83.5	Confident	89.4	Confident	99 Å²	99	50 Å²	50	52%	0.518	27%	0.27	S	S	.	.			trans	-87.9	80.1	-171.5	-167	76.4	0	0	0	111.9	R50 V54	R50-L57 VanDerWaalsContact CB-O 3.28Å; R50-L57 WeakPolarHBondContact CB-O 3.31Å; V54-L57 HydrophobicContact CB-CB 4.4Å; V54-L57 HydrophobicContact CG1-CB 3.54Å; V54-L57 HydrophobicContact CG1-CD2 4.35Å; V54-L57 PolarHBondContact O-N 2.95Å
58	W	89.9	Confident	89.2	Confident	60 Å²	60	55.5 Å²	55.5	23%	0.227	30%	0.299	C	S	.	.			trans	-71.7	130.9	165.9	-69.9	93.1	0	0	0	111	Q48 Y49 R50 E56 V83 C85 F100	Q48-W58 HydrophobicContact CB-CE3 3.95Å; Y49-W58 WeakPolarHBondContact O-CA 3.26Å; R50-W58 HydrophobicContact CB-CD2 4.27Å; R50-W58 HydrophobicContact CB-CE3 4.19Å; R50-W58 HydrophobicContact CG-CD2 4.09Å; R50-W58 HydrophobicContact CG-CE3 4.02Å; R50-W58 HydrophobicContact CG-CH2 4.05Å; R50-W58 HydrophobicContact CG-CZ2 4.1Å; R50-W58 HydrophobicContact CG-CZ3 3.99Å; E56-W58 PolarHBondContact O-N 2.99Å; E56-W58 VanDerWaalsContact O-N 3.1Å; W58-V83 HydrophobicContact CH2-CG2 4.35Å; W58-C85 HydrophobicContact CH2-CB 4.06Å; W58-C85 HydrophobicContact CZ3-CB 4.09Å; W58-C85 WeakPolarHBondContact CZ3-SG 3.13Å; W58-F100 AromaticContact CH2-CD1 3.78Å; W58-F100 HydrophobicContact CH2-CD1 3.78Å; W58-F100 AromaticContact CH2-CE1 3.75Å; W58-F100 HydrophobicContact CH2-CE1 3.75Å; W58-F100 HydrophobicContact CH2-CG 4.41Å; W58-F100 HydrophobicContact CH2-CZ 4.36Å; W58-F100 HydrophobicContact CZ2-CD1 4.06Å; W58-F100 AromaticContact CZ2-CE1 3.55Å; W58-F100 HydrophobicContact CZ2-CE1 3.55Å; W58-F100 AromaticContact CZ2-CZ 3.81Å; W58-F100 HydrophobicContact CZ2-CZ 3.81Å
59	Q	90.1	Very high	89.1	Confident	72 Å²	72	56.2 Å²	56.2	34%	0.336	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	141.8	172.6	-65	175.8	57.3	0	0	108.5	Q48 Y49	Q48-Q59 CarbonylContact C-O 3.58Å; Q48-Q59 VanDerWaalsContact CA-O 3.22Å; Q48-Q59 WeakPolarHBondContact CA-O 3.49Å; Y49-Q59 HydrophobicContact CD1-CB 3.99Å; Y49-Q59 VanDerWaalsContact CD1-O 3.3Å; Y49-Q59 WeakPolarHBondContact CD1-O 3.4Å; Y49-Q59 HydrophobicContact CE1-CB 3.54Å; Y49-Q59 HydrophobicContact CE2-CB 4.37Å; Y49-Q59 PolarHBondContact N-O 2.81Å; Y49-Q59 PolarHBondContact O-N 3.21Å; Y49-Q59 PolarHBondContact OH-OE1 2.85Å; Y49-Q59 VanDerWaalsContact OH-OE1 3.07Å
60	S	92.9	Very high	89	Confident	49 Å²	49	59.9 Å²	59.9	34%	0.343	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	136.9	165.4	-68.1	0	0	0	0	108.9	Q46 F62	Q46-S60 PolarHBondContact NE2-OG 3.16Å; S60-F62 VanDerWaalsContact C-N 3.26Å
61	A	91.7	Very high	89	Confident	22 Å²	22	58.9 Å²	58.9	18%	0.182	32%	0.322	C	S	.	.	S	Bend	trans	-74.7	-20.4	175	0	0	0	0	0	112.8	V47 Y49 V73	V47-A61 HydrophobicContact CB-CB 4.15Å; V47-A61 HydrophobicContact CG1-CB 4.1Å; V47-A61 PolarHBondContact O-N 3.02Å; Y49-A61 HydrophobicContact CD1-CB 3.96Å; Y49-A61 HydrophobicContact CE1-CB 4.31Å; A61-V73 HydrophobicContact CB-CB 4.29Å; A61-V73 HydrophobicContact CB-CG1 3.73Å; A61-V73 HydrophobicContact CB-CG2 3.62Å
62	F	91.9	Very high	89.2	Confident	58 Å²	58	60.7 Å²	60.7	25%	0.254	34%	0.335	S	S	.	.			trans	-152.8	143.8	-180	-40.1	-85.8	0	0	0	108.2	V47 S60 A64 V66 C71 T72 V73	V47-F62 HydrophobicContact CB-CD2 4.25Å; V47-F62 HydrophobicContact CB-CE2 4.09Å; V47-F62 HydrophobicContact CG2-CE2 4.25Å; S60-F62 VanDerWaalsContact C-N 3.26Å; F62-A64 WeakPolarHBondContact CB-O 3.5Å; F62-V66 HydrophobicContact CD2-CG2 3.35Å; F62-V66 HydrophobicContact CE2-CG2 3.55Å; F62-V66 HydrophobicContact CG-CG2 4.12Å; F62-V66 HydrophobicContact CZ-CG2 4.45Å; F62-C71 HydrophobicContact CE2-CB 3.83Å; F62-C71 HydrophobicContact CZ-CB 3.79Å; F62-T72 WeakPolarHBondContact CZ-O 3.4Å; F62-V73 HydrophobicContact CE2-CG2 4.3Å; F62-V73 HydrophobicContact CZ-CG2 4.21Å
63	D	82.9	Confident	89.5	Confident	119 Å²	119	58.6 Å²	58.6	64%	0.636	32%	0.322	S	S	*	.	S	Bend	trans	-76.9	-33.4	177.9	-30.5	-70.1	0	0	0	111.2	C208	D63-C208 PolarHBondContact OD2-SG 3.39Å
64	A	88.7	Confident	90	Very high	26 Å²	26	60.9 Å²	60.9	22%	0.215	34%	0.335	C	S	.	.	S	Bend	trans	-85.5	154.3	171.6	0	0	0	0	0	112.5	F62 V66 C208	F62-A64 WeakPolarHBondContact CB-O 3.5Å; A64-V66 PolarHBondContact O-N 2.67Å; A64-C208 HydrophobicContact CB-CB 3.74Å; A64-C208 PolarHBondContact N-SG 2.87Å
65	L	92.5	Very high	90.3	Very high	32 Å²	32	64.6 Å²	64.6	17%	0.168	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-62.6	127	169.9	-56.7	175.6	0	0	0	111.2	D43 Q46 K89 F94	D43-L65 HydrophobicContact CB-CD1 3.9Å; Q46-L65 HydrophobicContact CB-CD2 4.31Å; L65-K89 HydrophobicContact CD1-CB 4Å; L65-K89 HydrophobicContact CD1-CD 3.93Å; L65-K89 HydrophobicContact CD1-CG 4.06Å; L65-K89 HydrophobicContact CD2-CB 4.06Å; L65-K89 HydrophobicContact CD2-CD 4.43Å; L65-F94 HydrophobicContact CD2-CE1 3.67Å; L65-F94 HydrophobicContact CD2-CZ 3.99Å
66	V	93.9	Very high	90.9	Very high	16 Å²	16	61.9 Å²	61.9	10%	0.097	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-63	123.3	165.2	-174.5	0	0	0	0	107.9	G44 Y45 V47 F62 A64 L68 E70 C71	G44-V66 CarbonylContact C-O 3.54Å; G44-V66 WeakPolarHBondContact CA-O 3.46Å; Y45-V66 WeakPolarHBondContact CD2-O 3.42Å; Y45-V66 PolarHBondContact N-O 3.11Å; Y45-V66 PolarHBondContact O-N 2.85Å; V47-V66 HydrophobicContact CG2-CG2 3.79Å; F62-V66 HydrophobicContact CD2-CG2 3.35Å; F62-V66 HydrophobicContact CE2-CG2 3.55Å; F62-V66 HydrophobicContact CG-CG2 4.12Å; F62-V66 HydrophobicContact CZ-CG2 4.45Å; A64-V66 PolarHBondContact O-N 2.67Å; V66-L68 VanDerWaalsContact C-N 3.33Å; V66-L68 VanDerWaalsContact CG1-O 3.3Å; V66-L68 WeakPolarHBondContact CG1-O 3.36Å; V66-L68 PolarHBondContact O-N 2.71Å; V66-E70 WeakPolarHBondContact CG1-O 3.42Å; V66-C71 HydrophobicContact CG1-CB 3.95Å; V66-C71 HydrophobicContact CG2-CB 4.19Å
67	P	92.2	Very high	91.4	Very high	82 Å²	82	59.9 Å²	59.9	53%	0.532	33%	0.326	S	S	.	.	S	Bend	trans	-80.2	-12.8	-172.8	31.4	-35.9	0	0	0	114.1
68	L	92	Very high	91.7	Very high	115 Å²	115	58.3 Å²	58.3	60%	0.602	32%	0.322	S	S	*	.	S	Bend	trans	-121.1	158.1	-178.1	-64.9	178.1	0	0	0	109.8	Y45 V66 E70	Y45-L68 VanDerWaalsContact CD2-O 3.3Å; Y45-L68 WeakPolarHBondContact CD2-O 3.33Å; V66-L68 VanDerWaalsContact C-N 3.33Å; V66-L68 VanDerWaalsContact CG1-O 3.3Å; V66-L68 WeakPolarHBondContact CG1-O 3.36Å; V66-L68 PolarHBondContact O-N 2.71Å; L68-E70 PolarHBondContact O-N 2.86Å
69	P	94.3	Very high	91.5	Very high	41 Å²	41	55.8 Å²	55.8	27%	0.266	32%	0.315	S	S	.	.	S	Bend	trans	-78.9	33.9	178.1	36.3	-37.9	0	0	0	113.1	S29 W30 P32 Y45	S29-P69 WeakPolarHBondContact CA-O 3.19Å; W30-P69 VanDerWaalsContact CE2-C 3.44Å; W30-P69 HydrophobicContact CG-CB 4.38Å; W30-P69 PolarHBondContact N-O 3.16Å; W30-P69 WeakPolarHBondContact O-CB 3.49Å; P32-P69 HydrophobicContact CG-CB 4.18Å; P32-P69 HydrophobicContact CG-CG 4.15Å; Y45-P69 HydrophobicContact CE2-CB 4.03Å
70	E	94.5	Very high	91.6	Very high	107 Å²	107	55.1 Å²	55.1	50%	0.5	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	141.6	-179.7	-174.3	-179.1	179.3	0	0	109.4	L28 V66 L68	L28-E70 CarbonylContact O-C 3.59Å; L28-E70 VanDerWaalsContact O-CA 3.23Å; L28-E70 WeakPolarHBondContact O-CA 3.31Å; L28-E70 WeakPolarHBondContact O-CG 3.5Å; V66-E70 WeakPolarHBondContact CG1-O 3.42Å; L68-E70 PolarHBondContact O-N 2.86Å
71	C	95.6	Very high	91.6	Very high	13 Å²	13	56.2 Å²	56.2	9%	0.088	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	167.8	173.2	71.6	0	0	0	0	112	T27 L28 W30 F62 V66	T27-C71 CarbonylContact C-O 3.58Å; T27-C71 WeakPolarHBondContact CA-O 3.38Å; L28-C71 PolarHBondContact N-O 3.2Å; L28-C71 PolarHBondContact O-N 3.44Å; W30-C71 HydrophobicContact CH2-CB 4.15Å; F62-C71 HydrophobicContact CE2-CB 3.83Å; F62-C71 HydrophobicContact CZ-CB 3.79Å; V66-C71 HydrophobicContact CG1-CB 3.95Å; V66-C71 HydrophobicContact CG2-CB 4.19Å
72	T	95.4	Very high	91.8	Very high	59 Å²	59	55.3 Å²	55.3	36%	0.362	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	118.4	160.5	-58.2	0	0	0	0	108.7	V26 T27 F62 T74	V26-T72 CarbonylContact O-C 3.45Å; V26-T72 WeakPolarHBondContact O-CA 3.46Å; T27-T72 PolarHBondContact OG1-OG1 2.73Å; F62-T72 WeakPolarHBondContact CZ-O 3.4Å; T72-T74 HydrophobicContact CG2-CG2 4.12Å
73	V	94.9	Very high	92	Very high	2 Å²	2	53 Å²	53	1%	0.012	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	127.7	170.5	-172.1	0	0	0	0	107.6	S25 V26 L28 V47 Y49 A61 F62 L76 F84	S25-V73 CarbonylContact C-O 3.51Å; S25-V73 WeakPolarHBondContact CA-O 3.46Å; V26-V73 PolarHBondContact N-O 3.04Å; V26-V73 PolarHBondContact O-N 2.93Å; L28-V73 HydrophobicContact CD1-CG2 3.91Å; V47-V73 HydrophobicContact CG1-CG2 4.3Å; Y49-V73 HydrophobicContact CD1-CG1 4.47Å; A61-V73 HydrophobicContact CB-CB 4.29Å; A61-V73 HydrophobicContact CB-CG1 3.73Å; A61-V73 HydrophobicContact CB-CG2 3.62Å; F62-V73 HydrophobicContact CE2-CG2 4.3Å; F62-V73 HydrophobicContact CZ-CG2 4.21Å; V73-L76 HydrophobicContact CB-CD1 4.3Å; V73-L76 HydrophobicContact CG1-CD1 4.12Å; V73-L76 HydrophobicContact CG1-CD2 4.02Å; V73-L76 HydrophobicContact CG1-CG 4.19Å; V73-F84 HydrophobicContact CB-CE1 4.06Å; V73-F84 HydrophobicContact CG1-CE1 4.19Å; V73-F84 HydrophobicContact CG2-CD1 4.19Å; V73-F84 HydrophobicContact CG2-CE1 3.86Å
74	T	91.4	Very high	92.7	Very high	73 Å²	73	47.3 Å²	47.3	45%	0.448	26%	0.264	S	S	.	.			trans	-116.6	-178.6	-179.3	57.2	0	0	0	0	110.9	S24 T72 L76	S24-T74 CarbonylContact O-C 3.58Å; T72-T74 HydrophobicContact CG2-CG2 4.12Å; T74-L76 PolarHBondContact O-N 3.27Å
75	N	89.8	Confident	93.1	Very high	111 Å²	111	46.1 Å²	46.1	59%	0.594	25%	0.254	S	S	*	.	S	Bend	trans	60.6	26.3	177.9	-54.8	-20.5	0	0	0	114.1	S24	S24-N75 PolarHBondContact O-N 3.3Å; S24-N75 VanDerWaalsContact O-N 3.1Å
76	L	91.8	Very high	93.3	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.026	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-82.8	160.6	173.7	-57.9	169.9	0	0	0	110.6	S24 V26 Y49 V73 T74 Y82 F84 L106	S24-L76 WeakPolarHBondContact CA-O 3.36Å; S24-L76 WeakPolarHBondContact O-CB 3.19Å; S24-L76 PolarHBondContact O-N 2.96Å; V26-L76 HydrophobicContact CB-CD1 4.13Å; V26-L76 HydrophobicContact CG2-CD1 3.54Å; Y49-L76 HydrophobicContact CD2-CD2 3.67Å; Y49-L76 HydrophobicContact CE2-CD2 3.35Å; V73-L76 HydrophobicContact CB-CD1 4.3Å; V73-L76 HydrophobicContact CG1-CD1 4.12Å; V73-L76 HydrophobicContact CG1-CD2 4.02Å; V73-L76 HydrophobicContact CG1-CG 4.19Å; T74-L76 PolarHBondContact O-N 3.27Å; L76-Y82 HydrophobicContact CB-CE2 3.9Å; L76-Y82 HydrophobicContact CD2-CD1 4.2Å; L76-Y82 HydrophobicContact CD2-CE1 3.8Å; L76-Y82 HydrophobicContact CD2-CE2 4.29Å; L76-F84 HydrophobicContact CD1-CE1 4.46Å; L76-F84 HydrophobicContact CD1-CZ 3.96Å; L76-L106 HydrophobicContact CB-CD1 3.44Å; L76-L106 VanDerWaalsContact CB-CD1 3.44Å; L76-L106 HydrophobicContact CD1-CD1 4.26Å
77	E	89.8	Confident	93.4	Very high	96 Å²	96	44.9 Å²	44.9	45%	0.449	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-88.8	127.8	-171.8	-74.5	170.1	-135.5	0	0	113.8	K51 G79 E80 Y82	K51-E77 VanDerWaalsContact CE-OE1 3.24Å; K51-E77 WeakPolarHBondContact CE-OE1 3.46Å; K51-E77 IonicContact NZ-OE1 2.73Å; K51-E77 PolarHBondContact NZ-OE1 2.7Å; K51-E77 IonicContact NZ-OE2 3.7Å; K51-E77 PolarHBondContact NZ-OE2 2.86Å; E77-G79 PolarHBondContact O-N 3.48Å; E77-E80 HydrophobicContact CB-CB 4.25Å; E77-E80 HydrophobicContact CB-CG 4.05Å; E77-E80 PolarHBondContact O-N 3.34Å; E77-E80 VanDerWaalsContact O-N 3.16Å; E77-Y82 PolarHBondContact N-OH 2.99Å
78	P	88.7	Confident	93.5	Very high	66 Å²	66	41 Å²	41	43%	0.429	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	119	177.1	-30	34.9	0	0	0	114.9	D23 T109	D23-P78 HydrophobicContact CB-CB 4.14Å; D23-P78 HydrophobicContact CB-CG 4.28Å; D23-P78 WeakPolarHBondContact O-CA 3.49Å; D23-P78 WeakPolarHBondContact O-CD 3.39Å; D23-P78 VanDerWaalsContact O-CG 3.3Å; D23-P78 WeakPolarHBondContact O-CG 3.35Å; P78-T109 WeakPolarHBondContact CB-OG1 3.37Å; P78-T109 WeakPolarHBondContact CG-OG1 3.42Å
79	G	85.8	Confident	93.5	Very high	8 Å²	8	38.7 Å²	38.7	8%	0.082	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	-9	177.5	0	0	0	0	0	116.2	E77 L106 K107	E77-G79 PolarHBondContact O-N 3.48Å; G79-L106 WeakPolarHBondContact CA-O 3.49Å; G79-K107 PolarHBondContact N-O 3.27Å; G79-K107 VanDerWaalsContact N-O 3.1Å
80	E	92.7	Very high	93.3	Very high	57 Å²	57	36.8 Å²	36.8	27%	0.266	19%	0.194	S	C	.	.			trans	-71.7	162.7	174.5	-87	-61.3	113.4	0	0	112.2	K51 S53 E77 Y82 L106	K51-E80 HydrophobicContact CD-CG 4.24Å; S53-E80 PolarHBondContact OG-OE2 2.85Å; E77-E80 HydrophobicContact CB-CB 4.25Å; E77-E80 HydrophobicContact CB-CG 4.05Å; E77-E80 PolarHBondContact O-N 3.34Å; E77-E80 VanDerWaalsContact O-N 3.16Å; E80-Y82 HydrophobicContact CB-CD2 4.26Å; E80-Y82 HydrophobicContact CB-CE2 3.62Å; E80-L106 PolarHBondContact O-N 3.08Å
81	Q	93.9	Very high	92.7	Very high	72 Å²	72	35.6 Å²	35.6	34%	0.336	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	133.1	174.7	-74	-174.1	-7.2	0	0	110.6	K51 V52 V103 V104 Q105	K51-Q81 CarbonylContact C-O 3.47Å; K51-Q81 VanDerWaalsContact CA-O 3.3Å; K51-Q81 WeakPolarHBondContact CA-O 3.36Å; V52-Q81 HydrophobicContact CB-CB 3.86Å; V52-Q81 HydrophobicContact CG2-CB 3.79Å; V52-Q81 PolarHBondContact N-O 3.37Å; Q81-V103 HydrophobicContact CB-CG1 3.91Å; Q81-V103 HydrophobicContact CG-CG1 4.13Å; Q81-V104 CarbonylContact C-O 3.44Å; Q81-V104 VanDerWaalsContact CA-O 3.28Å; Q81-V104 WeakPolarHBondContact CA-O 3.46Å; Q81-Q105 HydrophobicContact CG-CB 3.83Å; Q81-Q105 HydrophobicContact CG-CG 3.76Å
82	Y	95.5	Very high	91.9	Very high	4 Å²	4	37 Å²	37	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.8	-176.3	-70.2	-85.9	0	0	0	112.7	Y49 R50 K51 L76 E77 E80 V103 V104 L106	Y49-Y82 AromaticContact CD2-CD1 3.74Å; Y49-Y82 HydrophobicContact CD2-CD1 3.74Å; Y49-Y82 AromaticContact CD2-CE1 3.79Å; Y49-Y82 HydrophobicContact CD2-CE1 3.79Å; Y49-Y82 HydrophobicContact CE2-CD1 4.26Å; Y49-Y82 AromaticContact CE2-CE1 3.82Å; Y49-Y82 HydrophobicContact CE2-CE1 3.82Å; R50-Y82 WeakPolarHBondContact O-CA 3.32Å; K51-Y82 HydrophobicContact CB-CE1 4.48Å; K51-Y82 HydrophobicContact CG-CD1 4.08Å; K51-Y82 HydrophobicContact CG-CE1 3.52Å; L76-Y82 HydrophobicContact CB-CE2 3.9Å; L76-Y82 HydrophobicContact CD2-CD1 4.2Å; L76-Y82 HydrophobicContact CD2-CE1 3.8Å; L76-Y82 HydrophobicContact CD2-CE2 4.29Å; E77-Y82 PolarHBondContact N-OH 2.99Å; E80-Y82 HydrophobicContact CB-CD2 4.26Å; E80-Y82 HydrophobicContact CB-CE2 3.62Å; Y82-V103 WeakPolarHBondContact O-CA 3.36Å; Y82-V104 PolarHBondContact N-O 2.74Å; Y82-V104 PolarHBondContact O-N 2.69Å; Y82-L106 HydrophobicContact CD2-CD1 4.06Å; Y82-L106 HydrophobicContact CD2-CG 4.29Å; Y82-L106 HydrophobicContact CE2-CD1 3.85Å; Y82-L106 HydrophobicContact CE2-CG 4.49Å
83	V	96.7	Very high	91.3	Very high	9 Å²	9	35.1 Å²	35.1	6%	0.055	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	146.8	165.4	-68	0	0	0	0	110.5	Y49 R50 V52 W58 V103	Y49-V83 WeakPolarHBondContact CA-O 3.39Å; R50-V83 HydrophobicContact CG-CG2 3.65Å; R50-V83 PolarHBondContact N-O 2.8Å; R50-V83 PolarHBondContact O-N 2.86Å; V52-V83 HydrophobicContact CG2-CG1 4.16Å; W58-V83 HydrophobicContact CH2-CG2 4.35Å; V83-V103 HydrophobicContact CG1-CB 4.33Å; V83-V103 HydrophobicContact CG1-CG2 3.66Å
84	F	97.3	Very high	91.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	152.3	-174.4	-58.5	-93.3	0	0	0	110.9	V26 L28 Q48 Y49 V73 L76 F100 S101 V104	V26-F84 HydrophobicContact CB-CE2 4.22Å; V26-F84 HydrophobicContact CB-CZ 3.94Å; V26-F84 HydrophobicContact CG1-CE2 3.94Å; V26-F84 HydrophobicContact CG1-CZ 4.15Å; V26-F84 HydrophobicContact CG2-CE2 4.11Å; V26-F84 HydrophobicContact CG2-CZ 3.87Å; L28-F84 HydrophobicContact CD1-CB 3.77Å; L28-F84 HydrophobicContact CD1-CD1 3.42Å; L28-F84 VanDerWaalsContact CD1-CD1 3.42Å; L28-F84 HydrophobicContact CD1-CD2 4.15Å; L28-F84 HydrophobicContact CD1-CE1 4.04Å; L28-F84 HydrophobicContact CD1-CG 3.5Å; L28-F84 VanDerWaalsContact CD1-CG 3.5Å; L28-F84 HydrophobicContact CD2-CB 4.34Å; L28-F84 HydrophobicContact CD2-CD2 3.98Å; L28-F84 HydrophobicContact CD2-CG 4.09Å; L28-F84 HydrophobicContact CG-CG 4.42Å; Q48-F84 CarbonylContact O-C 3.51Å; Q48-F84 WeakPolarHBondContact O-CA 3.32Å; Y49-F84 HydrophobicContact CG-CD1 4.42Å; Y49-F84 HydrophobicContact CG-CE1 4.08Å; V73-F84 HydrophobicContact CB-CE1 4.06Å; V73-F84 HydrophobicContact CG1-CE1 4.19Å; V73-F84 HydrophobicContact CG2-CD1 4.19Å; V73-F84 HydrophobicContact CG2-CE1 3.86Å; L76-F84 HydrophobicContact CD1-CE1 4.46Å; L76-F84 HydrophobicContact CD1-CZ 3.96Å; F84-F100 CarbonylContact O-C 3.49Å; F84-F100 VanDerWaalsContact O-CA 3.31Å; F84-F100 WeakPolarHBondContact O-CA 3.45Å; F84-S101 PolarHBondContact N-OG 2.79Å; F84-S101 PolarHBondContact O-N 3.02Å; F84-V104 HydrophobicContact CE2-CG1 3.78Å
85	C	96.2	Very high	91	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	162.1	170	72	0	0	0	0	109.6	Q48 W58 R97 S98 F100	Q48-C85 PolarHBondContact N-O 2.91Å; Q48-C85 PolarHBondContact O-N 2.76Å; Q48-C85 VanDerWaalsContact O-O 3.11Å; W58-C85 HydrophobicContact CH2-CB 4.06Å; W58-C85 HydrophobicContact CZ3-CB 4.09Å; W58-C85 WeakPolarHBondContact CZ3-SG 3.13Å; C85-R97 HydrophobicContact CB-CG 3.86Å; C85-R97 WeakPolarHBondContact SG-CD 3.4Å; C85-R97 PolarHBondContact SG-NE 3.37Å; C85-S98 WeakPolarHBondContact CA-OG 3.39Å; C85-F100 HydrophobicContact CB-CD1 3.94Å; C85-F100 HydrophobicContact CB-CE1 4.47Å
86	V	96.8	Very high	90.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139.6	-175.1	-174.9	0	0	0	0	110.7	P13 P16 W30 Y45 Q46 V47 S98	P13-V86 HydrophobicContact CB-CB 4.46Å; P13-V86 HydrophobicContact CB-CG1 4.46Å; P13-V86 HydrophobicContact CG-CB 4.37Å; P13-V86 HydrophobicContact CG-CG1 4.14Å; P16-V86 HydrophobicContact CB-CG2 4.42Å; P16-V86 HydrophobicContact CG-CB 4.48Å; P16-V86 HydrophobicContact CG-CG2 3.72Å; W30-V86 HydrophobicContact CD2-CB 4.4Å; W30-V86 HydrophobicContact CD2-CG1 4.23Å; W30-V86 HydrophobicContact CD2-CG2 3.84Å; W30-V86 HydrophobicContact CE3-CG2 3.84Å; W30-V86 HydrophobicContact CG-CG2 4.41Å; W30-V86 HydrophobicContact CH2-CG2 4.38Å; W30-V86 HydrophobicContact CZ2-CG1 3.98Å; W30-V86 HydrophobicContact CZ2-CG2 4.35Å; W30-V86 HydrophobicContact CZ3-CG2 4.13Å; Y45-V86 HydrophobicContact CD1-CG1 3.87Å; Y45-V86 HydrophobicContact CG-CG1 4.13Å; Q46-V86 WeakPolarHBondContact O-CA 3.28Å; V47-V86 HydrophobicContact CB-CG2 4.44Å; V47-V86 HydrophobicContact CG1-CG2 4.27Å; V47-V86 HydrophobicContact CG2-CG1 4.37Å; V47-V86 HydrophobicContact CG2-CG2 4.03Å; V86-S98 PolarHBondContact N-OG 2.9Å; V86-S98 WeakPolarHBondContact O-CB 3.34Å; V86-S98 PolarHBondContact O-N 3.23Å
87	I	96.1	Very high	91	Very high	22 Å²	22	40.4 Å²	40.4	11%	0.113	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120.7	175.8	-48.5	175.8	0	0	0	107.2	Y45 Q46 F94 G95 R97	Y45-I87 CarbonylContact C-O 3.53Å; Y45-I87 WeakPolarHBondContact CA-O 3.33Å; Q46-I87 PolarHBondContact N-O 3.37Å; Q46-I87 PolarHBondContact O-N 2.89Å; I87-F94 HydrophobicContact CG2-CB 4.07Å; I87-F94 HydrophobicContact CG2-CD1 3.97Å; I87-F94 HydrophobicContact CG2-CG 4.49Å; I87-G95 VanDerWaalsContact CG2-O 3.28Å; I87-G95 WeakPolarHBondContact CG2-O 3.44Å; I87-R97 HydrophobicContact CD1-CB 4.46Å; I87-R97 HydrophobicContact CG1-CB 3.96Å; I87-R97 HydrophobicContact CG1-CG 4.02Å
88	A	94.5	Very high	91.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	149.3	171.9	0	0	0	0	0	110.8	P10 P13 P33 I42 Y45 G95	P10-A88 HydrophobicContact CB-CB 4.03Å; P13-A88 HydrophobicContact CG-CB 3.94Å; P33-A88 HydrophobicContact CG-CB 3.38Å; I42-A88 HydrophobicContact CD1-CB 4.11Å; I42-A88 HydrophobicContact CG2-CB 4.15Å; Y45-A88 HydrophobicContact CD1-CB 3.89Å; Y45-A88 HydrophobicContact CE1-CB 3.87Å; A88-G95 PolarHBondContact O-N 2.86Å
89	K	92.1	Very high	91.4	Very high	68 Å²	68	36.7 Å²	36.7	30%	0.296	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.1	168.8	168.3	165.2	163	178.3	0	110.3	I42 D43 G44 L65 G93 F94	I42-K89 CarbonylContact C-O 3.58Å; I42-K89 WeakPolarHBondContact CG2-O 3.11Å; D43-K89 PolarHBondContact N-O 2.78Å; G44-K89 PolarHBondContact N-O 3.38Å; G44-K89 PolarHBondContact O-N 2.76Å; L65-K89 HydrophobicContact CD1-CB 4Å; L65-K89 HydrophobicContact CD1-CD 3.93Å; L65-K89 HydrophobicContact CD1-CG 4.06Å; L65-K89 HydrophobicContact CD2-CB 4.06Å; L65-K89 HydrophobicContact CD2-CD 4.43Å; K89-G93 VanDerWaalsContact CA-O 3.31Å; K89-G93 WeakPolarHBondContact CA-O 3.33Å; K89-F94 HydrophobicContact CB-CD1 3.68Å; K89-F94 HydrophobicContact CB-CE1 3.8Å; K89-F94 HydrophobicContact CB-CG 4.19Å; K89-F94 HydrophobicContact CB-CZ 4.42Å; K89-F94 HydrophobicContact CD-CD1 4.32Å; K89-F94 HydrophobicContact CD-CD2 4.06Å; K89-F94 HydrophobicContact CD-CE1 4.04Å; K89-F94 HydrophobicContact CD-CE2 3.77Å; K89-F94 HydrophobicContact CD-CG 4.33Å; K89-F94 HydrophobicContact CD-CZ 3.76Å; K89-F94 HydrophobicContact CG-CD1 4.46Å; K89-F94 HydrophobicContact CG-CE1 4.49Å
90	S	89.5	Confident	91.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	-177.9	162.4	61.4	0	0	0	0	109.5	P10 C36 S41 T92 G93	P10-S90 WeakPolarHBondContact CD-OG 3.3Å; P10-S90 WeakPolarHBondContact CG-OG 3.38Å; C36-S90 WeakPolarHBondContact O-CB 3.3Å; C36-S90 PolarHBondContact O-OG 2.78Å; S41-S90 WeakPolarHBondContact O-CB 3.34Å; S90-T92 PolarHBondContact O-N 2.81Å; S90-T92 VanDerWaalsContact O-N 3.13Å; S90-T92 PolarHBondContact OG-OG1 2.81Å; S90-G93 PolarHBondContact N-O 3.12Å; S90-G93 PolarHBondContact O-N 2.88Å
91	A	82.2	Confident	91.9	Very high	82 Å²	82	37.8 Å²	37.8	68%	0.678	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.6	179	0	0	0	0	0	114.3	C39 D43	C39-A91 PolarHBondContact SG-N 2.77Å; C39-A91 VanDerWaalsContact SG-N 3.39Å; D43-A91 PolarHBondContact OD1-N 2.83Å; D43-A91 PolarHBondContact OD2-N 2.94Å
92	T	78.7	Confident	91.8	Very high	43 Å²	43	38 Å²	38	26%	0.264	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-18.7	169.7	53.3	0	0	0	0	113.5	C7 A8 L9 D38 C39 S90	C7-T92 HydrophobicContact CB-CG2 3.68Å; A8-T92 WeakPolarHBondContact O-CB 3.24Å; A8-T92 PolarHBondContact O-OG1 2.85Å; L9-T92 VanDerWaalsContact CD2-O 3.27Å; L9-T92 WeakPolarHBondContact CD2-O 3.45Å; D38-T92 HydrophobicContact CB-CG2 4.39Å; C39-T92 PolarHBondContact SG-N 3.36Å; C39-T92 VanDerWaalsContact SG-N 3.37Å; S90-T92 PolarHBondContact O-N 2.81Å; S90-T92 VanDerWaalsContact O-N 3.13Å; S90-T92 PolarHBondContact OG-OG1 2.81Å
93	G	84.1	Confident	91.7	Very high	19 Å²	19	41.5 Å²	41.5	20%	0.196	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	137.5	-169.3	174.9	0	0	0	0	0	114.6	K89 S90	K89-G93 VanDerWaalsContact CA-O 3.31Å; K89-G93 WeakPolarHBondContact CA-O 3.33Å; S90-G93 PolarHBondContact N-O 3.12Å; S90-G93 PolarHBondContact O-N 2.88Å
94	F	90.6	Very high	91.5	Very high	89 Å²	89	41.2 Å²	41.2	39%	0.39	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	131.7	173	-73.3	-81.5	0	0	0	110.7	Q46 L65 I87 K89	Q46-F94 HydrophobicContact CB-CE1 3.88Å; L65-F94 HydrophobicContact CD2-CE1 3.67Å; L65-F94 HydrophobicContact CD2-CZ 3.99Å; I87-F94 HydrophobicContact CG2-CB 4.07Å; I87-F94 HydrophobicContact CG2-CD1 3.97Å; I87-F94 HydrophobicContact CG2-CG 4.49Å; K89-F94 HydrophobicContact CB-CD1 3.68Å; K89-F94 HydrophobicContact CB-CE1 3.8Å; K89-F94 HydrophobicContact CB-CG 4.19Å; K89-F94 HydrophobicContact CB-CZ 4.42Å; K89-F94 HydrophobicContact CD-CD1 4.32Å; K89-F94 HydrophobicContact CD-CD2 4.06Å; K89-F94 HydrophobicContact CD-CE1 4.04Å; K89-F94 HydrophobicContact CD-CE2 3.77Å; K89-F94 HydrophobicContact CD-CG 4.33Å; K89-F94 HydrophobicContact CD-CZ 3.76Å; K89-F94 HydrophobicContact CG-CD1 4.46Å; K89-F94 HydrophobicContact CG-CE1 4.49Å
95	G	89.3	Confident	91.3	Very high	17 Å²	17	45.7 Å²	45.7	18%	0.175	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-161.1	176.3	0	0	0	0	0	114	P10 I87 A88	P10-G95 WeakPolarHBondContact O-CA 3.4Å; I87-G95 VanDerWaalsContact CG2-O 3.28Å; I87-G95 WeakPolarHBondContact CG2-O 3.44Å; A88-G95 PolarHBondContact O-N 2.86Å
96	Q	87.3	Confident	91	Very high	108 Å²	108	45.9 Å²	45.9	51%	0.505	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	148.7	175.6	-167.3	178	11.7	0	0	111.5	P10 A12 P13	P10-Q96 PolarHBondContact O-N 3.06Å; A12-Q96 WeakPolarHBondContact CA-O 3.44Å; A12-Q96 HydrophobicContact CB-CB 4.01Å; A12-Q96 HydrophobicContact CB-CG 4.16Å; P13-Q96 WeakPolarHBondContact CD-O 3.48Å
97	R	93.1	Very high	90.3	Very high	88 Å²	88	51.4 Å²	51.4	33%	0.332	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	140.7	172.6	-174	-170.5	-91.7	-179.3	-11.1	110.8	C85 I87	C85-R97 HydrophobicContact CB-CG 3.86Å; C85-R97 WeakPolarHBondContact SG-CD 3.4Å; C85-R97 PolarHBondContact SG-NE 3.37Å; I87-R97 HydrophobicContact CD1-CB 4.46Å; I87-R97 HydrophobicContact CG1-CB 3.96Å; I87-R97 HydrophobicContact CG1-CG 4.02Å
98	S	95.1	Very high	89.4	Confident	6 Å²	6	59.8 Å²	59.8	4%	0.042	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-60	165.9	171.3	75.3	0	0	0	0	112.4	P13 G14 C85 V86	P13-S98 VanDerWaalsContact O-CB 3.29Å; P13-S98 WeakPolarHBondContact O-CB 3.33Å; G14-S98 WeakPolarHBondContact O-CB 3.45Å; C85-S98 WeakPolarHBondContact CA-OG 3.39Å; V86-S98 PolarHBondContact N-OG 2.9Å; V86-S98 WeakPolarHBondContact O-CB 3.34Å; V86-S98 PolarHBondContact O-N 3.23Å
99	T	91.3	Very high	87.8	Confident	78 Å²	78	63 Å²	63	48%	0.479	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-61.5	157.5	157.6	47.7	0	0	0	0	110.6	C15 P16	C15-T99 WeakPolarHBondContact CB-OG1 3.33Å; P16-T99 WeakPolarHBondContact CD-O 3.47Å
100	F	95.6	Very high	85.6	Confident	80 Å²	80	65.2 Å²	65.2	35%	0.351	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-72	148.9	178.6	-51	-28.2	0	0	0	111	C15 W58 F84 C85	C15-F100 PolarHBondContact SG-O 3.32Å; C15-F100 VanDerWaalsContact SG-O 3.35Å; W58-F100 AromaticContact CH2-CD1 3.78Å; W58-F100 HydrophobicContact CH2-CD1 3.78Å; W58-F100 AromaticContact CH2-CE1 3.75Å; W58-F100 HydrophobicContact CH2-CE1 3.75Å; W58-F100 HydrophobicContact CH2-CG 4.41Å; W58-F100 HydrophobicContact CH2-CZ 4.36Å; W58-F100 HydrophobicContact CZ2-CD1 4.06Å; W58-F100 AromaticContact CZ2-CE1 3.55Å; W58-F100 HydrophobicContact CZ2-CE1 3.55Å; W58-F100 AromaticContact CZ2-CZ 3.81Å; W58-F100 HydrophobicContact CZ2-CZ 3.81Å; F84-F100 CarbonylContact O-C 3.49Å; F84-F100 VanDerWaalsContact O-CA 3.31Å; F84-F100 WeakPolarHBondContact O-CA 3.45Å; C85-F100 HydrophobicContact CB-CD1 3.94Å; C85-F100 HydrophobicContact CB-CE1 4.47Å
101	S	94	Very high	83.1	Confident	9 Å²	9	72.7 Å²	72.7	6%	0.063	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-58.5	163.6	167	72.1	0	0	0	0	111.3	P16 F84	P16-S101 WeakPolarHBondContact O-CA 3.07Å; P16-S101 WeakPolarHBondContact O-CB 3.4Å; F84-S101 PolarHBondContact N-OG 2.79Å; F84-S101 PolarHBondContact O-N 3.02Å
102	P	91.3	Very high	80.8	Confident	75 Å²	75	76.5 Å²	76.5	49%	0.487	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-51.4	154.7	155.5	-21.6	33.2	0	0	0	110.9	I18 V104	I18-P102 HydrophobicContact CD1-CB 4.18Å; I18-P102 WeakPolarHBondContact CD1-O 3.34Å; P102-V104 PolarHBondContact O-N 2.83Å
103	V	93.2	Very high	78.5	Confident	78 Å²	78	79.8 Å²	79.8	47%	0.473	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-67.4	122.2	169.5	177.6	0	0	0	0	108.4	V52 Q81 Y82 V83	V52-V103 HydrophobicContact CG2-CG1 3.82Å; V52-V103 HydrophobicContact CG2-CG2 4.04Å; Q81-V103 HydrophobicContact CB-CG1 3.91Å; Q81-V103 HydrophobicContact CG-CG1 4.13Å; Y82-V103 WeakPolarHBondContact O-CA 3.36Å; V83-V103 HydrophobicContact CG1-CB 4.33Å; V83-V103 HydrophobicContact CG1-CG2 3.66Å
104	V	93	Very high	75.9	Confident	4 Å²	4	85.9 Å²	85.9	2%	0.024	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	139.3	163	71.9	0	0	0	0	108.6	I18 Y21 V26 Q81 Y82 F84 P102 L106	I18-V104 HydrophobicContact CD1-CB 3.84Å; I18-V104 HydrophobicContact CG2-CG2 4.41Å; Y21-V104 HydrophobicContact CD1-CG2 3.62Å; Y21-V104 HydrophobicContact CD2-CG2 3.68Å; Y21-V104 HydrophobicContact CE1-CG2 3.88Å; Y21-V104 HydrophobicContact CE2-CG2 3.92Å; Y21-V104 HydrophobicContact CG-CG2 3.52Å; V26-V104 HydrophobicContact CG1-CG1 4.49Å; V26-V104 HydrophobicContact CG2-CG1 3.83Å; V26-V104 HydrophobicContact CG2-CG2 4.46Å; Q81-V104 CarbonylContact C-O 3.44Å; Q81-V104 VanDerWaalsContact CA-O 3.28Å; Q81-V104 WeakPolarHBondContact CA-O 3.46Å; Y82-V104 PolarHBondContact N-O 2.74Å; Y82-V104 PolarHBondContact O-N 2.69Å; F84-V104 HydrophobicContact CE2-CG1 3.78Å; P102-V104 PolarHBondContact O-N 2.83Å; V104-L106 HydrophobicContact CG2-CD2 4.41Å
105	Q	93.4	Very high	73.3	Confident	93 Å²	93	91.3 Å²	91.3	44%	0.435	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.3	165.3	-174.6	165.4	-6.5	0	0	108	Y21 Q81	Y21-Q105 WeakPolarHBondContact CE2-O 3.49Å; Q81-Q105 HydrophobicContact CG-CB 3.83Å; Q81-Q105 HydrophobicContact CG-CG 3.76Å
106	L	90.4	Very high	70.7	Confident	5 Å²	5	102.7 Å²	102.7	3%	0.026	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-68.4	153.3	-180	-66	-175.3	0	0	0	111	Y21 V26 L76 G79 E80 Y82 V104	Y21-L106 HydrophobicContact CD2-CD2 4.05Å; Y21-L106 HydrophobicContact CG-CD2 4.46Å; V26-L106 HydrophobicContact CG2-CD2 3.67Å; L76-L106 HydrophobicContact CB-CD1 3.44Å; L76-L106 VanDerWaalsContact CB-CD1 3.44Å; L76-L106 HydrophobicContact CD1-CD1 4.26Å; G79-L106 WeakPolarHBondContact CA-O 3.49Å; E80-L106 PolarHBondContact O-N 3.08Å; Y82-L106 HydrophobicContact CD2-CD1 4.06Å; Y82-L106 HydrophobicContact CD2-CG 4.29Å; Y82-L106 HydrophobicContact CE2-CD1 3.85Å; Y82-L106 HydrophobicContact CE2-CG 4.49Å; V104-L106 HydrophobicContact CG2-CD2 4.41Å
107	K	81.6	Confident	68	Low	116 Å²	116	104 Å²	104	50%	0.504	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-63.8	142.3	174.2	-63.3	164.2	-163.1	158.4	0	107.7	Y21 D22 D23 G79	Y21-K107 WeakPolarHBondContact O-CE 3.36Å; Y21-K107 PolarHBondContact O-NZ 2.85Å; D22-K107 WeakPolarHBondContact O-CB 3.35Å; D22-K107 WeakPolarHBondContact O-CG 3.44Å; D22-K107 PolarHBondContact O-N 3.06Å; D23-K107 WeakPolarHBondContact CA-O 3.19Å; D23-K107 HydrophobicContact CB-CB 4.04Å; D23-K107 WeakPolarHBondContact CB-O 3Å; G79-K107 PolarHBondContact N-O 3.27Å; G79-K107 VanDerWaalsContact N-O 3.1Å
108	R	77.9	Confident	65.6	Low	197 Å²	197	107.2 Å²	107.2	74%	0.743	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-78	131	164.8	-74.3	179.8	-179.7	155.6	1.3	107.6	S110	R108-S110 PolarHBondContact O-N 3.16Å
109	T	59.5	Low	63.5	Low	69 Å²	69	113.7 Å²	113.7	42%	0.423	57%	0.566	S	S	.	*			trans	-57.3	113.4	177.1	-49.1	0	0	0	0	109.9	D23 P78 L111	D23-T109 WeakPolarHBondContact OD2-CB 3.47Å; D23-T109 WeakPolarHBondContact OD2-CG2 3.28Å; D23-T109 PolarHBondContact OD2-OG1 3.36Å; P78-T109 WeakPolarHBondContact CB-OG1 3.37Å; P78-T109 WeakPolarHBondContact CG-OG1 3.42Å; T109-L111 PolarHBondContact O-N 2.93Å
110	S	47.4	Very low	62.4	Low	114 Å²	114	111.9 Å²	111.9	80%	0.797	56%	0.556	S	S	*	*			trans	-76.8	85.8	-179.6	176	0	0	0	0	109.8	R108 L112	R108-S110 PolarHBondContact O-N 3.16Å; S110-L112 PolarHBondContact O-N 3.17Å
111	L	36.4	Very low	61.8	Low	156 Å²	156	110.8 Å²	110.8	82%	0.817	56%	0.556	S	S	*	*			trans	-57.3	101.4	174.8	-69.4	174.6	0	0	0	111.3	T109	T109-L111 PolarHBondContact O-N 2.93Å
112	L	33.4	Very low	61.4	Low	162 Å²	162	110.5 Å²	110.5	85%	0.848	55%	0.554	S	S	*	*			trans	-178.6	144.8	145.1	-97.9	159.4	0	0	0	111.1	S110	S110-L112 PolarHBondContact O-N 3.17Å
113	S	30.6	Very low	61.3	Low	112 Å²	112	110.7 Å²	110.7	78%	0.783	55%	0.547	S	S	*	.	S	Bend	trans	62.6	140.6	179.4	65.1	0	0	0	0	120.1
114	D	30.5	Very low	61.1	Low	148 Å²	148	109.2 Å²	109.2	79%	0.791	54%	0.54	S	S	*	.			trans	21	110.8	168.7	-62.2	-43.2	0	0	0	121.9
115	R	35.6	Very low	61	Low	203 Å²	203	109.1 Å²	109.1	77%	0.766	54%	0.539	S	S	*	.				-163.1	107.3	104.4	-101	163	-165.9	-89.4	-0.4	112.1	E117	R115-E117 IonicContact NH1-OE2 2.82Å; R115-E117 PolarHBondContact O-N 3.04Å; R115-E117 VanDerWaalsContact O-N 3.14Å
116	R	33.3	Very low	60.7	Low	255 Å²	255	108.6 Å²	108.6	96%	0.962	54%	0.537	S	S	*	.			trans	-82.3	54.8	157.8	-75.3	-175.4	175.5	167.4	-0.8	109.8
117	E	32.3	Very low	60.6	Low	135 Å²	135	113.9 Å²	113.9	63%	0.631	57%	0.565	S	S	*	*			trans	-161.6	76.3	-170.4	-142.3	176.5	-112.2	0	0	112.5	R115	R115-E117 IonicContact NH1-OE2 2.82Å; R115-E117 PolarHBondContact O-N 3.04Å; R115-E117 VanDerWaalsContact O-N 3.14Å
118	L	41.1	Very low	61	Low	156 Å²	156	109.1 Å²	109.1	82%	0.817	55%	0.545	S	S	*	.			trans	-162.1	120.7	134.7	-140.1	66.6	0	0	0	109.9
119	H	50.9	Low	61.5	Low	142 Å²	142	104.1 Å²	104.1	66%	0.657	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-82.3	121.3	173.5	-51	157.7	0	0	0	108.2	L201	H119-L201 HydrophobicContact CB-CD1 3.55Å; H119-L201 HydrophobicContact CB-CD2 3.51Å; H119-L201 HydrophobicContact CB-CG 4.07Å
120	S	69.7	Low	63	Low	41 Å²	41	103 Å²	103	29%	0.287	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-91.2	135.1	-173	58.1	0	0	0	0	113.9	T150 N199 L201	S120-T150 PolarHBondContact OG-N 3.13Å; S120-N199 PolarHBondContact O-ND2 3.38Å; S120-L201 WeakPolarHBondContact O-CD1 3.42Å
121	V	81.9	Confident	64.5	Low	57 Å²	57	100 Å²	100	35%	0.345	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-63.6	164.5	161.2	-61.9	0	0	0	0	110.5	L201	V121-L201 HydrophobicContact CG1-CB 4.46Å
122	P	86.2	Confident	66.6	Low	3 Å²	3	98.2 Å²	98.2	2%	0.019	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-65.7	165.9	178.4	-17.4	32.7	0	0	0	112.2	P145 H147 L154 A197 N199 S204	P122-P145 HydrophobicContact CB-CG 4.3Å; P122-H147 WeakPolarHBondContact CA-O 3.37Å; P122-L154 HydrophobicContact CB-CD1 4.29Å; P122-L154 HydrophobicContact CG-CD1 3.92Å; P122-A197 HydrophobicContact CB-CB 3.69Å; P122-A197 HydrophobicContact CG-CB 4.06Å; P122-N199 HydrophobicContact CG-CB 3.82Å; P122-S204 WeakPolarHBondContact O-CA 3.47Å; P122-S204 WeakPolarHBondContact O-CB 3.47Å
123	F	88.6	Confident	69	Low	78 Å²	78	94.8 Å²	94.8	34%	0.342	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-71.7	166.1	163.2	-75.6	13	0	0	0	110.6	P145 H147 S204	F123-P145 HydrophobicContact CB-CB 4.11Å; F123-P145 WeakPolarHBondContact O-CB 3.48Å; F123-H147 HydrophobicContact CB-CB 4.46Å; F123-H147 HydrophobicContact CD1-CB 4.08Å; F123-H147 HydrophobicContact CD2-CB 3.83Å; F123-H147 HydrophobicContact CE1-CB 4.28Å; F123-H147 HydrophobicContact CE2-CB 4.04Å; F123-H147 HydrophobicContact CG-CB 3.86Å; F123-H147 HydrophobicContact CZ-CB 4.26Å; F123-H147 PolarHBondContact N-O 2.92Å; F123-S204 WeakPolarHBondContact O-CB 3.47Å
124	P	89.1	Confident	71.3	Confident	48 Å²	48	92.1 Å²	92.1	31%	0.312	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-57.8	147.2	173	-23.3	33.6	0	0	0	112.8	P145 A205	P124-P145 WeakPolarHBondContact O-CB 3.42Å; P124-A205 WeakPolarHBondContact CA-O 3.39Å; P124-A205 WeakPolarHBondContact CB-O 3.47Å; P124-A205 HydrophobicContact CG-CB 4.03Å; P124-A205 WeakPolarHBondContact CG-O 3.38Å
125	P	90.7	Very high	73.2	Confident	2 Å²	2	90 Å²	90	1%	0.013	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-64.2	144.8	159.7	-12.4	26.9	0	0	0	110.8	W142 Y157 V195 A197 S207	P125-W142 HydrophobicContact CB-CB 4.48Å; P125-W142 HydrophobicContact CB-CG 4.2Å; P125-Y157 HydrophobicContact CB-CD1 4.45Å; P125-Y157 HydrophobicContact CB-CE1 4.28Å; P125-Y157 HydrophobicContact CG-CD1 3.89Å; P125-Y157 HydrophobicContact CG-CE1 4.07Å; P125-V195 WeakPolarHBondContact CD-O 3.19Å; P125-V195 HydrophobicContact CG-CB 4.16Å; P125-V195 HydrophobicContact CG-CG1 3.98Å; P125-A197 HydrophobicContact CG-CB 4.02Å; P125-S207 WeakPolarHBondContact O-CA 3.38Å; P125-S207 WeakPolarHBondContact O-CB 3.26Å
126	E	88.6	Confident	75	Confident	82 Å²	82	86.5 Å²	86.5	38%	0.383	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	171.3	-175.8	-65.1	172.6	160.7	0	0	110.6	L128 W142 A143 V146	E126-L128 PolarHBondContact O-N 3.04Å; E126-L128 VanDerWaalsContact O-N 3.14Å; E126-W142 VanDerWaalsContact O-CB 3.32Å; E126-W142 WeakPolarHBondContact O-CB 3.27Å; E126-A143 HydrophobicContact CB-CB 4.07Å; E126-A143 PolarHBondContact N-O 3.14Å; E126-A143 VanDerWaalsContact N-O 3.17Å; E126-A143 PolarHBondContact O-N 3.45Å; E126-V146 WeakPolarHBondContact OE1-CG2 3.23Å; E126-V146 VanDerWaalsContact OE2-CG2 3.32Å; E126-V146 WeakPolarHBondContact OE2-CG2 3.38Å
127	D	87.7	Confident	77.3	Confident	115 Å²	115	74.3 Å²	74.3	62%	0.615	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.7	42.4	172.7	-63.4	-24.1	0	0	0	116.7	I129 A143	D127-I129 PolarHBondContact O-N 2.75Å; D127-I129 VanDerWaalsContact O-N 3.13Å; D127-A143 HydrophobicContact CB-CB 4.2Å
128	L	90.7	Very high	80	Confident	16 Å²	16	67.9 Å²	67.9	8%	0.084	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	109.7	177.2	178.9	62.6	0	0	0	111.9	E126 L140 C141 W142 F193 V195 S207 L210	E126-L128 PolarHBondContact O-N 3.04Å; E126-L128 VanDerWaalsContact O-N 3.14Å; L128-L140 HydrophobicContact CD1-CB 4.25Å; L128-C141 WeakPolarHBondContact CA-O 3.43Å; L128-W142 HydrophobicContact CB-CB 4.43Å; L128-W142 HydrophobicContact CD1-CB 4.23Å; L128-W142 HydrophobicContact CD1-CD2 4.49Å; L128-W142 HydrophobicContact CD1-CE3 3.81Å; L128-F193 HydrophobicContact CD2-CB 4.39Å; L128-V195 HydrophobicContact CD1-CG2 3.72Å; L128-V195 HydrophobicContact CD2-CG2 4.06Å; L128-S207 WeakPolarHBondContact CD2-OG 3.36Å; L128-L210 HydrophobicContact CD2-CB 3.88Å; L128-L210 HydrophobicContact CG-CB 3.93Å; L128-L210 HydrophobicContact CG-CD2 4.07Å
129	I	88.5	Confident	82.3	Confident	92 Å²	92	60.5 Å²	60.5	47%	0.472	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	162.5	-177.1	60.2	170.4	0	0	0	112.7	D127 L140 C141	D127-I129 PolarHBondContact O-N 2.75Å; D127-I129 VanDerWaalsContact O-N 3.13Å; I129-L140 WeakPolarHBondContact O-CA 3.09Å; I129-C141 HydrophobicContact CG1-CB 4.09Å; I129-C141 PolarHBondContact N-O 3.26Å; I129-C141 PolarHBondContact O-N 2.7Å
130	V	89	Confident	84.1	Confident	45 Å²	45	53.8 Å²	53.8	27%	0.273	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	121.9	158.2	-176.2	0	0	0	0	108	E132 Q133 I138 S139 L140 L210 Y212	V130-E132 WeakPolarHBondContact CG1-O 3.48Å; V130-Q133 HydrophobicContact CG1-CB 4.48Å; V130-I138 HydrophobicContact CG1-CB 4.04Å; V130-I138 HydrophobicContact CG1-CG2 4.21Å; V130-I138 HydrophobicContact CG2-CD1 4.19Å; V130-S139 CarbonylContact C-O 3.5Å; V130-S139 WeakPolarHBondContact CA-O 3.41Å; V130-L140 HydrophobicContact CG2-CD2 4.23Å; V130-L210 HydrophobicContact CG2-CD2 3.92Å; V130-Y212 HydrophobicContact CG2-CD2 3.94Å; V130-Y212 HydrophobicContact CG2-CE2 4.37Å
131	A	79.3	Confident	85.2	Confident	53 Å²	53	53.4 Å²	53.4	44%	0.438	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-30.9	175.6	0	0	0	0	0	113	S139 C141	A131-S139 PolarHBondContact N-O 2.98Å; A131-C141 HydrophobicContact CB-CB 4.04Å; A131-C141 WeakPolarHBondContact CB-SG 3.32Å
132	E	80.1	Confident	85.7	Confident	118 Å²	118	51.5 Å²	51.5	55%	0.551	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.6	151.5	179.7	-51.8	168.2	131.3	0	0	109.9	V130 I138 S139 R181	V130-E132 WeakPolarHBondContact CG1-O 3.48Å; E132-I138 CarbonylContact O-C 3.47Å; E132-I138 WeakPolarHBondContact O-CA 3.3Å; E132-S139 PolarHBondContact O-N 3.18Å; E132-S139 WeakPolarHBondContact OE2-CB 3.48Å; E132-S139 PolarHBondContact OE2-OG 3.03Å; E132-R181 PolarHBondContact O-NH1 3.48Å; E132-R181 IonicContact OE2-NH1 3.07Å
133	Q	84.8	Confident	85.9	Confident	90 Å²	90	52.6 Å²	52.6	42%	0.421	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	147.1	171.3	60.3	180	-21.8	0	0	112.1	V130 G137 I138 Y212	V130-Q133 HydrophobicContact CG1-CB 4.48Å; Q133-G137 WeakPolarHBondContact CA-O 3.28Å; Q133-I138 HydrophobicContact CB-CG2 3.83Å; Q133-Y212 PolarHBondContact OE1-OH 3.19Å
134	D	78.1	Confident	85.8	Confident	56 Å²	56	52.5 Å²	52.5	30%	0.299	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	178.5	173.6	80.4	-11.5	0	0	0	111.3	K136 G137 R181 F217	D134-K136 PolarHBondContact O-N 3.31Å; D134-K136 WeakPolarHBondContact OD1-CA 3.28Å; D134-K136 WeakPolarHBondContact OD1-CB 3.26Å; D134-K136 PolarHBondContact OD1-N 3.44Å; D134-G137 PolarHBondContact N-O 2.8Å; D134-G137 PolarHBondContact O-N 2.81Å; D134-G137 VanDerWaalsContact O-N 3.16Å; D134-G137 VanDerWaalsContact O-O 3.12Å; D134-G137 PolarHBondContact OD1-N 3.33Å; D134-R181 IonicContact OD1-CZ 3.14Å; D134-R181 IonicContact OD1-NH2 3.28Å; D134-R181 PolarHBondContact OD1-NH2 2.67Å; D134-R181 IonicContact OD2-NH2 2.69Å; D134-F217 VanDerWaalsContact C-CE1 3.49Å; D134-F217 WeakPolarHBondContact O-CE2 3.38Å; D134-F217 VanDerWaalsContact O-CZ 3.22Å; D134-F217 WeakPolarHBondContact O-CZ 3.37Å
135	E	71.5	Confident	85.7	Confident	103 Å²	103	50.6 Å²	50.6	48%	0.481	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-5.5	177.6	54.5	147	-153.6	0	0	115.4	F217	E135-F217 HydrophobicContact CB-CB 4.01Å; E135-F217 HydrophobicContact CB-CD1 4.23Å; E135-F217 HydrophobicContact CB-CD2 4.43Å; E135-F217 HydrophobicContact CB-CG 3.96Å
136	K	73.5	Confident	85.3	Confident	129 Å²	129	55.8 Å²	55.8	56%	0.561	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-17.8	-179.3	-62.9	155.9	-167.5	154.9	0	112.5	D134 T183 G184	D134-K136 PolarHBondContact O-N 3.31Å; D134-K136 WeakPolarHBondContact OD1-CA 3.28Å; D134-K136 WeakPolarHBondContact OD1-CB 3.26Å; D134-K136 PolarHBondContact OD1-N 3.44Å; K136-T183 VanDerWaalsContact O-CA 3.3Å; K136-T183 WeakPolarHBondContact O-CA 3.33Å; K136-T183 WeakPolarHBondContact O-CB 3.31Å; K136-G184 PolarHBondContact O-N 3.46Å
137	G	80.8	Confident	84.9	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159	-147.7	177.3	0	0	0	0	0	115.4	Q133 D134 R181 V182	Q133-G137 WeakPolarHBondContact CA-O 3.28Å; D134-G137 PolarHBondContact N-O 2.8Å; D134-G137 PolarHBondContact O-N 2.81Å; D134-G137 VanDerWaalsContact O-N 3.16Å; D134-G137 VanDerWaalsContact O-O 3.12Å; D134-G137 PolarHBondContact OD1-N 3.33Å; G137-R181 PolarHBondContact O-NH2 3.09Å; G137-V182 CarbonylContact C-O 3.55Å; G137-V182 VanDerWaalsContact CA-O 3.29Å; G137-V182 WeakPolarHBondContact CA-O 3.44Å
138	I	88.9	Confident	84.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	145.1	-174.1	61.5	176.3	0	0	0	112.4	V130 E132 Q133 L140 R181 V182 L185 F193 Y212	V130-I138 HydrophobicContact CG1-CB 4.04Å; V130-I138 HydrophobicContact CG1-CG2 4.21Å; V130-I138 HydrophobicContact CG2-CD1 4.19Å; E132-I138 CarbonylContact O-C 3.47Å; E132-I138 WeakPolarHBondContact O-CA 3.3Å; Q133-I138 HydrophobicContact CB-CG2 3.83Å; I138-L140 HydrophobicContact CD1-CD2 3.8Å; I138-L140 HydrophobicContact CD1-CG 4.35Å; I138-L140 HydrophobicContact CG1-CD2 4.39Å; I138-R181 CarbonylContact O-C 3.42Å; I138-R181 WeakPolarHBondContact O-CA 3.47Å; I138-R181 WeakPolarHBondContact O-CD 3.4Å; I138-V182 HydrophobicContact CG1-CB 3.81Å; I138-V182 HydrophobicContact CG1-CG2 4.18Å; I138-V182 PolarHBondContact N-O 3.38Å; I138-V182 PolarHBondContact O-N 3.33Å; I138-L185 HydrophobicContact CD1-CD1 4.19Å; I138-L185 HydrophobicContact CG1-CD1 4.19Å; I138-L185 HydrophobicContact CG2-CD1 4.44Å; I138-F193 HydrophobicContact CD1-CD2 4.14Å; I138-F193 HydrophobicContact CD1-CE2 3.52Å; I138-F193 HydrophobicContact CD1-CZ 3.78Å; I138-Y212 HydrophobicContact CD1-CD1 4.01Å; I138-Y212 HydrophobicContact CD1-CE1 4.19Å; I138-Y212 HydrophobicContact CD1-CG 4.26Å; I138-Y212 HydrophobicContact CG2-CD1 4.46Å; I138-Y212 HydrophobicContact CG2-CE1 3.67Å; I138-Y212 HydrophobicContact CG2-CE2 3.93Å; I138-Y212 VanDerWaalsContact CG2-OH 3.3Å; I138-Y212 WeakPolarHBondContact CG2-OH 3.33Å
139	S	88.7	Confident	83.2	Confident	1 Å²	1	51 Å²	51	1%	0.007	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	115.5	167.5	-68.6	0	0	0	0	108.2	V130 A131 E132 F179 R181	V130-S139 CarbonylContact C-O 3.5Å; V130-S139 WeakPolarHBondContact CA-O 3.41Å; A131-S139 PolarHBondContact N-O 2.98Å; E132-S139 PolarHBondContact O-N 3.18Å; E132-S139 WeakPolarHBondContact OE2-CB 3.48Å; E132-S139 PolarHBondContact OE2-OG 3.03Å; S139-F179 WeakPolarHBondContact OG-CZ 3.34Å; S139-R181 VanDerWaalsContact OG-CD 3.26Å; S139-R181 WeakPolarHBondContact OG-CD 3.4Å; S139-R181 PolarHBondContact OG-NH1 3.44Å
140	L	90.6	Very high	81.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.4	169.5	-63.5	-179.4	0	0	0	109.7	L128 I129 V130 I138 W142 I159 F179 Y180 V182 F193 L210	L128-L140 HydrophobicContact CD1-CB 4.25Å; I129-L140 WeakPolarHBondContact O-CA 3.09Å; V130-L140 HydrophobicContact CG2-CD2 4.23Å; I138-L140 HydrophobicContact CD1-CD2 3.8Å; I138-L140 HydrophobicContact CD1-CG 4.35Å; I138-L140 HydrophobicContact CG1-CD2 4.39Å; L140-W142 HydrophobicContact CB-CE3 4.3Å; L140-W142 HydrophobicContact CB-CZ3 3.96Å; L140-I159 HydrophobicContact CD1-CG2 3.92Å; L140-F179 CarbonylContact O-C 3.59Å; L140-F179 VanDerWaalsContact O-CA 3.27Å; L140-F179 WeakPolarHBondContact O-CA 3.49Å; L140-Y180 PolarHBondContact N-O 3.03Å; L140-Y180 PolarHBondContact O-N 3.07Å; L140-V182 HydrophobicContact CD1-CG2 3.6Å; L140-V182 HydrophobicContact CG-CG2 3.95Å; L140-F193 HydrophobicContact CD1-CB 4Å; L140-F193 HydrophobicContact CD1-CD1 3.87Å; L140-F193 HydrophobicContact CD1-CG 3.93Å; L140-L210 HydrophobicContact CD2-CD2 3.52Å
141	C	91.2	Very high	80.7	Confident	34 Å²	34	52.3 Å²	52.3	23%	0.23	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	154.2	170.5	-76	0	0	0	0	109.9	L128 I129 A131 S178	L128-C141 WeakPolarHBondContact CA-O 3.43Å; I129-C141 HydrophobicContact CG1-CB 4.09Å; I129-C141 PolarHBondContact N-O 3.26Å; I129-C141 PolarHBondContact O-N 2.7Å; A131-C141 HydrophobicContact CB-CB 4.04Å; A131-C141 WeakPolarHBondContact CB-SG 3.32Å; C141-S178 WeakPolarHBondContact CA-O 3.47Å
142	W	93	Very high	79.8	Confident	16 Å²	16	52.2 Å²	52.2	6%	0.061	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	164.2	175.4	54.6	91.2	0	0	0	111.2	P125 E126 L128 L140 Y157 I159 S177 S178 F179 V195	P125-W142 HydrophobicContact CB-CB 4.48Å; P125-W142 HydrophobicContact CB-CG 4.2Å; E126-W142 VanDerWaalsContact O-CB 3.32Å; E126-W142 WeakPolarHBondContact O-CB 3.27Å; L128-W142 HydrophobicContact CB-CB 4.43Å; L128-W142 HydrophobicContact CD1-CB 4.23Å; L128-W142 HydrophobicContact CD1-CD2 4.49Å; L128-W142 HydrophobicContact CD1-CE3 3.81Å; L140-W142 HydrophobicContact CB-CE3 4.3Å; L140-W142 HydrophobicContact CB-CZ3 3.96Å; W142-Y157 AromaticContact CD1-CE1 3.81Å; W142-Y157 AromaticContact CE2-CD2 3.98Å; W142-Y157 AromaticContact CE2-CG 3.8Å; W142-Y157 HydrophobicContact CZ2-CD1 4.33Å; W142-Y157 AromaticContact CZ2-CD2 3.74Å; W142-Y157 HydrophobicContact CZ2-CD2 3.74Å; W142-Y157 HydrophobicContact CZ2-CE2 4.44Å; W142-Y157 AromaticContact CZ2-CG 3.67Å; W142-Y157 HydrophobicContact CZ2-CG 3.67Å; W142-Y157 AromaticContact NE1-CD1 3.18Å; W142-Y157 AromaticContact NE1-CD2 3.57Å; W142-Y157 AromaticContact NE1-CE1 3.2Å; W142-Y157 AromaticContact NE1-CE2 3.59Å; W142-Y157 AromaticContact NE1-CG 3.36Å; W142-Y157 AromaticContact NE1-CZ 3.4Å; W142-I159 HydrophobicContact CH2-CD1 3.96Å; W142-I159 HydrophobicContact CH2-CG1 3.72Å; W142-I159 HydrophobicContact CZ2-CG1 4.47Å; W142-I159 HydrophobicContact CZ3-CG1 4.19Å; W142-S177 WeakPolarHBondContact CZ2-O 3.19Å; W142-S178 VanDerWaalsContact CE2-CA 3.43Å; W142-S178 PolarHBondContact N-O 2.94Å; W142-S178 WeakPolarHBondContact O-CB 3.47Å; W142-F179 VanDerWaalsContact CH2-C 3.45Å; W142-V195 HydrophobicContact CD2-CB 4.39Å; W142-V195 HydrophobicContact CD2-CG1 4.12Å; W142-V195 HydrophobicContact CD2-CG2 4.02Å; W142-V195 HydrophobicContact CE3-CG2 3.8Å; W142-V195 HydrophobicContact CH2-CG1 4.34Å; W142-V195 HydrophobicContact CH2-CG2 4.36Å; W142-V195 HydrophobicContact CZ2-CG1 3.86Å; W142-V195 HydrophobicContact CZ3-CG2 3.98Å
143	A	89.7	Confident	79.5	Confident	26 Å²	26	49.8 Å²	49.8	22%	0.215	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	142.4	169.1	0	0	0	0	0	110.8	E126 D127	E126-A143 HydrophobicContact CB-CB 4.07Å; E126-A143 PolarHBondContact N-O 3.14Å; E126-A143 VanDerWaalsContact N-O 3.17Å; E126-A143 PolarHBondContact O-N 3.45Å; D127-A143 HydrophobicContact CB-CB 4.2Å
144	P	88.1	Confident	79.4	Confident	77 Å²	77	48 Å²	48	50%	0.5	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-58.4	148.5	169.1	-19.9	31.2	0	0	0	112	Y157	P144-Y157 WeakPolarHBondContact CA-OH 3.47Å; P144-Y157 WeakPolarHBondContact CB-OH 3.17Å
145	P	85.6	Confident	80	Confident	8 Å²	8	49.9 Å²	49.9	5%	0.052	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-61.5	139.2	177.1	28.4	-37.8	0	0	0	111.7	P122 F123 P124 H147 L154 A197	P122-P145 HydrophobicContact CB-CG 4.3Å; F123-P145 HydrophobicContact CB-CB 4.11Å; F123-P145 WeakPolarHBondContact O-CB 3.48Å; P124-P145 WeakPolarHBondContact O-CB 3.42Å; P145-H147 PolarHBondContact O-N 2.89Å; P145-L154 HydrophobicContact CG-CD1 4.43Å; P145-L154 HydrophobicContact CG-CD2 4.17Å; P145-A197 HydrophobicContact CB-CB 4.49Å; P145-A197 HydrophobicContact CG-CB 3.84Å
146	V	82	Confident	81	Confident	110 Å²	110	45.2 Å²	45.2	67%	0.667	27%	0.269	S	S	*	.	S	Bend	trans	-57.6	-23.5	178	-154.9	0	0	0	0	112.8	E126	E126-V146 WeakPolarHBondContact OE1-CG2 3.23Å; E126-V146 VanDerWaalsContact OE2-CG2 3.32Å; E126-V146 WeakPolarHBondContact OE2-CG2 3.38Å
147	H	81.2	Confident	82.1	Confident	79 Å²	79	39.6 Å²	39.6	37%	0.366	25%	0.245	S	C	.	.			trans	-135.9	114.4	174.8	-169.1	66.9	0	0	0	111.7	P122 F123 P145 G149	P122-H147 WeakPolarHBondContact CA-O 3.37Å; F123-H147 HydrophobicContact CB-CB 4.46Å; F123-H147 HydrophobicContact CD1-CB 4.08Å; F123-H147 HydrophobicContact CD2-CB 3.83Å; F123-H147 HydrophobicContact CE1-CB 4.28Å; F123-H147 HydrophobicContact CE2-CB 4.04Å; F123-H147 HydrophobicContact CG-CB 3.86Å; F123-H147 HydrophobicContact CZ-CB 4.26Å; F123-H147 PolarHBondContact N-O 2.92Å; P145-H147 PolarHBondContact O-N 2.89Å; H147-G149 PolarHBondContact CD2-N 3.39Å; H147-G149 PolarHBondContact O-N 3.18Å; H147-G149 VanDerWaalsContact O-N 3.16Å
148	S	77.4	Confident	82.9	Confident	33 Å²	33	41 Å²	41	23%	0.231	25%	0.251	C	S	.	.			trans	-72	1.6	178.4	-47.6	0	0	0	0	115	G152 N199	S148-G152 VanDerWaalsContact CB-C 3.47Å; S148-G152 WeakPolarHBondContact CB-O 3.34Å; S148-G152 PolarHBondContact OG-O 3.3Å; S148-N199 PolarHBondContact O-ND2 3.34Å
149	G	65.4	Low	83.2	Confident	2 Å²	2	41 Å²	41	2%	0.021	25%	0.251	C	S	.	.			trans	89.8	174.1	-166.5	0	0	0	0	0	112.8	H147 D151 G152	H147-G149 PolarHBondContact CD2-N 3.39Å; H147-G149 PolarHBondContact O-N 3.18Å; H147-G149 VanDerWaalsContact O-N 3.16Å; G149-D151 PolarHBondContact O-N 3.2Å; G149-D151 VanDerWaalsContact O-N 3.09Å; G149-G152 PolarHBondContact O-N 2.98Å
150	T	59.9	Low	83.5	Confident	94 Å²	94	41.9 Å²	41.9	58%	0.577	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.6	-168.4	38.5	0	0	0	0	116.4	S120	S120-T150 PolarHBondContact OG-N 3.13Å
151	D	65.9	Low	83.5	Confident	69 Å²	69	42.4 Å²	42.4	37%	0.369	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-0.3	178.5	63.9	6.7	0	0	0	113.5	G149 S153	G149-D151 PolarHBondContact O-N 3.2Å; G149-D151 VanDerWaalsContact O-N 3.09Å; D151-S153 PolarHBondContact O-N 2.78Å; D151-S153 PolarHBondContact O-OG 3.38Å; D151-S153 PolarHBondContact OD1-N 3.44Å
152	G	60.1	Low	83.5	Confident	51 Å²	51	43 Å²	43	53%	0.526	26%	0.256	S	S	.	.			trans	66.1	-2.3	-175.4	0	0	0	0	0	115.1	S148 G149 L154	S148-G152 VanDerWaalsContact CB-C 3.47Å; S148-G152 WeakPolarHBondContact CB-O 3.34Å; S148-G152 PolarHBondContact OG-O 3.3Å; G149-G152 PolarHBondContact O-N 2.98Å; G152-L154 PolarHBondContact O-N 3.37Å
153	S	74.2	Confident	83.1	Confident	68 Å²	68	45 Å²	45	48%	0.476	27%	0.271	S	S	.	.			trans	-105.6	75.4	-155.5	-64.3	0	0	0	0	111.9	D151 I155 N199	D151-S153 PolarHBondContact O-N 2.78Å; D151-S153 PolarHBondContact O-OG 3.38Å; D151-S153 PolarHBondContact OD1-N 3.44Å; S153-I155 PolarHBondContact O-N 3.15Å; S153-N199 WeakPolarHBondContact O-CB 3.38Å
154	L	82.1	Confident	82.4	Confident	52 Å²	52	45.8 Å²	45.8	27%	0.272	28%	0.275	S	S	.	.			trans	-65.8	122.6	171.9	-170.3	68.1	0	0	0	110.2	P122 P145 G152 Y157 A197 K198	P122-L154 HydrophobicContact CB-CD1 4.29Å; P122-L154 HydrophobicContact CG-CD1 3.92Å; P145-L154 HydrophobicContact CG-CD1 4.43Å; P145-L154 HydrophobicContact CG-CD2 4.17Å; G152-L154 PolarHBondContact O-N 3.37Å; L154-Y157 HydrophobicContact CD2-CE1 3.86Å; L154-Y157 HydrophobicContact CD2-CE2 4.22Å; L154-Y157 WeakPolarHBondContact CD2-OH 3.49Å; L154-A197 HydrophobicContact CD1-CB 3.64Å; L154-K198 WeakPolarHBondContact CD1-O 3.19Å
155	I	89.5	Confident	81.6	Confident	95 Å²	95	45.5 Å²	45.5	49%	0.487	29%	0.287	S	S	.	.			trans	-92.8	-49.1	-174.7	-63.1	177.7	0	0	0	111	S153 K198 A200	S153-I155 PolarHBondContact O-N 3.15Å; I155-K198 WeakPolarHBondContact CB-O 3.1Å; I155-K198 PolarHBondContact N-O 3.16Å; I155-A200 HydrophobicContact CD1-CB 4.21Å
156	S	94.1	Very high	81.3	Confident	6 Å²	6	51.7 Å²	51.7	4%	0.042	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	-179	-178.4	64.4	0	0	0	0	110.7	E174 S175 K198	S156-E174 PolarHBondContact OG-OE2 3.34Å; S156-S175 CarbonylContact C-O 3.5Å; S156-S175 VanDerWaalsContact CA-O 3.31Å; S156-S175 WeakPolarHBondContact CA-O 3.41Å; S156-S175 WeakPolarHBondContact CB-O 3.31Å; S156-K198 PolarHBondContact N-O 3.38Å; S156-K198 VanDerWaalsContact O-CB 3.28Å; S156-K198 WeakPolarHBondContact O-CB 3.46Å; S156-K198 PolarHBondContact O-N 3.22Å; S156-K198 WeakPolarHBondContact OG-CD 3.28Å
157	Y	96.1	Very high	81	Confident	10 Å²	10	54.6 Å²	54.6	4%	0.039	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.7	167.8	-59.6	-83.9	0	0	0	109	P125 W142 P144 L154 E174 S175 S177 S178 V195 L196 A197	P125-Y157 HydrophobicContact CB-CD1 4.45Å; P125-Y157 HydrophobicContact CB-CE1 4.28Å; P125-Y157 HydrophobicContact CG-CD1 3.89Å; P125-Y157 HydrophobicContact CG-CE1 4.07Å; W142-Y157 AromaticContact CD1-CE1 3.81Å; W142-Y157 AromaticContact CE2-CD2 3.98Å; W142-Y157 AromaticContact CE2-CG 3.8Å; W142-Y157 HydrophobicContact CZ2-CD1 4.33Å; W142-Y157 AromaticContact CZ2-CD2 3.74Å; W142-Y157 HydrophobicContact CZ2-CD2 3.74Å; W142-Y157 HydrophobicContact CZ2-CE2 4.44Å; W142-Y157 AromaticContact CZ2-CG 3.67Å; W142-Y157 HydrophobicContact CZ2-CG 3.67Å; W142-Y157 AromaticContact NE1-CD1 3.18Å; W142-Y157 AromaticContact NE1-CD2 3.57Å; W142-Y157 AromaticContact NE1-CE1 3.2Å; W142-Y157 AromaticContact NE1-CE2 3.59Å; W142-Y157 AromaticContact NE1-CG 3.36Å; W142-Y157 AromaticContact NE1-CZ 3.4Å; P144-Y157 WeakPolarHBondContact CA-OH 3.47Å; P144-Y157 WeakPolarHBondContact CB-OH 3.17Å; L154-Y157 HydrophobicContact CD2-CE1 3.86Å; L154-Y157 HydrophobicContact CD2-CE2 4.22Å; L154-Y157 WeakPolarHBondContact CD2-OH 3.49Å; Y157-E174 CarbonylContact O-C 3.53Å; Y157-E174 WeakPolarHBondContact O-CA 3.46Å; Y157-E174 WeakPolarHBondContact O-CB 3.38Å; Y157-S175 PolarHBondContact N-O 2.81Å; Y157-S175 PolarHBondContact O-N 3.17Å; Y157-S177 VanDerWaalsContact CD2-O 3.31Å; Y157-S177 WeakPolarHBondContact CD2-O 3.3Å; Y157-S178 WeakPolarHBondContact CE2-OG 3.39Å; Y157-S178 PolarHBondContact OH-OG 3Å; Y157-V195 HydrophobicContact CD1-CG1 4.04Å; Y157-V195 HydrophobicContact CG-CG1 4.18Å; Y157-L196 CarbonylContact C-O 3.59Å; Y157-L196 WeakPolarHBondContact CA-O 3.49Å; Y157-A197 HydrophobicContact CD1-CB 4.2Å; Y157-A197 HydrophobicContact CE1-CB 4.26Å
158	E	96.8	Very high	81	Confident	30 Å²	30	54.3 Å²	54.3	14%	0.14	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.3	168.4	-169.6	-173.2	112	0	0	109.6	Q160 P171 E174 V195 L196 L203	E158-Q160 HydrophobicContact CG-CG 4.49Å; E158-Q160 PolarHBondContact OE1-NE2 3.13Å; E158-P171 HydrophobicContact CG-CB 4.19Å; E158-E174 HydrophobicContact CB-CG 4.26Å; E158-E174 HydrophobicContact CG-CG 4.32Å; E158-V195 CarbonylContact O-C 3.51Å; E158-V195 WeakPolarHBondContact O-CA 3.36Å; E158-L196 HydrophobicContact CB-CB 4.47Å; E158-L196 PolarHBondContact N-O 3.28Å; E158-L196 PolarHBondContact O-N 2.9Å; E158-L203 HydrophobicContact CB-CD2 3.89Å; E158-L203 WeakPolarHBondContact OE2-CD1 3.34Å
159	I	95.9	Very high	81.6	Confident	0 Å²	0	55 Å²	55	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.1	179.5	-55.7	85.3	0	0	0	107.9	L140 W142 I172 G173 Y180 V195	L140-I159 HydrophobicContact CD1-CG2 3.92Å; W142-I159 HydrophobicContact CH2-CD1 3.96Å; W142-I159 HydrophobicContact CH2-CG1 3.72Å; W142-I159 HydrophobicContact CZ2-CG1 4.47Å; W142-I159 HydrophobicContact CZ3-CG1 4.19Å; I159-I172 HydrophobicContact CB-CG1 4.19Å; I159-I172 HydrophobicContact CG2-CD1 3.86Å; I159-I172 HydrophobicContact CG2-CG1 3.86Å; I159-I172 VanDerWaalsContact O-CG1 3.26Å; I159-I172 WeakPolarHBondContact O-CG1 3.3Å; I159-I172 PolarHBondContact O-N 3.19Å; I159-G173 WeakPolarHBondContact CD1-O 3.28Å; I159-G173 PolarHBondContact N-O 2.92Å; I159-G173 PolarHBondContact O-N 2.93Å; I159-Y180 HydrophobicContact CB-CD1 4.29Å; I159-Y180 HydrophobicContact CB-CG 4.47Å; I159-Y180 HydrophobicContact CD1-CD1 4.33Å; I159-Y180 HydrophobicContact CD1-CD2 3.72Å; I159-Y180 HydrophobicContact CD1-CE2 4.42Å; I159-Y180 HydrophobicContact CD1-CG 3.67Å; I159-Y180 HydrophobicContact CG1-CD1 4.15Å; I159-Y180 HydrophobicContact CG1-CD2 4.42Å; I159-Y180 HydrophobicContact CG1-CG 3.87Å; I159-Y180 HydrophobicContact CG2-CD1 4.22Å; I159-V195 HydrophobicContact CG1-CG1 4.37Å; I159-V195 HydrophobicContact CG1-CG2 4.12Å; I159-V195 HydrophobicContact CG2-CG2 4.3Å
160	Q	94.4	Very high	82.6	Confident	19 Å²	19	60 Å²	60	9%	0.089	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.5	178.3	-65.4	-177.4	-1.5	0	0	111.4	E158 W169 L170 P171 F193 R194 L196	E158-Q160 HydrophobicContact CG-CG 4.49Å; E158-Q160 PolarHBondContact OE1-NE2 3.13Å; Q160-W169 HydrophobicContact CB-CB 4.37Å; Q160-W169 HydrophobicContact CB-CE3 4.08Å; Q160-L170 CarbonylContact C-O 3.59Å; Q160-L170 VanDerWaalsContact CA-O 3.28Å; Q160-L170 WeakPolarHBondContact CA-O 3.27Å; Q160-P171 HydrophobicContact CG-CB 4.41Å; Q160-F193 WeakPolarHBondContact O-CA 3.46Å; Q160-R194 HydrophobicContact CB-CG 3.99Å; Q160-R194 PolarHBondContact N-O 3.26Å; Q160-R194 PolarHBondContact O-N 2.69Å; Q160-L196 HydrophobicContact CB-CD1 4.43Å; Q160-L196 VanDerWaalsContact CD-CD1 3.49Å; Q160-L196 HydrophobicContact CG-CD1 3.83Å
161	C	90.7	Very high	84.1	Confident	11 Å²	11	59.6 Å²	59.6	7%	0.074	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	151.2	178.1	177.9	0	0	0	0	111	L170 I172 E192 F193	C161-L170 PolarHBondContact N-O 2.92Å; C161-L170 PolarHBondContact O-N 2.86Å; C161-I172 HydrophobicContact CB-CD1 3.86Å; C161-I172 HydrophobicContact CB-CG1 4.17Å; C161-I172 HydrophobicContact CB-CG2 3.74Å; C161-E192 CarbonylContact C-O 3.55Å; C161-E192 VanDerWaalsContact CA-O 3.3Å; C161-E192 WeakPolarHBondContact CA-O 3.3Å; C161-F193 HydrophobicContact CB-CD1 3.69Å; C161-F193 HydrophobicContact CB-CE1 3.62Å; C161-F193 WeakPolarHBondContact SG-CE1 3.33Å
162	R	90.7	Very high	85.3	Confident	46 Å²	46	59.3 Å²	59.3	17%	0.174	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	146.6	161.1	62.8	-174.2	-167.7	163.8	10.1	110.6	K166 M167 A168 W169 Y191 E192	R162-K166 VanDerWaalsContact CD-O 3.26Å; R162-K166 WeakPolarHBondContact CD-O 3.49Å; R162-K166 PolarHBondContact NE-O 3.03Å; R162-K166 PolarHBondContact NH1-O 3.27Å; R162-M167 PolarHBondContact NH1-O 2.94Å; R162-A168 VanDerWaalsContact CB-O 3.28Å; R162-A168 WeakPolarHBondContact CB-O 3.45Å; R162-W169 HydrophobicContact CB-CD2 4.48Å; R162-W169 HydrophobicContact CB-CE3 4.39Å; R162-W169 VanDerWaalsContact CD-CE2 3.42Å; R162-W169 HydrophobicContact CG-CD2 4.01Å; R162-W169 HydrophobicContact CG-CE3 3.98Å; R162-W169 HydrophobicContact CG-CH2 4.19Å; R162-W169 HydrophobicContact CG-CZ2 4.2Å; R162-W169 HydrophobicContact CG-CZ3 4.07Å; R162-Y191 CarbonylContact O-C 3.48Å; R162-Y191 WeakPolarHBondContact O-CA 3.31Å; R162-E192 HydrophobicContact CG-CB 3.91Å; R162-E192 HydrophobicContact CG-CG 4.48Å; R162-E192 IonicContact CZ-OE1 2.69Å; R162-E192 IonicContact CZ-OE2 3.8Å; R162-E192 VanDerWaalsContact CZ-OE2 3.22Å; R162-E192 PolarHBondContact N-O 3.15Å; R162-E192 VanDerWaalsContact NE-CD 3.35Å; R162-E192 IonicContact NE-OE1 3.34Å; R162-E192 IonicContact NE-OE2 3.27Å; R162-E192 PolarHBondContact NE-OE2 2.77Å; R162-E192 IonicContact NH2-OE1 2.77Å; R162-E192 PolarHBondContact NH2-OE1 2.69Å; R162-E192 IonicContact NH2-OE2 3.13Å; R162-E192 PolarHBondContact NH2-OE2 3.07Å; R162-E192 PolarHBondContact O-N 3.46Å
163	P	84.3	Confident	86.8	Confident	58 Å²	58	57.8 Å²	57.8	38%	0.377	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	137.5	162.7	-18.2	31.5	0	0	0	109.3	G165 K166 S190 Y191	P163-G165 PolarHBondContact O-N 3Å; P163-K166 HydrophobicContact CB-CG 4.12Å; P163-K166 HydrophobicContact CG-CG 4.33Å; P163-K166 WeakPolarHBondContact O-CB 3.4Å; P163-K166 PolarHBondContact O-N 2.84Å; P163-S190 WeakPolarHBondContact CA-O 3.42Å; P163-Y191 HydrophobicContact CG-CE1 4.48Å
164	S	76.1	Confident	87.7	Confident	43 Å²	43	59 Å²	59	30%	0.301	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	136.6	-175.1	-54.3	0	0	0	0	111.7	K166 S190 Y191 E192	S164-K166 VanDerWaalsContact C-N 3.28Å; S164-K166 PolarHBondContact O-N 2.95Å; S164-S190 PolarHBondContact N-O 3.17Å; S164-S190 WeakPolarHBondContact OG-CB 3.43Å; S164-S190 PolarHBondContact OG-O 3.04Å; S164-Y191 PolarHBondContact OG-N 3.05Å; S164-E192 WeakPolarHBondContact CA-OE1 3.44Å
165	G	71.9	Confident	88.1	Confident	72 Å²	72	57.4 Å²	57.4	74%	0.742	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	0	-176.6	0	0	0	0	0	115.7	P163 E192	P163-G165 PolarHBondContact O-N 3Å; G165-E192 PolarHBondContact N-OE1 2.84Å
166	K	79.1	Confident	88.2	Confident	137 Å²	137	58.9 Å²	58.9	60%	0.596	34%	0.342	S	S	*	.			trans	-82.2	145.7	161.1	-63.4	-59.5	-177.1	-173.8	0	109.8	R162 P163 S164	R162-K166 VanDerWaalsContact CD-O 3.26Å; R162-K166 WeakPolarHBondContact CD-O 3.49Å; R162-K166 PolarHBondContact NE-O 3.03Å; R162-K166 PolarHBondContact NH1-O 3.27Å; P163-K166 HydrophobicContact CB-CG 4.12Å; P163-K166 HydrophobicContact CG-CG 4.33Å; P163-K166 WeakPolarHBondContact O-CB 3.4Å; P163-K166 PolarHBondContact O-N 2.84Å; S164-K166 VanDerWaalsContact C-N 3.28Å; S164-K166 PolarHBondContact O-N 2.95Å
167	M	74.1	Confident	87.9	Confident	172 Å²	172	61.4 Å²	61.4	85%	0.847	36%	0.359	S	S	*	.	S	Bend	trans	-78.3	-50	179.4	-67.2	-167.9	77.8	0	0	112.5	R162	R162-M167 PolarHBondContact NH1-O 2.94Å
168	A	81.5	Confident	87.6	Confident	72 Å²	72	62.4 Å²	62.4	60%	0.595	37%	0.368	S	S	*	.			trans	-68.8	134.6	-175.4	0	0	0	0	0	112.3	R162	R162-A168 VanDerWaalsContact CB-O 3.28Å; R162-A168 WeakPolarHBondContact CB-O 3.45Å
169	W	90.1	Very high	87.4	Confident	48 Å²	48	64.9 Å²	64.9	18%	0.182	38%	0.378	C	S	.	.			trans	-90.3	140.5	168.2	-69.3	85.9	0	0	0	109.6	Q160 R162 E192 R194 R209	Q160-W169 HydrophobicContact CB-CB 4.37Å; Q160-W169 HydrophobicContact CB-CE3 4.08Å; R162-W169 HydrophobicContact CB-CD2 4.48Å; R162-W169 HydrophobicContact CB-CE3 4.39Å; R162-W169 VanDerWaalsContact CD-CE2 3.42Å; R162-W169 HydrophobicContact CG-CD2 4.01Å; R162-W169 HydrophobicContact CG-CE3 3.98Å; R162-W169 HydrophobicContact CG-CH2 4.19Å; R162-W169 HydrophobicContact CG-CZ2 4.2Å; R162-W169 HydrophobicContact CG-CZ3 4.07Å; W169-E192 HydrophobicContact CH2-CB 3.7Å; W169-E192 HydrophobicContact CZ2-CB 4.43Å; W169-E192 HydrophobicContact CZ3-CB 4.2Å; W169-E192 VanDerWaalsContact CZ3-O 3.26Å; W169-E192 WeakPolarHBondContact CZ3-O 3.36Å; W169-R194 HydrophobicContact CD2-CG 4.18Å; W169-R194 VanDerWaalsContact CD2-NE 3.35Å; W169-R194 HydrophobicContact CE3-CG 3.69Å; W169-R194 HydrophobicContact CH2-CB 4.07Å; W169-R194 HydrophobicContact CH2-CG 4.01Å; W169-R194 HydrophobicContact CZ2-CG 4.47Å; W169-R194 HydrophobicContact CZ3-CB 3.95Å; W169-R194 HydrophobicContact CZ3-CG 3.59Å; W169-R209 HydrophobicContact CH2-CB 4.15Å; W169-R209 HydrophobicContact CZ2-CB 4.48Å
170	L	87.3	Confident	87.1	Confident	107 Å²	107	67.6 Å²	67.6	56%	0.56	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.7	177.7	-59.9	174.7	0	0	0	109	Q160 C161 I172	Q160-L170 CarbonylContact C-O 3.59Å; Q160-L170 VanDerWaalsContact CA-O 3.28Å; Q160-L170 WeakPolarHBondContact CA-O 3.27Å; C161-L170 PolarHBondContact N-O 2.92Å; C161-L170 PolarHBondContact O-N 2.86Å; L170-I172 PolarHBondContact O-N 2.96Å
171	P	91.9	Very high	87	Confident	86 Å²	86	69.9 Å²	69.9	56%	0.558	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	127.7	167.4	27.7	-32.6	0	0	0	109.2	E158 Q160	E158-P171 HydrophobicContact CG-CB 4.19Å; Q160-P171 HydrophobicContact CG-CB 4.41Å
172	I	91.2	Very high	86.9	Confident	62 Å²	62	69.7 Å²	69.7	32%	0.318	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-18.9	177.9	54.5	163.5	0	0	0	112.6	I159 C161 L170 Y180 V182 F193	I159-I172 HydrophobicContact CB-CG1 4.19Å; I159-I172 HydrophobicContact CG2-CD1 3.86Å; I159-I172 HydrophobicContact CG2-CG1 3.86Å; I159-I172 VanDerWaalsContact O-CG1 3.26Å; I159-I172 WeakPolarHBondContact O-CG1 3.3Å; I159-I172 PolarHBondContact O-N 3.19Å; C161-I172 HydrophobicContact CB-CD1 3.86Å; C161-I172 HydrophobicContact CB-CG1 4.17Å; C161-I172 HydrophobicContact CB-CG2 3.74Å; L170-I172 PolarHBondContact O-N 2.96Å; I172-Y180 HydrophobicContact CD1-CE1 4.19Å; I172-Y180 HydrophobicContact CG1-CE1 4.41Å; I172-Y180 PolarHBondContact O-OH 3.14Å; I172-V182 HydrophobicContact CD1-CB 4.28Å; I172-V182 HydrophobicContact CD1-CG1 3.79Å; I172-V182 HydrophobicContact CD1-CG2 3.58Å; I172-F193 HydrophobicContact CD1-CD1 4.21Å; I172-F193 HydrophobicContact CD1-CE1 4.02Å
173	G	90.3	Very high	86.6	Confident	20 Å²	20	72 Å²	72	21%	0.206	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.7	175.3	169.3	0	0	0	0	0	113.2	I159	I159-G173 WeakPolarHBondContact CD1-O 3.28Å; I159-G173 PolarHBondContact N-O 2.92Å; I159-G173 PolarHBondContact O-N 2.93Å
174	E	93.3	Very high	86.3	Confident	93 Å²	93	72.5 Å²	72.5	44%	0.435	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	153.5	164.6	-73	-173.4	-137.5	0	0	110.5	S156 Y157 E158 K198	S156-E174 PolarHBondContact OG-OE2 3.34Å; Y157-E174 CarbonylContact O-C 3.53Å; Y157-E174 WeakPolarHBondContact O-CA 3.46Å; Y157-E174 WeakPolarHBondContact O-CB 3.38Å; E158-E174 HydrophobicContact CB-CG 4.26Å; E158-E174 HydrophobicContact CG-CG 4.32Å; E174-K198 IonicContact OE1-NZ 2.72Å; E174-K198 PolarHBondContact OE1-NZ 3.23Å; E174-K198 IonicContact OE2-NZ 3.99Å; E174-K198 PolarHBondContact OE2-NZ 3.22Å
175	S	91.5	Very high	86.6	Confident	19 Å²	19	71.6 Å²	71.6	13%	0.133	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	143.8	172	-167.7	0	0	0	0	111.1	S156 Y157 S177 F179	S156-S175 CarbonylContact C-O 3.5Å; S156-S175 VanDerWaalsContact CA-O 3.31Å; S156-S175 WeakPolarHBondContact CA-O 3.41Å; S156-S175 WeakPolarHBondContact CB-O 3.31Å; Y157-S175 PolarHBondContact N-O 2.81Å; Y157-S175 PolarHBondContact O-N 3.17Å; S175-S177 WeakPolarHBondContact CB-O 3.16Å; S175-S177 PolarHBondContact OG-N 3.14Å; S175-S177 PolarHBondContact OG-O 2.79Å; S175-S177 VanDerWaalsContact OG-O 3.12Å; S175-S177 PolarHBondContact OG-OG 3.47Å; S175-F179 VanDerWaalsContact CB-O 3.3Å; S175-F179 WeakPolarHBondContact CB-O 3.35Å; S175-F179 PolarHBondContact OG-O 3.2Å
176	T	90.3	Very high	86.7	Confident	125 Å²	125	77.7 Å²	77.7	77%	0.767	42%	0.423	S	S	*	.	S	Bend	trans	-89.9	-5.5	172.5	53.1	0	0	0	0	113
177	S	88.3	Confident	86.1	Confident	59 Å²	59	74.4 Å²	74.4	41%	0.413	42%	0.421	S	S	.	.	S	Bend	trans	-115.9	164.1	172.5	62.6	0	0	0	0	110.4	W142 Y157 S175 F179	W142-S177 WeakPolarHBondContact CZ2-O 3.19Å; Y157-S177 VanDerWaalsContact CD2-O 3.31Å; Y157-S177 WeakPolarHBondContact CD2-O 3.3Å; S175-S177 WeakPolarHBondContact CB-O 3.16Å; S175-S177 PolarHBondContact OG-N 3.14Å; S175-S177 PolarHBondContact OG-O 2.79Å; S175-S177 VanDerWaalsContact OG-O 3.12Å; S175-S177 PolarHBondContact OG-OG 3.47Å; S177-F179 PolarHBondContact O-N 2.85Å
178	S	90.7	Very high	86	Confident	31 Å²	31	73.6 Å²	73.6	22%	0.217	42%	0.415	C	S	.	.	S	Bend	trans	-78.2	40.2	178.5	-46.1	0	0	0	0	113.8	C141 W142 Y157	C141-S178 WeakPolarHBondContact CA-O 3.47Å; W142-S178 VanDerWaalsContact CE2-CA 3.43Å; W142-S178 PolarHBondContact N-O 2.94Å; W142-S178 WeakPolarHBondContact O-CB 3.47Å; Y157-S178 WeakPolarHBondContact CE2-OG 3.39Å; Y157-S178 PolarHBondContact OH-OG 3Å
179	F	91.4	Very high	85.8	Confident	82 Å²	82	70.9 Å²	70.9	36%	0.36	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	141.3	-175.6	172.7	-82.2	0	0	0	109.8	S139 L140 W142 S175 S177 R181	S139-F179 WeakPolarHBondContact OG-CZ 3.34Å; L140-F179 CarbonylContact O-C 3.59Å; L140-F179 VanDerWaalsContact O-CA 3.27Å; L140-F179 WeakPolarHBondContact O-CA 3.49Å; W142-F179 VanDerWaalsContact CH2-C 3.45Å; S175-F179 VanDerWaalsContact CB-O 3.3Å; S175-F179 WeakPolarHBondContact CB-O 3.35Å; S175-F179 PolarHBondContact OG-O 3.2Å; S177-F179 PolarHBondContact O-N 2.85Å; F179-R181 HydrophobicContact CE1-CB 4.41Å
180	Y	90.4	Very high	85.5	Confident	58 Å²	58	70.5 Å²	70.5	23%	0.227	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	131	169.1	-174.8	-94.4	0	0	0	112.9	L140 I159 I172 V182	L140-Y180 PolarHBondContact N-O 3.03Å; L140-Y180 PolarHBondContact O-N 3.07Å; I159-Y180 HydrophobicContact CB-CD1 4.29Å; I159-Y180 HydrophobicContact CB-CG 4.47Å; I159-Y180 HydrophobicContact CD1-CD1 4.33Å; I159-Y180 HydrophobicContact CD1-CD2 3.72Å; I159-Y180 HydrophobicContact CD1-CE2 4.42Å; I159-Y180 HydrophobicContact CD1-CG 3.67Å; I159-Y180 HydrophobicContact CG1-CD1 4.15Å; I159-Y180 HydrophobicContact CG1-CD2 4.42Å; I159-Y180 HydrophobicContact CG1-CG 3.87Å; I159-Y180 HydrophobicContact CG2-CD1 4.22Å; I172-Y180 HydrophobicContact CD1-CE1 4.19Å; I172-Y180 HydrophobicContact CG1-CE1 4.41Å; I172-Y180 PolarHBondContact O-OH 3.14Å; Y180-V182 HydrophobicContact CD1-CG2 3.95Å; Y180-V182 HydrophobicContact CE1-CG2 4.2Å
181	R	91.5	Very high	85.5	Confident	66 Å²	66	66.7 Å²	66.7	25%	0.249	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	108.3	175.6	-170	79.8	-172.2	177.8	-0.2	110.6	E132 D134 G137 I138 S139 F179 T183	E132-R181 PolarHBondContact O-NH1 3.48Å; E132-R181 IonicContact OE2-NH1 3.07Å; D134-R181 IonicContact OD1-CZ 3.14Å; D134-R181 IonicContact OD1-NH2 3.28Å; D134-R181 PolarHBondContact OD1-NH2 2.67Å; D134-R181 IonicContact OD2-NH2 2.69Å; G137-R181 PolarHBondContact O-NH2 3.09Å; I138-R181 CarbonylContact O-C 3.42Å; I138-R181 WeakPolarHBondContact O-CA 3.47Å; I138-R181 WeakPolarHBondContact O-CD 3.4Å; S139-R181 VanDerWaalsContact OG-CD 3.26Å; S139-R181 WeakPolarHBondContact OG-CD 3.4Å; S139-R181 PolarHBondContact OG-NH1 3.44Å; F179-R181 HydrophobicContact CE1-CB 4.41Å; R181-T183 HydrophobicContact CG-CG2 4.13Å
182	V	88.3	Confident	85.5	Confident	7 Å²	7	63.3 Å²	63.3	4%	0.042	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	137.8	169.1	-172.5	0	0	0	0	109.1	G137 I138 L140 I172 Y180 L185 F193	G137-V182 CarbonylContact C-O 3.55Å; G137-V182 VanDerWaalsContact CA-O 3.29Å; G137-V182 WeakPolarHBondContact CA-O 3.44Å; I138-V182 HydrophobicContact CG1-CB 3.81Å; I138-V182 HydrophobicContact CG1-CG2 4.18Å; I138-V182 PolarHBondContact N-O 3.38Å; I138-V182 PolarHBondContact O-N 3.33Å; L140-V182 HydrophobicContact CD1-CG2 3.6Å; L140-V182 HydrophobicContact CG-CG2 3.95Å; I172-V182 HydrophobicContact CD1-CB 4.28Å; I172-V182 HydrophobicContact CD1-CG1 3.79Å; I172-V182 HydrophobicContact CD1-CG2 3.58Å; Y180-V182 HydrophobicContact CD1-CG2 3.95Å; Y180-V182 HydrophobicContact CE1-CG2 4.2Å; V182-L185 HydrophobicContact CG1-CD2 3.86Å; V182-L185 HydrophobicContact CG1-CG 4.27Å; V182-F193 HydrophobicContact CB-CE1 4.35Å; V182-F193 HydrophobicContact CG1-CE1 3.82Å; V182-F193 HydrophobicContact CG1-CZ 4.13Å; V182-F193 HydrophobicContact CG2-CD1 4.3Å; V182-F193 HydrophobicContact CG2-CE1 3.88Å; V182-F193 HydrophobicContact CG2-CZ 4.49Å
183	T	85.4	Confident	85.6	Confident	94 Å²	94	60.4 Å²	60.4	58%	0.577	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136	169.3	176.1	57.7	0	0	0	0	111.2	K136 R181 L185	K136-T183 VanDerWaalsContact O-CA 3.3Å; K136-T183 WeakPolarHBondContact O-CA 3.33Å; K136-T183 WeakPolarHBondContact O-CB 3.31Å; R181-T183 HydrophobicContact CG-CG2 4.13Å; T183-L185 VanDerWaalsContact C-N 3.35Å; T183-L185 PolarHBondContact O-N 2.98Å
184	G	78.6	Confident	85.8	Confident	70 Å²	70	62.1 Å²	62.1	72%	0.722	34%	0.34	S	S	*	.			trans	75.5	20.6	176.6	0	0	0	0	0	114.9	K136	K136-G184 PolarHBondContact O-N 3.46Å
185	L	80.7	Confident	85.9	Confident	24 Å²	24	57.7 Å²	57.7	13%	0.126	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-66.5	144.9	170.8	-57	-176.2	0	0	0	110.2	I138 V182 T183 Y191 F193 Y212 H214	I138-L185 HydrophobicContact CD1-CD1 4.19Å; I138-L185 HydrophobicContact CG1-CD1 4.19Å; I138-L185 HydrophobicContact CG2-CD1 4.44Å; V182-L185 HydrophobicContact CG1-CD2 3.86Å; V182-L185 HydrophobicContact CG1-CG 4.27Å; T183-L185 VanDerWaalsContact C-N 3.35Å; T183-L185 PolarHBondContact O-N 2.98Å; L185-Y191 HydrophobicContact CB-CD2 4.48Å; L185-Y191 HydrophobicContact CB-CE2 3.86Å; L185-Y191 HydrophobicContact CD1-CD2 4.46Å; L185-Y191 HydrophobicContact CD2-CD1 4.13Å; L185-Y191 HydrophobicContact CD2-CD2 4.01Å; L185-Y191 HydrophobicContact CD2-CE1 3.97Å; L185-Y191 HydrophobicContact CD2-CE2 3.86Å; L185-Y191 HydrophobicContact CD2-CG 4.14Å; L185-Y191 HydrophobicContact CG-CE2 4.32Å; L185-F193 HydrophobicContact CD1-CZ 4.23Å; L185-F193 HydrophobicContact CD2-CZ 4.05Å; L185-Y212 HydrophobicContact CD1-CD1 4.11Å; L185-Y212 HydrophobicContact CD1-CE1 3.72Å; L185-H214 HydrophobicContact CB-CB 4.34Å
186	R	74.8	Confident	86.2	Confident	200 Å²	200	57.3 Å²	57.3	76%	0.755	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-80.6	134.1	173.4	-64.9	-178.4	-179.9	-173.5	-0.8	108.9	G189 Y191 H214	R186-G189 WeakPolarHBondContact O-CA 3.41Å; R186-G189 PolarHBondContact O-N 3.45Å; R186-Y191 PolarHBondContact N-OH 3.45Å; R186-H214 PolarHBondContact O-CD2 3.03Å
187	A	67.3	Low	86.3	Confident	67 Å²	67	51.4 Å²	51.4	55%	0.554	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	139.3	171.2	0	0	0	0	0	110.5	G189	A187-G189 PolarHBondContact O-N 2.85Å; A187-G189 VanDerWaalsContact O-N 3.1Å
188	Q	70.7	Confident	86.5	Confident	155 Å²	155	51.4 Å²	51.4	72%	0.724	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	6.9	-170.3	-56.3	-179	-25.3	0	0	115.1	S190 H214 V216	Q188-S190 PolarHBondContact O-N 3.23Å; Q188-H214 VanDerWaalsContact CA-O 3.26Å; Q188-H214 WeakPolarHBondContact CA-O 3.46Å; Q188-H214 PolarHBondContact N-O 3.34Å; Q188-V216 HydrophobicContact CG-CG2 3.54Å
189	G	78.3	Confident	86.4	Confident	16 Å²	16	50.1 Å²	50.1	17%	0.165	26%	0.263	C	S	.	.			trans	-70.6	127.3	174.6	0	0	0	0	0	111.2	R186 A187 Y191 H214	R186-G189 WeakPolarHBondContact O-CA 3.41Å; R186-G189 PolarHBondContact O-N 3.45Å; A187-G189 PolarHBondContact O-N 2.85Å; A187-G189 VanDerWaalsContact O-N 3.1Å; G189-Y191 VanDerWaalsContact O-CD2 3.29Å; G189-Y191 WeakPolarHBondContact O-CD2 3.32Å; G189-H214 PolarHBondContact O-N 2.93Å
190	S	84.3	Confident	86.1	Confident	40 Å²	40	49.8 Å²	49.8	28%	0.28	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	128.7	167.1	-57.6	0	0	0	0	109.4	P163 S164 Q188 Q213	P163-S190 WeakPolarHBondContact CA-O 3.42Å; S164-S190 PolarHBondContact N-O 3.17Å; S164-S190 WeakPolarHBondContact OG-CB 3.43Å; S164-S190 PolarHBondContact OG-O 3.04Å; Q188-S190 PolarHBondContact O-N 3.23Å; S190-Q213 PolarHBondContact OG-NE2 2.75Å
191	Y	86.3	Confident	85.8	Confident	27 Å²	27	50.3 Å²	50.3	11%	0.106	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	155.3	-176.7	-67	-85.3	0	0	0	110.8	R162 P163 S164 L185 R186 G189 F193 Y212	R162-Y191 CarbonylContact O-C 3.48Å; R162-Y191 WeakPolarHBondContact O-CA 3.31Å; P163-Y191 HydrophobicContact CG-CE1 4.48Å; S164-Y191 PolarHBondContact OG-N 3.05Å; L185-Y191 HydrophobicContact CB-CD2 4.48Å; L185-Y191 HydrophobicContact CB-CE2 3.86Å; L185-Y191 HydrophobicContact CD1-CD2 4.46Å; L185-Y191 HydrophobicContact CD2-CD1 4.13Å; L185-Y191 HydrophobicContact CD2-CD2 4.01Å; L185-Y191 HydrophobicContact CD2-CE1 3.97Å; L185-Y191 HydrophobicContact CD2-CE2 3.86Å; L185-Y191 HydrophobicContact CD2-CG 4.14Å; L185-Y191 HydrophobicContact CG-CE2 4.32Å; R186-Y191 PolarHBondContact N-OH 3.45Å; G189-Y191 VanDerWaalsContact O-CD2 3.29Å; G189-Y191 WeakPolarHBondContact O-CD2 3.32Å; Y191-F193 HydrophobicContact CG-CZ 4.4Å; Y191-Y212 PolarHBondContact N-O 3.47Å; Y191-Y212 PolarHBondContact O-N 2.87Å
192	E	91.9	Very high	85.5	Confident	15 Å²	15	48.5 Å²	48.5	7%	0.07	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133	170.1	-56.6	173	-137.1	0	0	108.2	C161 R162 S164 G165 W169 R209 L210 V211	C161-E192 CarbonylContact C-O 3.55Å; C161-E192 VanDerWaalsContact CA-O 3.3Å; C161-E192 WeakPolarHBondContact CA-O 3.3Å; R162-E192 HydrophobicContact CG-CB 3.91Å; R162-E192 HydrophobicContact CG-CG 4.48Å; R162-E192 IonicContact CZ-OE1 2.69Å; R162-E192 IonicContact CZ-OE2 3.8Å; R162-E192 VanDerWaalsContact CZ-OE2 3.22Å; R162-E192 PolarHBondContact N-O 3.15Å; R162-E192 VanDerWaalsContact NE-CD 3.35Å; R162-E192 IonicContact NE-OE1 3.34Å; R162-E192 IonicContact NE-OE2 3.27Å; R162-E192 PolarHBondContact NE-OE2 2.77Å; R162-E192 IonicContact NH2-OE1 2.77Å; R162-E192 PolarHBondContact NH2-OE1 2.69Å; R162-E192 IonicContact NH2-OE2 3.13Å; R162-E192 PolarHBondContact NH2-OE2 3.07Å; R162-E192 PolarHBondContact O-N 3.46Å; S164-E192 WeakPolarHBondContact CA-OE1 3.44Å; G165-E192 PolarHBondContact N-OE1 2.84Å; W169-E192 HydrophobicContact CH2-CB 3.7Å; W169-E192 HydrophobicContact CZ2-CB 4.43Å; W169-E192 HydrophobicContact CZ3-CB 4.2Å; W169-E192 VanDerWaalsContact CZ3-O 3.26Å; W169-E192 WeakPolarHBondContact CZ3-O 3.36Å; E192-R209 WeakPolarHBondContact OE2-CD 3.45Å; E192-R209 IonicContact OE2-NE 3.65Å; E192-L210 CarbonylContact C-O 3.54Å; E192-L210 WeakPolarHBondContact CA-O 3.44Å; E192-V211 HydrophobicContact CG-CG2 4.36Å
193	F	92.6	Very high	85.6	Confident	0 Å²	0	51 Å²	51	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148.1	178.5	-61.2	-80.1	0	0	0	110.9	L128 I138 L140 Q160 C161 I172 V182 L185 Y191 R209 L210 Y212	L128-F193 HydrophobicContact CD2-CB 4.39Å; I138-F193 HydrophobicContact CD1-CD2 4.14Å; I138-F193 HydrophobicContact CD1-CE2 3.52Å; I138-F193 HydrophobicContact CD1-CZ 3.78Å; L140-F193 HydrophobicContact CD1-CB 4Å; L140-F193 HydrophobicContact CD1-CD1 3.87Å; L140-F193 HydrophobicContact CD1-CG 3.93Å; Q160-F193 WeakPolarHBondContact O-CA 3.46Å; C161-F193 HydrophobicContact CB-CD1 3.69Å; C161-F193 HydrophobicContact CB-CE1 3.62Å; C161-F193 WeakPolarHBondContact SG-CE1 3.33Å; I172-F193 HydrophobicContact CD1-CD1 4.21Å; I172-F193 HydrophobicContact CD1-CE1 4.02Å; V182-F193 HydrophobicContact CB-CE1 4.35Å; V182-F193 HydrophobicContact CG1-CE1 3.82Å; V182-F193 HydrophobicContact CG1-CZ 4.13Å; V182-F193 HydrophobicContact CG2-CD1 4.3Å; V182-F193 HydrophobicContact CG2-CE1 3.88Å; V182-F193 HydrophobicContact CG2-CZ 4.49Å; L185-F193 HydrophobicContact CD1-CZ 4.23Å; L185-F193 HydrophobicContact CD2-CZ 4.05Å; Y191-F193 HydrophobicContact CG-CZ 4.4Å; F193-R209 CarbonylContact O-C 3.54Å; F193-R209 WeakPolarHBondContact O-CA 3.47Å; F193-L210 HydrophobicContact CB-CB 4.37Å; F193-L210 PolarHBondContact N-O 3.39Å; F193-L210 PolarHBondContact O-N 3.34Å; F193-Y212 HydrophobicContact CE2-CD1 4.15Å; F193-Y212 HydrophobicContact CE2-CG 4.42Å
194	R	96	Very high	85.8	Confident	56 Å²	56	46.9 Å²	46.9	21%	0.211	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	156	168.9	72.8	-169.9	-171.3	168.1	2.4	109.8	Q160 W169 L196 P206 S207	Q160-R194 HydrophobicContact CB-CG 3.99Å; Q160-R194 PolarHBondContact N-O 3.26Å; Q160-R194 PolarHBondContact O-N 2.69Å; W169-R194 HydrophobicContact CD2-CG 4.18Å; W169-R194 VanDerWaalsContact CD2-NE 3.35Å; W169-R194 HydrophobicContact CE3-CG 3.69Å; W169-R194 HydrophobicContact CH2-CB 4.07Å; W169-R194 HydrophobicContact CH2-CG 4.01Å; W169-R194 HydrophobicContact CZ2-CG 4.47Å; W169-R194 HydrophobicContact CZ3-CB 3.95Å; W169-R194 HydrophobicContact CZ3-CG 3.59Å; R194-L196 HydrophobicContact CG-CD1 4.27Å; R194-P206 HydrophobicContact CB-CB 4.29Å; R194-P206 HydrophobicContact CG-CB 4Å; R194-S207 WeakPolarHBondContact CA-OG 3.36Å
195	V	95.2	Very high	86.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	141.9	179.8	-173.7	0	0	0	0	110.1	P125 L128 W142 Y157 E158 I159 P206 S207	P125-V195 WeakPolarHBondContact CD-O 3.19Å; P125-V195 HydrophobicContact CG-CB 4.16Å; P125-V195 HydrophobicContact CG-CG1 3.98Å; L128-V195 HydrophobicContact CD1-CG2 3.72Å; L128-V195 HydrophobicContact CD2-CG2 4.06Å; W142-V195 HydrophobicContact CD2-CB 4.39Å; W142-V195 HydrophobicContact CD2-CG1 4.12Å; W142-V195 HydrophobicContact CD2-CG2 4.02Å; W142-V195 HydrophobicContact CE3-CG2 3.8Å; W142-V195 HydrophobicContact CH2-CG1 4.34Å; W142-V195 HydrophobicContact CH2-CG2 4.36Å; W142-V195 HydrophobicContact CZ2-CG1 3.86Å; W142-V195 HydrophobicContact CZ3-CG2 3.98Å; Y157-V195 HydrophobicContact CD1-CG1 4.04Å; Y157-V195 HydrophobicContact CG-CG1 4.18Å; E158-V195 CarbonylContact O-C 3.51Å; E158-V195 WeakPolarHBondContact O-CA 3.36Å; I159-V195 HydrophobicContact CG1-CG1 4.37Å; I159-V195 HydrophobicContact CG1-CG2 4.12Å; I159-V195 HydrophobicContact CG2-CG2 4.3Å; V195-P206 WeakPolarHBondContact O-CA 3.3Å; V195-S207 PolarHBondContact N-OG 3.49Å; V195-S207 WeakPolarHBondContact O-CB 3.23Å; V195-S207 PolarHBondContact O-N 2.97Å
196	L	96.5	Very high	86.9	Confident	12 Å²	12	47.5 Å²	47.5	6%	0.063	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	131.2	177.2	-63.1	80.1	0	0	0	108.3	Y157 E158 Q160 R194 L203 P206	Y157-L196 CarbonylContact C-O 3.59Å; Y157-L196 WeakPolarHBondContact CA-O 3.49Å; E158-L196 HydrophobicContact CB-CB 4.47Å; E158-L196 PolarHBondContact N-O 3.28Å; E158-L196 PolarHBondContact O-N 2.9Å; Q160-L196 HydrophobicContact CB-CD1 4.43Å; Q160-L196 VanDerWaalsContact CD-CD1 3.49Å; Q160-L196 HydrophobicContact CG-CD1 3.83Å; R194-L196 HydrophobicContact CG-CD1 4.27Å; L196-L203 HydrophobicContact CB-CB 4.33Å; L196-L203 HydrophobicContact CB-CD2 3.97Å; L196-L203 HydrophobicContact CD2-CB 4.06Å; L196-L203 HydrophobicContact CD2-CD1 4.22Å; L196-P206 HydrophobicContact CD1-CB 4.05Å; L196-P206 HydrophobicContact CG-CB 3.93Å
197	A	93	Very high	87.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	138.5	173.8	0	0	0	0	0	110.3	P122 P125 P145 L154 Y157 L203 S204	P122-A197 HydrophobicContact CB-CB 3.69Å; P122-A197 HydrophobicContact CG-CB 4.06Å; P125-A197 HydrophobicContact CG-CB 4.02Å; P145-A197 HydrophobicContact CB-CB 4.49Å; P145-A197 HydrophobicContact CG-CB 3.84Å; L154-A197 HydrophobicContact CD1-CB 3.64Å; Y157-A197 HydrophobicContact CD1-CB 4.2Å; Y157-A197 HydrophobicContact CE1-CB 4.26Å; A197-L203 CarbonylContact O-C 3.56Å; A197-L203 WeakPolarHBondContact O-CA 3.34Å; A197-S204 PolarHBondContact N-OG 3.36Å; A197-S204 WeakPolarHBondContact O-CB 3.14Å; A197-S204 PolarHBondContact O-N 3.19Å
198	K	92.3	Very high	88.5	Confident	59 Å²	59	37.2 Å²	37.2	26%	0.257	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	122.2	-173.1	-163	-175.5	-172.5	178.9	0	110.9	L154 I155 S156 E174 G202 L203	L154-K198 WeakPolarHBondContact CD1-O 3.19Å; I155-K198 WeakPolarHBondContact CB-O 3.1Å; I155-K198 PolarHBondContact N-O 3.16Å; S156-K198 PolarHBondContact N-O 3.38Å; S156-K198 VanDerWaalsContact O-CB 3.28Å; S156-K198 WeakPolarHBondContact O-CB 3.46Å; S156-K198 PolarHBondContact O-N 3.22Å; S156-K198 WeakPolarHBondContact OG-CD 3.28Å; E174-K198 IonicContact OE1-NZ 2.72Å; E174-K198 PolarHBondContact OE1-NZ 3.23Å; E174-K198 IonicContact OE2-NZ 3.99Å; E174-K198 PolarHBondContact OE2-NZ 3.22Å; K198-G202 WeakPolarHBondContact CA-O 3.48Å; K198-L203 HydrophobicContact CB-CD2 3.76Å; K198-L203 HydrophobicContact CD-CD2 4.14Å; K198-L203 HydrophobicContact CG-CD2 3.73Å; K198-L203 HydrophobicContact CG-CG 4.42Å
199	N	89.1	Confident	89.4	Confident	5 Å²	5	34.1 Å²	34.1	3%	0.027	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	-170.7	166.6	71.3	9.8	0	0	0	110.5	S120 P122 S148 S153 L201 G202	S120-N199 PolarHBondContact O-ND2 3.38Å; P122-N199 HydrophobicContact CG-CB 3.82Å; S148-N199 PolarHBondContact O-ND2 3.34Å; S153-N199 WeakPolarHBondContact O-CB 3.38Å; N199-L201 PolarHBondContact O-N 3.22Å; N199-L201 VanDerWaalsContact OD1-CB 3.29Å; N199-L201 WeakPolarHBondContact OD1-CB 3.19Å; N199-L201 PolarHBondContact OD1-N 3.23Å; N199-G202 PolarHBondContact N-O 3.12Å; N199-G202 PolarHBondContact O-N 3.35Å; N199-G202 PolarHBondContact OD1-N 3.27Å
200	A	85.5	Confident	89.9	Confident	74 Å²	74	35 Å²	35	61%	0.612	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-10.7	-178.6	0	0	0	0	0	114.5	I155	I155-A200 HydrophobicContact CD1-CB 4.21Å
201	L	82.4	Confident	90	Very high	70 Å²	70	37.1 Å²	37.1	37%	0.366	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-20.2	-170.8	-54	162.9	0	0	0	112.1	H119 S120 V121 N199	H119-L201 HydrophobicContact CB-CD1 3.55Å; H119-L201 HydrophobicContact CB-CD2 3.51Å; H119-L201 HydrophobicContact CB-CG 4.07Å; S120-L201 WeakPolarHBondContact O-CD1 3.42Å; V121-L201 HydrophobicContact CG1-CB 4.46Å; N199-L201 PolarHBondContact O-N 3.22Å; N199-L201 VanDerWaalsContact OD1-CB 3.29Å; N199-L201 WeakPolarHBondContact OD1-CB 3.19Å; N199-L201 PolarHBondContact OD1-N 3.23Å
202	G	85.7	Confident	90	Very high	27 Å²	27	36.9 Å²	36.9	28%	0.278	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	152.5	-165.5	176.6	0	0	0	0	0	113.9	K198 N199	K198-G202 WeakPolarHBondContact CA-O 3.48Å; N199-G202 PolarHBondContact N-O 3.12Å; N199-G202 PolarHBondContact O-N 3.35Å; N199-G202 PolarHBondContact OD1-N 3.27Å
203	L	90	Very high	89.7	Confident	61 Å²	61	43 Å²	43	32%	0.319	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	144.6	174.3	-67.2	164.3	0	0	0	110.4	E158 L196 A197 K198	E158-L203 HydrophobicContact CB-CD2 3.89Å; E158-L203 WeakPolarHBondContact OE2-CD1 3.34Å; L196-L203 HydrophobicContact CB-CB 4.33Å; L196-L203 HydrophobicContact CB-CD2 3.97Å; L196-L203 HydrophobicContact CD2-CB 4.06Å; L196-L203 HydrophobicContact CD2-CD1 4.22Å; A197-L203 CarbonylContact O-C 3.56Å; A197-L203 WeakPolarHBondContact O-CA 3.34Å; K198-L203 HydrophobicContact CB-CD2 3.76Å; K198-L203 HydrophobicContact CD-CD2 4.14Å; K198-L203 HydrophobicContact CG-CD2 3.73Å; K198-L203 HydrophobicContact CG-CG 4.42Å
204	S	91.1	Very high	88.8	Confident	7 Å²	7	43.5 Å²	43.5	5%	0.049	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-64.6	170.6	170.4	70.9	0	0	0	0	112	P122 F123 A197	P122-S204 WeakPolarHBondContact O-CA 3.47Å; P122-S204 WeakPolarHBondContact O-CB 3.47Å; F123-S204 WeakPolarHBondContact O-CB 3.47Å; A197-S204 PolarHBondContact N-OG 3.36Å; A197-S204 WeakPolarHBondContact O-CB 3.14Å; A197-S204 PolarHBondContact O-N 3.19Å
205	A	90.2	Very high	87.5	Confident	59 Å²	59	43.2 Å²	43.2	49%	0.488	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-58.7	145.2	152.8	0	0	0	0	0	109.6	P124	P124-A205 WeakPolarHBondContact CA-O 3.39Å; P124-A205 WeakPolarHBondContact CB-O 3.47Å; P124-A205 HydrophobicContact CG-CB 4.03Å; P124-A205 WeakPolarHBondContact CG-O 3.38Å
206	P	92.3	Very high	85.7	Confident	48 Å²	48	47.3 Å²	47.3	31%	0.312	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-70.8	154.8	-176.7	29.4	-36	0	0	0	112.6	R194 V195 L196	R194-P206 HydrophobicContact CB-CB 4.29Å; R194-P206 HydrophobicContact CG-CB 4Å; V195-P206 WeakPolarHBondContact O-CA 3.3Å; L196-P206 HydrophobicContact CD1-CB 4.05Å; L196-P206 HydrophobicContact CG-CB 3.93Å
207	S	91.5	Very high	83.6	Confident	9 Å²	9	50.4 Å²	50.4	6%	0.063	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-54.5	162	168	74.9	0	0	0	0	112.2	P125 L128 R194 V195	P125-S207 WeakPolarHBondContact O-CA 3.38Å; P125-S207 WeakPolarHBondContact O-CB 3.26Å; L128-S207 WeakPolarHBondContact CD2-OG 3.36Å; R194-S207 WeakPolarHBondContact CA-OG 3.36Å; V195-S207 PolarHBondContact N-OG 3.49Å; V195-S207 WeakPolarHBondContact O-CB 3.23Å; V195-S207 PolarHBondContact O-N 2.97Å
208	C	83.2	Confident	81.1	Confident	42 Å²	42	56.1 Å²	56.1	28%	0.284	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-46.1	139.1	159.3	-74.8	0	0	0	0	111.1	D63 A64	D63-C208 PolarHBondContact OD2-SG 3.39Å; A64-C208 HydrophobicContact CB-CB 3.74Å; A64-C208 PolarHBondContact N-SG 2.87Å
209	R	90.4	Very high	78.7	Confident	90 Å²	90	63.9 Å²	63.9	34%	0.34	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-79.4	125.2	-175.7	75.2	179.5	-171.3	-87.5	0.2	110.9	W169 E192 F193	W169-R209 HydrophobicContact CH2-CB 4.15Å; W169-R209 HydrophobicContact CZ2-CB 4.48Å; E192-R209 WeakPolarHBondContact OE2-CD 3.45Å; E192-R209 IonicContact OE2-NE 3.65Å; F193-R209 CarbonylContact O-C 3.54Å; F193-R209 WeakPolarHBondContact O-CA 3.47Å
210	L	87.7	Confident	76.3	Confident	33 Å²	33	66.8 Å²	66.8	17%	0.173	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	113.3	172.5	173.7	65.3	0	0	0	108.9	L128 V130 L140 E192 F193	L128-L210 HydrophobicContact CD2-CB 3.88Å; L128-L210 HydrophobicContact CG-CB 3.93Å; L128-L210 HydrophobicContact CG-CD2 4.07Å; V130-L210 HydrophobicContact CG2-CD2 3.92Å; L140-L210 HydrophobicContact CD2-CD2 3.52Å; E192-L210 CarbonylContact C-O 3.54Å; E192-L210 WeakPolarHBondContact CA-O 3.44Å; F193-L210 HydrophobicContact CB-CB 4.37Å; F193-L210 PolarHBondContact N-O 3.39Å; F193-L210 PolarHBondContact O-N 3.34Å
211	V	88.1	Confident	73.8	Confident	86 Å²	86	69.1 Å²	69.1	52%	0.521	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	129.8	174.1	-171.5	0	0	0	0	108.6	E192	E192-V211 HydrophobicContact CG-CG2 4.36Å
212	Y	85.8	Confident	71.7	Confident	21 Å²	21	73.8 Å²	73.8	8%	0.082	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	130.6	-176.5	173.7	-102.7	0	0	0	110.9	V130 Q133 I138 L185 Y191 F193 H214 P215	V130-Y212 HydrophobicContact CG2-CD2 3.94Å; V130-Y212 HydrophobicContact CG2-CE2 4.37Å; Q133-Y212 PolarHBondContact OE1-OH 3.19Å; I138-Y212 HydrophobicContact CD1-CD1 4.01Å; I138-Y212 HydrophobicContact CD1-CE1 4.19Å; I138-Y212 HydrophobicContact CD1-CG 4.26Å; I138-Y212 HydrophobicContact CG2-CD1 4.46Å; I138-Y212 HydrophobicContact CG2-CE1 3.67Å; I138-Y212 HydrophobicContact CG2-CE2 3.93Å; I138-Y212 VanDerWaalsContact CG2-OH 3.3Å; I138-Y212 WeakPolarHBondContact CG2-OH 3.33Å; L185-Y212 HydrophobicContact CD1-CD1 4.11Å; L185-Y212 HydrophobicContact CD1-CE1 3.72Å; Y191-Y212 PolarHBondContact N-O 3.47Å; Y191-Y212 PolarHBondContact O-N 2.87Å; F193-Y212 HydrophobicContact CE2-CD1 4.15Å; F193-Y212 HydrophobicContact CE2-CG 4.42Å; Y212-H214 HydrophobicContact CD1-CB 4.42Å; Y212-H214 VanDerWaalsContact CE1-CA 3.46Å; Y212-H214 HydrophobicContact CE1-CB 3.65Å; Y212-H214 AromaticContact CE1-CG 3.98Å; Y212-H214 AromaticContact CE1-ND1 3.59Å; Y212-H214 AromaticContact CZ-ND1 3.75Å; Y212-H214 PolarHBondContact OH-ND1 2.92Å; Y212-P215 WeakPolarHBondContact OH-CD 3.29Å
213	Q	84.3	Confident	69	Low	144 Å²	144	81.7 Å²	81.7	67%	0.673	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	120.4	169.4	-64.9	-169.3	-44.6	0	0	108.9	S190 P215	S190-Q213 PolarHBondContact OG-NE2 2.75Å; Q213-P215 WeakPolarHBondContact O-CD 3.45Å
214	H	75.3	Confident	66.6	Low	10 Å²	10	82.1 Å²	82.1	5%	0.046	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-76	116.2	-179.5	-165.1	47.1	0	0	0	110.1	L185 R186 Q188 G189 Y212 F217	L185-H214 HydrophobicContact CB-CB 4.34Å; R186-H214 PolarHBondContact O-CD2 3.03Å; Q188-H214 VanDerWaalsContact CA-O 3.26Å; Q188-H214 WeakPolarHBondContact CA-O 3.46Å; Q188-H214 PolarHBondContact N-O 3.34Å; G189-H214 PolarHBondContact O-N 2.93Å; Y212-H214 HydrophobicContact CD1-CB 4.42Å; Y212-H214 VanDerWaalsContact CE1-CA 3.46Å; Y212-H214 HydrophobicContact CE1-CB 3.65Å; Y212-H214 AromaticContact CE1-CG 3.98Å; Y212-H214 AromaticContact CE1-ND1 3.59Å; Y212-H214 AromaticContact CZ-ND1 3.75Å; Y212-H214 PolarHBondContact OH-ND1 2.92Å; H214-F217 AromaticContact CE1-CE2 3.57Å
215	P	67.8	Low	64.2	Low	51 Å²	51	86.7 Å²	86.7	33%	0.331	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-72.3	170.8	-172.3	30.5	-34.6	0	0	0	112	Y212 Q213 F217	Y212-P215 WeakPolarHBondContact OH-CD 3.29Å; Q213-P215 WeakPolarHBondContact O-CD 3.45Å; P215-F217 HydrophobicContact CG-CD2 4.37Å; P215-F217 HydrophobicContact CG-CE2 3.68Å; P215-F217 HydrophobicContact CG-CZ 3.87Å; P215-F217 PolarHBondContact O-N 2.97Å
216	V	57.6	Low	62.5	Low	85 Å²	85	91.8 Å²	91.8	52%	0.515	52%	0.517	S	S	.	.			trans	-85	108.2	169.6	-179.5	0	0	0	0	108.4	Q188 C218	Q188-V216 HydrophobicContact CG-CG2 3.54Å; V216-C218 PolarHBondContact O-N 3.07Å
217	F	52.1	Low	61.1	Low	77 Å²	77	93.1 Å²	93.1	34%	0.338	52%	0.524	S	S	.	.			trans	-75.3	106.6	171.7	-70.1	-90.6	0	0	0	109.9	D134 E135 H214 P215 R219	D134-F217 VanDerWaalsContact C-CE1 3.49Å; D134-F217 WeakPolarHBondContact O-CE2 3.38Å; D134-F217 VanDerWaalsContact O-CZ 3.22Å; D134-F217 WeakPolarHBondContact O-CZ 3.37Å; E135-F217 HydrophobicContact CB-CB 4.01Å; E135-F217 HydrophobicContact CB-CD1 4.23Å; E135-F217 HydrophobicContact CB-CD2 4.43Å; E135-F217 HydrophobicContact CB-CG 3.96Å; H214-F217 AromaticContact CE1-CE2 3.57Å; P215-F217 HydrophobicContact CG-CD2 4.37Å; P215-F217 HydrophobicContact CG-CE2 3.68Å; P215-F217 HydrophobicContact CG-CZ 3.87Å; P215-F217 PolarHBondContact O-N 2.97Å; F217-R219 PolarHBondContact O-N 3.1Å
218	C	41.3	Very low	60.3	Low	120 Å²	120	93 Å²	93	81%	0.811	52%	0.524	S	S	*	.			trans	-65.9	111.7	173.3	-68.3	0	0	0	0	110.1	V216 G220	V216-C218 PolarHBondContact O-N 3.07Å; C218-G220 PolarHBondContact O-N 3.2Å
219	R	40.9	Very low	60.2	Low	222 Å²	222	93.4 Å²	93.4	84%	0.838	53%	0.527	S	S	*	.			trans	-67.3	120.9	167.1	-69.9	-177.7	173.6	177.3	-0.6	108.8	F217	F217-R219 PolarHBondContact O-N 3.1Å
220	G	38.1	Very low	59.9	Low	67 Å²	67	90.8 Å²	90.8	69%	0.691	52%	0.521	S	S	*	.			trans	-69.2	-171.4	169.9	0	0	0	0	0	112.8	C218	C218-G220 PolarHBondContact O-N 3.2Å
221	P	33.8	Very low	60	Low	123 Å²	123	89.3 Å²	89.3	80%	0.799	51%	0.514	S	S	*	.			cis	-122.3	178.3	13.9	42.1	-30.7	0	0	0	113.9
222	L	38.4	Very low	60.1	Low	167 Å²	167	87.8 Å²	87.8	87%	0.874	50%	0.504	S	S	*	.				-168.7	163.6	129	-103.9	165.1	0	0	0	110.8
223	E	30	Very low	60.2	Low	193 Å²	193	92 Å²	92	90%	0.902	53%	0.528	S	S	*	.			trans	-91.3	144.8	-169.4	-60	165.6	127	0	0	112.3
224	G	39.4	Very low	60.6	Low	71 Å²	71	85.8 Å²	85.8	73%	0.732	50%	0.5	S	S	*	.			trans	140.6	85.1	172.3	0	0	0	0	0	113.7	M226	G224-M226 PolarHBondContact O-N 3.42Å; G224-M226 VanDerWaalsContact O-N 3.12Å
225	S	39.1	Very low	61.3	Low	103 Å²	103	91 Å²	91	72%	0.72	52%	0.524	S	S	*	.			trans	-71.2	106.2	172.4	-177.5	0	0	0	0	110.1
226	M	54.8	Low	62.3	Low	166 Å²	166	91 Å²	91	82%	0.818	52%	0.521	S	S	*	.			trans	-112.9	114.5	160.2	-68.1	-169.9	71.6	0	0	107.4	G224	G224-M226 PolarHBondContact O-N 3.42Å; G224-M226 VanDerWaalsContact O-N 3.12Å
227	T	63.3	Low	63.8	Low	75 Å²	75	89.2 Å²	89.2	46%	0.46	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-58.8	138.8	174.2	41.5	0	0	0	0	110
228	P	75.2	Confident	65.3	Low	8 Å²	8	88.4 Å²	88.4	5%	0.052	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-67.8	147.4	-178.6	29.9	-35.6	0	0	0	110.6	S303 D309 S311	P228-S303 WeakPolarHBondContact CG-O 3.3Å; P228-D309 WeakPolarHBondContact CG-O 3.29Å; P228-S311 WeakPolarHBondContact O-CA 3.38Å; P228-S311 WeakPolarHBondContact O-CB 3.39Å
229	S	81.4	Confident	67.2	Low	49 Å²	49	84 Å²	84	34%	0.343	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-76.1	148	172	-62.9	0	0	0	0	109.7	P251 S303	S229-P251 VanDerWaalsContact O-CG 3.22Å; S229-P251 WeakPolarHBondContact O-CG 3.31Å; S229-S303 WeakPolarHBondContact O-CB 3.45Å; S229-S303 PolarHBondContact O-OG 2.86Å
230	P	83.3	Confident	68.9	Low	35 Å²	35	75 Å²	75	23%	0.227	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-61.1	152.8	174.6	28.2	-35.9	0	0	0	111.1	P251 Q313	P230-P251 WeakPolarHBondContact O-CG 3.37Å; P230-Q313 HydrophobicContact CB-CB 4.28Å; P230-Q313 HydrophobicContact CG-CB 4.11Å
231	P	89.1	Confident	70.6	Confident	2 Å²	2	73.3 Å²	73.3	1%	0.013	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-65	173.1	168	29.5	-31.6	0	0	0	110.4	W248 T249 Y261 V301 S303 L315	P231-W248 HydrophobicContact CB-CB 4.43Å; P231-W248 HydrophobicContact CB-CG 4.24Å; P231-T249 WeakPolarHBondContact CB-O 3.2Å; P231-Y261 HydrophobicContact CB-CD1 4.45Å; P231-Y261 HydrophobicContact CB-CE1 4.04Å; P231-Y261 HydrophobicContact CG-CD1 4.44Å; P231-Y261 HydrophobicContact CG-CE1 4.46Å; P231-V301 HydrophobicContact CG-CB 4.02Å; P231-V301 HydrophobicContact CG-CG1 3.87Å; P231-S303 WeakPolarHBondContact CD-OG 3.18Å; P231-L315 HydrophobicContact CB-CD2 4.21Å; P231-L315 HydrophobicContact CG-CB 3.88Å; P231-L315 HydrophobicContact CG-CD2 4.04Å; P231-L315 WeakPolarHBondContact O-CD2 3.5Å
232	V	90.3	Very high	72.4	Confident	54 Å²	54	70.3 Å²	70.3	33%	0.327	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	162.4	175.1	-61.9	0	0	0	0	111.8	T249 L315	V232-T249 WeakPolarHBondContact CG2-OG1 3.43Å; V232-T249 PolarHBondContact N-O 3.19Å; V232-T249 PolarHBondContact O-N 2.66Å; V232-T249 PolarHBondContact O-OG1 3.26Å; V232-L315 VanDerWaalsContact C-CD2 3.47Å
233	N	89.7	Confident	74.3	Confident	109 Å²	109	66.5 Å²	66.5	58%	0.583	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	57.7	60.5	177.8	-47.6	-44.8	0	0	0	115.1	W248 T249	N233-W248 WeakPolarHBondContact O-CA 3.48Å; N233-T249 PolarHBondContact ND2-OG1 2.78Å; N233-T249 VanDerWaalsContact ND2-OG1 3.07Å
234	L	91.6	Very high	76.6	Confident	14 Å²	14	57.3 Å²	57.3	7%	0.073	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	128.9	174.2	178.4	56	0	0	0	109.5	L246 S247 W248 V301 L315	L234-L246 HydrophobicContact CD1-CB 4.21Å; L234-S247 CarbonylContact C-O 3.49Å; L234-S247 WeakPolarHBondContact CA-O 3.38Å; L234-S247 WeakPolarHBondContact CD1-O 3.47Å; L234-W248 HydrophobicContact CD1-CB 4.35Å; L234-W248 HydrophobicContact CD1-CE3 4.02Å; L234-V301 HydrophobicContact CD1-CG2 4.09Å; L234-V301 HydrophobicContact CD2-CG2 4.01Å; L234-L315 HydrophobicContact CB-CD2 3.46Å; L234-L315 VanDerWaalsContact CB-CD2 3.46Å; L234-L315 HydrophobicContact CB-CG 3.66Å; L234-L315 HydrophobicContact CD2-CG 4.31Å
235	Q	90.7	Very high	79	Confident	121 Å²	121	54.1 Å²	54.1	57%	0.565	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	154.4	179.3	-61.6	-69.7	-92.3	0	0	109.4	L246 S247	Q235-L246 WeakPolarHBondContact O-CA 3.39Å; Q235-S247 PolarHBondContact N-O 3.4Å; Q235-S247 PolarHBondContact O-N 3.21Å
236	I	89.1	Confident	81.4	Confident	51 Å²	51	49.2 Å²	49.2	26%	0.262	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127	176.8	-47.1	-172.6	0	0	0	109.4	V239 C244 T245 L246 F299 V320	I236-V239 HydrophobicContact CG2-CG2 3.69Å; I236-C244 HydrophobicContact CG2-CB 3.76Å; I236-T245 CarbonylContact C-O 3.59Å; I236-T245 VanDerWaalsContact CA-O 3.31Å; I236-T245 WeakPolarHBondContact CA-O 3.38Å; I236-L246 HydrophobicContact CB-CD2 4.42Å; I236-L246 HydrophobicContact CD1-CD2 4.09Å; I236-L246 HydrophobicContact CG1-CD2 3.78Å; I236-L246 HydrophobicContact CG2-CD2 4.19Å; I236-F299 HydrophobicContact CD1-CD2 3.83Å; I236-F299 HydrophobicContact CD1-CE2 4.08Å; I236-V320 HydrophobicContact CD1-CB 3.97Å; I236-V320 HydrophobicContact CG2-CG2 4.16Å
237	S	88.7	Confident	83.3	Confident	47 Å²	47	43.2 Å²	43.2	33%	0.329	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	179.8	174.3	64.6	0	0	0	0	111.4	V239 T245	S237-V239 PolarHBondContact O-N 2.97Å; S237-T245 PolarHBondContact N-O 3.36Å; S237-T245 PolarHBondContact O-N 3.49Å; S237-T245 WeakPolarHBondContact OG-CB 3.47Å
238	D	83.9	Confident	84.8	Confident	60 Å²	60	40 Å²	40	32%	0.321	22%	0.223	S	C	.	.			trans	53.6	22.2	170.7	-51	-61.7	0	0	0	116.5	D240 T245	D238-D240 PolarHBondContact O-N 3.12Å; D238-D240 VanDerWaalsContact O-N 3.08Å; D238-T245 VanDerWaalsContact OD2-CB 3.25Å; D238-T245 WeakPolarHBondContact OD2-CB 3.29Å; D238-T245 PolarHBondContact OD2-OG1 3.42Å
239	V	81.4	Confident	85.5	Confident	28 Å²	28	42.2 Å²	42.2	17%	0.17	24%	0.237	C	C	.	.			trans	-61.6	107.1	-177.9	-174.4	0	0	0	0	110.3	I236 S237 R243 C244 V320 L322 R323	I236-V239 HydrophobicContact CG2-CG2 3.69Å; S237-V239 PolarHBondContact O-N 2.97Å; V239-R243 WeakPolarHBondContact CA-O 3.42Å; V239-C244 HydrophobicContact CB-CB 4.36Å; V239-C244 HydrophobicContact CG2-CB 3.9Å; V239-V320 HydrophobicContact CB-CG2 4.14Å; V239-V320 HydrophobicContact CG1-CG2 3.44Å; V239-V320 VanDerWaalsContact CG1-CG2 3.44Å; V239-V320 HydrophobicContact CG2-CG2 3.51Å; V239-L322 HydrophobicContact CG1-CD2 3.6Å; V239-R323 PolarHBondContact O-NE 3.06Å; V239-R323 PolarHBondContact O-NH2 2.83Å
240	D	75.6	Confident	85.8	Confident	31 Å²	31	42 Å²	42	17%	0.166	23%	0.234	C	C	.	.			trans	-112.5	-146.8	171.3	72.5	27.2	0	0	0	112.2	D238 T242 R243 R323	D238-D240 PolarHBondContact O-N 3.12Å; D238-D240 VanDerWaalsContact O-N 3.08Å; D240-T242 PolarHBondContact OD1-N 3.4Å; D240-R243 PolarHBondContact N-O 3.06Å; D240-R243 WeakPolarHBondContact OD1-CG 3.16Å; D240-R243 PolarHBondContact OD1-N 2.98Å; D240-R243 WeakPolarHBondContact OD2-CG 3.26Å; D240-R243 IonicContact OD2-CZ 2.67Å; D240-R243 IonicContact OD2-NE 3.86Å; D240-R243 PolarHBondContact OD2-NE 2.96Å; D240-R243 IonicContact OD2-NH2 3.53Å; D240-R243 PolarHBondContact OD2-NH2 2.81Å; D240-R323 PolarHBondContact O-N 3.49Å
241	S	73.7	Confident	85.9	Confident	33 Å²	33	40.5 Å²	40.5	23%	0.231	22%	0.224	C	C	.	.	S	Bend	trans	-87.6	-12.5	178.9	55.7	0	0	0	0	114.1	P293 R323	S241-P293 WeakPolarHBondContact O-CA 3.5Å; S241-P293 WeakPolarHBondContact O-CB 3.3Å; S241-P293 VanDerWaalsContact O-CG 3.29Å; S241-P293 WeakPolarHBondContact O-CG 3.38Å; S241-R323 WeakPolarHBondContact CA-O 3.44Å; S241-R323 WeakPolarHBondContact CB-O 3.42Å
242	T	71.4	Confident	85.1	Confident	59 Å²	59	45.7 Å²	45.7	36%	0.362	26%	0.258	S	S	.	.	S	Bend	trans	-141.5	0.7	-177.2	51.3	0	0	0	0	114.6	D240 I289 N290 L291 P293	D240-T242 PolarHBondContact OD1-N 3.4Å; T242-I289 CarbonylContact O-C 3.51Å; T242-N290 PolarHBondContact O-N 3.06Å; T242-L291 WeakPolarHBondContact CA-O 3.3Å; T242-L291 PolarHBondContact O-N 3.07Å; T242-P293 HydrophobicContact CG2-CG 3.98Å
243	R	78.5	Confident	84.1	Confident	88 Å²	88	50.4 Å²	50.4	33%	0.332	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	164.9	177.4	56	169.6	177.3	120.6	24	113.4	V239 D240 T287 V288 I289	V239-R243 WeakPolarHBondContact CA-O 3.42Å; D240-R243 PolarHBondContact N-O 3.06Å; D240-R243 WeakPolarHBondContact OD1-CG 3.16Å; D240-R243 PolarHBondContact OD1-N 2.98Å; D240-R243 WeakPolarHBondContact OD2-CG 3.26Å; D240-R243 IonicContact OD2-CZ 2.67Å; D240-R243 IonicContact OD2-NE 3.86Å; D240-R243 PolarHBondContact OD2-NE 2.96Å; D240-R243 IonicContact OD2-NH2 3.53Å; D240-R243 PolarHBondContact OD2-NH2 2.81Å; R243-T287 HydrophobicContact CB-CG2 4.24Å; R243-V288 CarbonylContact C-O 3.53Å; R243-V288 WeakPolarHBondContact CA-O 3.26Å; R243-V288 WeakPolarHBondContact CB-O 3.28Å; R243-I289 HydrophobicContact CB-CB 4.33Å; R243-I289 HydrophobicContact CB-CG2 3.9Å
244	C	78.1	Confident	82.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	151.7	163	58.3	0	0	0	0	110	I236 V239 T287 V288 F299	I236-C244 HydrophobicContact CG2-CB 3.76Å; V239-C244 HydrophobicContact CB-CB 4.36Å; V239-C244 HydrophobicContact CG2-CB 3.9Å; C244-T287 CarbonylContact O-C 3.5Å; C244-T287 WeakPolarHBondContact O-CA 3.21Å; C244-V288 PolarHBondContact N-O 3.14Å; C244-V288 PolarHBondContact O-N 2.73Å; C244-F299 WeakPolarHBondContact SG-CZ 3.42Å
245	T	89.3	Confident	81.4	Confident	4 Å²	4	51.8 Å²	51.8	3%	0.025	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	135.6	171.7	-58.9	0	0	0	0	109.8	I236 S237 D238 E285 T287	I236-T245 CarbonylContact C-O 3.59Å; I236-T245 VanDerWaalsContact CA-O 3.31Å; I236-T245 WeakPolarHBondContact CA-O 3.38Å; S237-T245 PolarHBondContact N-O 3.36Å; S237-T245 PolarHBondContact O-N 3.49Å; S237-T245 WeakPolarHBondContact OG-CB 3.47Å; D238-T245 VanDerWaalsContact OD2-CB 3.25Å; D238-T245 WeakPolarHBondContact OD2-CB 3.29Å; D238-T245 PolarHBondContact OD2-OG1 3.42Å; T245-E285 HydrophobicContact CG2-CG 3.76Å; T245-E285 WeakPolarHBondContact CG2-OE1 3.39Å; T245-T287 PolarHBondContact OG1-OG1 2.89Å
246	L	90.8	Very high	79.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.1	174	-56.9	174.3	0	0	0	108.2	L234 Q235 I236 W248 V263 E285 L286 V288 F299	L234-L246 HydrophobicContact CD1-CB 4.21Å; Q235-L246 WeakPolarHBondContact O-CA 3.39Å; I236-L246 HydrophobicContact CB-CD2 4.42Å; I236-L246 HydrophobicContact CD1-CD2 4.09Å; I236-L246 HydrophobicContact CG1-CD2 3.78Å; I236-L246 HydrophobicContact CG2-CD2 4.19Å; L246-W248 HydrophobicContact CB-CE3 4.32Å; L246-W248 HydrophobicContact CB-CZ3 3.93Å; L246-V263 HydrophobicContact CD1-CG1 3.58Å; L246-E285 CarbonylContact O-C 3.55Å; L246-E285 VanDerWaalsContact O-CA 3.24Å; L246-E285 WeakPolarHBondContact O-CA 3.46Å; L246-L286 PolarHBondContact N-O 2.71Å; L246-L286 PolarHBondContact O-N 3.41Å; L246-V288 HydrophobicContact CD1-CG2 3.58Å; L246-V288 HydrophobicContact CG-CG2 4.15Å; L246-F299 HydrophobicContact CD1-CB 3.94Å; L246-F299 HydrophobicContact CD1-CD1 3.57Å; L246-F299 HydrophobicContact CD1-CE1 4.26Å; L246-F299 HydrophobicContact CD1-CG 3.75Å; L246-F299 HydrophobicContact CD2-CB 4.14Å; L246-F299 HydrophobicContact CD2-CD1 4.17Å; L246-F299 HydrophobicContact CD2-CD2 3.69Å; L246-F299 HydrophobicContact CD2-CE2 4.15Å; L246-F299 HydrophobicContact CD2-CG 3.71Å; L246-F299 HydrophobicContact CG-CD1 4.38Å; L246-F299 HydrophobicContact CG-CG 4.34Å
247	S	94.7	Very high	78.3	Confident	39 Å²	39	52.7 Å²	52.7	27%	0.273	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	144.4	171.5	60	0	0	0	0	110.9	L234 Q235 T284	L234-S247 CarbonylContact C-O 3.49Å; L234-S247 WeakPolarHBondContact CA-O 3.38Å; L234-S247 WeakPolarHBondContact CD1-O 3.47Å; Q235-S247 PolarHBondContact N-O 3.4Å; Q235-S247 PolarHBondContact O-N 3.21Å; S247-T284 WeakPolarHBondContact CA-O 3.38Å
248	W	93.5	Very high	77.4	Confident	8 Å²	8	53 Å²	53	3%	0.03	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	177.5	178.8	57.4	92.4	0	0	0	110.9	P231 N233 L234 L246 Y261 V263 M281 S283 T284 L286 V301 L315	P231-W248 HydrophobicContact CB-CB 4.43Å; P231-W248 HydrophobicContact CB-CG 4.24Å; N233-W248 WeakPolarHBondContact O-CA 3.48Å; L234-W248 HydrophobicContact CD1-CB 4.35Å; L234-W248 HydrophobicContact CD1-CE3 4.02Å; L246-W248 HydrophobicContact CB-CE3 4.32Å; L246-W248 HydrophobicContact CB-CZ3 3.93Å; W248-Y261 AromaticContact CE2-CG 3.83Å; W248-Y261 HydrophobicContact CZ2-CD2 4.09Å; W248-Y261 AromaticContact CZ2-CG 3.85Å; W248-Y261 HydrophobicContact CZ2-CG 3.85Å; W248-Y261 AromaticContact NE1-CD1 3.29Å; W248-Y261 VanDerWaalsContact NE1-CD1 3.29Å; W248-Y261 AromaticContact NE1-CD2 3.47Å; W248-Y261 AromaticContact NE1-CE1 3.57Å; W248-Y261 AromaticContact NE1-CE2 3.75Å; W248-Y261 AromaticContact NE1-CG 3.25Å; W248-Y261 AromaticContact NE1-CZ 3.8Å; W248-V263 HydrophobicContact CH2-CG2 3.42Å; W248-V263 VanDerWaalsContact CH2-CG2 3.42Å; W248-V263 HydrophobicContact CZ2-CG2 4.11Å; W248-V263 HydrophobicContact CZ3-CG2 3.94Å; W248-M281 HydrophobicContact CH2-CE 3.79Å; W248-M281 HydrophobicContact CH2-SD 4.09Å; W248-M281 HydrophobicContact CZ2-CE 4.01Å; W248-M281 HydrophobicContact CZ2-SD 4.38Å; W248-S283 WeakPolarHBondContact CZ2-O 3.48Å; W248-T284 VanDerWaalsContact CD2-O 3.31Å; W248-T284 PolarHBondContact N-O 3.19Å; W248-T284 VanDerWaalsContact O-CB 3.32Å; W248-T284 WeakPolarHBondContact O-CB 3.39Å; W248-T284 PolarHBondContact O-OG1 2.82Å; W248-L286 HydrophobicContact CH2-CB 4Å; W248-L286 HydrophobicContact CZ3-CB 4.22Å; W248-V301 HydrophobicContact CD2-CG1 3.95Å; W248-V301 HydrophobicContact CD2-CG2 4.15Å; W248-V301 HydrophobicContact CE3-CG1 4.41Å; W248-V301 HydrophobicContact CE3-CG2 3.89Å; W248-V301 HydrophobicContact CG-CG1 4.39Å; W248-V301 HydrophobicContact CH2-CG1 4.45Å; W248-V301 HydrophobicContact CZ2-CG1 3.97Å; W248-V301 HydrophobicContact CZ3-CG2 4.16Å; W248-L315 HydrophobicContact CB-CD2 4.37Å
249	T	91.2	Very high	77.1	Confident	55 Å²	55	50.5 Å²	50.5	34%	0.337	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.6	176.9	53.6	0	0	0	0	111.7	P231 V232 N233	P231-T249 WeakPolarHBondContact CB-O 3.2Å; V232-T249 WeakPolarHBondContact CG2-OG1 3.43Å; V232-T249 PolarHBondContact N-O 3.19Å; V232-T249 PolarHBondContact O-N 2.66Å; V232-T249 PolarHBondContact O-OG1 3.26Å; N233-T249 PolarHBondContact ND2-OG1 2.78Å; N233-T249 VanDerWaalsContact ND2-OG1 3.07Å
250	P	87.3	Confident	77.4	Confident	44 Å²	44	53 Å²	53	29%	0.286	30%	0.303	S	S	.	.			trans	-61.3	159.3	179.7	-24	34.7	0	0	0	113.5	P256 Y261 T284	P250-P256 HydrophobicContact CB-CG 4.49Å; P250-Y261 WeakPolarHBondContact CA-OH 3.28Å; P250-Y261 WeakPolarHBondContact CB-OH 3.42Å; P250-T284 HydrophobicContact CG-CG2 3.93Å
251	P	84.7	Confident	78.1	Confident	4 Å²	4	51.7 Å²	51.7	3%	0.026	30%	0.296	C	S	.	.			trans	-64.8	128.9	177.1	-13.5	27.1	0	0	0	110.8	S229 P230 N253 Q254 I259	S229-P251 VanDerWaalsContact O-CG 3.22Å; S229-P251 WeakPolarHBondContact O-CG 3.31Å; P230-P251 WeakPolarHBondContact O-CG 3.37Å; P251-N253 PolarHBondContact O-N 2.98Å; P251-Q254 HydrophobicContact CB-CG 4.4Å; P251-Q254 PolarHBondContact O-N 3.19Å; P251-I259 HydrophobicContact CG-CD1 4.15Å
252	P	74.1	Confident	78.8	Confident	110 Å²	110	51 Å²	51	71%	0.714	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.4	-168.1	24.1	-34.9	0	0	0	115.1
253	N	68.2	Low	79.6	Confident	153 Å²	153	48.1 Å²	48.1	82%	0.818	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	12.6	-177.9	-68.1	-25.5	0	0	0	113.7	P251	P251-N253 PolarHBondContact O-N 2.98Å
254	Q	64.3	Low	80.1	Confident	51 Å²	51	45.7 Å²	45.7	24%	0.238	27%	0.265	C	S	.	.	S	Bend	trans	-128.3	149.8	-179.7	-58.3	-162.8	-73.4	0	0	112.6	P251 P256 I259	P251-Q254 HydrophobicContact CB-CG 4.4Å; P251-Q254 PolarHBondContact O-N 3.19Å; Q254-P256 WeakPolarHBondContact O-CD 3.41Å; Q254-I259 HydrophobicContact CB-CD1 3.57Å; Q254-I259 HydrophobicContact CG-CD1 4.29Å
255	V	60.8	Low	80.5	Confident	101 Å²	101	47.5 Å²	47.5	61%	0.612	27%	0.273	S	S	*	.			trans	-74.1	118.4	-179.5	-172.1	0	0	0	0	109.2	T257 S258	V255-T257 WeakPolarHBondContact CG1-OG1 3.22Å; V255-T257 PolarHBondContact O-N 3.12Å; V255-T257 VanDerWaalsContact O-N 3.08Å; V255-S258 PolarHBondContact O-N 2.77Å
256	P	56.9	Low	80.3	Confident	78 Å²	78	50.2 Å²	50.2	51%	0.506	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-62.8	-22.2	-170.4	-26.8	36	0	0	0	115.3	P250 Q254 S258	P250-P256 HydrophobicContact CB-CG 4.49Å; Q254-P256 WeakPolarHBondContact O-CD 3.41Å; P256-S258 PolarHBondContact O-N 2.92Å; P256-S258 VanDerWaalsContact O-N 3.17Å
257	T	57.8	Low	79.7	Confident	113 Å²	113	52.8 Å²	52.8	69%	0.693	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-73.6	-1.3	-175.7	58.4	0	0	0	0	114.8	V255	V255-T257 WeakPolarHBondContact CG1-OG1 3.22Å; V255-T257 PolarHBondContact O-N 3.12Å; V255-T257 VanDerWaalsContact O-N 3.08Å
258	S	68.9	Low	78.8	Confident	54 Å²	54	52.8 Å²	52.8	38%	0.378	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-128.6	19.4	-174.1	-53.9	0	0	0	0	112.8	V255 P256 P306	V255-S258 PolarHBondContact O-N 2.77Å; P256-S258 PolarHBondContact O-N 2.92Å; P256-S258 VanDerWaalsContact O-N 3.17Å; S258-P306 WeakPolarHBondContact O-CD 3.41Å
259	I	79	Confident	77.2	Confident	7 Å²	7	54.9 Å²	54.9	4%	0.036	32%	0.315	C	S	.	.			trans	-130.4	132.9	-178.8	-64.2	176.8	0	0	0	109.2	P251 Q254 Y261	P251-I259 HydrophobicContact CG-CD1 4.15Å; Q254-I259 HydrophobicContact CB-CD1 3.57Å; Q254-I259 HydrophobicContact CG-CD1 4.29Å; I259-Y261 HydrophobicContact CG2-CE1 3.87Å; I259-Y261 HydrophobicContact CG2-CE2 4.45Å
260	W	87.6	Confident	75.9	Confident	81 Å²	81	56 Å²	56	31%	0.307	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	171.1	167	-61.8	-106.7	0	0	0	109	P280 M281 L282 S303 C304 P306	W260-P280 HydrophobicContact CB-CB 3.5Å; W260-P280 VanDerWaalsContact CD1-O 3.3Å; W260-P280 HydrophobicContact CG-CB 4.12Å; W260-M281 CarbonylContact C-O 3.57Å; W260-M281 VanDerWaalsContact CA-O 3.28Å; W260-M281 WeakPolarHBondContact CA-O 3.3Å; W260-L282 HydrophobicContact CD2-CD2 4.15Å; W260-L282 HydrophobicContact CG-CD2 4.06Å; W260-L282 HydrophobicContact CG-CG 4.48Å; W260-L282 HydrophobicContact CZ2-CD2 4.43Å; W260-S303 CarbonylContact O-C 3.57Å; W260-S303 WeakPolarHBondContact O-CA 3.47Å; W260-C304 HydrophobicContact CB-CB 4.17Å; W260-C304 PolarHBondContact N-O 3.35Å; W260-C304 PolarHBondContact O-N 2.88Å; W260-P306 HydrophobicContact CZ3-CB 4.21Å; W260-P306 HydrophobicContact CZ3-CG 4.1Å
261	Y	88.9	Confident	74.4	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.016	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147	177.3	-57	-77	0	0	0	111.2	P231 W248 P250 I259 P280 M281 S283 T284 V301 F302	P231-Y261 HydrophobicContact CB-CD1 4.45Å; P231-Y261 HydrophobicContact CB-CE1 4.04Å; P231-Y261 HydrophobicContact CG-CD1 4.44Å; P231-Y261 HydrophobicContact CG-CE1 4.46Å; W248-Y261 AromaticContact CE2-CG 3.83Å; W248-Y261 HydrophobicContact CZ2-CD2 4.09Å; W248-Y261 AromaticContact CZ2-CG 3.85Å; W248-Y261 HydrophobicContact CZ2-CG 3.85Å; W248-Y261 AromaticContact NE1-CD1 3.29Å; W248-Y261 VanDerWaalsContact NE1-CD1 3.29Å; W248-Y261 AromaticContact NE1-CD2 3.47Å; W248-Y261 AromaticContact NE1-CE1 3.57Å; W248-Y261 AromaticContact NE1-CE2 3.75Å; W248-Y261 AromaticContact NE1-CG 3.25Å; W248-Y261 AromaticContact NE1-CZ 3.8Å; P250-Y261 WeakPolarHBondContact CA-OH 3.28Å; P250-Y261 WeakPolarHBondContact CB-OH 3.42Å; I259-Y261 HydrophobicContact CG2-CE1 3.87Å; I259-Y261 HydrophobicContact CG2-CE2 4.45Å; Y261-P280 CarbonylContact O-C 3.54Å; Y261-P280 VanDerWaalsContact O-CA 3.31Å; Y261-P280 WeakPolarHBondContact O-CA 3.46Å; Y261-M281 PolarHBondContact N-O 3.36Å; Y261-M281 WeakPolarHBondContact O-CG 3.37Å; Y261-M281 PolarHBondContact O-N 3.4Å; Y261-S283 WeakPolarHBondContact CD2-O 3.29Å; Y261-T284 HydrophobicContact CD2-CG2 4.35Å; Y261-T284 HydrophobicContact CE2-CG2 3.6Å; Y261-V301 HydrophobicContact CD1-CG1 4.14Å; Y261-V301 HydrophobicContact CG-CG1 4.42Å; Y261-F302 CarbonylContact C-O 3.55Å; Y261-F302 VanDerWaalsContact CA-O 3.25Å; Y261-F302 WeakPolarHBondContact CA-O 3.12Å
262	V	89.2	Confident	73.1	Confident	17 Å²	17	65.2 Å²	65.2	10%	0.103	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.1	170.4	172.4	0	0	0	0	107.6	Q264 P280 F302 C304 L310	V262-Q264 HydrophobicContact CG1-CG 4.4Å; V262-P280 HydrophobicContact CG2-CB 4.02Å; V262-P280 HydrophobicContact CG2-CG 3.9Å; V262-F302 HydrophobicContact CB-CB 4.5Å; V262-F302 PolarHBondContact N-O 2.81Å; V262-F302 PolarHBondContact O-N 2.92Å; V262-C304 HydrophobicContact CG2-CB 4.44Å; V262-L310 HydrophobicContact CB-CD2 4.16Å; V262-L310 HydrophobicContact CG2-CD2 3.86Å
263	V	89	Confident	73.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129	-179.1	-176.4	0	0	0	0	109.1	L246 W248 A276 T277 M281 L286 V301	L246-V263 HydrophobicContact CD1-CG1 3.58Å; W248-V263 HydrophobicContact CH2-CG2 3.42Å; W248-V263 VanDerWaalsContact CH2-CG2 3.42Å; W248-V263 HydrophobicContact CZ2-CG2 4.11Å; W248-V263 HydrophobicContact CZ3-CG2 3.94Å; V263-A276 HydrophobicContact CB-CB 4.2Å; V263-A276 HydrophobicContact CG1-CB 4.05Å; V263-A276 PolarHBondContact O-N 3.43Å; V263-T277 HydrophobicContact CB-CG2 4.06Å; V263-T277 HydrophobicContact CG2-CG2 4.1Å; V263-T277 PolarHBondContact N-OG1 2.82Å; V263-T277 VanDerWaalsContact N-OG1 3.09Å; V263-T277 PolarHBondContact O-N 2.96Å; V263-T277 PolarHBondContact O-OG1 2.91Å; V263-M281 HydrophobicContact CG2-SD 4.15Å; V263-L286 HydrophobicContact CB-CD2 3.71Å; V263-L286 HydrophobicContact CG1-CD2 4.02Å; V263-L286 HydrophobicContact CG2-CD2 3.69Å; V263-V301 HydrophobicContact CG2-CG1 4.33Å; V263-V301 HydrophobicContact CG2-CG2 4.23Å
264	Q	88.9	Confident	73.5	Confident	37 Å²	37	58.1 Å²	58.1	17%	0.173	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	151.3	173.2	-65.4	179.6	-9.8	0	0	110.6	V262 W273 C274 F299 R300	V262-Q264 HydrophobicContact CG1-CG 4.4Å; Q264-W273 HydrophobicContact CB-CB 4.35Å; Q264-W273 HydrophobicContact CB-CE3 3.94Å; Q264-C274 CarbonylContact C-O 3.5Å; Q264-C274 WeakPolarHBondContact CA-O 3.27Å; Q264-C274 WeakPolarHBondContact CB-O 3.5Å; Q264-F299 CarbonylContact O-C 3.43Å; Q264-F299 WeakPolarHBondContact O-CA 3.4Å; Q264-R300 HydrophobicContact CB-CG 3.94Å; Q264-R300 PolarHBondContact N-O 2.91Å; Q264-R300 PolarHBondContact O-N 2.9Å; Q264-R300 VanDerWaalsContact OE1-CZ 3.27Å
265	F	86.1	Confident	74.1	Confident	38 Å²	38	58.9 Å²	58.9	17%	0.167	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	155	-179.1	70.2	-79.3	0	0	0	110.6	C274 A276 V288 L291 Y297 E298 F299	F265-C274 HydrophobicContact CD1-CB 3.91Å; F265-C274 WeakPolarHBondContact CD1-O 3.15Å; F265-C274 HydrophobicContact CD2-CB 4.41Å; F265-C274 HydrophobicContact CE1-CB 3.48Å; F265-C274 VanDerWaalsContact CE1-CB 3.48Å; F265-C274 HydrophobicContact CE2-CB 4.02Å; F265-C274 HydrophobicContact CG-CB 4.37Å; F265-C274 HydrophobicContact CZ-CB 3.55Å; F265-C274 PolarHBondContact N-O 2.99Å; F265-C274 PolarHBondContact O-N 2.66Å; F265-A276 HydrophobicContact CD1-CB 3.86Å; F265-A276 HydrophobicContact CE1-CB 4.2Å; F265-V288 HydrophobicContact CD1-CG1 4.32Å; F265-V288 HydrophobicContact CG-CG1 4.47Å; F265-L291 HydrophobicContact CD2-CD2 3.55Å; F265-L291 HydrophobicContact CE2-CD2 3.58Å; F265-L291 HydrophobicContact CG-CD2 4.39Å; F265-L291 HydrophobicContact CZ-CD2 4.43Å; F265-Y297 AromaticContact CD2-CD1 3.93Å; F265-Y297 HydrophobicContact CD2-CD1 3.93Å; F265-Y297 HydrophobicContact CD2-CE1 4.04Å; F265-Y297 HydrophobicContact CE2-CE1 4.32Å; F265-E298 WeakPolarHBondContact CA-O 3.49Å; F265-F299 HydrophobicContact CB-CD1 3.38Å; F265-F299 HydrophobicContact CB-CE1 3.42Å; F265-F299 VanDerWaalsContact CB-CE1 3.42Å; F265-F299 HydrophobicContact CB-CG 4.43Å; F265-F299 HydrophobicContact CB-CZ 4.49Å; F265-F299 HydrophobicContact CG-CE1 4.32Å
266	R	84.6	Confident	74.5	Confident	60 Å²	60	55.6 Å²	55.6	23%	0.226	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	146.6	168	64.7	178.6	-179.8	127.6	4.9	112.2	D270 Q272 W273 Y297 E298	R266-D270 PolarHBondContact NH1-O 3.38Å; R266-Q272 WeakPolarHBondContact CB-O 3.36Å; R266-W273 HydrophobicContact CB-CD2 4.24Å; R266-W273 HydrophobicContact CB-CE3 4.18Å; R266-W273 VanDerWaalsContact CD-CE2 3.45Å; R266-W273 HydrophobicContact CG-CD2 3.97Å; R266-W273 HydrophobicContact CG-CE3 3.96Å; R266-W273 HydrophobicContact CG-CH2 4.14Å; R266-W273 HydrophobicContact CG-CZ2 4.13Å; R266-W273 HydrophobicContact CG-CZ3 4.03Å; R266-W273 VanDerWaalsContact NE-CZ2 3.33Å; R266-Y297 VanDerWaalsContact C-CD1 3.45Å; R266-Y297 VanDerWaalsContact O-CA 3.27Å; R266-Y297 WeakPolarHBondContact O-CA 3.31Å; R266-Y297 WeakPolarHBondContact O-CD1 3.37Å; R266-E298 HydrophobicContact CG-CG 3.61Å; R266-E298 IonicContact CZ-OE1 3.74Å; R266-E298 IonicContact CZ-OE2 3.57Å; R266-E298 PolarHBondContact N-O 3.24Å; R266-E298 IonicContact NE-OE1 2.85Å; R266-E298 PolarHBondContact NE-OE1 3.4Å; R266-E298 IonicContact NE-OE2 2.75Å; R266-E298 IonicContact NH2-OE1 2.69Å; R266-E298 PolarHBondContact NH2-OE1 3.37Å; R266-E298 IonicContact NH2-OE2 3.1Å; R266-E298 PolarHBondContact NH2-OE2 3.12Å; R266-E298 PolarHBondContact O-N 2.7Å; R266-E298 VanDerWaalsContact O-N 3.08Å
267	E	78.7	Confident	75.1	Confident	55 Å²	55	52.5 Å²	52.5	26%	0.257	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	135.1	171.9	-159.1	170.2	148	0	0	108.9	G269 D270 H292 S295 T296 Y297	E267-G269 PolarHBondContact O-N 2.93Å; E267-D270 WeakPolarHBondContact O-CB 3.49Å; E267-D270 PolarHBondContact O-N 3.32Å; E267-H292 IonicContact OE2-CE1 2.68Å; E267-H292 IonicContact OE2-CG 3.81Å; E267-H292 IonicContact OE2-ND1 3.83Å; E267-H292 PolarHBondContact OE2-ND1 3.23Å; E267-S295 VanDerWaalsContact OE1-CB 3.29Å; E267-S295 WeakPolarHBondContact OE1-CB 3.43Å; E267-S295 PolarHBondContact OE1-OG 3.38Å; E267-T296 CarbonylContact C-O 3.57Å; E267-T296 WeakPolarHBondContact CA-O 3.27Å; E267-T296 WeakPolarHBondContact CG-O 3.28Å; E267-Y297 HydrophobicContact CB-CD1 4.05Å; E267-Y297 HydrophobicContact CB-CE1 3.56Å; E267-Y297 HydrophobicContact CG-CD1 4.46Å; E267-Y297 HydrophobicContact CG-CE1 3.9Å; E267-Y297 HydrophobicContact CG-CE2 4.45Å; E267-Y297 PolarHBondContact OE2-OH 3.39Å
268	I	74.7	Confident	75.1	Confident	38 Å²	38	55.7 Å²	55.7	20%	0.195	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	123.8	-173	-57.1	-68.6	0	0	0	110.3	T296 E298 I319 Y495	I268-T296 PolarHBondContact N-O 3.48Å; I268-E298 HydrophobicContact CD1-CB 3.79Å; I268-E298 HydrophobicContact CD1-CG 3.54Å; I268-E298 WeakPolarHBondContact CD1-OE2 3.41Å; I268-I319 HydrophobicContact CD1-CD1 4.06Å; I268-I319 HydrophobicContact CD1-CG1 4.05Å; I268-I319 HydrophobicContact CD1-CG2 4.27Å; I268-I319 HydrophobicContact CG1-CD1 4.35Å; I268-I319 HydrophobicContact CG1-CG1 4.47Å; I268-I319 HydrophobicContact CG1-CG2 3.83Å; I268-Y495 WeakPolarHBondContact CB-OH 3.4Å; I268-Y495 VanDerWaalsContact CG1-OH 3.25Å; I268-Y495 WeakPolarHBondContact CG1-OH 3.22Å; I268-Y495 WeakPolarHBondContact CG2-OH 3.49Å
269	G	61.6	Low	75.2	Confident	52 Å²	52	58.7 Å²	58.7	54%	0.536	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.7	-16.7	-169.4	0	0	0	0	0	113.2	E267	E267-G269 PolarHBondContact O-N 2.93Å
270	D	61.9	Low	75.3	Confident	80 Å²	80	61.1 Å²	61.1	43%	0.428	34%	0.338	S	S	.	.			trans	-83.7	131.4	166.3	-152.3	-56	0	0	0	110.5	R266 E267 Q272	R266-D270 PolarHBondContact NH1-O 3.38Å; E267-D270 WeakPolarHBondContact O-CB 3.49Å; E267-D270 PolarHBondContact O-N 3.32Å; D270-Q272 VanDerWaalsContact C-N 3.34Å; D270-Q272 WeakPolarHBondContact OD1-CB 3.47Å; D270-Q272 PolarHBondContact OD1-N 3.13Å
271	P	57.6	Low	75.2	Confident	104 Å²	104	58.7 Å²	58.7	68%	0.675	33%	0.331	S	S	*	.			trans	-75.5	-18.5	171.6	30.5	-36.5	0	0	0	114
272	Q	57.4	Low	75	Confident	136 Å²	136	63.8 Å²	63.8	64%	0.636	36%	0.358	S	S	*	.			trans	-87.4	146.1	-175.9	-65.6	-64.3	-6.4	0	0	112.6	R266 D270	R266-Q272 WeakPolarHBondContact CB-O 3.36Å; D270-Q272 VanDerWaalsContact C-N 3.34Å; D270-Q272 WeakPolarHBondContact OD1-CB 3.47Å; D270-Q272 PolarHBondContact OD1-N 3.13Å
273	W	80.4	Confident	74.8	Confident	49 Å²	49	65.9 Å²	65.9	19%	0.186	37%	0.373	C	S	.	.			trans	-106.4	119.3	173.4	-74.2	87.3	0	0	0	110	Q264 R266 E298 R300	Q264-W273 HydrophobicContact CB-CB 4.35Å; Q264-W273 HydrophobicContact CB-CE3 3.94Å; R266-W273 HydrophobicContact CB-CD2 4.24Å; R266-W273 HydrophobicContact CB-CE3 4.18Å; R266-W273 VanDerWaalsContact CD-CE2 3.45Å; R266-W273 HydrophobicContact CG-CD2 3.97Å; R266-W273 HydrophobicContact CG-CE3 3.96Å; R266-W273 HydrophobicContact CG-CH2 4.14Å; R266-W273 HydrophobicContact CG-CZ2 4.13Å; R266-W273 HydrophobicContact CG-CZ3 4.03Å; R266-W273 VanDerWaalsContact NE-CZ2 3.33Å; W273-E298 HydrophobicContact CH2-CG 3.71Å; W273-E298 WeakPolarHBondContact CH2-OE1 3.38Å; W273-E298 HydrophobicContact CZ2-CG 4.27Å; W273-E298 WeakPolarHBondContact CZ2-OE1 3.4Å; W273-E298 HydrophobicContact CZ3-CG 4.3Å; W273-R300 HydrophobicContact CD2-CG 4.24Å; W273-R300 HydrophobicContact CE3-CG 3.74Å; W273-R300 VanDerWaalsContact CG-CZ 3.46Å; W273-R300 HydrophobicContact CH2-CB 3.82Å; W273-R300 HydrophobicContact CH2-CG 3.78Å; W273-R300 HydrophobicContact CZ2-CG 4.27Å; W273-R300 HydrophobicContact CZ3-CB 3.88Å; W273-R300 HydrophobicContact CZ3-CG 3.51Å
274	C	68.3	Low	74.9	Confident	66 Å²	66	68.1 Å²	68.1	45%	0.446	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	148.5	171.9	-63.7	0	0	0	0	110.2	Q264 F265	Q264-C274 CarbonylContact C-O 3.5Å; Q264-C274 WeakPolarHBondContact CA-O 3.27Å; Q264-C274 WeakPolarHBondContact CB-O 3.5Å; F265-C274 HydrophobicContact CD1-CB 3.91Å; F265-C274 WeakPolarHBondContact CD1-O 3.15Å; F265-C274 HydrophobicContact CD2-CB 4.41Å; F265-C274 HydrophobicContact CE1-CB 3.48Å; F265-C274 VanDerWaalsContact CE1-CB 3.48Å; F265-C274 HydrophobicContact CE2-CB 4.02Å; F265-C274 HydrophobicContact CG-CB 4.37Å; F265-C274 HydrophobicContact CZ-CB 3.55Å; F265-C274 PolarHBondContact N-O 2.99Å; F265-C274 PolarHBondContact O-N 2.66Å
275	S	78	Confident	75.1	Confident	66 Å²	66	71.2 Å²	71.2	46%	0.462	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	127.5	172.7	-156.9	0	0	0	0	110.2	T277	S275-T277 WeakPolarHBondContact CB-O 3.3Å; S275-T277 PolarHBondContact OG-O 2.79Å; S275-T277 PolarHBondContact OG-OG1 3.37Å
276	A	69.1	Low	75.1	Confident	33 Å²	33	71.2 Å²	71.2	27%	0.273	40%	0.403	S	S	.	.	S	Bend	trans	-83.7	-24.8	168.6	0	0	0	0	0	111.4	V263 F265 L286 V288	V263-A276 HydrophobicContact CB-CB 4.2Å; V263-A276 HydrophobicContact CG1-CB 4.05Å; V263-A276 PolarHBondContact O-N 3.43Å; F265-A276 HydrophobicContact CD1-CB 3.86Å; F265-A276 HydrophobicContact CE1-CB 4.2Å; A276-L286 HydrophobicContact CB-CD2 3.81Å; A276-V288 HydrophobicContact CB-CG1 3.96Å; A276-V288 HydrophobicContact CB-CG2 3.81Å
277	T	69.1	Low	75.2	Confident	12 Å²	12	71.1 Å²	71.1	7%	0.074	41%	0.409	C	S	.	.			trans	-96.4	127.6	174.3	46.1	0	0	0	0	111.1	V263 S275 D279 M281 L286	V263-T277 HydrophobicContact CB-CG2 4.06Å; V263-T277 HydrophobicContact CG2-CG2 4.1Å; V263-T277 PolarHBondContact N-OG1 2.82Å; V263-T277 VanDerWaalsContact N-OG1 3.09Å; V263-T277 PolarHBondContact O-N 2.96Å; V263-T277 PolarHBondContact O-OG1 2.91Å; S275-T277 WeakPolarHBondContact CB-O 3.3Å; S275-T277 PolarHBondContact OG-O 2.79Å; S275-T277 PolarHBondContact OG-OG1 3.37Å; T277-D279 WeakPolarHBondContact CB-O 3.4Å; T277-M281 HydrophobicContact CG2-CB 4.47Å; T277-M281 HydrophobicContact CG2-CG 3.81Å; T277-M281 HydrophobicContact CG2-SD 3.37Å; T277-M281 WeakPolarHBondContact CG2-SD 3.32Å; T277-L286 HydrophobicContact CG2-CD2 3.93Å
278	L	57.4	Low	75	Confident	180 Å²	180	68.8 Å²	68.8	94%	0.942	40%	0.399	S	S	*	.	S	Bend	trans	-71.8	-50.6	168.6	-80.1	159.6	0	0	0	110.9
279	D	71.2	Confident	75	Confident	118 Å²	118	71.5 Å²	71.5	63%	0.631	41%	0.412	S	S	*	.	S	Bend	trans	-116.9	154.3	174.3	-67.1	-75.8	0	0	0	110.3	T277 M281	T277-D279 WeakPolarHBondContact CB-O 3.4Å; D279-M281 PolarHBondContact O-N 2.93Å
280	P	81.4	Confident	75	Confident	57 Å²	57	75.6 Å²	75.6	37%	0.37	42%	0.422	S	S	.	.			trans	-56.6	129.6	171.7	-23.7	34.1	0	0	0	112.1	W260 Y261 V262 C304	W260-P280 HydrophobicContact CB-CB 3.5Å; W260-P280 VanDerWaalsContact CD1-O 3.3Å; W260-P280 HydrophobicContact CG-CB 4.12Å; Y261-P280 CarbonylContact O-C 3.54Å; Y261-P280 VanDerWaalsContact O-CA 3.31Å; Y261-P280 WeakPolarHBondContact O-CA 3.46Å; V262-P280 HydrophobicContact CG2-CB 4.02Å; V262-P280 HydrophobicContact CG2-CG 3.9Å; P280-C304 HydrophobicContact CB-CB 4.25Å
281	M	84.9	Confident	75.5	Confident	30 Å²	30	71.9 Å²	71.9	15%	0.148	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-105	142.8	-170.2	57.5	-178.7	-80	0	0	113.2	W248 W260 Y261 V263 T277 D279 S283 E285 L286	W248-M281 HydrophobicContact CH2-CE 3.79Å; W248-M281 HydrophobicContact CH2-SD 4.09Å; W248-M281 HydrophobicContact CZ2-CE 4.01Å; W248-M281 HydrophobicContact CZ2-SD 4.38Å; W260-M281 CarbonylContact C-O 3.57Å; W260-M281 VanDerWaalsContact CA-O 3.28Å; W260-M281 WeakPolarHBondContact CA-O 3.3Å; Y261-M281 PolarHBondContact N-O 3.36Å; Y261-M281 WeakPolarHBondContact O-CG 3.37Å; Y261-M281 PolarHBondContact O-N 3.4Å; V263-M281 HydrophobicContact CG2-SD 4.15Å; T277-M281 HydrophobicContact CG2-CB 4.47Å; T277-M281 HydrophobicContact CG2-CG 3.81Å; T277-M281 HydrophobicContact CG2-SD 3.37Å; T277-M281 WeakPolarHBondContact CG2-SD 3.32Å; D279-M281 PolarHBondContact O-N 2.93Å; M281-S283 WeakPolarHBondContact CE-O 3.41Å; M281-E285 WeakPolarHBondContact CE-O 3.29Å; M281-L286 HydrophobicContact CE-CB 3.82Å; M281-L286 HydrophobicContact CE-CD1 4.39Å; M281-L286 HydrophobicContact SD-CB 4Å; M281-L286 HydrophobicContact SD-CD1 4.11Å; M281-L286 HydrophobicContact SD-CD2 3.99Å; M281-L286 HydrophobicContact SD-CG 4.26Å
282	L	84.8	Confident	76.3	Confident	112 Å²	112	72 Å²	72	59%	0.586	39%	0.394	S	S	*	.	S	Bend	trans	-81.5	-22.1	175.8	-73	168.9	0	0	0	113.7	W260	W260-L282 HydrophobicContact CD2-CD2 4.15Å; W260-L282 HydrophobicContact CG-CD2 4.06Å; W260-L282 HydrophobicContact CG-CG 4.48Å; W260-L282 HydrophobicContact CZ2-CD2 4.43Å
283	S	86.1	Confident	76.9	Confident	61 Å²	61	68 Å²	68	43%	0.427	38%	0.379	S	S	.	.			trans	-69.8	146.5	176.6	173.9	0	0	0	0	110.7	W248 Y261 M281 E285	W248-S283 WeakPolarHBondContact CZ2-O 3.48Å; Y261-S283 WeakPolarHBondContact CD2-O 3.29Å; M281-S283 WeakPolarHBondContact CE-O 3.41Å; S283-E285 VanDerWaalsContact C-N 3.3Å; S283-E285 PolarHBondContact OG-N 2.99Å; S283-E285 PolarHBondContact OG-O 3.06Å
284	T	91.4	Very high	76.7	Confident	47 Å²	47	68.4 Å²	68.4	29%	0.288	39%	0.385	S	S	.	.	S	Bend	trans	-95.6	17	171.2	59.1	0	0	0	0	112.5	S247 W248 P250 Y261	S247-T284 WeakPolarHBondContact CA-O 3.38Å; W248-T284 VanDerWaalsContact CD2-O 3.31Å; W248-T284 PolarHBondContact N-O 3.19Å; W248-T284 VanDerWaalsContact O-CB 3.32Å; W248-T284 WeakPolarHBondContact O-CB 3.39Å; W248-T284 PolarHBondContact O-OG1 2.82Å; P250-T284 HydrophobicContact CG-CG2 3.93Å; Y261-T284 HydrophobicContact CD2-CG2 4.35Å; Y261-T284 HydrophobicContact CE2-CG2 3.6Å
285	E	91.7	Very high	76.8	Confident	102 Å²	102	66.3 Å²	66.3	48%	0.477	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	134.3	-179.7	-174.7	-175.8	166.8	0	0	110.3	T245 L246 M281 S283	T245-E285 HydrophobicContact CG2-CG 3.76Å; T245-E285 WeakPolarHBondContact CG2-OE1 3.39Å; L246-E285 CarbonylContact O-C 3.55Å; L246-E285 VanDerWaalsContact O-CA 3.24Å; L246-E285 WeakPolarHBondContact O-CA 3.46Å; M281-E285 WeakPolarHBondContact CE-O 3.29Å; S283-E285 VanDerWaalsContact C-N 3.3Å; S283-E285 PolarHBondContact OG-N 2.99Å; S283-E285 PolarHBondContact OG-O 3.06Å
286	L	87.2	Confident	76.9	Confident	38 Å²	38	64 Å²	64	20%	0.199	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	121.6	179	-178.8	66.2	0	0	0	111.9	L246 W248 V263 A276 T277 M281 V288	L246-L286 PolarHBondContact N-O 2.71Å; L246-L286 PolarHBondContact O-N 3.41Å; W248-L286 HydrophobicContact CH2-CB 4Å; W248-L286 HydrophobicContact CZ3-CB 4.22Å; V263-L286 HydrophobicContact CB-CD2 3.71Å; V263-L286 HydrophobicContact CG1-CD2 4.02Å; V263-L286 HydrophobicContact CG2-CD2 3.69Å; A276-L286 HydrophobicContact CB-CD2 3.81Å; T277-L286 HydrophobicContact CG2-CD2 3.93Å; M281-L286 HydrophobicContact CE-CB 3.82Å; M281-L286 HydrophobicContact CE-CD1 4.39Å; M281-L286 HydrophobicContact SD-CB 4Å; M281-L286 HydrophobicContact SD-CD1 4.11Å; M281-L286 HydrophobicContact SD-CD2 3.99Å; M281-L286 HydrophobicContact SD-CG 4.26Å; L286-V288 HydrophobicContact CD2-CG2 4.13Å; L286-V288 HydrophobicContact CG-CG2 4.31Å; L286-V288 PolarHBondContact O-N 3.14Å
287	T	85.5	Confident	77.4	Confident	58 Å²	58	62.7 Å²	62.7	36%	0.356	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	109.5	163.4	-48.9	0	0	0	0	110.5	R243 C244 T245 I289	R243-T287 HydrophobicContact CB-CG2 4.24Å; C244-T287 CarbonylContact O-C 3.5Å; C244-T287 WeakPolarHBondContact O-CA 3.21Å; T245-T287 PolarHBondContact OG1-OG1 2.89Å; T287-I289 HydrophobicContact CG2-CG2 4Å
288	V	75.2	Confident	78.4	Confident	6 Å²	6	63.4 Å²	63.4	4%	0.036	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	126.8	171.9	-171.6	0	0	0	0	108.5	R243 C244 L246 F265 A276 L286 L291 F299	R243-V288 CarbonylContact C-O 3.53Å; R243-V288 WeakPolarHBondContact CA-O 3.26Å; R243-V288 WeakPolarHBondContact CB-O 3.28Å; C244-V288 PolarHBondContact N-O 3.14Å; C244-V288 PolarHBondContact O-N 2.73Å; L246-V288 HydrophobicContact CD1-CG2 3.58Å; L246-V288 HydrophobicContact CG-CG2 4.15Å; F265-V288 HydrophobicContact CD1-CG1 4.32Å; F265-V288 HydrophobicContact CG-CG1 4.47Å; A276-V288 HydrophobicContact CB-CG1 3.96Å; A276-V288 HydrophobicContact CB-CG2 3.81Å; L286-V288 HydrophobicContact CD2-CG2 4.13Å; L286-V288 HydrophobicContact CG-CG2 4.31Å; L286-V288 PolarHBondContact O-N 3.14Å; V288-L291 HydrophobicContact CB-CD1 4.41Å; V288-L291 HydrophobicContact CG1-CD1 4.23Å; V288-L291 HydrophobicContact CG1-CD2 3.97Å; V288-L291 HydrophobicContact CG1-CG 4.17Å; V288-F299 HydrophobicContact CB-CE1 4.16Å; V288-F299 HydrophobicContact CG1-CE1 4.17Å; V288-F299 HydrophobicContact CG2-CD1 4.3Å; V288-F299 HydrophobicContact CG2-CE1 4.02Å
289	I	74	Confident	80	Confident	94 Å²	94	54.8 Å²	54.8	48%	0.482	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	171.2	-174.5	64.9	169.5	0	0	0	111.8	T242 R243 T287 L291	T242-I289 CarbonylContact O-C 3.51Å; R243-I289 HydrophobicContact CB-CB 4.33Å; R243-I289 HydrophobicContact CB-CG2 3.9Å; T287-I289 HydrophobicContact CG2-CG2 4Å; I289-L291 PolarHBondContact O-N 3.13Å
290	N	62.5	Low	81	Confident	138 Å²	138	52 Å²	52	74%	0.738	28%	0.28	S	S	*	.	S	Bend	trans	61.5	25.8	-179.9	-53.1	-33.4	0	0	0	114.2	T242	T242-N290 PolarHBondContact O-N 3.06Å
291	L	71.3	Confident	81.6	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.016	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-72.6	156.4	169.6	-61.7	175.9	0	0	0	110.2	T242 F265 V288 I289 Y297 F299 L322	T242-L291 WeakPolarHBondContact CA-O 3.3Å; T242-L291 PolarHBondContact O-N 3.07Å; F265-L291 HydrophobicContact CD2-CD2 3.55Å; F265-L291 HydrophobicContact CE2-CD2 3.58Å; F265-L291 HydrophobicContact CG-CD2 4.39Å; F265-L291 HydrophobicContact CZ-CD2 4.43Å; V288-L291 HydrophobicContact CB-CD1 4.41Å; V288-L291 HydrophobicContact CG1-CD1 4.23Å; V288-L291 HydrophobicContact CG1-CD2 3.97Å; V288-L291 HydrophobicContact CG1-CG 4.17Å; I289-L291 PolarHBondContact O-N 3.13Å; L291-Y297 HydrophobicContact CB-CD2 4.36Å; L291-Y297 HydrophobicContact CB-CE2 3.81Å; L291-Y297 HydrophobicContact CD1-CD2 4.42Å; L291-Y297 HydrophobicContact CD2-CD1 3.93Å; L291-Y297 HydrophobicContact CD2-CD2 4.29Å; L291-Y297 HydrophobicContact CD2-CE1 3.8Å; L291-Y297 HydrophobicContact CD2-CE2 4.14Å; L291-Y297 HydrophobicContact CD2-CG 4.21Å; L291-Y297 HydrophobicContact CG-CE2 4.42Å; L291-F299 HydrophobicContact CD1-CE1 4.44Å; L291-F299 HydrophobicContact CD1-CZ 3.99Å; L291-L322 HydrophobicContact CB-CD1 3.37Å; L291-L322 HydrophobicContact CB-CG 4.43Å; L291-L322 HydrophobicContact CD1-CD1 3.97Å; L291-L322 HydrophobicContact CD1-CD2 4.43Å; L291-L322 HydrophobicContact CG-CD1 4.32Å
292	H	75	Confident	81.9	Confident	107 Å²	107	49 Å²	49	50%	0.495	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-78.6	134	-177.6	-63.1	133.7	0	0	0	112.7	E267 S295 Y297	E267-H292 IonicContact OE2-CE1 2.68Å; E267-H292 IonicContact OE2-CG 3.81Å; E267-H292 IonicContact OE2-ND1 3.83Å; E267-H292 PolarHBondContact OE2-ND1 3.23Å; H292-S295 WeakPolarHBondContact O-CB 3.37Å; H292-S295 PolarHBondContact O-N 2.61Å; H292-Y297 WeakPolarHBondContact CB-OH 3.29Å; H292-Y297 PolarHBondContact N-OH 2.99Å; H292-Y297 PolarHBondContact ND1-OH 2.83Å; H292-Y297 VanDerWaalsContact ND1-OH 3.17Å
293	P	71.4	Confident	82.1	Confident	51 Å²	51	43.7 Å²	43.7	33%	0.331	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	143.1	172	-20.3	29.7	0	0	0	112.8	S241 T242 S295 A325	S241-P293 WeakPolarHBondContact O-CA 3.5Å; S241-P293 WeakPolarHBondContact O-CB 3.3Å; S241-P293 VanDerWaalsContact O-CG 3.29Å; S241-P293 WeakPolarHBondContact O-CG 3.38Å; T242-P293 HydrophobicContact CG2-CG 3.98Å; P293-S295 PolarHBondContact O-N 3.04Å; P293-S295 VanDerWaalsContact O-N 3.08Å; P293-A325 HydrophobicContact CB-CB 3.63Å; P293-A325 HydrophobicContact CG-CB 3.88Å
294	N	74.8	Confident	82.1	Confident	57 Å²	57	41 Å²	41	31%	0.305	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	0.3	-175.3	-157.2	68.4	0	0	0	115.5	Q321 L322 R323	N294-Q321 VanDerWaalsContact C-NE2 3.26Å; N294-Q321 PolarHBondContact O-NE2 3.39Å; N294-L322 WeakPolarHBondContact CA-O 3.37Å; N294-R323 PolarHBondContact N-O 3.35Å
295	S	71.9	Confident	81.6	Confident	23 Å²	23	39 Å²	39	16%	0.161	20%	0.203	C	C	.	.			trans	-86.5	158.6	175.5	-72.7	0	0	0	0	112.8	E267 H292 P293 Q321 L322	E267-S295 VanDerWaalsContact OE1-CB 3.29Å; E267-S295 WeakPolarHBondContact OE1-CB 3.43Å; E267-S295 PolarHBondContact OE1-OG 3.38Å; H292-S295 WeakPolarHBondContact O-CB 3.37Å; H292-S295 PolarHBondContact O-N 2.61Å; P293-S295 PolarHBondContact O-N 3.04Å; P293-S295 VanDerWaalsContact O-N 3.08Å; S295-Q321 PolarHBondContact O-NE2 3.42Å; S295-L322 WeakPolarHBondContact O-CB 3.36Å; S295-L322 PolarHBondContact O-N 2.89Å
296	T	78.3	Confident	80.6	Confident	16 Å²	16	39 Å²	39	10%	0.098	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140.5	177.6	36.8	0	0	0	0	110.7	E267 I268 I319 V320 Q321 Y495	E267-T296 CarbonylContact C-O 3.57Å; E267-T296 WeakPolarHBondContact CA-O 3.27Å; E267-T296 WeakPolarHBondContact CG-O 3.28Å; I268-T296 PolarHBondContact N-O 3.48Å; T296-I319 HydrophobicContact CG2-CG2 4.24Å; T296-V320 CarbonylContact C-O 3.53Å; T296-V320 WeakPolarHBondContact CA-O 3.47Å; T296-Q321 HydrophobicContact CG2-CB 4.02Å; T296-Q321 HydrophobicContact CG2-CG 4.45Å; T296-Q321 VanDerWaalsContact CG2-OE1 3.24Å; T296-Y495 WeakPolarHBondContact CB-OH 3.39Å; T296-Y495 HydrophobicContact CG2-CE1 4.39Å; T296-Y495 HydrophobicContact CG2-CE2 4.11Å; T296-Y495 WeakPolarHBondContact CG2-OH 3.49Å; T296-Y495 PolarHBondContact OG1-OH 2.94Å
297	Y	79.9	Confident	79.7	Confident	6 Å²	6	41.3 Å²	41.3	2%	0.024	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	147.4	-178.7	-67.5	-90	0	0	0	111.9	F265 R266 E267 L291 H292 I319 V320 L322	F265-Y297 AromaticContact CD2-CD1 3.93Å; F265-Y297 HydrophobicContact CD2-CD1 3.93Å; F265-Y297 HydrophobicContact CD2-CE1 4.04Å; F265-Y297 HydrophobicContact CE2-CE1 4.32Å; R266-Y297 VanDerWaalsContact C-CD1 3.45Å; R266-Y297 VanDerWaalsContact O-CA 3.27Å; R266-Y297 WeakPolarHBondContact O-CA 3.31Å; R266-Y297 WeakPolarHBondContact O-CD1 3.37Å; E267-Y297 HydrophobicContact CB-CD1 4.05Å; E267-Y297 HydrophobicContact CB-CE1 3.56Å; E267-Y297 HydrophobicContact CG-CD1 4.46Å; E267-Y297 HydrophobicContact CG-CE1 3.9Å; E267-Y297 HydrophobicContact CG-CE2 4.45Å; E267-Y297 PolarHBondContact OE2-OH 3.39Å; L291-Y297 HydrophobicContact CB-CD2 4.36Å; L291-Y297 HydrophobicContact CB-CE2 3.81Å; L291-Y297 HydrophobicContact CD1-CD2 4.42Å; L291-Y297 HydrophobicContact CD2-CD1 3.93Å; L291-Y297 HydrophobicContact CD2-CD2 4.29Å; L291-Y297 HydrophobicContact CD2-CE1 3.8Å; L291-Y297 HydrophobicContact CD2-CE2 4.14Å; L291-Y297 HydrophobicContact CD2-CG 4.21Å; L291-Y297 HydrophobicContact CG-CE2 4.42Å; H292-Y297 WeakPolarHBondContact CB-OH 3.29Å; H292-Y297 PolarHBondContact N-OH 2.99Å; H292-Y297 PolarHBondContact ND1-OH 2.83Å; H292-Y297 VanDerWaalsContact ND1-OH 3.17Å; Y297-I319 WeakPolarHBondContact O-CA 3.32Å; Y297-V320 PolarHBondContact N-O 2.86Å; Y297-V320 PolarHBondContact O-N 3.46Å; Y297-L322 HydrophobicContact CD2-CG 4.19Å; Y297-L322 HydrophobicContact CE2-CD1 4.49Å; Y297-L322 HydrophobicContact CE2-CG 4.36Å
298	E	90.5	Very high	79.1	Confident	27 Å²	27	40.9 Å²	40.9	13%	0.126	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	151	159.6	60.6	-179.5	-116.8	0	0	109.7	F265 R266 I268 W273	F265-E298 WeakPolarHBondContact CA-O 3.49Å; R266-E298 HydrophobicContact CG-CG 3.61Å; R266-E298 IonicContact CZ-OE1 3.74Å; R266-E298 IonicContact CZ-OE2 3.57Å; R266-E298 PolarHBondContact N-O 3.24Å; R266-E298 IonicContact NE-OE1 2.85Å; R266-E298 PolarHBondContact NE-OE1 3.4Å; R266-E298 IonicContact NE-OE2 2.75Å; R266-E298 IonicContact NH2-OE1 2.69Å; R266-E298 PolarHBondContact NH2-OE1 3.37Å; R266-E298 IonicContact NH2-OE2 3.1Å; R266-E298 PolarHBondContact NH2-OE2 3.12Å; R266-E298 PolarHBondContact O-N 2.7Å; R266-E298 VanDerWaalsContact O-N 3.08Å; I268-E298 HydrophobicContact CD1-CB 3.79Å; I268-E298 HydrophobicContact CD1-CG 3.54Å; I268-E298 WeakPolarHBondContact CD1-OE2 3.41Å; W273-E298 HydrophobicContact CH2-CG 3.71Å; W273-E298 WeakPolarHBondContact CH2-OE1 3.38Å; W273-E298 HydrophobicContact CZ2-CG 4.27Å; W273-E298 WeakPolarHBondContact CZ2-OE1 3.4Å; W273-E298 HydrophobicContact CZ3-CG 4.3Å
299	F	91.3	Very high	79.2	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	152.6	-179.4	-57	-87.6	0	0	0	110.1	I236 C244 L246 Q264 F265 V288 L291 I316 S317 V320	I236-F299 HydrophobicContact CD1-CD2 3.83Å; I236-F299 HydrophobicContact CD1-CE2 4.08Å; C244-F299 WeakPolarHBondContact SG-CZ 3.42Å; L246-F299 HydrophobicContact CD1-CB 3.94Å; L246-F299 HydrophobicContact CD1-CD1 3.57Å; L246-F299 HydrophobicContact CD1-CE1 4.26Å; L246-F299 HydrophobicContact CD1-CG 3.75Å; L246-F299 HydrophobicContact CD2-CB 4.14Å; L246-F299 HydrophobicContact CD2-CD1 4.17Å; L246-F299 HydrophobicContact CD2-CD2 3.69Å; L246-F299 HydrophobicContact CD2-CE2 4.15Å; L246-F299 HydrophobicContact CD2-CG 3.71Å; L246-F299 HydrophobicContact CG-CD1 4.38Å; L246-F299 HydrophobicContact CG-CG 4.34Å; Q264-F299 CarbonylContact O-C 3.43Å; Q264-F299 WeakPolarHBondContact O-CA 3.4Å; F265-F299 HydrophobicContact CB-CD1 3.38Å; F265-F299 HydrophobicContact CB-CE1 3.42Å; F265-F299 VanDerWaalsContact CB-CE1 3.42Å; F265-F299 HydrophobicContact CB-CG 4.43Å; F265-F299 HydrophobicContact CB-CZ 4.49Å; F265-F299 HydrophobicContact CG-CE1 4.32Å; V288-F299 HydrophobicContact CB-CE1 4.16Å; V288-F299 HydrophobicContact CG1-CE1 4.17Å; V288-F299 HydrophobicContact CG2-CD1 4.3Å; V288-F299 HydrophobicContact CG2-CE1 4.02Å; L291-F299 HydrophobicContact CD1-CE1 4.44Å; L291-F299 HydrophobicContact CD1-CZ 3.99Å; F299-I316 CarbonylContact O-C 3.54Å; F299-I316 WeakPolarHBondContact O-CA 3.44Å; F299-S317 PolarHBondContact N-OG 3.35Å; F299-S317 PolarHBondContact O-N 3.37Å; F299-V320 HydrophobicContact CE2-CB 4.38Å; F299-V320 HydrophobicContact CE2-CG1 3.64Å; F299-V320 HydrophobicContact CZ-CG1 4.23Å
300	R	92.7	Very high	79.7	Confident	58 Å²	58	42.9 Å²	42.9	22%	0.219	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	138.2	169	71.2	-175.6	179.9	-179.4	2.7	111.2	Q264 W273 F302 C314 L315 I316	Q264-R300 HydrophobicContact CB-CG 3.94Å; Q264-R300 PolarHBondContact N-O 2.91Å; Q264-R300 PolarHBondContact O-N 2.9Å; Q264-R300 VanDerWaalsContact OE1-CZ 3.27Å; W273-R300 HydrophobicContact CD2-CG 4.24Å; W273-R300 HydrophobicContact CE3-CG 3.74Å; W273-R300 VanDerWaalsContact CG-CZ 3.46Å; W273-R300 HydrophobicContact CH2-CB 3.82Å; W273-R300 HydrophobicContact CH2-CG 3.78Å; W273-R300 HydrophobicContact CZ2-CG 4.27Å; W273-R300 HydrophobicContact CZ3-CB 3.88Å; W273-R300 HydrophobicContact CZ3-CG 3.51Å; R300-F302 HydrophobicContact CG-CE2 3.8Å; R300-F302 HydrophobicContact CG-CZ 4.44Å; R300-C314 HydrophobicContact CB-CB 4.08Å; R300-C314 HydrophobicContact CG-CB 4.48Å; R300-L315 CarbonylContact C-O 3.5Å; R300-L315 VanDerWaalsContact CA-O 3.27Å; R300-L315 WeakPolarHBondContact CA-O 3.43Å; R300-I316 HydrophobicContact CB-CG1 4.12Å
301	V	92.9	Very high	80.7	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.6	179	-170.1	0	0	0	0	109.5	P231 L234 W248 Y261 V263 C314 L315	P231-V301 HydrophobicContact CG-CB 4.02Å; P231-V301 HydrophobicContact CG-CG1 3.87Å; L234-V301 HydrophobicContact CD1-CG2 4.09Å; L234-V301 HydrophobicContact CD2-CG2 4.01Å; W248-V301 HydrophobicContact CD2-CG1 3.95Å; W248-V301 HydrophobicContact CD2-CG2 4.15Å; W248-V301 HydrophobicContact CE3-CG1 4.41Å; W248-V301 HydrophobicContact CE3-CG2 3.89Å; W248-V301 HydrophobicContact CG-CG1 4.39Å; W248-V301 HydrophobicContact CH2-CG1 4.45Å; W248-V301 HydrophobicContact CZ2-CG1 3.97Å; W248-V301 HydrophobicContact CZ3-CG2 4.16Å; Y261-V301 HydrophobicContact CD1-CG1 4.14Å; Y261-V301 HydrophobicContact CG-CG1 4.42Å; V263-V301 HydrophobicContact CG2-CG1 4.33Å; V263-V301 HydrophobicContact CG2-CG2 4.23Å; V301-C314 WeakPolarHBondContact O-CA 3.29Å; V301-C314 WeakPolarHBondContact O-CB 3.35Å; V301-L315 PolarHBondContact N-O 2.83Å; V301-L315 PolarHBondContact O-N 2.8Å
302	F	91.3	Very high	80.9	Confident	25 Å²	25	45 Å²	45	11%	0.11	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	144.5	169.8	-61.8	-95.3	0	0	0	109.5	Y261 V262 R300 L310 S311 C314	Y261-F302 CarbonylContact C-O 3.55Å; Y261-F302 VanDerWaalsContact CA-O 3.25Å; Y261-F302 WeakPolarHBondContact CA-O 3.12Å; V262-F302 HydrophobicContact CB-CB 4.5Å; V262-F302 PolarHBondContact N-O 2.81Å; V262-F302 PolarHBondContact O-N 2.92Å; R300-F302 HydrophobicContact CG-CE2 3.8Å; R300-F302 HydrophobicContact CG-CZ 4.44Å; F302-L310 HydrophobicContact CB-CB 4.34Å; F302-L310 HydrophobicContact CB-CD1 4.38Å; F302-L310 HydrophobicContact CB-CD2 4.13Å; F302-L310 HydrophobicContact CD1-CB 4.24Å; F302-L310 HydrophobicContact CD1-CD1 4.36Å; F302-L310 HydrophobicContact CG-CD1 4.19Å; F302-S311 WeakPolarHBondContact CD1-O 3.39Å; F302-C314 HydrophobicContact CD1-CB 3.73Å; F302-C314 HydrophobicContact CD2-CB 4.15Å; F302-C314 HydrophobicContact CE1-CB 3.61Å; F302-C314 HydrophobicContact CE2-CB 4.03Å; F302-C314 HydrophobicContact CG-CB 4Å; F302-C314 HydrophobicContact CZ-CB 3.76Å
303	S	89.7	Confident	81.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	146.8	159	-61.1	0	0	0	0	109.1	P228 S229 P231 W260 L310 S311	P228-S303 WeakPolarHBondContact CG-O 3.3Å; S229-S303 WeakPolarHBondContact O-CB 3.45Å; S229-S303 PolarHBondContact O-OG 2.86Å; P231-S303 WeakPolarHBondContact CD-OG 3.18Å; W260-S303 CarbonylContact O-C 3.57Å; W260-S303 WeakPolarHBondContact O-CA 3.47Å; S303-L310 CarbonylContact O-C 3.51Å; S303-L310 WeakPolarHBondContact O-CA 3.26Å; S303-S311 PolarHBondContact N-OG 3.13Å; S303-S311 PolarHBondContact O-N 2.82Å
304	C	85.8	Confident	82	Confident	5 Å²	5	45.6 Å²	45.6	3%	0.034	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.8	-179.8	-177.9	0	0	0	0	109	W260 V262 P280 D309 L310	W260-C304 HydrophobicContact CB-CB 4.17Å; W260-C304 PolarHBondContact N-O 3.35Å; W260-C304 PolarHBondContact O-N 2.88Å; V262-C304 HydrophobicContact CG2-CB 4.44Å; P280-C304 HydrophobicContact CB-CB 4.25Å; C304-D309 WeakPolarHBondContact CA-O 3.36Å; C304-L310 HydrophobicContact CB-CD2 3.75Å
305	G	79.8	Confident	82.7	Confident	6 Å²	6	44.8 Å²	44.8	6%	0.062	25%	0.252	C	S	.	.			trans	-84.9	173.2	-178.2	0	0	0	0	0	113.6	S307 G308 D309	G305-S307 PolarHBondContact O-N 2.95Å; G305-G308 PolarHBondContact O-N 2.78Å; G305-D309 PolarHBondContact N-O 2.85Å
306	P	71.2	Confident	83.5	Confident	102 Å²	102	48.1 Å²	48.1	66%	0.662	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.3	179	-21.7	33.1	0	0	0	114.9	S258 W260	S258-P306 WeakPolarHBondContact O-CD 3.41Å; W260-P306 HydrophobicContact CZ3-CB 4.21Å; W260-P306 HydrophobicContact CZ3-CG 4.1Å
307	S	69.4	Low	83.9	Confident	86 Å²	86	48.1 Å²	48.1	60%	0.601	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-8.1	173.8	46.4	0	0	0	0	114.2	G305 D309	G305-S307 PolarHBondContact O-N 2.95Å; S307-D309 VanDerWaalsContact C-N 3.34Å; S307-D309 VanDerWaalsContact CB-OD2 3.26Å; S307-D309 WeakPolarHBondContact CB-OD2 3.36Å; S307-D309 PolarHBondContact OG-OD2 3.45Å
308	G	72.4	Confident	84	Confident	48 Å²	48	54.3 Å²	54.3	50%	0.495	30%	0.301	S	S	.	.	S	Bend	trans	87.2	-3.9	-170.1	0	0	0	0	0	114.6	G305 L310	G305-G308 PolarHBondContact O-N 2.78Å; G308-L310 PolarHBondContact O-N 2.9Å
309	D	77.3	Confident	83.7	Confident	72 Å²	72	56.1 Å²	56.1	39%	0.385	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-67.6	129.2	179.5	-65.1	-58.6	0	0	0	111.6	P228 C304 G305 S307	P228-D309 WeakPolarHBondContact CG-O 3.29Å; C304-D309 WeakPolarHBondContact CA-O 3.36Å; G305-D309 PolarHBondContact N-O 2.85Å; S307-D309 VanDerWaalsContact C-N 3.34Å; S307-D309 VanDerWaalsContact CB-OD2 3.26Å; S307-D309 WeakPolarHBondContact CB-OD2 3.36Å; S307-D309 PolarHBondContact OG-OD2 3.45Å
310	L	85	Confident	83.3	Confident	70 Å²	70	56.8 Å²	56.8	37%	0.366	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-82.7	153.8	174.2	-61	-175	0	0	0	112.4	V262 F302 S303 C304 G308	V262-L310 HydrophobicContact CB-CD2 4.16Å; V262-L310 HydrophobicContact CG2-CD2 3.86Å; F302-L310 HydrophobicContact CB-CB 4.34Å; F302-L310 HydrophobicContact CB-CD1 4.38Å; F302-L310 HydrophobicContact CB-CD2 4.13Å; F302-L310 HydrophobicContact CD1-CB 4.24Å; F302-L310 HydrophobicContact CD1-CD1 4.36Å; F302-L310 HydrophobicContact CG-CD1 4.19Å; S303-L310 CarbonylContact O-C 3.51Å; S303-L310 WeakPolarHBondContact O-CA 3.26Å; C304-L310 HydrophobicContact CB-CD2 3.75Å; G308-L310 PolarHBondContact O-N 2.9Å
311	S	83.9	Confident	82.9	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.021	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-63.6	134.3	172.9	55.7	0	0	0	0	111	P228 F302 S303 Q313	P228-S311 WeakPolarHBondContact O-CA 3.38Å; P228-S311 WeakPolarHBondContact O-CB 3.39Å; F302-S311 WeakPolarHBondContact CD1-O 3.39Å; S303-S311 PolarHBondContact N-OG 3.13Å; S303-S311 PolarHBondContact O-N 2.82Å; S311-Q313 CarbonylContact C-O 3.46Å; S311-Q313 VanDerWaalsContact CB-O 3.28Å; S311-Q313 WeakPolarHBondContact CB-O 3.39Å; S311-Q313 PolarHBondContact O-N 2.98Å; S311-Q313 VanDerWaalsContact O-N 3.16Å; S311-Q313 PolarHBondContact OG-O 3.43Å
312	Q	75	Confident	82.1	Confident	182 Å²	182	58.9 Å²	58.9	85%	0.85	33%	0.327	S	S	*	.	S	Bend	trans	-62.8	-24.6	-178.7	-73.4	-167.6	-8.2	0	0	113.4
313	Q	83.7	Confident	81	Confident	139 Å²	139	62.3 Å²	62.3	65%	0.65	34%	0.339	S	S	*	.	S	Bend	trans	-106.6	150.2	168	-68.9	177.4	-16.1	0	0	109.2	P230 S311	P230-Q313 HydrophobicContact CB-CB 4.28Å; P230-Q313 HydrophobicContact CG-CB 4.11Å; S311-Q313 CarbonylContact C-O 3.46Å; S311-Q313 VanDerWaalsContact CB-O 3.28Å; S311-Q313 WeakPolarHBondContact CB-O 3.39Å; S311-Q313 PolarHBondContact O-N 2.98Å; S311-Q313 VanDerWaalsContact O-N 3.16Å; S311-Q313 PolarHBondContact OG-O 3.43Å
314	C	85.4	Confident	79.3	Confident	33 Å²	33	65.6 Å²	65.6	22%	0.223	36%	0.361	C	S	.	.			trans	-114.8	154.7	166.7	50.6	0	0	0	0	109.1	R300 V301 F302	R300-C314 HydrophobicContact CB-CB 4.08Å; R300-C314 HydrophobicContact CG-CB 4.48Å; V301-C314 WeakPolarHBondContact O-CA 3.29Å; V301-C314 WeakPolarHBondContact O-CB 3.35Å; F302-C314 HydrophobicContact CD1-CB 3.73Å; F302-C314 HydrophobicContact CD2-CB 4.15Å; F302-C314 HydrophobicContact CE1-CB 3.61Å; F302-C314 HydrophobicContact CE2-CB 4.03Å; F302-C314 HydrophobicContact CG-CB 4Å; F302-C314 HydrophobicContact CZ-CB 3.76Å
315	L	89.1	Confident	77.6	Confident	39 Å²	39	68 Å²	68	20%	0.204	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	113.8	169.5	-175.8	63.2	0	0	0	107.9	P231 V232 L234 W248 R300 V301	P231-L315 HydrophobicContact CB-CD2 4.21Å; P231-L315 HydrophobicContact CG-CB 3.88Å; P231-L315 HydrophobicContact CG-CD2 4.04Å; P231-L315 WeakPolarHBondContact O-CD2 3.5Å; V232-L315 VanDerWaalsContact C-CD2 3.47Å; L234-L315 HydrophobicContact CB-CD2 3.46Å; L234-L315 VanDerWaalsContact CB-CD2 3.46Å; L234-L315 HydrophobicContact CB-CG 3.66Å; L234-L315 HydrophobicContact CD2-CG 4.31Å; W248-L315 HydrophobicContact CB-CD2 4.37Å; R300-L315 CarbonylContact C-O 3.5Å; R300-L315 VanDerWaalsContact CA-O 3.27Å; R300-L315 WeakPolarHBondContact CA-O 3.43Å; V301-L315 PolarHBondContact N-O 2.83Å; V301-L315 PolarHBondContact O-N 2.8Å
316	I	88.2	Confident	75.8	Confident	94 Å²	94	74.8 Å²	74.8	48%	0.482	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	143	-179.4	-56	176.9	0	0	0	108.6	F299 R300	F299-I316 CarbonylContact O-C 3.54Å; F299-I316 WeakPolarHBondContact O-CA 3.44Å; R300-I316 HydrophobicContact CB-CG1 4.12Å
317	S	87.4	Confident	74.2	Confident	15 Å²	15	76.4 Å²	76.4	11%	0.105	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-85.6	164	177.1	73.2	0	0	0	0	112.5	F299	F299-S317 PolarHBondContact N-OG 3.35Å; F299-S317 PolarHBondContact O-N 3.37Å
318	D	81.7	Confident	72.3	Confident	136 Å²	136	77.9 Å²	77.9	73%	0.727	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-59.7	160	154.3	-62	-58.9	0	0	0	110.8	V320	D318-V320 PolarHBondContact O-N 2.9Å
319	I	84.2	Confident	70.3	Confident	65 Å²	65	82.1 Å²	82.1	33%	0.333	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-74.9	123.6	178.7	-59.4	175.2	0	0	0	109.4	I268 T296 Y297 Y495	I268-I319 HydrophobicContact CD1-CD1 4.06Å; I268-I319 HydrophobicContact CD1-CG1 4.05Å; I268-I319 HydrophobicContact CD1-CG2 4.27Å; I268-I319 HydrophobicContact CG1-CD1 4.35Å; I268-I319 HydrophobicContact CG1-CG1 4.47Å; I268-I319 HydrophobicContact CG1-CG2 3.83Å; T296-I319 HydrophobicContact CG2-CG2 4.24Å; Y297-I319 WeakPolarHBondContact O-CA 3.32Å; I319-Y495 HydrophobicContact CD1-CE1 4.04Å; I319-Y495 HydrophobicContact CG2-CE1 4.15Å
320	V	82.9	Confident	68.2	Low	14 Å²	14	82.1 Å²	82.1	9%	0.085	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	141.1	169.2	83.4	0	0	0	0	110.5	I236 V239 T296 Y297 F299 D318 L322	I236-V320 HydrophobicContact CD1-CB 3.97Å; I236-V320 HydrophobicContact CG2-CG2 4.16Å; V239-V320 HydrophobicContact CB-CG2 4.14Å; V239-V320 HydrophobicContact CG1-CG2 3.44Å; V239-V320 VanDerWaalsContact CG1-CG2 3.44Å; V239-V320 HydrophobicContact CG2-CG2 3.51Å; T296-V320 CarbonylContact C-O 3.53Å; T296-V320 WeakPolarHBondContact CA-O 3.47Å; Y297-V320 PolarHBondContact N-O 2.86Å; Y297-V320 PolarHBondContact O-N 3.46Å; F299-V320 HydrophobicContact CE2-CB 4.38Å; F299-V320 HydrophobicContact CE2-CG1 3.64Å; F299-V320 HydrophobicContact CZ-CG1 4.23Å; D318-V320 PolarHBondContact O-N 2.9Å; V320-L322 HydrophobicContact CG1-CD2 3.94Å; V320-L322 HydrophobicContact CG2-CD2 4.35Å
321	Q	84.6	Confident	65.9	Low	102 Å²	102	81.5 Å²	81.5	48%	0.477	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116.2	165	170.9	66.3	77.2	0	0	108	N294 S295 T296	N294-Q321 VanDerWaalsContact C-NE2 3.26Å; N294-Q321 PolarHBondContact O-NE2 3.39Å; S295-Q321 PolarHBondContact O-NE2 3.42Å; T296-Q321 HydrophobicContact CG2-CB 4.02Å; T296-Q321 HydrophobicContact CG2-CG 4.45Å; T296-Q321 VanDerWaalsContact CG2-OE1 3.24Å
322	L	75.2	Confident	63.6	Low	0 Å²	0	89.9 Å²	89.9	0%	0	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-72.8	149.3	171.9	-69.1	-145	0	0	0	110.8	V239 L291 N294 S295 Y297 V320	V239-L322 HydrophobicContact CG1-CD2 3.6Å; L291-L322 HydrophobicContact CB-CD1 3.37Å; L291-L322 HydrophobicContact CB-CG 4.43Å; L291-L322 HydrophobicContact CD1-CD1 3.97Å; L291-L322 HydrophobicContact CD1-CD2 4.43Å; L291-L322 HydrophobicContact CG-CD1 4.32Å; N294-L322 WeakPolarHBondContact CA-O 3.37Å; S295-L322 WeakPolarHBondContact O-CB 3.36Å; S295-L322 PolarHBondContact O-N 2.89Å; Y297-L322 HydrophobicContact CD2-CG 4.19Å; Y297-L322 HydrophobicContact CE2-CD1 4.49Å; Y297-L322 HydrophobicContact CE2-CG 4.36Å; V320-L322 HydrophobicContact CG1-CD2 3.94Å; V320-L322 HydrophobicContact CG2-CD2 4.35Å
323	R	69.2	Low	62.2	Low	97 Å²	97	83.9 Å²	83.9	37%	0.366	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-66.6	151	-179.9	-54.6	-174.6	-159.5	170	8.5	110.3	V239 D240 S241 N294	V239-R323 PolarHBondContact O-NE 3.06Å; V239-R323 PolarHBondContact O-NH2 2.83Å; D240-R323 PolarHBondContact O-N 3.49Å; S241-R323 WeakPolarHBondContact CA-O 3.44Å; S241-R323 WeakPolarHBondContact CB-O 3.42Å; N294-R323 PolarHBondContact N-O 3.35Å
324	P	54	Low	61	Low	69 Å²	69	85.6 Å²	85.6	45%	0.448	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-56.4	143.6	166.4	-20.8	30.9	0	0	0	111.1	L326	P324-L326 PolarHBondContact O-N 2.82Å
325	A	49.4	Very low	60.5	Low	56 Å²	56	88.3 Å²	88.3	46%	0.463	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-66	120	166.6	0	0	0	0	0	108.7	P293 L327	P293-A325 HydrophobicContact CB-CB 3.63Å; P293-A325 HydrophobicContact CG-CB 3.88Å; A325-L327 PolarHBondContact O-N 3.3Å
326	L	43.7	Very low	60.2	Low	149 Å²	149	90.9 Å²	90.9	78%	0.78	50%	0.502	S	S	*	.			trans	-70.4	100.9	175.2	-67.5	177.1	0	0	0	109.4	P324 S328	P324-L326 PolarHBondContact O-N 2.82Å; L326-S328 PolarHBondContact O-N 2.81Å
327	L	35.8	Very low	60.1	Low	135 Å²	135	87.1 Å²	87.1	71%	0.707	48%	0.483	S	S	*	.			trans	-56.4	122.7	167.9	-81.1	164	0	0	0	109	A325 T329	A325-L327 PolarHBondContact O-N 3.3Å; L327-T329 PolarHBondContact O-N 2.82Å
328	S	30.6	Very low	60.3	Low	117 Å²	117	89.5 Å²	89.5	82%	0.818	50%	0.504	S	S	*	.			trans	-76.8	67.8	-172.4	-179.7	0	0	0	0	112.4	L326	L326-S328 PolarHBondContact O-N 2.81Å
329	T	30.3	Very low	60.8	Low	137 Å²	137	86.3 Å²	86.3	84%	0.84	49%	0.491	S	S	*	.			trans	-82.5	-13.2	174.9	47.5	0	0	0	0	113.7	L327 G331	L327-T329 PolarHBondContact O-N 2.82Å; T329-G331 PolarHBondContact O-N 3.28Å
330	C	33.5	Very low	61.3	Low	73 Å²	73	83.5 Å²	83.5	49%	0.493	48%	0.477	S	S	.	.	S	Bend	trans	-72.2	115.3	173.4	-157.8	0	0	0	0	110.1
331	G	35.8	Very low	61.8	Low	56 Å²	56	84.3 Å²	84.3	58%	0.577	48%	0.484	S	S	*	.			trans	-62.8	164.4	179.3	0	0	0	0	0	113.1	T329 V333	T329-G331 PolarHBondContact O-N 3.28Å; G331-V333 PolarHBondContact O-N 3.1Å
332	Y	36.2	Very low	62.3	Low	179 Å²	179	81 Å²	81	70%	0.702	47%	0.474	S	S	*	.			trans	-52.6	84.5	-173.7	-90.8	-92.8	0	0	0	115.1
333	V	46.1	Very low	63.1	Low	56 Å²	56	81 Å²	81	34%	0.339	47%	0.474	S	S	.	.			trans	-86.7	112.6	169.1	177.9	0	0	0	0	109.4	G331 T335 A362	G331-V333 PolarHBondContact O-N 3.1Å; V333-T335 VanDerWaalsContact C-N 3.32Å; V333-A362 HydrophobicContact CB-CB 4.32Å; V333-A362 HydrophobicContact CG1-CB 4.44Å; V333-A362 HydrophobicContact CG2-CB 3.54Å
334	K	56.7	Low	64.2	Low	175 Å²	175	81.3 Å²	81.3	76%	0.761	48%	0.483	S	S	*	.			trans	-90	7.2	-177.7	-64.6	-175.4	177.4	-179	0	113.7
335	T	76.6	Confident	65.7	Low	91 Å²	91	80.2 Å²	80.2	56%	0.558	48%	0.475	S	S	*	.	S	Bend	trans	-124	151.4	-173	51	0	0	0	0	111.3	V333 N412	V333-T335 VanDerWaalsContact C-N 3.32Å; T335-N412 PolarHBondContact O-ND2 2.68Å
336	I	81.7	Confident	67.2	Low	93 Å²	93	80.2 Å²	80.2	48%	0.477	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-56.4	146.8	161.4	-64.9	175.1	0	0	0	108.8	I414 Y416	I336-I414 HydrophobicContact CG1-CG2 3.89Å; I336-Y416 WeakPolarHBondContact CG2-O 3.36Å
337	P	87.1	Confident	68.6	Low	14 Å²	14	74.3 Å²	74.3	9%	0.091	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-60.9	162	178.3	-22.6	34.6	0	0	0	113.3	V360 V363 A410 N412 G415 S417	P337-V360 HydrophobicContact CB-CG1 3.99Å; P337-V363 HydrophobicContact CB-CG1 4.05Å; P337-V363 HydrophobicContact CG-CG1 4.2Å; P337-A410 HydrophobicContact CB-CB 3.67Å; P337-A410 HydrophobicContact CG-CB 4.24Å; P337-N412 HydrophobicContact CG-CB 3.83Å; P337-G415 WeakPolarHBondContact CD-O 3.38Å; P337-S417 WeakPolarHBondContact O-CB 3.22Å
338	A	90.4	Very high	70.5	Confident	65 Å²	65	72 Å²	72	54%	0.537	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-61.6	158.6	168	0	0	0	0	0	111.2	V360 S417	A338-V360 HydrophobicContact CB-CG1 3.97Å; A338-S417 VanDerWaalsContact O-CB 3.29Å; A338-S417 WeakPolarHBondContact O-CB 3.37Å
339	C	92.6	Very high	71.9	Confident	69 Å²	69	70.6 Å²	70.6	47%	0.466	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-67.1	127.9	171.8	-161.9	0	0	0	0	109.4	K418 P419	C339-K418 PolarHBondContact SG-O 3.32Å; C339-K418 VanDerWaalsContact SG-O 3.4Å; C339-P419 PolarHBondContact SG-O 2.89Å
340	P	94.9	Very high	73.7	Confident	6 Å²	6	65.6 Å²	65.6	4%	0.039	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-61.2	160.3	169.9	-21.1	33	0	0	0	111.8	V360 Y366 V408 A410 S417 S420	P340-V360 HydrophobicContact CB-CG2 4.32Å; P340-V360 HydrophobicContact CG-CG2 4.27Å; P340-Y366 HydrophobicContact CG-CD1 4.43Å; P340-V408 HydrophobicContact CB-CB 4.02Å; P340-V408 HydrophobicContact CB-CG1 4.13Å; P340-V408 HydrophobicContact CG-CB 4.17Å; P340-V408 HydrophobicContact CG-CG1 4Å; P340-A410 HydrophobicContact CG-CB 3.8Å; P340-S417 WeakPolarHBondContact CD-OG 3.34Å; P340-S420 VanDerWaalsContact O-CB 3.3Å; P340-S420 WeakPolarHBondContact O-CB 3.32Å
341	S	94.1	Very high	75.5	Confident	32 Å²	32	65.1 Å²	65.1	22%	0.224	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-69	163.3	165.9	63.8	0	0	0	0	111.7	D358 S420	S341-D358 WeakPolarHBondContact CB-OD2 3.48Å; S341-D358 WeakPolarHBondContact OG-CB 3.42Å; S341-D358 VanDerWaalsContact OG-CG 3.23Å; S341-D358 PolarHBondContact OG-N 3.49Å; S341-D358 PolarHBondContact OG-OD2 3.33Å; S341-S420 VanDerWaalsContact O-CB 3.24Å; S341-S420 WeakPolarHBondContact O-CB 3.5Å
342	A	93.6	Very high	77.1	Confident	32 Å²	32	63.9 Å²	63.9	26%	0.264	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-58.5	134.5	172.5	0	0	0	0	0	109.9	N344 E421	A342-N344 PolarHBondContact O-N 3.39Å; A342-E421 WeakPolarHBondContact CA-O 3.36Å; A342-E421 HydrophobicContact CB-CB 4.23Å; A342-E421 WeakPolarHBondContact CB-O 3.09Å
343	P	93.8	Very high	79.3	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.006	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-69.7	117.6	179.8	26.5	-31.4	0	0	0	110	L355 W357 F406 V408 S420 S423	P343-L355 HydrophobicContact CB-CB 4.34Å; P343-L355 HydrophobicContact CB-CD2 4.37Å; P343-W357 HydrophobicContact CB-CE3 4.26Å; P343-F406 HydrophobicContact CG-CB 4Å; P343-F406 VanDerWaalsContact CG-O 3.25Å; P343-F406 WeakPolarHBondContact CG-O 3.38Å; P343-V408 HydrophobicContact CB-CG2 3.78Å; P343-V408 HydrophobicContact CG-CG2 3.86Å; P343-S420 WeakPolarHBondContact CD-OG 3.33Å; P343-S423 VanDerWaalsContact O-CB 3.27Å; P343-S423 WeakPolarHBondContact O-CB 3.32Å
344	N	90.8	Very high	81	Confident	102 Å²	102	53 Å²	53	55%	0.545	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	133.4	176.3	-72.2	-60.5	0	0	0	110.3	A342 T346 L355 T356	A342-N344 PolarHBondContact O-N 3.39Å; N344-T346 PolarHBondContact O-N 2.98Å; N344-L355 WeakPolarHBondContact O-CA 3.29Å; N344-T356 PolarHBondContact N-O 3.11Å; N344-T356 PolarHBondContact O-N 3.1Å
345	V	86.8	Confident	82.5	Confident	46 Å²	46	44.7 Å²	44.7	28%	0.279	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	105.5	172.8	-178.5	0	0	0	0	107.9	E347 I348 I353 N354 L355 L426	V345-E347 WeakPolarHBondContact CG1-O 3.48Å; V345-I348 HydrophobicContact CG1-CG1 3.97Å; V345-I353 HydrophobicContact CG1-CB 4.35Å; V345-I353 HydrophobicContact CG2-CD1 4.39Å; V345-N354 CarbonylContact C-O 3.55Å; V345-N354 WeakPolarHBondContact CA-O 3.29Å; V345-L355 HydrophobicContact CG2-CD2 3.8Å; V345-L426 HydrophobicContact CB-CD2 4.43Å; V345-L426 HydrophobicContact CG1-CD1 4.09Å; V345-L426 HydrophobicContact CG1-CD2 4.35Å; V345-L426 HydrophobicContact CG2-CD1 3.93Å; V345-L426 HydrophobicContact CG2-CD2 4.11Å; V345-L426 HydrophobicContact CG2-CG 4.17Å
346	T	80.7	Confident	83.3	Confident	57 Å²	57	42.2 Å²	42.2	35%	0.35	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-22.7	178.2	51.4	0	0	0	0	112.6	N344 N354 T356	N344-T346 PolarHBondContact O-N 2.98Å; T346-N354 PolarHBondContact N-O 2.87Å; T346-N354 WeakPolarHBondContact OG1-CB 3.26Å; T346-N354 PolarHBondContact OG1-O 3.46Å; T346-N354 VanDerWaalsContact OG1-O 3.06Å; T346-T356 HydrophobicContact CG2-CG2 3.7Å; T346-T356 WeakPolarHBondContact CG2-OG1 3.35Å
347	E	73	Confident	83.9	Confident	24 Å²	24	38 Å²	38	11%	0.112	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	154.5	179.4	-167.1	171.7	-131.9	0	0	113.1	V345 R349 I353 N354 G460 I461	V345-E347 WeakPolarHBondContact CG1-O 3.48Å; E347-R349 VanDerWaalsContact CD-CD 3.42Å; E347-R349 HydrophobicContact CG-CG 4.02Å; E347-R349 IonicContact OE1-CZ 2.78Å; E347-R349 IonicContact OE1-NE 3.68Å; E347-R349 PolarHBondContact OE1-NE 2.83Å; E347-R349 IonicContact OE1-NH2 2.72Å; E347-R349 PolarHBondContact OE1-NH2 3.16Å; E347-R349 WeakPolarHBondContact OE2-CD 3.4Å; E347-R349 IonicContact OE2-NE 3.56Å; E347-R349 PolarHBondContact OE2-NE 3.41Å; E347-R349 VanDerWaalsContact OE2-NE 3.15Å; E347-I353 CarbonylContact O-C 3.56Å; E347-I353 VanDerWaalsContact O-CA 3.24Å; E347-I353 WeakPolarHBondContact O-CA 3.44Å; E347-I353 WeakPolarHBondContact O-CB 3.38Å; E347-N354 HydrophobicContact CB-CB 4.08Å; E347-N354 PolarHBondContact O-N 3.19Å; E347-N354 PolarHBondContact OE2-ND2 2.9Å; E347-G460 VanDerWaalsContact CD-C 3.47Å; E347-G460 VanDerWaalsContact CD-CA 3.41Å; E347-G460 WeakPolarHBondContact OE1-CA 3.4Å; E347-G460 VanDerWaalsContact OE2-C 3.29Å; E347-I461 PolarHBondContact OE2-N 2.93Å; E347-I461 VanDerWaalsContact OE2-O 3.1Å
348	I	74.4	Confident	84.2	Confident	88 Å²	88	42.7 Å²	42.7	45%	0.451	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.7	165.9	-51.9	178.3	0	0	0	107.7	V345 I353 L426 M430	V345-I348 HydrophobicContact CG1-CG1 3.97Å; I348-I353 HydrophobicContact CB-CG2 4.27Å; I348-I353 HydrophobicContact CG1-CG2 3.94Å; I348-I353 HydrophobicContact CG2-CG2 4.11Å; I348-L426 HydrophobicContact CD1-CD1 4.21Å; I348-L426 HydrophobicContact CD1-CD2 4.1Å; I348-M430 HydrophobicContact CG2-CE 4.16Å; I348-M430 HydrophobicContact CG2-CG 4.24Å
349	R	61.3	Low	84.1	Confident	86 Å²	86	46.7 Å²	46.7	33%	0.325	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	99.1	-178	-87.9	175.6	173.4	-81	-42.9	109.6	E347 N351 C352 H462	E347-R349 VanDerWaalsContact CD-CD 3.42Å; E347-R349 HydrophobicContact CG-CG 4.02Å; E347-R349 IonicContact OE1-CZ 2.78Å; E347-R349 IonicContact OE1-NE 3.68Å; E347-R349 PolarHBondContact OE1-NE 2.83Å; E347-R349 IonicContact OE1-NH2 2.72Å; E347-R349 PolarHBondContact OE1-NH2 3.16Å; E347-R349 WeakPolarHBondContact OE2-CD 3.4Å; E347-R349 IonicContact OE2-NE 3.56Å; E347-R349 PolarHBondContact OE2-NE 3.41Å; E347-R349 VanDerWaalsContact OE2-NE 3.15Å; R349-N351 PolarHBondContact O-N 3.23Å; R349-C352 PolarHBondContact N-O 3.06Å; R349-C352 WeakPolarHBondContact O-CB 3.39Å; R349-C352 PolarHBondContact O-N 2.84Å; R349-H462 WeakPolarHBondContact CD-ND1 3.34Å; R349-H462 VanDerWaalsContact CZ-CB 3.5Å; R349-H462 PolarHBondContact NE-CD2 2.96Å; R349-H462 VanDerWaalsContact NE-CD2 3.34Å; R349-H462 PolarHBondContact NE-CE1 3.07Å; R349-H462 PolarHBondContact NE-ND1 2.85Å; R349-H462 PolarHBondContact NH1-CD2 3.44Å; R349-H462 PolarHBondContact NH1-CE1 2.81Å; R349-H462 PolarHBondContact NH1-ND1 2.82Å; R349-H462 PolarHBondContact NH1-NE2 2.69Å; R349-H462 PolarHBondContact NH2-CD2 2.94Å; R349-H462 PolarHBondContact NH2-CE1 3.18Å; R349-H462 VanDerWaalsContact NH2-CG 3.29Å; R349-H462 PolarHBondContact NH2-NE2 3.39Å
350	G	68.6	Low	84.1	Confident	33 Å²	33	44.1 Å²	44.1	34%	0.34	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.4	-128.6	-174.6	0	0	0	0	0	110.9	C352 M430	G350-C352 VanDerWaalsContact C-N 3.27Å; G350-M430 WeakPolarHBondContact O-CE 3.31Å; G350-M430 WeakPolarHBondContact O-CG 3.11Å
351	N	70	Confident	83.5	Confident	62 Å²	62	52.3 Å²	52.3	33%	0.332	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	5.3	171.8	62.7	-30.5	0	0	0	113.9	R349 D397 L398	R349-N351 PolarHBondContact O-N 3.23Å; N351-D397 WeakPolarHBondContact ND2-CA 3.35Å; N351-D397 PolarHBondContact ND2-OD1 3.34Å; N351-D397 VanDerWaalsContact ND2-OD1 3.14Å; N351-L398 WeakPolarHBondContact CB-O 3.41Å; N351-L398 WeakPolarHBondContact O-CB 3.35Å; N351-L398 PolarHBondContact O-N 3.18Å
352	C	70.5	Confident	82.9	Confident	31 Å²	31	52.3 Å²	52.3	21%	0.209	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	152.9	-177.9	-48.2	0	0	0	0	112.8	R349 G350 V395	R349-C352 PolarHBondContact N-O 3.06Å; R349-C352 WeakPolarHBondContact O-CB 3.39Å; R349-C352 PolarHBondContact O-N 2.84Å; G350-C352 VanDerWaalsContact C-N 3.27Å; C352-V395 CarbonylContact C-O 3.55Å; C352-V395 WeakPolarHBondContact CA-O 3.31Å; C352-V395 WeakPolarHBondContact CB-O 3.47Å
353	I	82.4	Confident	82.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	162	173.1	67.5	168.5	0	0	0	112.3	V345 E347 I348 L355 N394 V395 L398 F406 L426 M430	V345-I353 HydrophobicContact CG1-CB 4.35Å; V345-I353 HydrophobicContact CG2-CD1 4.39Å; E347-I353 CarbonylContact O-C 3.56Å; E347-I353 VanDerWaalsContact O-CA 3.24Å; E347-I353 WeakPolarHBondContact O-CA 3.44Å; E347-I353 WeakPolarHBondContact O-CB 3.38Å; I348-I353 HydrophobicContact CB-CG2 4.27Å; I348-I353 HydrophobicContact CG1-CG2 3.94Å; I348-I353 HydrophobicContact CG2-CG2 4.11Å; I353-L355 HydrophobicContact CD1-CD2 3.85Å; I353-L355 HydrophobicContact CD1-CG 4.26Å; I353-N394 WeakPolarHBondContact O-CA 3.49Å; I353-N394 PolarHBondContact O-ND2 2.97Å; I353-N394 VanDerWaalsContact O-ND2 3.17Å; I353-V395 HydrophobicContact CG1-CB 3.75Å; I353-V395 HydrophobicContact CG1-CG1 4.47Å; I353-V395 HydrophobicContact CG1-CG2 4.15Å; I353-V395 PolarHBondContact N-O 3.03Å; I353-V395 PolarHBondContact O-N 3.38Å; I353-L398 HydrophobicContact CD1-CD1 4.14Å; I353-L398 HydrophobicContact CG1-CD1 4.03Å; I353-L398 HydrophobicContact CG2-CD1 4.1Å; I353-F406 HydrophobicContact CD1-CD2 3.96Å; I353-F406 HydrophobicContact CD1-CE1 4.39Å; I353-F406 HydrophobicContact CD1-CE2 3.34Å; I353-F406 HydrophobicContact CD1-CZ 3.59Å; I353-L426 HydrophobicContact CD1-CD1 3.92Å; I353-L426 HydrophobicContact CG2-CD1 3.95Å; I353-M430 HydrophobicContact CG2-CE 4.16Å
354	N	80.9	Confident	81.6	Confident	5 Å²	5	57.2 Å²	57.2	3%	0.027	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.3	173.2	-73.8	-53	0	0	0	111.7	V345 T346 E347 N394 I461 Y463	V345-N354 CarbonylContact C-O 3.55Å; V345-N354 WeakPolarHBondContact CA-O 3.29Å; T346-N354 PolarHBondContact N-O 2.87Å; T346-N354 WeakPolarHBondContact OG1-CB 3.26Å; T346-N354 PolarHBondContact OG1-O 3.46Å; T346-N354 VanDerWaalsContact OG1-O 3.06Å; E347-N354 HydrophobicContact CB-CB 4.08Å; E347-N354 PolarHBondContact O-N 3.19Å; E347-N354 PolarHBondContact OE2-ND2 2.9Å; N354-N394 PolarHBondContact OD1-ND2 2.79Å; N354-I461 PolarHBondContact ND2-O 2.99Å; N354-Y463 VanDerWaalsContact OD1-CE2 3.23Å; N354-Y463 WeakPolarHBondContact OD1-CE2 3.31Å
355	L	89.3	Confident	81.4	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	140.2	177.2	-59.7	175.6	0	0	0	111	P343 N344 V345 I353 W357 V368 R392 M393 V395 F406	P343-L355 HydrophobicContact CB-CB 4.34Å; P343-L355 HydrophobicContact CB-CD2 4.37Å; N344-L355 WeakPolarHBondContact O-CA 3.29Å; V345-L355 HydrophobicContact CG2-CD2 3.8Å; I353-L355 HydrophobicContact CD1-CD2 3.85Å; I353-L355 HydrophobicContact CD1-CG 4.26Å; L355-W357 HydrophobicContact CB-CZ3 4.2Å; L355-V368 HydrophobicContact CD1-CG1 3.95Å; L355-R392 CarbonylContact O-C 3.59Å; L355-R392 VanDerWaalsContact O-CA 3.22Å; L355-R392 WeakPolarHBondContact O-CA 3.45Å; L355-M393 PolarHBondContact N-O 3.15Å; L355-M393 PolarHBondContact O-N 3.44Å; L355-V395 HydrophobicContact CD1-CG2 3.76Å; L355-V395 HydrophobicContact CG-CG2 4.22Å; L355-F406 HydrophobicContact CD1-CB 3.76Å; L355-F406 HydrophobicContact CD1-CD1 3.75Å; L355-F406 HydrophobicContact CD1-CD2 4.39Å; L355-F406 HydrophobicContact CD1-CE1 4.48Å; L355-F406 HydrophobicContact CD1-CG 3.69Å; L355-F406 HydrophobicContact CD2-CB 4.28Å; L355-F406 HydrophobicContact CD2-CD2 4.14Å; L355-F406 HydrophobicContact CD2-CG 4.19Å
356	T	92.6	Very high	81.6	Confident	39 Å²	39	50.2 Å²	50.2	24%	0.239	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	144.3	171.6	61.6	0	0	0	0	111.2	N344 T346 N391 R392	N344-T356 PolarHBondContact N-O 3.11Å; N344-T356 PolarHBondContact O-N 3.1Å; T346-T356 HydrophobicContact CG2-CG2 3.7Å; T346-T356 WeakPolarHBondContact CG2-OG1 3.35Å; T356-N391 WeakPolarHBondContact CA-O 3.49Å; T356-R392 HydrophobicContact CG2-CB 3.98Å
357	W	94.3	Very high	82.2	Confident	5 Å²	5	48.2 Å²	48.2	2%	0.019	25%	0.253	C	S	.	.			trans	-138.1	169	177.3	53.7	93.2	0	0	0	110.8	P343 L355 Y366 V368 T388 V390 N391 M393 V408	P343-W357 HydrophobicContact CB-CE3 4.26Å; L355-W357 HydrophobicContact CB-CZ3 4.2Å; W357-Y366 AromaticContact CD1-CE1 3.93Å; W357-Y366 AromaticContact CE2-CG 3.85Å; W357-Y366 AromaticContact CZ2-CD2 3.93Å; W357-Y366 HydrophobicContact CZ2-CD2 3.93Å; W357-Y366 AromaticContact CZ2-CG 3.82Å; W357-Y366 HydrophobicContact CZ2-CG 3.82Å; W357-Y366 AromaticContact NE1-CD1 3.21Å; W357-Y366 AromaticContact NE1-CD2 3.61Å; W357-Y366 AromaticContact NE1-CE1 3.4Å; W357-Y366 AromaticContact NE1-CE2 3.8Å; W357-Y366 AromaticContact NE1-CG 3.33Å; W357-Y366 VanDerWaalsContact NE1-CG 3.33Å; W357-Y366 AromaticContact NE1-CZ 3.72Å; W357-V368 HydrophobicContact CH2-CG2 3.46Å; W357-V368 VanDerWaalsContact CH2-CG2 3.46Å; W357-V368 HydrophobicContact CZ2-CG2 4.19Å; W357-V368 HydrophobicContact CZ3-CG2 3.79Å; W357-T388 HydrophobicContact CH2-CG2 4.01Å; W357-T388 HydrophobicContact CZ2-CG2 3.86Å; W357-V390 WeakPolarHBondContact CZ2-O 3.29Å; W357-N391 VanDerWaalsContact CE2-C 3.44Å; W357-N391 VanDerWaalsContact CE2-CA 3.47Å; W357-N391 PolarHBondContact N-O 3.41Å; W357-N391 WeakPolarHBondContact O-CB 3.39Å; W357-N391 PolarHBondContact O-ND2 3.16Å; W357-M393 HydrophobicContact CH2-CB 3.92Å; W357-M393 HydrophobicContact CZ3-CB 4.02Å; W357-V408 HydrophobicContact CB-CG2 4.48Å; W357-V408 HydrophobicContact CD2-CB 4.45Å; W357-V408 HydrophobicContact CD2-CG1 4.02Å; W357-V408 HydrophobicContact CD2-CG2 3.75Å; W357-V408 HydrophobicContact CE3-CG2 3.76Å; W357-V408 HydrophobicContact CG-CG1 4.25Å; W357-V408 HydrophobicContact CG-CG2 4.08Å; W357-V408 HydrophobicContact CZ2-CG1 4.15Å; W357-V408 HydrophobicContact CZ3-CG2 4.29Å
358	D	93.4	Very high	83.1	Confident	112 Å²	112	47.1 Å²	47.1	60%	0.599	25%	0.247	S	C	*	.			trans	-72.1	142.6	178.1	-60	-50.2	0	0	0	110.7	S341	S341-D358 WeakPolarHBondContact CB-OD2 3.48Å; S341-D358 WeakPolarHBondContact OG-CB 3.42Å; S341-D358 VanDerWaalsContact OG-CG 3.23Å; S341-D358 PolarHBondContact OG-N 3.49Å; S341-D358 PolarHBondContact OG-OD2 3.33Å
359	E	89.3	Confident	84.1	Confident	150 Å²	150	44.3 Å²	44.3	70%	0.701	23%	0.232	S	C	*	.			trans	-72.8	133.3	-179.2	-167.9	173.8	178.3	0	0	111.3	Y366 N391	E359-Y366 WeakPolarHBondContact CG-OH 3.46Å; E359-N391 HydrophobicContact CB-CB 4.5Å
360	V	91.1	Very high	85.6	Confident	14 Å²	14	42.8 Å²	42.8	9%	0.085	23%	0.228	C	C	.	.			trans	-105.2	124.9	177.4	177.7	0	0	0	0	108.9	P337 A338 P340 V363 Y366 A410	P337-V360 HydrophobicContact CB-CG1 3.99Å; A338-V360 HydrophobicContact CB-CG1 3.97Å; P340-V360 HydrophobicContact CB-CG2 4.32Å; P340-V360 HydrophobicContact CG-CG2 4.27Å; V360-V363 HydrophobicContact CB-CG1 3.96Å; V360-V363 HydrophobicContact CG1-CG1 3.88Å; V360-V363 WeakPolarHBondContact O-CG1 3.34Å; V360-V363 WeakPolarHBondContact O-CG2 3.19Å; V360-Y366 HydrophobicContact CB-CE1 4.15Å; V360-Y366 HydrophobicContact CG2-CE1 4.24Å; V360-Y366 PolarHBondContact N-OH 2.96Å; V360-A410 HydrophobicContact CB-CB 4.18Å; V360-A410 HydrophobicContact CG1-CB 4.11Å; V360-A410 HydrophobicContact CG2-CB 4.29Å
361	E	83.8	Confident	86.8	Confident	179 Å²	179	41.2 Å²	41.2	84%	0.836	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	151.1	178.4	-66.7	-172.2	169.4	0	0	113	V363	E361-V363 VanDerWaalsContact C-N 3.33Å; E361-V363 PolarHBondContact O-N 3.29Å
362	A	80.4	Confident	87.7	Confident	32 Å²	32	38.6 Å²	38.6	26%	0.264	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	37	172.9	0	0	0	0	0	115.9	V333 N412	V333-A362 HydrophobicContact CB-CB 4.32Å; V333-A362 HydrophobicContact CG1-CB 4.44Å; V333-A362 HydrophobicContact CG2-CB 3.54Å; A362-N412 VanDerWaalsContact O-CB 3.23Å; A362-N412 WeakPolarHBondContact O-CB 3.36Å
363	V	81.8	Confident	88.6	Confident	36 Å²	36	40.3 Å²	40.3	22%	0.218	21%	0.205	C	C	.	.			trans	-90.1	152.1	169.5	-60.7	0	0	0	0	112.3	P337 V360 E361 Y366 A410 K411	P337-V363 HydrophobicContact CB-CG1 4.05Å; P337-V363 HydrophobicContact CG-CG1 4.2Å; V360-V363 HydrophobicContact CB-CG1 3.96Å; V360-V363 HydrophobicContact CG1-CG1 3.88Å; V360-V363 WeakPolarHBondContact O-CG1 3.34Å; V360-V363 WeakPolarHBondContact O-CG2 3.19Å; E361-V363 VanDerWaalsContact C-N 3.33Å; E361-V363 PolarHBondContact O-N 3.29Å; V363-Y366 HydrophobicContact CG1-CE1 4.49Å; V363-Y366 HydrophobicContact CG2-CE1 4.49Å; V363-Y366 HydrophobicContact CG2-CE2 4.14Å; V363-A410 HydrophobicContact CG1-CB 3.64Å; V363-K411 CarbonylContact C-O 3.59Å; V363-K411 WeakPolarHBondContact CA-O 3.29Å; V363-K411 WeakPolarHBondContact CB-O 3.4Å
364	Q	77.8	Confident	88.7	Confident	99 Å²	99	43.4 Å²	43.4	46%	0.463	23%	0.227	S	C	.	.	S	Bend	trans	-84.8	-14.9	159.6	-70.3	175	-31.9	0	0	111.8	K411 N412	Q364-K411 PolarHBondContact N-O 3.42Å; Q364-N412 VanDerWaalsContact OE1-C 3.23Å; Q364-N412 PolarHBondContact OE1-O 2.64Å
365	G	86.4	Confident	88.9	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.9	-175	175.5	0	0	0	0	0	112.3	T388 K411	G365-T388 CarbonylContact C-O 3.52Å; G365-T388 WeakPolarHBondContact CA-O 3.31Å; G365-K411 PolarHBondContact N-O 2.91Å; G365-K411 PolarHBondContact O-N 3.4Å
366	Y	90.8	Very high	88.6	Confident	1 Å²	1	50.6 Å²	50.6	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	141	-175.7	-51.1	-89	0	0	0	112.1	P340 W357 E359 V360 V363 N384 L387 T388 N391 V408 L409 A410	P340-Y366 HydrophobicContact CG-CD1 4.43Å; W357-Y366 AromaticContact CD1-CE1 3.93Å; W357-Y366 AromaticContact CE2-CG 3.85Å; W357-Y366 AromaticContact CZ2-CD2 3.93Å; W357-Y366 HydrophobicContact CZ2-CD2 3.93Å; W357-Y366 AromaticContact CZ2-CG 3.82Å; W357-Y366 HydrophobicContact CZ2-CG 3.82Å; W357-Y366 AromaticContact NE1-CD1 3.21Å; W357-Y366 AromaticContact NE1-CD2 3.61Å; W357-Y366 AromaticContact NE1-CE1 3.4Å; W357-Y366 AromaticContact NE1-CE2 3.8Å; W357-Y366 AromaticContact NE1-CG 3.33Å; W357-Y366 VanDerWaalsContact NE1-CG 3.33Å; W357-Y366 AromaticContact NE1-CZ 3.72Å; E359-Y366 WeakPolarHBondContact CG-OH 3.46Å; V360-Y366 HydrophobicContact CB-CE1 4.15Å; V360-Y366 HydrophobicContact CG2-CE1 4.24Å; V360-Y366 PolarHBondContact N-OH 2.96Å; V363-Y366 HydrophobicContact CG1-CE1 4.49Å; V363-Y366 HydrophobicContact CG2-CE1 4.49Å; V363-Y366 HydrophobicContact CG2-CE2 4.14Å; Y366-N384 PolarHBondContact O-ND2 3.44Å; Y366-L387 WeakPolarHBondContact O-CA 3.18Å; Y366-T388 HydrophobicContact CD2-CG2 4.36Å; Y366-T388 WeakPolarHBondContact CD2-O 3.33Å; Y366-T388 PolarHBondContact N-O 2.93Å; Y366-T388 PolarHBondContact O-N 3.19Å; Y366-N391 HydrophobicContact CE2-CB 4.36Å; Y366-V408 HydrophobicContact CD1-CG1 3.91Å; Y366-V408 HydrophobicContact CG-CG1 4.21Å; Y366-L409 CarbonylContact C-O 3.55Å; Y366-L409 WeakPolarHBondContact CA-O 3.34Å; Y366-A410 HydrophobicContact CD1-CB 4.1Å; Y366-A410 HydrophobicContact CE1-CB 4.12Å
367	Q	93.7	Very high	88.4	Confident	16 Å²	16	53.3 Å²	53.3	8%	0.075	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.9	163.4	-178.5	69.4	63.2	0	0	108	E369 N384 L387 V408 L409 Y416	Q367-E369 HydrophobicContact CG-CG 4.05Å; Q367-N384 PolarHBondContact NE2-O 3.09Å; Q367-N384 PolarHBondContact NE2-OD1 2.92Å; Q367-N384 VanDerWaalsContact NE2-OD1 3.08Å; Q367-L387 HydrophobicContact CB-CD2 4.05Å; Q367-V408 CarbonylContact O-C 3.55Å; Q367-V408 WeakPolarHBondContact O-CA 3.35Å; Q367-L409 HydrophobicContact CB-CB 4.28Å; Q367-L409 HydrophobicContact CB-CD1 4.35Å; Q367-L409 HydrophobicContact CG-CD1 4.3Å; Q367-L409 PolarHBondContact N-O 3.15Å; Q367-L409 PolarHBondContact O-N 3.39Å; Q367-Y416 HydrophobicContact CB-CD1 4.38Å; Q367-Y416 HydrophobicContact CB-CE1 3.78Å; Q367-Y416 HydrophobicContact CG-CE1 4.35Å
368	V	92.7	Very high	88	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	140.5	164.9	-175.8	0	0	0	0	107.5	L355 W357 L383 N384 M393 R407 V408	L355-V368 HydrophobicContact CD1-CG1 3.95Å; W357-V368 HydrophobicContact CH2-CG2 3.46Å; W357-V368 VanDerWaalsContact CH2-CG2 3.46Å; W357-V368 HydrophobicContact CZ2-CG2 4.19Å; W357-V368 HydrophobicContact CZ3-CG2 3.79Å; V368-L383 HydrophobicContact CB-CB 4.28Å; V368-L383 HydrophobicContact CG1-CB 4.21Å; V368-L383 HydrophobicContact CG1-CD1 4.45Å; V368-L383 PolarHBondContact O-N 3.01Å; V368-N384 PolarHBondContact N-OD1 3.44Å; V368-N384 PolarHBondContact O-OD1 3.13Å; V368-M393 HydrophobicContact CB-SD 3.73Å; V368-M393 HydrophobicContact CG1-SD 4.36Å; V368-M393 HydrophobicContact CG2-CB 4.25Å; V368-M393 HydrophobicContact CG2-CE 4.26Å; V368-M393 HydrophobicContact CG2-SD 3.54Å; V368-M393 VanDerWaalsContact CG2-SD 3.54Å; V368-R407 WeakPolarHBondContact CA-O 3.39Å; V368-V408 HydrophobicContact CG2-CG2 4.43Å
369	E	95	Very high	87.8	Confident	29 Å²	29	53.9 Å²	53.9	14%	0.136	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	148.5	174	-62.5	177.9	170.5	0	0	109.4	Q367 W380 N381 F406 R407 L409	Q367-E369 HydrophobicContact CG-CG 4.05Å; E369-W380 HydrophobicContact CB-CE3 4.1Å; E369-N381 CarbonylContact C-O 3.6Å; E369-N381 WeakPolarHBondContact CA-O 3.35Å; E369-F406 CarbonylContact O-C 3.56Å; E369-F406 WeakPolarHBondContact O-CA 3.31Å; E369-R407 HydrophobicContact CB-CG 4.06Å; E369-R407 PolarHBondContact N-O 3.45Å; E369-R407 PolarHBondContact O-N 3.13Å; E369-R407 IonicContact OE2-CZ 3.7Å; E369-R407 IonicContact OE2-NE 2.68Å; E369-R407 PolarHBondContact OE2-NE 3.03Å; E369-R407 IonicContact OE2-NH2 3.43Å; E369-R407 PolarHBondContact OE2-NH2 3.49Å; E369-L409 VanDerWaalsContact CD-CD1 3.42Å; E369-L409 HydrophobicContact CG-CD1 3.85Å; E369-L409 WeakPolarHBondContact OE1-CD1 3.31Å
370	F	93	Very high	88	Confident	54 Å²	54	49.9 Å²	49.9	24%	0.237	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	152.2	175.1	76.4	-80.5	0	0	0	111.8	W380 N381 L383 Y404 A405 F406	F370-W380 WeakPolarHBondContact O-CA 3.43Å; F370-N381 HydrophobicContact CD1-CB 4.05Å; F370-N381 WeakPolarHBondContact CD1-O 3.38Å; F370-N381 HydrophobicContact CE1-CB 3.62Å; F370-N381 HydrophobicContact CZ-CB 3.91Å; F370-N381 PolarHBondContact N-O 3.18Å; F370-N381 PolarHBondContact O-N 2.99Å; F370-L383 HydrophobicContact CB-CD1 4.07Å; F370-L383 HydrophobicContact CD1-CB 4.08Å; F370-L383 HydrophobicContact CD1-CD1 3.97Å; F370-L383 HydrophobicContact CD1-CG 4.24Å; F370-L383 HydrophobicContact CG-CD1 4.3Å; F370-Y404 HydrophobicContact CD2-CD1 4.1Å; F370-Y404 HydrophobicContact CD2-CE1 4.31Å; F370-Y404 HydrophobicContact CE2-CE1 4.43Å; F370-A405 CarbonylContact C-O 3.11Å; F370-A405 WeakPolarHBondContact CA-O 3.07Å; F370-F406 HydrophobicContact CB-CD1 3.5Å; F370-F406 HydrophobicContact CB-CE1 3.48Å; F370-F406 VanDerWaalsContact CB-CE1 3.48Å; F370-F406 HydrophobicContact CB-CZ 4.47Å; F370-F406 HydrophobicContact CG-CE1 4.45Å
371	C	92.9	Very high	87.9	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.007	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	121.5	169.5	-176.9	0	0	0	0	108.3	L373 G378 V379 W380 A405	C371-L373 HydrophobicContact CB-CD2 4.5Å; C371-L373 PolarHBondContact O-N 3.07Å; C371-G378 PolarHBondContact SG-N 3.22Å; C371-V379 WeakPolarHBondContact CA-O 3.28Å; C371-V379 WeakPolarHBondContact CB-O 3.31Å; C371-V379 PolarHBondContact SG-O 3.4Å; C371-W380 HydrophobicContact CB-CD2 3.79Å; C371-W380 HydrophobicContact CB-CE3 3.81Å; C371-W380 HydrophobicContact CB-CG 4.4Å; C371-W380 HydrophobicContact CB-CH2 4.06Å; C371-W380 HydrophobicContact CB-CZ2 4.03Å; C371-W380 HydrophobicContact CB-CZ3 3.94Å; C371-A405 PolarHBondContact N-O 3.25Å; C371-A405 PolarHBondContact O-N 3.16Å
372	D	89.2	Confident	88.1	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.037	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	107.8	169.6	-171.6	-40.1	0	0	0	108.2	S374 L375 S376 H402 Y404	D372-S374 PolarHBondContact O-N 3.39Å; D372-S374 WeakPolarHBondContact OD1-CA 3.43Å; D372-S374 WeakPolarHBondContact OD1-CB 3.27Å; D372-S374 PolarHBondContact OD1-N 2.85Å; D372-L375 HydrophobicContact CB-CB 4.27Å; D372-L375 PolarHBondContact OD1-N 3.29Å; D372-S376 CarbonylContact O-C 3.58Å; D372-S376 WeakPolarHBondContact O-CA 3.36Å; D372-S376 PolarHBondContact O-N 3.2Å; D372-H402 IonicContact OD1-ND1 3.74Å; D372-H402 IonicContact OD2-CE1 3.78Å; D372-H402 IonicContact OD2-CG 3.23Å; D372-H402 IonicContact OD2-ND1 2.68Å; D372-H402 PolarHBondContact OD2-ND1 3.21Å; D372-Y404 HydrophobicContact CB-CD1 4Å; D372-Y404 HydrophobicContact CB-CE1 3.65Å; D372-Y404 VanDerWaalsContact OD2-CE1 3.24Å; D372-Y404 WeakPolarHBondContact OD2-CE1 3.36Å; D372-Y404 PolarHBondContact OD2-OH 3.17Å
373	L	89.4	Confident	88.3	Confident	67 Å²	67	48 Å²	48	35%	0.351	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-6.8	-178.7	-51.2	173	0	0	0	112.7	C371 S403 A405	C371-L373 HydrophobicContact CB-CD2 4.5Å; C371-L373 PolarHBondContact O-N 3.07Å; L373-S403 WeakPolarHBondContact CA-O 3.14Å; L373-S403 WeakPolarHBondContact CB-O 3.35Å; L373-S403 WeakPolarHBondContact CG-O 3.24Å; L373-S403 PolarHBondContact N-O 3.45Å; L373-A405 HydrophobicContact CD1-CB 4.12Å; L373-A405 HydrophobicContact CD2-CB 4.41Å; L373-A405 HydrophobicContact CG-CB 4.41Å
374	S	86.1	Confident	88.4	Confident	65 Å²	65	47 Å²	47	46%	0.455	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-39.7	173.7	-67.5	0	0	0	0	112	D372 H402 S403	D372-S374 PolarHBondContact O-N 3.39Å; D372-S374 WeakPolarHBondContact OD1-CA 3.43Å; D372-S374 WeakPolarHBondContact OD1-CB 3.27Å; D372-S374 PolarHBondContact OD1-N 2.85Å; S374-H402 WeakPolarHBondContact OG-CA 3.31Å; S374-S403 PolarHBondContact OG-N 3.36Å; S374-S403 VanDerWaalsContact OG-N 3.11Å
375	L	83.8	Confident	87.9	Confident	122 Å²	122	51.8 Å²	51.8	64%	0.639	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-42.5	179.2	-77.2	175.5	0	0	0	114.5	D372	D372-L375 HydrophobicContact CB-CB 4.27Å; D372-L375 PolarHBondContact OD1-N 3.29Å
376	S	83.6	Confident	86.8	Confident	35 Å²	35	56.2 Å²	56.2	25%	0.245	32%	0.316	C	S	.	.			trans	-147.2	62	-166.4	58.4	0	0	0	0	114.5	D372 G378 V379	D372-S376 CarbonylContact O-C 3.58Å; D372-S376 WeakPolarHBondContact O-CA 3.36Å; D372-S376 PolarHBondContact O-N 3.2Å; S376-G378 PolarHBondContact O-N 2.97Å; S376-V379 WeakPolarHBondContact O-CB 3.4Å; S376-V379 PolarHBondContact O-N 3.47Å
377	P	87.6	Confident	86.1	Confident	96 Å²	96	58 Å²	58	62%	0.623	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	124.2	-178.3	-25.7	33.4	0	0	0	113.7	V379	P377-V379 VanDerWaalsContact C-N 3.34Å
378	G	86.5	Confident	85.2	Confident	55 Å²	55	58.3 Å²	58.3	57%	0.567	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.5	-9.6	-179.2	0	0	0	0	0	115.5	C371 S376 W380	C371-G378 PolarHBondContact SG-N 3.22Å; S376-G378 PolarHBondContact O-N 2.97Å; G378-W380 VanDerWaalsContact O-CD1 3.3Å
379	V	89.9	Confident	84.6	Confident	74 Å²	74	62.8 Å²	62.8	45%	0.448	36%	0.36	S	S	.	.			trans	-82.4	117.6	171.5	-175.4	0	0	0	0	108.9	C371 S376 P377	C371-V379 WeakPolarHBondContact CA-O 3.28Å; C371-V379 WeakPolarHBondContact CB-O 3.31Å; C371-V379 PolarHBondContact SG-O 3.4Å; S376-V379 WeakPolarHBondContact O-CB 3.4Å; S376-V379 PolarHBondContact O-N 3.47Å; P377-V379 VanDerWaalsContact C-N 3.34Å
380	W	91.8	Very high	84	Confident	66 Å²	66	64.4 Å²	64.4	25%	0.25	37%	0.372	C	S	.	.			trans	-103.5	120.2	178.8	-70.3	90.2	0	0	0	110.1	E369 F370 C371 G378 A405 R407 A422	E369-W380 HydrophobicContact CB-CE3 4.1Å; F370-W380 WeakPolarHBondContact O-CA 3.43Å; C371-W380 HydrophobicContact CB-CD2 3.79Å; C371-W380 HydrophobicContact CB-CE3 3.81Å; C371-W380 HydrophobicContact CB-CG 4.4Å; C371-W380 HydrophobicContact CB-CH2 4.06Å; C371-W380 HydrophobicContact CB-CZ2 4.03Å; C371-W380 HydrophobicContact CB-CZ3 3.94Å; G378-W380 VanDerWaalsContact O-CD1 3.3Å; W380-A405 HydrophobicContact CH2-CB 4.01Å; W380-A405 WeakPolarHBondContact CZ3-O 3.28Å; W380-R407 HydrophobicContact CD2-CG 4.24Å; W380-R407 HydrophobicContact CE3-CB 4.45Å; W380-R407 HydrophobicContact CE3-CG 3.62Å; W380-R407 HydrophobicContact CH2-CB 4.12Å; W380-R407 HydrophobicContact CH2-CG 4.11Å; W380-R407 HydrophobicContact CZ3-CB 3.88Å; W380-R407 HydrophobicContact CZ3-CG 3.55Å; W380-A422 HydrophobicContact CH2-CB 3.89Å; W380-A422 HydrophobicContact CZ2-CB 4.28Å
381	N	89.5	Confident	83.9	Confident	56 Å²	56	64.3 Å²	64.3	30%	0.299	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.8	-177.3	-58.6	-70.9	0	0	0	109.8	E369 F370 L383	E369-N381 CarbonylContact C-O 3.6Å; E369-N381 WeakPolarHBondContact CA-O 3.35Å; F370-N381 HydrophobicContact CD1-CB 4.05Å; F370-N381 WeakPolarHBondContact CD1-O 3.38Å; F370-N381 HydrophobicContact CE1-CB 3.62Å; F370-N381 HydrophobicContact CZ-CB 3.91Å; F370-N381 PolarHBondContact N-O 3.18Å; F370-N381 PolarHBondContact O-N 2.99Å; N381-L383 PolarHBondContact O-N 3.49Å
382	P	88.2	Confident	83.7	Confident	83 Å²	83	70.1 Å²	70.1	54%	0.539	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	125.2	175.8	27.8	-33.7	0	0	0	110.5
383	L	84.4	Confident	83.5	Confident	46 Å²	46	71 Å²	71	24%	0.241	40%	0.4	C	S	.	.	S	Bend	trans	-83.1	-36.5	-177.5	-163.7	144.5	0	0	0	111.6	V368 F370 N381 M393 V395 F406	V368-L383 HydrophobicContact CB-CB 4.28Å; V368-L383 HydrophobicContact CG1-CB 4.21Å; V368-L383 HydrophobicContact CG1-CD1 4.45Å; V368-L383 PolarHBondContact O-N 3.01Å; F370-L383 HydrophobicContact CB-CD1 4.07Å; F370-L383 HydrophobicContact CD1-CB 4.08Å; F370-L383 HydrophobicContact CD1-CD1 3.97Å; F370-L383 HydrophobicContact CD1-CG 4.24Å; F370-L383 HydrophobicContact CG-CD1 4.3Å; N381-L383 PolarHBondContact O-N 3.49Å; L383-M393 HydrophobicContact CD2-CG 4.14Å; L383-M393 HydrophobicContact CD2-SD 3.64Å; L383-V395 HydrophobicContact CD1-CB 4.25Å; L383-V395 HydrophobicContact CD1-CG1 3.74Å; L383-V395 HydrophobicContact CD1-CG2 3.55Å; L383-V395 HydrophobicContact CD2-CG2 3.88Å; L383-V395 HydrophobicContact CG-CG2 4.38Å; L383-F406 HydrophobicContact CD1-CD1 3.91Å; L383-F406 HydrophobicContact CD1-CE1 3.71Å
384	N	83.7	Confident	83.2	Confident	15 Å²	15	69.9 Å²	69.9	8%	0.08	39%	0.394	C	S	.	.			trans	-111.8	124.7	175	58.3	-52.2	0	0	0	111.3	Y366 Q367 V368 I386 T388 M393	Y366-N384 PolarHBondContact O-ND2 3.44Å; Q367-N384 PolarHBondContact NE2-O 3.09Å; Q367-N384 PolarHBondContact NE2-OD1 2.92Å; Q367-N384 VanDerWaalsContact NE2-OD1 3.08Å; V368-N384 PolarHBondContact N-OD1 3.44Å; V368-N384 PolarHBondContact O-OD1 3.13Å; N384-I386 PolarHBondContact ND2-O 3.42Å; N384-I386 PolarHBondContact O-N 3.26Å; N384-T388 PolarHBondContact ND2-N 3.06Å; N384-M393 HydrophobicContact CB-CE 3.61Å; N384-M393 HydrophobicContact CB-SD 3.93Å
385	Q	68.8	Low	83.1	Confident	200 Å²	200	67.1 Å²	67.1	94%	0.935	37%	0.374	S	S	*	.	S	Bend	trans	-70.6	-22.9	173.8	-63.5	179.3	-3.4	0	0	112.7
386	I	63.3	Low	82.8	Confident	92 Å²	92	62.7 Å²	62.7	47%	0.472	36%	0.358	S	S	.	.	S	Bend	trans	-115.5	127.8	179.3	-56.2	-179.7	0	0	0	108	N384 T388	N384-I386 PolarHBondContact ND2-O 3.42Å; N384-I386 PolarHBondContact O-N 3.26Å; I386-T388 PolarHBondContact O-N 3.45Å
387	L	75.6	Confident	82.4	Confident	40 Å²	40	67.5 Å²	67.5	21%	0.209	38%	0.381	C	S	.	.			trans	-52	124.4	174.6	-61.5	174.5	0	0	0	110.3	Y366 Q367 K411 Y416	Y366-L387 WeakPolarHBondContact O-CA 3.18Å; Q367-L387 HydrophobicContact CB-CD2 4.05Å; L387-K411 HydrophobicContact CD1-CB 4.05Å; L387-K411 HydrophobicContact CD1-CD 3.76Å; L387-K411 HydrophobicContact CD1-CG 3.91Å; L387-K411 HydrophobicContact CD2-CB 4.25Å; L387-K411 HydrophobicContact CD2-CD 4.21Å; L387-Y416 HydrophobicContact CD2-CE1 4.12Å
388	T	74.2	Confident	81.9	Confident	21 Å²	21	63.4 Å²	63.4	13%	0.129	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-74.8	132.9	172.7	175.8	0	0	0	0	109.3	W357 G365 Y366 N384 I386 V390 M393	W357-T388 HydrophobicContact CH2-CG2 4.01Å; W357-T388 HydrophobicContact CZ2-CG2 3.86Å; G365-T388 CarbonylContact C-O 3.52Å; G365-T388 WeakPolarHBondContact CA-O 3.31Å; Y366-T388 HydrophobicContact CD2-CG2 4.36Å; Y366-T388 WeakPolarHBondContact CD2-O 3.33Å; Y366-T388 PolarHBondContact N-O 2.93Å; Y366-T388 PolarHBondContact O-N 3.19Å; N384-T388 PolarHBondContact ND2-N 3.06Å; I386-T388 PolarHBondContact O-N 3.45Å; T388-V390 VanDerWaalsContact C-N 3.29Å; T388-V390 WeakPolarHBondContact CG2-O 3.31Å; T388-V390 VanDerWaalsContact OG1-CG2 3.29Å; T388-V390 WeakPolarHBondContact OG1-CG2 3.39Å; T388-V390 PolarHBondContact OG1-N 3.4Å; T388-V390 PolarHBondContact OG1-O 3.18Å; T388-V390 VanDerWaalsContact OG1-O 3.07Å; T388-M393 HydrophobicContact CG2-CE 3.59Å
389	S	79.8	Confident	81.5	Confident	95 Å²	95	64.7 Å²	64.7	66%	0.664	35%	0.348	S	S	*	.	S	Bend	trans	-77.3	-17.8	172.8	51.5	0	0	0	0	112.7
390	V	83	Confident	80.6	Confident	62 Å²	62	66.1 Å²	66.1	38%	0.376	36%	0.359	S	S	.	.	S	Bend	trans	-102	147.4	-178.9	-63.8	0	0	0	0	111.7	W357 T388 R392	W357-V390 WeakPolarHBondContact CZ2-O 3.29Å; T388-V390 VanDerWaalsContact C-N 3.29Å; T388-V390 WeakPolarHBondContact CG2-O 3.31Å; T388-V390 VanDerWaalsContact OG1-CG2 3.29Å; T388-V390 WeakPolarHBondContact OG1-CG2 3.39Å; T388-V390 PolarHBondContact OG1-N 3.4Å; T388-V390 PolarHBondContact OG1-O 3.18Å; T388-V390 VanDerWaalsContact OG1-O 3.07Å; V390-R392 HydrophobicContact CB-CG 4.16Å; V390-R392 HydrophobicContact CG2-CG 3.85Å; V390-R392 PolarHBondContact O-N 3.39Å
391	N	90.2	Very high	79.7	Confident	53 Å²	53	65.5 Å²	65.5	28%	0.283	37%	0.373	S	S	.	.	S	Bend	trans	-76.7	31.5	-178.1	69	-39.3	0	0	0	114.5	T356 W357 E359 Y366	T356-N391 WeakPolarHBondContact CA-O 3.49Å; W357-N391 VanDerWaalsContact CE2-C 3.44Å; W357-N391 VanDerWaalsContact CE2-CA 3.47Å; W357-N391 PolarHBondContact N-O 3.41Å; W357-N391 WeakPolarHBondContact O-CB 3.39Å; W357-N391 PolarHBondContact O-ND2 3.16Å; E359-N391 HydrophobicContact CB-CB 4.5Å; Y366-N391 HydrophobicContact CE2-CB 4.36Å
392	R	89.9	Confident	79.4	Confident	122 Å²	122	65 Å²	65	46%	0.46	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	150.9	-176.2	56.7	-179.5	165.6	-170	-7.2	111.4	L355 T356 V390	L355-R392 CarbonylContact O-C 3.59Å; L355-R392 VanDerWaalsContact O-CA 3.22Å; L355-R392 WeakPolarHBondContact O-CA 3.45Å; T356-R392 HydrophobicContact CG2-CB 3.98Å; V390-R392 HydrophobicContact CB-CG 4.16Å; V390-R392 HydrophobicContact CG2-CG 3.85Å; V390-R392 PolarHBondContact O-N 3.39Å
393	M	84.9	Confident	79.2	Confident	26 Å²	26	62.9 Å²	62.9	13%	0.128	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	135.5	179.3	-174	151.2	-76.6	0	0	111.2	L355 W357 V368 L383 N384 T388	L355-M393 PolarHBondContact N-O 3.15Å; L355-M393 PolarHBondContact O-N 3.44Å; W357-M393 HydrophobicContact CH2-CB 3.92Å; W357-M393 HydrophobicContact CZ3-CB 4.02Å; V368-M393 HydrophobicContact CB-SD 3.73Å; V368-M393 HydrophobicContact CG1-SD 4.36Å; V368-M393 HydrophobicContact CG2-CB 4.25Å; V368-M393 HydrophobicContact CG2-CE 4.26Å; V368-M393 HydrophobicContact CG2-SD 3.54Å; V368-M393 VanDerWaalsContact CG2-SD 3.54Å; L383-M393 HydrophobicContact CD2-CG 4.14Å; L383-M393 HydrophobicContact CD2-SD 3.64Å; N384-M393 HydrophobicContact CB-CE 3.61Å; N384-M393 HydrophobicContact CB-SD 3.93Å; T388-M393 HydrophobicContact CG2-CE 3.59Å
394	N	82.9	Confident	79.5	Confident	44 Å²	44	61.2 Å²	61.2	24%	0.235	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	143.3	162.3	-174.7	-100	0	0	0	109.3	I353 N354 Y463	I353-N394 WeakPolarHBondContact O-CA 3.49Å; I353-N394 PolarHBondContact O-ND2 2.97Å; I353-N394 VanDerWaalsContact O-ND2 3.17Å; N354-N394 PolarHBondContact OD1-ND2 2.79Å; N394-Y463 HydrophobicContact CB-CD1 4.05Å; N394-Y463 HydrophobicContact CB-CD2 3.79Å; N394-Y463 HydrophobicContact CB-CE1 3.78Å; N394-Y463 HydrophobicContact CB-CE2 3.55Å; N394-Y463 HydrophobicContact CB-CG 4.06Å; N394-Y463 WeakPolarHBondContact ND2-CD2 3.47Å
395	V	83.8	Confident	79.9	Confident	6 Å²	6	60.9 Å²	60.9	4%	0.036	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	119.1	172.3	-179.9	0	0	0	0	106.5	C352 I353 L355 L383 L398 F406	C352-V395 CarbonylContact C-O 3.55Å; C352-V395 WeakPolarHBondContact CA-O 3.31Å; C352-V395 WeakPolarHBondContact CB-O 3.47Å; I353-V395 HydrophobicContact CG1-CB 3.75Å; I353-V395 HydrophobicContact CG1-CG1 4.47Å; I353-V395 HydrophobicContact CG1-CG2 4.15Å; I353-V395 PolarHBondContact N-O 3.03Å; I353-V395 PolarHBondContact O-N 3.38Å; L355-V395 HydrophobicContact CD1-CG2 3.76Å; L355-V395 HydrophobicContact CG-CG2 4.22Å; L383-V395 HydrophobicContact CD1-CB 4.25Å; L383-V395 HydrophobicContact CD1-CG1 3.74Å; L383-V395 HydrophobicContact CD1-CG2 3.55Å; L383-V395 HydrophobicContact CD2-CG2 3.88Å; L383-V395 HydrophobicContact CG-CG2 4.38Å; V395-L398 HydrophobicContact CG1-CD1 4.17Å; V395-L398 HydrophobicContact CG1-CD2 3.73Å; V395-L398 HydrophobicContact CG1-CG 3.96Å; V395-F406 HydrophobicContact CG1-CE1 4.14Å; V395-F406 HydrophobicContact CG1-CZ 4.44Å; V395-F406 HydrophobicContact CG2-CE1 4.19Å
396	G	77.2	Confident	81.1	Confident	29 Å²	29	51.3 Å²	51.3	30%	0.299	30%	0.301	S	S	.	.			trans	-95.2	-178.9	169.9	0	0	0	0	0	112.2	L398	G396-L398 VanDerWaalsContact C-N 3.29Å; G396-L398 PolarHBondContact O-N 2.95Å; G396-L398 VanDerWaalsContact O-N 3.11Å
397	D	74.5	Confident	82.6	Confident	137 Å²	137	49.7 Å²	49.7	73%	0.733	29%	0.289	S	S	*	.			trans	53.2	37.7	160.9	-54.2	-35.4	0	0	0	116.2	N351	N351-D397 WeakPolarHBondContact ND2-CA 3.35Å; N351-D397 PolarHBondContact ND2-OD1 3.34Å; N351-D397 VanDerWaalsContact ND2-OD1 3.14Å
398	L	79	Confident	83.6	Confident	10 Å²	10	47.8 Å²	47.8	5%	0.052	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-78.2	133.9	169	-60.9	178.4	0	0	0	110.7	N351 I353 V395 G396 P400 Y404 F406 M430	N351-L398 WeakPolarHBondContact CB-O 3.41Å; N351-L398 WeakPolarHBondContact O-CB 3.35Å; N351-L398 PolarHBondContact O-N 3.18Å; I353-L398 HydrophobicContact CD1-CD1 4.14Å; I353-L398 HydrophobicContact CG1-CD1 4.03Å; I353-L398 HydrophobicContact CG2-CD1 4.1Å; V395-L398 HydrophobicContact CG1-CD1 4.17Å; V395-L398 HydrophobicContact CG1-CD2 3.73Å; V395-L398 HydrophobicContact CG1-CG 3.96Å; G396-L398 VanDerWaalsContact C-N 3.29Å; G396-L398 PolarHBondContact O-N 2.95Å; G396-L398 VanDerWaalsContact O-N 3.11Å; L398-P400 WeakPolarHBondContact O-CD 3.43Å; L398-Y404 HydrophobicContact CB-CD2 4.19Å; L398-Y404 HydrophobicContact CB-CE2 3.7Å; L398-Y404 HydrophobicContact CD1-CD2 4.2Å; L398-Y404 HydrophobicContact CD2-CD1 4.11Å; L398-Y404 HydrophobicContact CD2-CD2 3.98Å; L398-Y404 HydrophobicContact CD2-CE1 4.04Å; L398-Y404 HydrophobicContact CD2-CE2 3.9Å; L398-Y404 HydrophobicContact CD2-CG 4.08Å; L398-Y404 HydrophobicContact CG-CD2 4.36Å; L398-Y404 HydrophobicContact CG-CE2 4.25Å; L398-F406 HydrophobicContact CD1-CZ 4.08Å; L398-F406 HydrophobicContact CD2-CZ 4.15Å; L398-M430 HydrophobicContact CB-CE 4.21Å; L398-M430 HydrophobicContact CD1-CE 4.09Å
399	D	77.7	Confident	84.6	Confident	82 Å²	82	47.5 Å²	47.5	44%	0.439	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-66.3	125.4	-179.2	-73.5	-56.3	0	0	0	111.1	G401 H402 Y404	D399-G401 PolarHBondContact O-N 2.75Å; D399-H402 HydrophobicContact CB-CB 4.19Å; D399-H402 WeakPolarHBondContact O-CB 3.47Å; D399-H402 PolarHBondContact O-N 2.76Å; D399-H402 VanDerWaalsContact O-N 3.08Å; D399-H402 IonicContact OD2-CE1 2.85Å; D399-H402 IonicContact OD2-ND1 2.99Å; D399-Y404 WeakPolarHBondContact CB-OH 3.49Å; D399-Y404 PolarHBondContact N-OH 3.35Å
400	P	70.9	Confident	85.2	Confident	104 Å²	104	43 Å²	43	68%	0.675	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	128.1	178.4	-27	36	0	0	0	112.6	L398 H402	L398-P400 WeakPolarHBondContact O-CD 3.43Å; P400-H402 VanDerWaalsContact C-N 3.34Å
401	G	72.1	Confident	85.4	Confident	53 Å²	53	42.7 Å²	42.7	55%	0.546	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	-7.1	-177.8	0	0	0	0	0	115	D399	D399-G401 PolarHBondContact O-N 2.75Å
402	H	83.4	Confident	85	Confident	46 Å²	46	40.6 Å²	40.6	21%	0.213	23%	0.227	C	C	.	.			trans	-77.9	151.7	169.6	-72.3	-162	0	0	0	111.2	D372 S374 D399 P400 Y404 A428	D372-H402 IonicContact OD1-ND1 3.74Å; D372-H402 IonicContact OD2-CE1 3.78Å; D372-H402 IonicContact OD2-CG 3.23Å; D372-H402 IonicContact OD2-ND1 2.68Å; D372-H402 PolarHBondContact OD2-ND1 3.21Å; S374-H402 WeakPolarHBondContact OG-CA 3.31Å; D399-H402 HydrophobicContact CB-CB 4.19Å; D399-H402 WeakPolarHBondContact O-CB 3.47Å; D399-H402 PolarHBondContact O-N 2.76Å; D399-H402 VanDerWaalsContact O-N 3.08Å; D399-H402 IonicContact OD2-CE1 2.85Å; D399-H402 IonicContact OD2-ND1 2.99Å; P400-H402 VanDerWaalsContact C-N 3.34Å; H402-Y404 HydrophobicContact CB-CD2 4.34Å; H402-Y404 HydrophobicContact CB-CE2 3.51Å; H402-A428 VanDerWaalsContact O-CB 3.27Å; H402-A428 WeakPolarHBondContact O-CB 3.46Å
403	S	85	Confident	84	Confident	38 Å²	38	37.5 Å²	37.5	27%	0.266	23%	0.228	S	C	.	.			trans	-105.9	124.8	176.9	-65.5	0	0	0	0	109.7	L373 S374 L426	L373-S403 WeakPolarHBondContact CA-O 3.14Å; L373-S403 WeakPolarHBondContact CB-O 3.35Å; L373-S403 WeakPolarHBondContact CG-O 3.24Å; L373-S403 PolarHBondContact N-O 3.45Å; S374-S403 PolarHBondContact OG-N 3.36Å; S374-S403 VanDerWaalsContact OG-N 3.11Å; S403-L426 WeakPolarHBondContact CA-O 3.32Å
404	Y	88.8	Confident	83.5	Confident	11 Å²	11	40.7 Å²	40.7	4%	0.043	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	146.5	-175.6	-64	-82.9	0	0	0	112.4	F370 D372 L398 D399 H402 F406 S425 L426	F370-Y404 HydrophobicContact CD2-CD1 4.1Å; F370-Y404 HydrophobicContact CD2-CE1 4.31Å; F370-Y404 HydrophobicContact CE2-CE1 4.43Å; D372-Y404 HydrophobicContact CB-CD1 4Å; D372-Y404 HydrophobicContact CB-CE1 3.65Å; D372-Y404 VanDerWaalsContact OD2-CE1 3.24Å; D372-Y404 WeakPolarHBondContact OD2-CE1 3.36Å; D372-Y404 PolarHBondContact OD2-OH 3.17Å; L398-Y404 HydrophobicContact CB-CD2 4.19Å; L398-Y404 HydrophobicContact CB-CE2 3.7Å; L398-Y404 HydrophobicContact CD1-CD2 4.2Å; L398-Y404 HydrophobicContact CD2-CD1 4.11Å; L398-Y404 HydrophobicContact CD2-CD2 3.98Å; L398-Y404 HydrophobicContact CD2-CE1 4.04Å; L398-Y404 HydrophobicContact CD2-CE2 3.9Å; L398-Y404 HydrophobicContact CD2-CG 4.08Å; L398-Y404 HydrophobicContact CG-CD2 4.36Å; L398-Y404 HydrophobicContact CG-CE2 4.25Å; D399-Y404 WeakPolarHBondContact CB-OH 3.49Å; D399-Y404 PolarHBondContact N-OH 3.35Å; H402-Y404 HydrophobicContact CB-CD2 4.34Å; H402-Y404 HydrophobicContact CB-CE2 3.51Å; Y404-F406 HydrophobicContact CG-CZ 4.23Å; Y404-S425 WeakPolarHBondContact O-CA 3.46Å; Y404-L426 PolarHBondContact O-N 2.91Å
405	A	92.1	Very high	83.4	Confident	7 Å²	7	39.6 Å²	39.6	6%	0.058	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.1	166.8	0	0	0	0	0	110.2	F370 C371 L373 W380 A422	F370-A405 CarbonylContact C-O 3.11Å; F370-A405 WeakPolarHBondContact CA-O 3.07Å; C371-A405 PolarHBondContact N-O 3.25Å; C371-A405 PolarHBondContact O-N 3.16Å; L373-A405 HydrophobicContact CD1-CB 4.12Å; L373-A405 HydrophobicContact CD2-CB 4.41Å; L373-A405 HydrophobicContact CG-CB 4.41Å; W380-A405 HydrophobicContact CH2-CB 4.01Å; W380-A405 WeakPolarHBondContact CZ3-O 3.28Å; A405-A422 HydrophobicContact CB-CB 4.39Å
406	F	94.1	Very high	83.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.3	-175.7	-57.9	-88	0	0	0	110.8	P343 I353 L355 E369 F370 L383 V395 L398 Y404 A422 S423	P343-F406 HydrophobicContact CG-CB 4Å; P343-F406 VanDerWaalsContact CG-O 3.25Å; P343-F406 WeakPolarHBondContact CG-O 3.38Å; I353-F406 HydrophobicContact CD1-CD2 3.96Å; I353-F406 HydrophobicContact CD1-CE1 4.39Å; I353-F406 HydrophobicContact CD1-CE2 3.34Å; I353-F406 HydrophobicContact CD1-CZ 3.59Å; L355-F406 HydrophobicContact CD1-CB 3.76Å; L355-F406 HydrophobicContact CD1-CD1 3.75Å; L355-F406 HydrophobicContact CD1-CD2 4.39Å; L355-F406 HydrophobicContact CD1-CE1 4.48Å; L355-F406 HydrophobicContact CD1-CG 3.69Å; L355-F406 HydrophobicContact CD2-CB 4.28Å; L355-F406 HydrophobicContact CD2-CD2 4.14Å; L355-F406 HydrophobicContact CD2-CG 4.19Å; E369-F406 CarbonylContact O-C 3.56Å; E369-F406 WeakPolarHBondContact O-CA 3.31Å; F370-F406 HydrophobicContact CB-CD1 3.5Å; F370-F406 HydrophobicContact CB-CE1 3.48Å; F370-F406 VanDerWaalsContact CB-CE1 3.48Å; F370-F406 HydrophobicContact CB-CZ 4.47Å; F370-F406 HydrophobicContact CG-CE1 4.45Å; L383-F406 HydrophobicContact CD1-CD1 3.91Å; L383-F406 HydrophobicContact CD1-CE1 3.71Å; V395-F406 HydrophobicContact CG1-CE1 4.14Å; V395-F406 HydrophobicContact CG1-CZ 4.44Å; V395-F406 HydrophobicContact CG2-CE1 4.19Å; L398-F406 HydrophobicContact CD1-CZ 4.08Å; L398-F406 HydrophobicContact CD2-CZ 4.15Å; Y404-F406 HydrophobicContact CG-CZ 4.23Å; F406-A422 CarbonylContact O-C 3.42Å; F406-A422 WeakPolarHBondContact O-CA 3.31Å; F406-S423 PolarHBondContact N-OG 2.94Å; F406-S423 PolarHBondContact O-N 2.8Å
407	R	95.7	Very high	84.4	Confident	57 Å²	57	42.8 Å²	42.8	22%	0.215	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	163.8	174.1	73.6	-173.5	-171.7	-175.9	-1.3	111.2	V368 E369 W380 P419 S420	V368-R407 WeakPolarHBondContact CA-O 3.39Å; E369-R407 HydrophobicContact CB-CG 4.06Å; E369-R407 PolarHBondContact N-O 3.45Å; E369-R407 PolarHBondContact O-N 3.13Å; E369-R407 IonicContact OE2-CZ 3.7Å; E369-R407 IonicContact OE2-NE 2.68Å; E369-R407 PolarHBondContact OE2-NE 3.03Å; E369-R407 IonicContact OE2-NH2 3.43Å; E369-R407 PolarHBondContact OE2-NH2 3.49Å; W380-R407 HydrophobicContact CD2-CG 4.24Å; W380-R407 HydrophobicContact CE3-CB 4.45Å; W380-R407 HydrophobicContact CE3-CG 3.62Å; W380-R407 HydrophobicContact CH2-CB 4.12Å; W380-R407 HydrophobicContact CH2-CG 4.11Å; W380-R407 HydrophobicContact CZ3-CB 3.88Å; W380-R407 HydrophobicContact CZ3-CG 3.55Å; R407-P419 HydrophobicContact CG-CB 4.21Å; R407-S420 WeakPolarHBondContact CA-OG 3.37Å
408	V	95.9	Very high	85.3	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	138	-175	-168.7	0	0	0	0	111.1	P340 P343 W357 Y366 Q367 V368 P419 S420	P340-V408 HydrophobicContact CB-CB 4.02Å; P340-V408 HydrophobicContact CB-CG1 4.13Å; P340-V408 HydrophobicContact CG-CB 4.17Å; P340-V408 HydrophobicContact CG-CG1 4Å; P343-V408 HydrophobicContact CB-CG2 3.78Å; P343-V408 HydrophobicContact CG-CG2 3.86Å; W357-V408 HydrophobicContact CB-CG2 4.48Å; W357-V408 HydrophobicContact CD2-CB 4.45Å; W357-V408 HydrophobicContact CD2-CG1 4.02Å; W357-V408 HydrophobicContact CD2-CG2 3.75Å; W357-V408 HydrophobicContact CE3-CG2 3.76Å; W357-V408 HydrophobicContact CG-CG1 4.25Å; W357-V408 HydrophobicContact CG-CG2 4.08Å; W357-V408 HydrophobicContact CZ2-CG1 4.15Å; W357-V408 HydrophobicContact CZ3-CG2 4.29Å; Y366-V408 HydrophobicContact CD1-CG1 3.91Å; Y366-V408 HydrophobicContact CG-CG1 4.21Å; Q367-V408 CarbonylContact O-C 3.55Å; Q367-V408 WeakPolarHBondContact O-CA 3.35Å; V368-V408 HydrophobicContact CG2-CG2 4.43Å; V408-P419 WeakPolarHBondContact O-CA 3.3Å; V408-S420 PolarHBondContact N-OG 3.33Å; V408-S420 PolarHBondContact O-N 3.03Å
409	L	96.4	Very high	86	Confident	15 Å²	15	46.2 Å²	46.2	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.6	169.7	-53.4	79.5	0	0	0	108.6	Y366 Q367 E369 Y416 P419	Y366-L409 CarbonylContact C-O 3.55Å; Y366-L409 WeakPolarHBondContact CA-O 3.34Å; Q367-L409 HydrophobicContact CB-CB 4.28Å; Q367-L409 HydrophobicContact CB-CD1 4.35Å; Q367-L409 HydrophobicContact CG-CD1 4.3Å; Q367-L409 PolarHBondContact N-O 3.15Å; Q367-L409 PolarHBondContact O-N 3.39Å; E369-L409 VanDerWaalsContact CD-CD1 3.42Å; E369-L409 HydrophobicContact CG-CD1 3.85Å; E369-L409 WeakPolarHBondContact OE1-CD1 3.31Å; L409-Y416 HydrophobicContact CB-CD1 3.91Å; L409-Y416 HydrophobicContact CD2-CD1 4.13Å; L409-Y416 HydrophobicContact CD2-CG 4.33Å; L409-P419 HydrophobicContact CD1-CB 4.27Å; L409-P419 HydrophobicContact CD1-CG 4.44Å; L409-P419 HydrophobicContact CD2-CG 4Å; L409-P419 HydrophobicContact CG-CB 4.02Å; L409-P419 HydrophobicContact CG-CG 4Å
410	A	92.9	Very high	86.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	139.1	167.5	0	0	0	0	0	109.3	P337 P340 V360 V363 Y366 Y416 S417	P337-A410 HydrophobicContact CB-CB 3.67Å; P337-A410 HydrophobicContact CG-CB 4.24Å; P340-A410 HydrophobicContact CG-CB 3.8Å; V360-A410 HydrophobicContact CB-CB 4.18Å; V360-A410 HydrophobicContact CG1-CB 4.11Å; V360-A410 HydrophobicContact CG2-CB 4.29Å; V363-A410 HydrophobicContact CG1-CB 3.64Å; Y366-A410 HydrophobicContact CD1-CB 4.1Å; Y366-A410 HydrophobicContact CE1-CB 4.12Å; A410-Y416 CarbonylContact O-C 3.53Å; A410-Y416 WeakPolarHBondContact O-CA 3.3Å; A410-S417 PolarHBondContact N-OG 3.07Å; A410-S417 WeakPolarHBondContact O-CB 3.14Å; A410-S417 PolarHBondContact O-N 3.29Å; A410-S417 PolarHBondContact O-OG 3.24Å
411	K	85.4	Confident	88	Confident	56 Å²	56	45.2 Å²	45.2	24%	0.243	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	141.1	177.6	171.9	157.7	161.2	-170.7	0	111.6	V363 Q364 G365 L387 G415 Y416	V363-K411 CarbonylContact C-O 3.59Å; V363-K411 WeakPolarHBondContact CA-O 3.29Å; V363-K411 WeakPolarHBondContact CB-O 3.4Å; Q364-K411 PolarHBondContact N-O 3.42Å; G365-K411 PolarHBondContact N-O 2.91Å; G365-K411 PolarHBondContact O-N 3.4Å; L387-K411 HydrophobicContact CD1-CB 4.05Å; L387-K411 HydrophobicContact CD1-CD 3.76Å; L387-K411 HydrophobicContact CD1-CG 3.91Å; L387-K411 HydrophobicContact CD2-CB 4.25Å; L387-K411 HydrophobicContact CD2-CD 4.21Å; K411-G415 WeakPolarHBondContact CA-O 3.2Å; K411-Y416 HydrophobicContact CB-CD1 3.75Å; K411-Y416 HydrophobicContact CB-CE1 3.93Å; K411-Y416 HydrophobicContact CB-CG 4.35Å; K411-Y416 HydrophobicContact CD-CD1 3.77Å; K411-Y416 HydrophobicContact CD-CD2 3.96Å; K411-Y416 HydrophobicContact CD-CE1 3.37Å; K411-Y416 HydrophobicContact CD-CE2 3.58Å; K411-Y416 HydrophobicContact CD-CG 4.05Å; K411-Y416 HydrophobicContact CG-CD1 4.28Å; K411-Y416 HydrophobicContact CG-CE1 4.27Å; K411-Y416 PolarHBondContact NZ-OH 3.21Å
412	N	82.9	Confident	89	Confident	9 Å²	9	44.8 Å²	44.8	5%	0.048	24%	0.237	C	C	.	.			trans	-134.1	-170.1	165.4	73.8	10.5	0	0	0	111	T335 P337 A362 Q364 I414 G415	T335-N412 PolarHBondContact O-ND2 2.68Å; P337-N412 HydrophobicContact CG-CB 3.83Å; A362-N412 VanDerWaalsContact O-CB 3.23Å; A362-N412 WeakPolarHBondContact O-CB 3.36Å; Q364-N412 VanDerWaalsContact OE1-C 3.23Å; Q364-N412 PolarHBondContact OE1-O 2.64Å; N412-I414 PolarHBondContact O-N 3.39Å; N412-I414 VanDerWaalsContact O-N 3.11Å; N412-I414 WeakPolarHBondContact OD1-CB 3.26Å; N412-I414 PolarHBondContact OD1-N 2.95Å; N412-G415 PolarHBondContact N-O 3.31Å; N412-G415 PolarHBondContact O-N 3.33Å; N412-G415 VanDerWaalsContact O-N 3.16Å; N412-G415 PolarHBondContact OD1-N 3.04Å
413	A	68.1	Low	89.2	Confident	57 Å²	57	43.1 Å²	43.1	47%	0.471	23%	0.23	S	C	.	.	S	Bend	trans	-62.7	-15.5	-178.3	0	0	0	0	0	114.9
414	I	75.2	Confident	89	Confident	94 Å²	94	48.8 Å²	48.8	48%	0.482	26%	0.257	S	S	.	.	S	Bend	trans	-89.7	-35.3	176.6	-50.3	-58.9	0	0	0	111.2	I336 N412	I336-I414 HydrophobicContact CG1-CG2 3.89Å; N412-I414 PolarHBondContact O-N 3.39Å; N412-I414 VanDerWaalsContact O-N 3.11Å; N412-I414 WeakPolarHBondContact OD1-CB 3.26Å; N412-I414 PolarHBondContact OD1-N 2.95Å
415	G	79.8	Confident	88	Confident	21 Å²	21	51.7 Å²	51.7	22%	0.216	28%	0.278	C	S	.	.			trans	159.3	-169.3	177.4	0	0	0	0	0	114.6	P337 K411 N412	P337-G415 WeakPolarHBondContact CD-O 3.38Å; K411-G415 WeakPolarHBondContact CA-O 3.2Å; N412-G415 PolarHBondContact N-O 3.31Å; N412-G415 PolarHBondContact O-N 3.33Å; N412-G415 VanDerWaalsContact O-N 3.16Å; N412-G415 PolarHBondContact OD1-N 3.04Å
416	Y	88.7	Confident	86.5	Confident	93 Å²	93	53 Å²	53	37%	0.365	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-81.9	142.2	170.4	-68.1	-86	0	0	0	111	I336 Q367 L387 L409 A410 K411	I336-Y416 WeakPolarHBondContact CG2-O 3.36Å; Q367-Y416 HydrophobicContact CB-CD1 4.38Å; Q367-Y416 HydrophobicContact CB-CE1 3.78Å; Q367-Y416 HydrophobicContact CG-CE1 4.35Å; L387-Y416 HydrophobicContact CD2-CE1 4.12Å; L409-Y416 HydrophobicContact CB-CD1 3.91Å; L409-Y416 HydrophobicContact CD2-CD1 4.13Å; L409-Y416 HydrophobicContact CD2-CG 4.33Å; A410-Y416 CarbonylContact O-C 3.53Å; A410-Y416 WeakPolarHBondContact O-CA 3.3Å; K411-Y416 HydrophobicContact CB-CD1 3.75Å; K411-Y416 HydrophobicContact CB-CE1 3.93Å; K411-Y416 HydrophobicContact CB-CG 4.35Å; K411-Y416 HydrophobicContact CD-CD1 3.77Å; K411-Y416 HydrophobicContact CD-CD2 3.96Å; K411-Y416 HydrophobicContact CD-CE1 3.37Å; K411-Y416 HydrophobicContact CD-CE2 3.58Å; K411-Y416 HydrophobicContact CD-CG 4.05Å; K411-Y416 HydrophobicContact CG-CD1 4.28Å; K411-Y416 HydrophobicContact CG-CE1 4.27Å; K411-Y416 PolarHBondContact NZ-OH 3.21Å
417	S	93.3	Very high	84.6	Confident	8 Å²	8	58 Å²	58	6%	0.056	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-60.5	172.5	165.7	70	0	0	0	0	111.4	P337 A338 P340 A410	P337-S417 WeakPolarHBondContact O-CB 3.22Å; A338-S417 VanDerWaalsContact O-CB 3.29Å; A338-S417 WeakPolarHBondContact O-CB 3.37Å; P340-S417 WeakPolarHBondContact CD-OG 3.34Å; A410-S417 PolarHBondContact N-OG 3.07Å; A410-S417 WeakPolarHBondContact O-CB 3.14Å; A410-S417 PolarHBondContact O-N 3.29Å; A410-S417 PolarHBondContact O-OG 3.24Å
418	K	93.4	Very high	82	Confident	170 Å²	170	56.6 Å²	56.6	74%	0.739	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-57.6	144.7	154.8	-68.1	-175.6	177.1	-176.8	0	108.7	C339	C339-K418 PolarHBondContact SG-O 3.32Å; C339-K418 VanDerWaalsContact SG-O 3.4Å
419	P	95.2	Very high	79.5	Confident	49 Å²	49	64 Å²	64	32%	0.318	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-61	146.2	168.3	-16.4	28.7	0	0	0	110.6	C339 R407 V408 L409	C339-P419 PolarHBondContact SG-O 2.89Å; R407-P419 HydrophobicContact CG-CB 4.21Å; V408-P419 WeakPolarHBondContact O-CA 3.3Å; L409-P419 HydrophobicContact CD1-CB 4.27Å; L409-P419 HydrophobicContact CD1-CG 4.44Å; L409-P419 HydrophobicContact CD2-CG 4Å; L409-P419 HydrophobicContact CG-CB 4.02Å; L409-P419 HydrophobicContact CG-CG 4Å
420	S	96.2	Very high	77.1	Confident	7 Å²	7	65.1 Å²	65.1	5%	0.049	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-56.3	162.4	167.9	72.9	0	0	0	0	111.1	P340 S341 P343 R407 V408	P340-S420 VanDerWaalsContact O-CB 3.3Å; P340-S420 WeakPolarHBondContact O-CB 3.32Å; S341-S420 VanDerWaalsContact O-CB 3.24Å; S341-S420 WeakPolarHBondContact O-CB 3.5Å; P343-S420 WeakPolarHBondContact CD-OG 3.33Å; R407-S420 WeakPolarHBondContact CA-OG 3.37Å; V408-S420 PolarHBondContact N-OG 3.33Å; V408-S420 PolarHBondContact O-N 3.03Å
421	E	93.9	Very high	74.4	Confident	159 Å²	159	75 Å²	75	74%	0.743	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-54.7	150.1	157.1	-67.7	-58.5	151	0	0	110	A342	A342-E421 WeakPolarHBondContact CA-O 3.36Å; A342-E421 HydrophobicContact CB-CB 4.23Å; A342-E421 WeakPolarHBondContact CB-O 3.09Å
422	A	92.3	Very high	71.7	Confident	44 Å²	44	81.2 Å²	81.2	36%	0.364	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-69.5	150.5	179.7	0	0	0	0	0	111.3	W380 A405 F406	W380-A422 HydrophobicContact CH2-CB 3.89Å; W380-A422 HydrophobicContact CZ2-CB 4.28Å; A405-A422 HydrophobicContact CB-CB 4.39Å; F406-A422 CarbonylContact O-C 3.42Å; F406-A422 WeakPolarHBondContact O-CA 3.31Å
423	S	88.6	Confident	69.3	Low	10 Å²	10	84.8 Å²	84.8	7%	0.07	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-55.3	153.7	164.1	71.4	0	0	0	0	110.1	P343 F406 S425	P343-S423 VanDerWaalsContact O-CB 3.27Å; P343-S423 WeakPolarHBondContact O-CB 3.32Å; F406-S423 PolarHBondContact N-OG 2.94Å; F406-S423 PolarHBondContact O-N 2.8Å; S423-S425 PolarHBondContact O-N 3.35Å
424	L	79.6	Confident	67.5	Low	158 Å²	158	91.2 Å²	91.2	83%	0.827	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-54.3	135	163.2	-63.4	175.1	0	0	0	108.9	L426	L424-L426 PolarHBondContact O-N 3.47Å
425	S	69	Low	65.2	Low	72 Å²	72	96 Å²	96	50%	0.503	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-64.1	121.6	179.3	54.3	0	0	0	0	109.8	Y404 S423 P427	Y404-S425 WeakPolarHBondContact O-CA 3.46Å; S423-S425 PolarHBondContact O-N 3.35Å; S425-P427 WeakPolarHBondContact O-CD 3.28Å
426	L	60.6	Low	62.8	Low	34 Å²	34	100.3 Å²	100.3	18%	0.178	52%	0.519	C	S	.	.	B	Isolated β-bridge	trans	-80.9	119.5	176.1	-67	-179.2	0	0	0	110.4	V345 I348 I353 S403 Y404 L424	V345-L426 HydrophobicContact CB-CD2 4.43Å; V345-L426 HydrophobicContact CG1-CD1 4.09Å; V345-L426 HydrophobicContact CG1-CD2 4.35Å; V345-L426 HydrophobicContact CG2-CD1 3.93Å; V345-L426 HydrophobicContact CG2-CD2 4.11Å; V345-L426 HydrophobicContact CG2-CG 4.17Å; I348-L426 HydrophobicContact CD1-CD1 4.21Å; I348-L426 HydrophobicContact CD1-CD2 4.1Å; I353-L426 HydrophobicContact CD1-CD1 3.92Å; I353-L426 HydrophobicContact CG2-CD1 3.95Å; S403-L426 WeakPolarHBondContact CA-O 3.32Å; Y404-L426 PolarHBondContact O-N 2.91Å; L424-L426 PolarHBondContact O-N 3.47Å
427	P	53.2	Low	60	Low	105 Å²	105	100.9 Å²	100.9	68%	0.682	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-77.1	119.1	162.4	-3.2	22.6	0	0	0	107.8	S425 E429	S425-P427 WeakPolarHBondContact O-CD 3.28Å; P427-E429 PolarHBondContact O-N 3.23Å
428	A	41.2	Very low	56.9	Low	27 Å²	27	106.6 Å²	106.6	22%	0.223	57%	0.571	C	S	.	*			trans	-76	65.1	-176.1	0	0	0	0	0	113.7	H402 M430	H402-A428 VanDerWaalsContact O-CB 3.27Å; H402-A428 WeakPolarHBondContact O-CB 3.46Å; A428-M430 HydrophobicContact CB-CG 4.07Å; A428-M430 HydrophobicContact CB-SD 4.01Å; A428-M430 PolarHBondContact O-N 2.82Å
429	E	44.5	Very low	53.9	Low	157 Å²	157	106.3 Å²	106.3	73%	0.734	58%	0.576	S	S	*	*			trans	-71.2	54.6	151.9	-76.8	-163.1	-169.4	0	0	110.1	P427 R431	P427-E429 PolarHBondContact O-N 3.23Å; E429-R431 PolarHBondContact O-N 2.86Å
430	M	45.8	Very low	50.9	Low	38 Å²	38	109.8 Å²	109.8	19%	0.187	60%	0.597	C	S	.	*			trans	-72.1	80.5	175.4	-75.8	173.5	149.8	0	0	109	I348 G350 I353 L398 A428 E432	I348-M430 HydrophobicContact CG2-CE 4.16Å; I348-M430 HydrophobicContact CG2-CG 4.24Å; G350-M430 WeakPolarHBondContact O-CE 3.31Å; G350-M430 WeakPolarHBondContact O-CG 3.11Å; I353-M430 HydrophobicContact CG2-CE 4.16Å; L398-M430 HydrophobicContact CB-CE 4.21Å; L398-M430 HydrophobicContact CD1-CE 4.09Å; A428-M430 HydrophobicContact CB-CG 4.07Å; A428-M430 HydrophobicContact CB-SD 4.01Å; A428-M430 PolarHBondContact O-N 2.82Å; M430-E432 PolarHBondContact O-N 2.95Å
431	R	35.9	Very low	47.6	Very low	208 Å²	208	116.2 Å²	116.2	79%	0.785	63%	0.63	S	S	*	*			trans	-54.9	130.7	-175.3	-67.6	-178.5	178.4	-178.3	-1.1	111.4	E429 A433	E429-R431 PolarHBondContact O-N 2.86Å; R431-A433 PolarHBondContact O-N 3.16Å
432	E	29.1	Very low	44.6	Very low	186 Å²	186	116.5 Å²	116.5	87%	0.869	64%	0.637	S	S	*	*			trans	-48.2	106.3	-178.9	-61.6	174.9	134.2	0	0	112.3	M430 K434	M430-E432 PolarHBondContact O-N 2.95Å; E432-K434 PolarHBondContact O-N 3.05Å; E432-K434 VanDerWaalsContact O-N 3.11Å
433	A	32.2	Very low	41.7	Very low	83 Å²	83	120.7 Å²	120.7	69%	0.686	65%	0.653	S	S	*	*			trans	-75.3	96.9	165.4	0	0	0	0	0	107.6	R431 E435	R431-A433 PolarHBondContact O-N 3.16Å; A433-E435 PolarHBondContact O-N 2.98Å
434	K	30	Very low	38.9	Very low	192 Å²	192	129.9 Å²	129.9	84%	0.835	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-46.9	126.1	-177.6	-70.2	-178	176.1	-178.3	0	111.7	E432 S436	E432-K434 PolarHBondContact O-N 3.05Å; E432-K434 VanDerWaalsContact O-N 3.11Å; K434-S436 PolarHBondContact O-N 2.68Å
435	E	27.3	Very low	36.6	Very low	196 Å²	196	126.4 Å²	126.4	92%	0.916	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-50.9	126.3	172.9	-62.1	-179.2	144.1	0	0	110.1	A433	A433-E435 PolarHBondContact O-N 2.98Å
436	S	29.4	Very low	34.8	Very low	110 Å²	110	128.6 Å²	128.6	77%	0.769	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-91.5	133	166.9	-65	0	0	0	0	107.6	K434	K434-S436 PolarHBondContact O-N 2.68Å
437	P	29.1	Very low	33.6	Very low	106 Å²	106	132.8 Å²	132.8	69%	0.688	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-63.9	151.5	-175.1	27.4	-35.3	0	0	0	111	I439	P437-I439 PolarHBondContact O-N 2.83Å; P437-I439 VanDerWaalsContact O-N 3.08Å
438	P	28.7	Very low	32.5	Very low	128 Å²	128	133.3 Å²	133.3	83%	0.831	73%	0.729	S	S	*	*			trans	-62.4	115.2	178.9	26.1	-34	0	0	0	110	T440	P438-T440 PolarHBondContact O-N 2.81Å
439	I	30.9	Very low	31.9	Very low	164 Å²	164	140.4 Å²	140.4	84%	0.841	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-76.1	120.3	171.6	-66	179.4	0	0	0	107.4	P437	P437-I439 PolarHBondContact O-N 2.83Å; P437-I439 VanDerWaalsContact O-N 3.08Å
440	T	30.7	Very low	31.2	Very low	122 Å²	122	143.1 Å²	143.1	75%	0.748	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-69.1	157.2	178.8	51.8	0	0	0	0	111.9	P438	P438-T440 PolarHBondContact O-N 2.81Å
441	D	28	Very low	30.3	Very low	141 Å²	141	150.9 Å²	150.9	75%	0.754	79%	0.793	S	S	*	*	S	Bend	trans	-49.9	161.7	167	-66.3	-68.1	0	0	0	113.3
442	N	29.6	Very low	29.9	Very low	165 Å²	165	149.3 Å²	149.3	88%	0.882	80%	0.799	S	S	*	*			trans	88.3	70	172	-45.6	-83.2	0	0	0	117.7
443	D	32.3	Very low	29.9	Very low	132 Å²	132	146.6 Å²	146.6	71%	0.706	80%	0.795	S	S	*	*			trans	-147.8	124.8	144.6	-163.4	-22.9	0	0	0	110.2	S445	D443-S445 VanDerWaalsContact C-N 3.32Å; D443-S445 PolarHBondContact O-N 3.38Å; D443-S445 VanDerWaalsContact OD1-CB 3.23Å; D443-S445 WeakPolarHBondContact OD1-CB 3.32Å; D443-S445 PolarHBondContact OD1-N 2.79Å; D443-S445 PolarHBondContact OD1-OG 2.64Å
444	E	30.4	Very low	29.7	Very low	204 Å²	204	149.4 Å²	149.4	95%	0.953	80%	0.804	S	S	*	*			trans	-93.6	32.7	-178.1	-68.2	-167.2	108.3	0	0	113
445	S	31.8	Very low	29.6	Very low	85 Å²	85	149.8 Å²	149.8	59%	0.594	81%	0.809	S	S	*	*			trans	-105.9	122.1	-172.3	-61	0	0	0	0	113.4	D443	D443-S445 VanDerWaalsContact C-N 3.32Å; D443-S445 PolarHBondContact O-N 3.38Å; D443-S445 VanDerWaalsContact OD1-CB 3.23Å; D443-S445 WeakPolarHBondContact OD1-CB 3.32Å; D443-S445 PolarHBondContact OD1-N 2.79Å; D443-S445 PolarHBondContact OD1-OG 2.64Å
446	P	30.8	Very low	29.8	Very low	118 Å²	118	145.4 Å²	145.4	77%	0.766	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-72.2	137	174.8	29.3	-33.8	0	0	0	111.5
447	P	33.9	Very low	29.7	Very low	121 Å²	121	149.2 Å²	149.2	79%	0.786	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-69.2	141.7	-177.7	27.5	-34.5	0	0	0	112.2
448	P	30.1	Very low	29.9	Very low	117 Å²	117	151.2 Å²	151.2	76%	0.76	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-79.6	133.6	-171.5	30.3	-35.3	0	0	0	113.6	R450	P448-R450 PolarHBondContact O-N 3.35Å
449	L	28.6	Very low	30.1	Very low	175 Å²	175	148.6 Å²	148.6	92%	0.916	81%	0.812	S	S	*	*			trans	-65	89.4	172.5	-73.1	169.3	0	0	0	112.6
450	R	30	Very low	30.2	Very low	214 Å²	214	142.4 Å²	142.4	81%	0.808	79%	0.789	S	S	*	*			trans	-169.4	144.7	165	-100.5	145.3	-169.3	-159.5	4.6	108.2	P448	P448-R450 PolarHBondContact O-N 3.35Å
451	R	27.3	Very low	31.2	Very low	201 Å²	201	139.8 Å²	139.8	76%	0.758	77%	0.77	S	S	*	*			cis	-155.7	146.5	9.9	-154.5	176.8	-55.6	-149.6	4.3	109.3	T453	R451-T453 PolarHBondContact O-N 2.75Å
452	L	27.3	Very low	32.4	Very low	176 Å²	176	139.7 Å²	139.7	92%	0.921	77%	0.765	S	S	*	*			trans	-65.9	124.1	167.9	-81	158.7	0	0	0	110.4
453	T	29.6	Very low	33.6	Very low	128 Å²	128	138.1 Å²	138.1	79%	0.785	75%	0.747	S	S	*	*			trans	-137.6	124	161.3	44.6	0	0	0	0	109.2	R451	R451-T453 PolarHBondContact O-N 2.75Å
454	T	26.8	Very low	35.6	Very low	142 Å²	142	138.1 Å²	138.1	87%	0.871	74%	0.737	S	S	*	*			trans	-72.5	127.2	-171.9	46.6	0	0	0	0	113.4
455	Q	29.8	Very low	37.6	Very low	200 Å²	200	134.6 Å²	134.6	94%	0.935	73%	0.725	S	S	*	*			trans	-145.9	163.7	151.9	-107.8	168.9	34	0	0	110.2
456	S	30.8	Very low	40.1	Very low	104 Å²	104	132 Å²	132	73%	0.727	71%	0.706	S	S	*	*			trans	-85	126.6	-151.3	49.8	0	0	0	0	116.6
457	Q	27.3	Very low	42.9	Very low	190 Å²	190	130.1 Å²	130.1	89%	0.888	69%	0.693	S	S	*	*			trans	30.5	89.9	135.2	-64.6	179.8	-17.7	0	0	119.2
458	T	32.5	Very low	45.7	Very low	148 Å²	148	125.1 Å²	125.1	91%	0.908	66%	0.659	S	S	*	*			trans	-149.9	130.3	134.3	41	0	0	0	0	106.7
459	G	33.4	Very low	48.8	Very low	73 Å²	73	122.2 Å²	122.2	75%	0.753	64%	0.641	S	S	*	*			trans	-118.3	125.5	-166.3	0	0	0	0	0	114
460	G	34.2	Very low	52	Low	34 Å²	34	116.5 Å²	116.5	35%	0.351	61%	0.609	S	S	.	*			trans	-155.1	174.7	179.9	0	0	0	0	0	113.5	E347	E347-G460 VanDerWaalsContact CD-C 3.47Å; E347-G460 VanDerWaalsContact CD-CA 3.41Å; E347-G460 WeakPolarHBondContact OE1-CA 3.4Å; E347-G460 VanDerWaalsContact OE2-C 3.29Å
461	I	50.3	Low	55	Low	67 Å²	67	106.3 Å²	106.3	34%	0.344	57%	0.571	S	S	.	*			trans	-105	99.9	-167.8	-51	173.8	0	0	0	110.7	E347 N354 Y463	E347-I461 PolarHBondContact OE2-N 2.93Å; E347-I461 VanDerWaalsContact OE2-O 3.1Å; N354-I461 PolarHBondContact ND2-O 2.99Å; I461-Y463 HydrophobicContact CB-CE2 4.12Å; I461-Y463 HydrophobicContact CG2-CD2 4.03Å; I461-Y463 HydrophobicContact CG2-CE2 3.57Å; I461-Y463 WeakPolarHBondContact O-CD2 3.5Å; I461-Y463 PolarHBondContact O-N 2.85Å
462	H	53.3	Low	58.4	Low	140 Å²	140	97 Å²	97	65%	0.648	54%	0.536	S	S	*	.			trans	-65.3	115.1	168	-81.5	-70.9	0	0	0	111.2	R349	R349-H462 WeakPolarHBondContact CD-ND1 3.34Å; R349-H462 VanDerWaalsContact CZ-CB 3.5Å; R349-H462 PolarHBondContact NE-CD2 2.96Å; R349-H462 VanDerWaalsContact NE-CD2 3.34Å; R349-H462 PolarHBondContact NE-CE1 3.07Å; R349-H462 PolarHBondContact NE-ND1 2.85Å; R349-H462 PolarHBondContact NH1-CD2 3.44Å; R349-H462 PolarHBondContact NH1-CE1 2.81Å; R349-H462 PolarHBondContact NH1-ND1 2.82Å; R349-H462 PolarHBondContact NH1-NE2 2.69Å; R349-H462 PolarHBondContact NH2-CD2 2.94Å; R349-H462 PolarHBondContact NH2-CE1 3.18Å; R349-H462 VanDerWaalsContact NH2-CG 3.29Å; R349-H462 PolarHBondContact NH2-NE2 3.39Å
463	Y	54.2	Low	61.7	Low	131 Å²	131	93.5 Å²	93.5	51%	0.514	52%	0.518	S	S	.	.			trans	-80.9	121.6	164.6	-77.7	-109.4	0	0	0	109	N354 N394 I461	N354-Y463 VanDerWaalsContact OD1-CE2 3.23Å; N354-Y463 WeakPolarHBondContact OD1-CE2 3.31Å; N394-Y463 HydrophobicContact CB-CD1 4.05Å; N394-Y463 HydrophobicContact CB-CD2 3.79Å; N394-Y463 HydrophobicContact CB-CE1 3.78Å; N394-Y463 HydrophobicContact CB-CE2 3.55Å; N394-Y463 HydrophobicContact CB-CG 4.06Å; N394-Y463 WeakPolarHBondContact ND2-CD2 3.47Å; I461-Y463 HydrophobicContact CB-CE2 4.12Å; I461-Y463 HydrophobicContact CG2-CD2 4.03Å; I461-Y463 HydrophobicContact CG2-CE2 3.57Å; I461-Y463 WeakPolarHBondContact O-CD2 3.5Å; I461-Y463 PolarHBondContact O-N 2.85Å
464	R	74.6	Confident	64.9	Low	132 Å²	132	91.5 Å²	91.5	50%	0.498	50%	0.497	S	S	.	.			trans	-155.3	150.3	172.5	68.4	-179.4	-175.7	117.1	0.7	107.1	P466 E470 Y474	R464-P466 VanDerWaalsContact O-CD 3.29Å; R464-P466 WeakPolarHBondContact O-CD 3.17Å; R464-E470 IonicContact CZ-OE1 3.78Å; R464-E470 VanDerWaalsContact CZ-OE1 3.23Å; R464-E470 IonicContact CZ-OE2 3.56Å; R464-E470 VanDerWaalsContact NH1-CD 3.3Å; R464-E470 IonicContact NH1-OE1 2.73Å; R464-E470 PolarHBondContact NH1-OE1 2.67Å; R464-E470 IonicContact NH1-OE2 3.68Å; R464-E470 PolarHBondContact NH1-OE2 3.14Å; R464-E470 IonicContact NH2-OE1 3.19Å; R464-E470 PolarHBondContact NH2-OE1 2.99Å; R464-E470 IonicContact NH2-OE2 2.95Å; R464-Y474 PolarHBondContact NH2-OH 3.47Å
465	D	73.1	Confident	68.2	Low	130 Å²	130	84.9 Å²	84.9	70%	0.695	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-70.6	120.1	164.5	-72	-59.1	0	0	0	109.1	Y489	D465-Y489 PolarHBondContact OD1-OH 3.26Å
466	P	83.2	Confident	71.4	Confident	30 Å²	30	78.9 Å²	78.9	20%	0.195	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-71.7	137.4	173.9	29.9	-33.5	0	0	0	109.8	R464 E470 V471 Y474 Y489	R464-P466 VanDerWaalsContact O-CD 3.29Å; R464-P466 WeakPolarHBondContact O-CD 3.17Å; P466-E470 HydrophobicContact CB-CB 4.26Å; P466-V471 HydrophobicContact CB-CG2 3.93Å; P466-V471 HydrophobicContact CG-CG2 3.58Å; P466-Y474 HydrophobicContact CB-CE2 3.86Å; P466-Y474 HydrophobicContact CG-CE2 4.47Å; P466-Y489 HydrophobicContact CG-CD1 4.27Å; P466-Y489 HydrophobicContact CG-CE1 3.8Å
467	T	90.9	Very high	74.4	Confident	79 Å²	79	74.9 Å²	74.9	49%	0.485	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-64.5	154	176.6	62.5	0	0	0	0	110.7	P469 E470 V471	T467-P469 VanDerWaalsContact C-CD 3.44Å; T467-P469 VanDerWaalsContact C-N 3.32Å; T467-E470 WeakPolarHBondContact CB-OE2 3.33Å; T467-E470 PolarHBondContact N-OE2 3.22Å; T467-E470 WeakPolarHBondContact O-CA 3.44Å; T467-E470 WeakPolarHBondContact O-CB 3.27Å; T467-E470 PolarHBondContact O-N 3.05Å; T467-E470 VanDerWaalsContact OG1-CD 3.3Å; T467-E470 VanDerWaalsContact OG1-CG 3.29Å; T467-E470 WeakPolarHBondContact OG1-CG 3.24Å; T467-E470 PolarHBondContact OG1-OE2 3.49Å; T467-V471 PolarHBondContact O-N 2.9Å
468	L	91.6	Very high	77.5	Confident	17 Å²	17	72 Å²	72	9%	0.089	41%	0.406	C	S	.	.	H	α-helix	trans	-52.7	-39.1	-177	-170.8	65.2	0	0	0	114.4	I472 L490 L493 V500 R503 V504 L507	L468-I472 HydrophobicContact CG-CD1 4.19Å; L468-I472 VanDerWaalsContact O-CG1 3.29Å; L468-I472 WeakPolarHBondContact O-CG1 3.48Å; L468-I472 PolarHBondContact O-N 2.61Å; L468-I472 VanDerWaalsContact O-N 3.15Å; L468-L490 HydrophobicContact CD1-CD1 3.45Å; L468-L490 VanDerWaalsContact CD1-CD1 3.45Å; L468-L493 HydrophobicContact CD1-CD1 4.23Å; L468-V500 HydrophobicContact CD1-CG1 4.11Å; L468-V500 HydrophobicContact CD2-CG1 4.25Å; L468-R503 HydrophobicContact CD2-CB 3.54Å; L468-V504 HydrophobicContact CD1-CG2 3.88Å; L468-V504 HydrophobicContact CD2-CG2 4.26Å; L468-V504 HydrophobicContact CG-CG2 4.4Å; L468-L507 HydrophobicContact CD2-CD1 4.18Å; L468-L507 HydrophobicContact CG-CD1 4.13Å
469	P	96.2	Very high	80.4	Confident	56 Å²	56	68.2 Å²	68.2	36%	0.364	38%	0.38	S	S	.	.	H	α-helix	trans	-62	-40.4	171.4	-22.6	34.6	0	0	0	113.5	T467 I472 D473 L507	T467-P469 VanDerWaalsContact C-CD 3.44Å; T467-P469 VanDerWaalsContact C-N 3.32Å; P469-I472 CarbonylContact O-C 3.58Å; P469-I472 PolarHBondContact O-N 3.33Å; P469-D473 PolarHBondContact O-N 3.05Å; P469-L507 HydrophobicContact CB-CD1 4.47Å; P469-L507 HydrophobicContact CG-CD1 3.94Å; P469-L507 HydrophobicContact CG-CD2 4.27Å
470	E	94.7	Very high	83.2	Confident	54 Å²	54	68 Å²	68	25%	0.252	36%	0.362	S	S	.	.	H	α-helix	trans	-66.7	-41.3	179.3	-65.6	172.6	110.1	0	0	111.7	R464 P466 T467 I472 D473 Y474	R464-E470 IonicContact CZ-OE1 3.78Å; R464-E470 VanDerWaalsContact CZ-OE1 3.23Å; R464-E470 IonicContact CZ-OE2 3.56Å; R464-E470 VanDerWaalsContact NH1-CD 3.3Å; R464-E470 IonicContact NH1-OE1 2.73Å; R464-E470 PolarHBondContact NH1-OE1 2.67Å; R464-E470 IonicContact NH1-OE2 3.68Å; R464-E470 PolarHBondContact NH1-OE2 3.14Å; R464-E470 IonicContact NH2-OE1 3.19Å; R464-E470 PolarHBondContact NH2-OE1 2.99Å; R464-E470 IonicContact NH2-OE2 2.95Å; P466-E470 HydrophobicContact CB-CB 4.26Å; T467-E470 WeakPolarHBondContact CB-OE2 3.33Å; T467-E470 PolarHBondContact N-OE2 3.22Å; T467-E470 WeakPolarHBondContact O-CA 3.44Å; T467-E470 WeakPolarHBondContact O-CB 3.27Å; T467-E470 PolarHBondContact O-N 3.05Å; T467-E470 VanDerWaalsContact OG1-CD 3.3Å; T467-E470 VanDerWaalsContact OG1-CG 3.29Å; T467-E470 WeakPolarHBondContact OG1-CG 3.24Å; T467-E470 PolarHBondContact OG1-OE2 3.49Å; E470-I472 VanDerWaalsContact C-N 3.25Å; E470-I472 PolarHBondContact O-N 3.29Å; E470-D473 PolarHBondContact O-N 3.17Å; E470-D473 VanDerWaalsContact O-N 3.13Å; E470-Y474 HydrophobicContact CB-CE2 4.42Å; E470-Y474 WeakPolarHBondContact O-CD1 3.48Å; E470-Y474 WeakPolarHBondContact O-CD2 3.45Å; E470-Y474 PolarHBondContact O-N 3.01Å
471	V	94.6	Very high	85.8	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.006	37%	0.365	C	S	.	.	H	α-helix	trans	-57.8	-42.5	171.9	-178.2	0	0	0	0	110.6	P466 T467 D473 Y474 L475 A486 Y489 L490	P466-V471 HydrophobicContact CB-CG2 3.93Å; P466-V471 HydrophobicContact CG-CG2 3.58Å; T467-V471 PolarHBondContact O-N 2.9Å; V471-D473 VanDerWaalsContact C-N 3.33Å; V471-D473 PolarHBondContact O-N 3.2Å; V471-Y474 PolarHBondContact O-N 3.38Å; V471-L475 PolarHBondContact O-N 3.35Å; V471-A486 HydrophobicContact CG1-CB 4.34Å; V471-Y489 HydrophobicContact CG1-CD1 4.21Å; V471-Y489 HydrophobicContact CG2-CD1 3.72Å; V471-Y489 HydrophobicContact CG2-CE1 3.81Å; V471-L490 HydrophobicContact CG1-CB 3.95Å; V471-L490 HydrophobicContact CG1-CD1 3.99Å; V471-L490 HydrophobicContact CG1-CG 4.41Å
472	I	97.2	Very high	87.7	Confident	4 Å²	4	69.4 Å²	69.4	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-68.8	-30	178.5	-71.4	170.6	0	0	0	111.8	L468 P469 E470 L475 L490 V504 L507 K512	L468-I472 HydrophobicContact CG-CD1 4.19Å; L468-I472 VanDerWaalsContact O-CG1 3.29Å; L468-I472 WeakPolarHBondContact O-CG1 3.48Å; L468-I472 PolarHBondContact O-N 2.61Å; L468-I472 VanDerWaalsContact O-N 3.15Å; P469-I472 CarbonylContact O-C 3.58Å; P469-I472 PolarHBondContact O-N 3.33Å; E470-I472 VanDerWaalsContact C-N 3.25Å; E470-I472 PolarHBondContact O-N 3.29Å; I472-L475 WeakPolarHBondContact O-CB 3.41Å; I472-L490 HydrophobicContact CG1-CD2 4.2Å; I472-V504 HydrophobicContact CD1-CB 4.41Å; I472-V504 HydrophobicContact CD1-CG1 4.4Å; I472-V504 HydrophobicContact CD1-CG2 4.21Å; I472-L507 HydrophobicContact CD1-CB 3.54Å; I472-L507 HydrophobicContact CD1-CD1 3.81Å; I472-L507 HydrophobicContact CD1-CG 4.33Å; I472-K512 HydrophobicContact CG2-CD 4Å; I472-K512 WeakPolarHBondContact O-CD 3.46Å; I472-K512 WeakPolarHBondContact O-CE 3.08Å; I472-K512 PolarHBondContact O-NZ 3.36Å
473	D	96.8	Very high	89.7	Confident	103 Å²	103	63.5 Å²	63.5	55%	0.551	34%	0.339	S	S	*	.	H	α-helix	trans	-77.2	-30.3	171	-80.5	-21.5	0	0	0	113.7	P469 E470 V471 L475 S476 K512	P469-D473 PolarHBondContact O-N 3.05Å; E470-D473 PolarHBondContact O-N 3.17Å; E470-D473 VanDerWaalsContact O-N 3.13Å; V471-D473 VanDerWaalsContact C-N 3.33Å; V471-D473 PolarHBondContact O-N 3.2Å; D473-L475 PolarHBondContact O-N 3.24Å; D473-S476 WeakPolarHBondContact O-CA 3.47Å; D473-S476 WeakPolarHBondContact O-CB 3.28Å; D473-S476 PolarHBondContact O-N 2.91Å; D473-K512 IonicContact OD1-NZ 2.76Å; D473-K512 PolarHBondContact OD1-NZ 2.75Å
474	Y	96.8	Very high	91.5	Very high	87 Å²	87	59.8 Å²	59.8	34%	0.341	33%	0.327	S	S	.	.	H	α-helix	trans	-64.6	-25.8	171.6	-62.3	-16.3	0	0	0	113.1	R464 P466 E470 V471 S476 S477 I482	R464-Y474 PolarHBondContact NH2-OH 3.47Å; P466-Y474 HydrophobicContact CB-CE2 3.86Å; P466-Y474 HydrophobicContact CG-CE2 4.47Å; E470-Y474 HydrophobicContact CB-CE2 4.42Å; E470-Y474 WeakPolarHBondContact O-CD1 3.48Å; E470-Y474 WeakPolarHBondContact O-CD2 3.45Å; E470-Y474 PolarHBondContact O-N 3.01Å; V471-Y474 PolarHBondContact O-N 3.38Å; Y474-S476 PolarHBondContact O-N 3.36Å; Y474-S476 VanDerWaalsContact O-N 3.15Å; Y474-S477 WeakPolarHBondContact O-CB 3.42Å; Y474-S477 PolarHBondContact O-N 3.28Å; Y474-I482 HydrophobicContact CG-CG2 4.14Å
475	L	97.1	Very high	92	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.01	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-15.8	167.6	-58	175.9	0	0	0	113.8	V471 I472 D473 A486 A487 L490 K512 L513 L516	V471-L475 PolarHBondContact O-N 3.35Å; I472-L475 WeakPolarHBondContact O-CB 3.41Å; D473-L475 PolarHBondContact O-N 3.24Å; L475-A486 HydrophobicContact CD2-CB 3.9Å; L475-A486 HydrophobicContact CG-CB 4.47Å; L475-A487 HydrophobicContact CD2-CB 4Å; L475-L490 HydrophobicContact CD1-CD2 3.87Å; L475-K512 HydrophobicContact CB-CB 3.92Å; L475-K512 HydrophobicContact CB-CD 4.18Å; L475-K512 HydrophobicContact CD1-CB 3.96Å; L475-L513 HydrophobicContact CD1-CD2 3.94Å; L475-L513 HydrophobicContact CD1-CG 3.87Å; L475-L513 HydrophobicContact CD2-CD2 3.9Å; L475-L516 HydrophobicContact CB-CD1 4.4Å; L475-L516 HydrophobicContact CD2-CD1 3.87Å
476	S	95.8	Very high	93	Very high	74 Å²	74	52.2 Å²	52.2	52%	0.517	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	12.1	175.7	-58.1	0	0	0	0	113.1	D473 Y474 K512	D473-S476 WeakPolarHBondContact O-CA 3.47Å; D473-S476 WeakPolarHBondContact O-CB 3.28Å; D473-S476 PolarHBondContact O-N 2.91Å; Y474-S476 PolarHBondContact O-N 3.36Å; Y474-S476 VanDerWaalsContact O-N 3.15Å; S476-K512 VanDerWaalsContact OG-CD 3.29Å; S476-K512 WeakPolarHBondContact OG-CD 3.46Å; S476-K512 VanDerWaalsContact OG-CE 3.29Å; S476-K512 WeakPolarHBondContact OG-CE 3.43Å; S476-K512 PolarHBondContact OG-NZ 3.23Å
477	S	94.6	Very high	93.5	Very high	20 Å²	20	50.8 Å²	50.8	14%	0.14	29%	0.288	C	S	.	.			trans	-61.4	144.4	175.2	-176.7	0	0	0	0	111.6	Y474 D479 Q483	Y474-S477 WeakPolarHBondContact O-CB 3.42Å; Y474-S477 PolarHBondContact O-N 3.28Å; S477-D479 PolarHBondContact O-N 3.5Å; S477-D479 PolarHBondContact OG-N 2.97Å; S477-D479 VanDerWaalsContact OG-N 3.12Å; S477-Q483 PolarHBondContact O-NE2 3.47Å
478	P	93.1	Very high	93.1	Very high	130 Å²	130	48.1 Å²	48.1	84%	0.844	28%	0.276	S	S	*	.	S	Bend	trans	-72.2	-10.2	167.9	32	-36.5	0	0	0	113.4
479	D	92.4	Very high	93	Very high	69 Å²	69	50.5 Å²	50.5	37%	0.369	28%	0.284	S	S	.	.			trans	-94.1	114.7	174.1	-179.6	-0.1	0	0	0	110.5	S477 S481 I482 Q483	S477-D479 PolarHBondContact O-N 3.5Å; S477-D479 PolarHBondContact OG-N 2.97Å; S477-D479 VanDerWaalsContact OG-N 3.12Å; D479-S481 PolarHBondContact O-N 2.87Å; D479-S481 WeakPolarHBondContact OD1-CA 3.24Å; D479-S481 WeakPolarHBondContact OD1-CB 3.13Å; D479-S481 PolarHBondContact OD1-N 3.28Å; D479-S481 PolarHBondContact OD1-OG 3.06Å; D479-I482 HydrophobicContact CB-CB 4.23Å; D479-I482 HydrophobicContact CB-CD1 4.02Å; D479-I482 HydrophobicContact CB-CG1 4.05Å; D479-I482 WeakPolarHBondContact O-CB 3.45Å; D479-I482 PolarHBondContact O-N 3.37Å; D479-Q483 PolarHBondContact O-N 2.81Å
480	N	91.9	Very high	92.9	Very high	67 Å²	67	47.9 Å²	47.9	36%	0.358	27%	0.267	S	S	.	.	H	α-helix	trans	-59.2	-29.5	178	-53.2	-46.7	0	0	0	112.4	I482 Q483 M484 I521 V524	N480-I482 VanDerWaalsContact C-N 3.32Å; N480-Q483 PolarHBondContact O-N 3.5Å; N480-M484 VanDerWaalsContact O-CB 3.28Å; N480-M484 WeakPolarHBondContact O-CB 3.33Å; N480-M484 PolarHBondContact O-N 3.16Å; N480-I521 HydrophobicContact CB-CD1 3.53Å; N480-I521 VanDerWaalsContact ND2-CD1 3.32Å; N480-I521 WeakPolarHBondContact ND2-CD1 3.27Å; N480-V524 HydrophobicContact CB-CG2 4.43Å
481	S	89	Confident	92.6	Very high	62 Å²	62	47.2 Å²	47.2	43%	0.434	26%	0.264	S	S	.	.	H	α-helix	trans	-65.3	-38.6	175.3	-32.2	0	0	0	0	111	D479 N485	D479-S481 PolarHBondContact O-N 2.87Å; D479-S481 WeakPolarHBondContact OD1-CA 3.24Å; D479-S481 WeakPolarHBondContact OD1-CB 3.13Å; D479-S481 PolarHBondContact OD1-N 3.28Å; D479-S481 PolarHBondContact OD1-OG 3.06Å; S481-N485 WeakPolarHBondContact O-CB 3.29Å; S481-N485 PolarHBondContact O-N 3.48Å; S481-N485 VanDerWaalsContact O-N 3.16Å; S481-N485 PolarHBondContact O-ND2 3.06Å
482	I	91.2	Very high	91.8	Very high	69 Å²	69	53.3 Å²	53.3	35%	0.354	29%	0.292	S	S	.	.	H	α-helix	trans	-72	-42.4	175.8	-66.2	177.9	0	0	0	109.9	Y474 D479 N480 M484 N485 A486	Y474-I482 HydrophobicContact CG-CG2 4.14Å; D479-I482 HydrophobicContact CB-CB 4.23Å; D479-I482 HydrophobicContact CB-CD1 4.02Å; D479-I482 HydrophobicContact CB-CG1 4.05Å; D479-I482 WeakPolarHBondContact O-CB 3.45Å; D479-I482 PolarHBondContact O-N 3.37Å; N480-I482 VanDerWaalsContact C-N 3.32Å; I482-M484 PolarHBondContact O-N 3.41Å; I482-N485 PolarHBondContact O-N 3.41Å; I482-A486 WeakPolarHBondContact O-CB 3.48Å; I482-A486 PolarHBondContact O-N 2.93Å
483	Q	94.3	Very high	91.3	Very high	16 Å²	16	55.4 Å²	55.4	8%	0.075	30%	0.303	C	S	.	.	H	α-helix	trans	-58.4	-47.9	174.2	-63.5	173.8	0.5	0	0	112.2	S477 D479 N480 A486 A487 L516 V524	S477-Q483 PolarHBondContact O-NE2 3.47Å; D479-Q483 PolarHBondContact O-N 2.81Å; N480-Q483 PolarHBondContact O-N 3.5Å; Q483-A486 PolarHBondContact O-N 2.92Å; Q483-A487 WeakPolarHBondContact O-CB 3.44Å; Q483-A487 PolarHBondContact O-N 2.88Å; Q483-L516 HydrophobicContact CB-CD1 4.46Å; Q483-L516 HydrophobicContact CB-CD2 4.09Å; Q483-L516 HydrophobicContact CG-CD2 4.01Å; Q483-V524 HydrophobicContact CB-CG1 4.46Å
484	M	92.1	Very high	90.8	Very high	54 Å²	54	50.5 Å²	50.5	27%	0.266	28%	0.277	S	S	.	.	H	α-helix	trans	-58.3	-49.8	179.3	179.4	-169.6	71.3	0	0	111.6	N480 I482 G488 E523 V524 N527	N480-M484 VanDerWaalsContact O-CB 3.28Å; N480-M484 WeakPolarHBondContact O-CB 3.33Å; N480-M484 PolarHBondContact O-N 3.16Å; I482-M484 PolarHBondContact O-N 3.41Å; M484-G488 PolarHBondContact O-N 3.28Å; M484-E523 HydrophobicContact CG-CB 3.91Å; M484-E523 HydrophobicContact SD-CB 3.51Å; M484-E523 VanDerWaalsContact SD-CB 3.51Å; M484-E523 HydrophobicContact SD-CG 4.18Å; M484-V524 HydrophobicContact CB-CG2 3.87Å; M484-N527 PolarHBondContact O-ND2 2.89Å
485	N	85.3	Confident	90	Very high	96 Å²	96	49.3 Å²	49.3	51%	0.513	27%	0.272	S	S	.	.	H	α-helix	trans	-68.8	-40.3	-180	-74	-54.2	0	0	0	111.7	S481 I482 G488 Y489	S481-N485 WeakPolarHBondContact O-CB 3.29Å; S481-N485 PolarHBondContact O-N 3.48Å; S481-N485 VanDerWaalsContact O-N 3.16Å; S481-N485 PolarHBondContact O-ND2 3.06Å; I482-N485 PolarHBondContact O-N 3.41Å; N485-G488 PolarHBondContact O-N 2.86Å; N485-Y489 WeakPolarHBondContact O-CB 3.43Å; N485-Y489 PolarHBondContact O-N 2.97Å
486	A	93.7	Very high	89	Confident	7 Å²	7	54.2 Å²	54.2	6%	0.058	30%	0.298	C	S	.	.	H	α-helix	trans	-63.2	-43.1	175.8	0	0	0	0	0	111.9	V471 L475 I482 Q483 L490	V471-A486 HydrophobicContact CG1-CB 4.34Å; L475-A486 HydrophobicContact CD2-CB 3.9Å; L475-A486 HydrophobicContact CG-CB 4.47Å; I482-A486 WeakPolarHBondContact O-CB 3.48Å; I482-A486 PolarHBondContact O-N 2.93Å; Q483-A486 PolarHBondContact O-N 2.92Å; A486-L490 WeakPolarHBondContact O-CB 3.34Å; A486-L490 PolarHBondContact O-N 2.93Å
487	A	93.9	Very high	88.4	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.6	-39.9	176	0	0	0	0	0	112.3	L475 Q483 L490 Q491 L513 L516 N527	L475-A487 HydrophobicContact CD2-CB 4Å; Q483-A487 WeakPolarHBondContact O-CB 3.44Å; Q483-A487 PolarHBondContact O-N 2.88Å; A487-L490 PolarHBondContact O-N 3.44Å; A487-Q491 WeakPolarHBondContact O-CB 3.37Å; A487-Q491 PolarHBondContact O-N 3.44Å; A487-L513 HydrophobicContact CB-CD2 4.24Å; A487-L516 HydrophobicContact CB-CD1 4.28Å; A487-N527 HydrophobicContact CB-CB 3.77Å
488	G	82.9	Confident	88	Confident	22 Å²	22	55.4 Å²	55.4	23%	0.227	30%	0.297	C	S	.	.	H	α-helix	trans	-68.9	-43.5	177.5	0	0	0	0	0	113.2	M484 N485 L490 Q491 H492	M484-G488 PolarHBondContact O-N 3.28Å; N485-G488 PolarHBondContact O-N 2.86Å; G488-L490 VanDerWaalsContact C-N 3.35Å; G488-Q491 WeakPolarHBondContact O-CB 3.32Å; G488-Q491 PolarHBondContact O-N 3.36Å; G488-H492 PolarHBondContact O-N 3.36Å; G488-H492 VanDerWaalsContact O-N 3.1Å
489	Y	89.9	Confident	87.9	Confident	68 Å²	68	53.3 Å²	53.3	27%	0.267	28%	0.279	S	S	.	.	H	α-helix	trans	-65.1	-39	173.5	-174.6	-114.3	0	0	0	111.2	D465 P466 V471 N485 Q491 H492 L493	D465-Y489 PolarHBondContact OD1-OH 3.26Å; P466-Y489 HydrophobicContact CG-CD1 4.27Å; P466-Y489 HydrophobicContact CG-CE1 3.8Å; V471-Y489 HydrophobicContact CG1-CD1 4.21Å; V471-Y489 HydrophobicContact CG2-CD1 3.72Å; V471-Y489 HydrophobicContact CG2-CE1 3.81Å; N485-Y489 WeakPolarHBondContact O-CB 3.43Å; N485-Y489 PolarHBondContact O-N 2.97Å; Y489-Q491 PolarHBondContact O-N 2.86Å; Y489-H492 WeakPolarHBondContact O-CB 3.43Å; Y489-H492 PolarHBondContact O-N 2.86Å; Y489-L493 HydrophobicContact CD1-CD1 3.87Å; Y489-L493 HydrophobicContact CD1-CG 4.29Å; Y489-L493 HydrophobicContact CE1-CD1 3.54Å; Y489-L493 HydrophobicContact CE1-CD2 4.47Å; Y489-L493 HydrophobicContact CE1-CG 4.09Å; Y489-L493 WeakPolarHBondContact O-CG 3.42Å; Y489-L493 PolarHBondContact O-N 3.05Å
490	L	93.1	Very high	87.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69	-31.3	175.3	-162.3	61.8	0	0	0	112.9	L468 V471 I472 L475 A486 A487 G488 H492 A494 V504 L513	L468-L490 HydrophobicContact CD1-CD1 3.45Å; L468-L490 VanDerWaalsContact CD1-CD1 3.45Å; V471-L490 HydrophobicContact CG1-CB 3.95Å; V471-L490 HydrophobicContact CG1-CD1 3.99Å; V471-L490 HydrophobicContact CG1-CG 4.41Å; I472-L490 HydrophobicContact CG1-CD2 4.2Å; L475-L490 HydrophobicContact CD1-CD2 3.87Å; A486-L490 WeakPolarHBondContact O-CB 3.34Å; A486-L490 PolarHBondContact O-N 2.93Å; A487-L490 PolarHBondContact O-N 3.44Å; G488-L490 VanDerWaalsContact C-N 3.35Å; L490-H492 VanDerWaalsContact C-N 3.34Å; L490-A494 WeakPolarHBondContact O-CB 3.28Å; L490-A494 PolarHBondContact O-N 3.35Å; L490-V504 HydrophobicContact CD1-CG2 3.69Å; L490-V504 HydrophobicContact CD2-CG1 4.15Å; L490-V504 HydrophobicContact CD2-CG2 4.36Å; L490-V504 HydrophobicContact CG-CG2 4.24Å; L490-L513 HydrophobicContact CD2-CD1 4.16Å; L490-L513 HydrophobicContact CD2-CD2 4.48Å
491	Q	88.8	Confident	88	Confident	40 Å²	40	48 Å²	48	19%	0.187	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-42.5	169.9	179.3	175.2	-3.7	0	0	111.2	A487 G488 Y489 Y495 C531 N534	A487-Q491 WeakPolarHBondContact O-CB 3.37Å; A487-Q491 PolarHBondContact O-N 3.44Å; G488-Q491 WeakPolarHBondContact O-CB 3.32Å; G488-Q491 PolarHBondContact O-N 3.36Å; Y489-Q491 PolarHBondContact O-N 2.86Å; Q491-Y495 PolarHBondContact O-N 3.47Å; Q491-C531 HydrophobicContact CB-CB 3.85Å; Q491-N534 PolarHBondContact O-ND2 3.12Å
492	H	78.7	Confident	88.3	Confident	129 Å²	129	46.4 Å²	46.4	60%	0.597	24%	0.237	S	C	*	.	H	α-helix	trans	-65.1	-49.5	174.1	170.3	69.3	0	0	0	112	G488 Y489 L490 A494 Y495	G488-H492 PolarHBondContact O-N 3.36Å; G488-H492 VanDerWaalsContact O-N 3.1Å; Y489-H492 WeakPolarHBondContact O-CB 3.43Å; Y489-H492 PolarHBondContact O-N 2.86Å; L490-H492 VanDerWaalsContact C-N 3.34Å; H492-A494 VanDerWaalsContact C-N 3.29Å; H492-A494 PolarHBondContact O-N 3.42Å; H492-Y495 VanDerWaalsContact O-CB 3.22Å; H492-Y495 WeakPolarHBondContact O-CB 3.36Å; H492-Y495 PolarHBondContact O-N 2.99Å; H492-Y495 VanDerWaalsContact O-N 3.07Å
493	L	85.7	Confident	88.5	Confident	49 Å²	49	49 Å²	49	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-63.2	-32.1	178.1	-66.2	-178.8	0	0	0	113.3	L468 Y489 Y495 V500	L468-L493 HydrophobicContact CD1-CD1 4.23Å; Y489-L493 HydrophobicContact CD1-CD1 3.87Å; Y489-L493 HydrophobicContact CD1-CG 4.29Å; Y489-L493 HydrophobicContact CE1-CD1 3.54Å; Y489-L493 HydrophobicContact CE1-CD2 4.47Å; Y489-L493 HydrophobicContact CE1-CG 4.09Å; Y489-L493 WeakPolarHBondContact O-CG 3.42Å; Y489-L493 PolarHBondContact O-N 3.05Å; L493-Y495 VanDerWaalsContact C-N 3.27Å; L493-Y495 PolarHBondContact O-N 3.45Å; L493-V500 HydrophobicContact CB-CG1 4.04Å; L493-V500 WeakPolarHBondContact O-CG1 3.45Å
494	A	86.1	Confident	88.6	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	0.2	176.7	0	0	0	0	0	113.9	L490 H492 K501 N534 L535	L490-A494 WeakPolarHBondContact O-CB 3.28Å; L490-A494 PolarHBondContact O-N 3.35Å; H492-A494 VanDerWaalsContact C-N 3.29Å; H492-A494 PolarHBondContact O-N 3.42Å; A494-K501 HydrophobicContact CB-CG 4.34Å; A494-K501 WeakPolarHBondContact O-CE 3.37Å; A494-N534 HydrophobicContact CB-CB 4.24Å; A494-L535 HydrophobicContact CB-CD2 3.83Å; A494-L535 HydrophobicContact CB-CG 4.18Å
495	Y	80.4	Confident	88.9	Confident	61 Å²	61	49.7 Å²	49.7	24%	0.239	24%	0.241	C	C	.	.	S	Bend	trans	-80.3	124.6	179.9	175.1	-93	0	0	0	111	I268 T296 I319 Q491 H492 L493 D497	I268-Y495 WeakPolarHBondContact CB-OH 3.4Å; I268-Y495 VanDerWaalsContact CG1-OH 3.25Å; I268-Y495 WeakPolarHBondContact CG1-OH 3.22Å; I268-Y495 WeakPolarHBondContact CG2-OH 3.49Å; T296-Y495 WeakPolarHBondContact CB-OH 3.39Å; T296-Y495 HydrophobicContact CG2-CE1 4.39Å; T296-Y495 HydrophobicContact CG2-CE2 4.11Å; T296-Y495 WeakPolarHBondContact CG2-OH 3.49Å; T296-Y495 PolarHBondContact OG1-OH 2.94Å; I319-Y495 HydrophobicContact CD1-CE1 4.04Å; I319-Y495 HydrophobicContact CG2-CE1 4.15Å; Q491-Y495 PolarHBondContact O-N 3.47Å; H492-Y495 VanDerWaalsContact O-CB 3.22Å; H492-Y495 WeakPolarHBondContact O-CB 3.36Å; H492-Y495 PolarHBondContact O-N 2.99Å; H492-Y495 VanDerWaalsContact O-N 3.07Å; L493-Y495 VanDerWaalsContact C-N 3.27Å; L493-Y495 PolarHBondContact O-N 3.45Å; Y495-D497 PolarHBondContact O-N 2.83Å
496	N	76.3	Confident	89.5	Confident	105 Å²	105	49.4 Å²	49.4	56%	0.561	25%	0.252	S	S	*	.	S	Bend	trans	58.5	-26.6	-176.4	-153.2	30.6	0	0	0	116.7	D498	N496-D498 PolarHBondContact O-N 3.2Å
497	D	83.6	Confident	89.6	Confident	69 Å²	69	52.8 Å²	52.8	37%	0.369	27%	0.268	S	S	.	.			trans	-72.4	124.4	175.7	-168.9	-50.5	0	0	0	111.4	Y495 D499 V500 K501	Y495-D497 PolarHBondContact O-N 2.83Å; D497-D499 WeakPolarHBondContact OD1-CA 3.46Å; D497-D499 PolarHBondContact OD1-N 3.48Å; D497-V500 HydrophobicContact CB-CB 4.17Å; D497-V500 HydrophobicContact CB-CG2 4.19Å; D497-V500 PolarHBondContact OD1-N 3.12Å; D497-K501 VanDerWaalsContact C-NZ 3.34Å; D497-K501 VanDerWaalsContact O-CE 3.29Å; D497-K501 WeakPolarHBondContact O-CE 2.94Å; D497-K501 WeakPolarHBondContact O-CG 3.35Å; D497-K501 PolarHBondContact O-NZ 3.32Å
498	D	84.8	Confident	89.8	Confident	50 Å²	50	53.9 Å²	53.9	27%	0.267	28%	0.28	S	S	.	.	H	α-helix	trans	-93.3	-18.8	-178.9	-128.7	44	0	0	0	113.6	N496 K501 Q502 R539	N496-D498 PolarHBondContact O-N 3.2Å; D498-K501 IonicContact OD1-NZ 3.86Å; D498-K501 PolarHBondContact OD1-NZ 2.72Å; D498-Q502 WeakPolarHBondContact O-CG 3.49Å; D498-Q502 PolarHBondContact O-N 3.28Å; D498-R539 IonicContact OD2-CZ 3.79Å; D498-R539 IonicContact OD2-NE 3.85Å; D498-R539 PolarHBondContact OD2-NE 2.97Å; D498-R539 IonicContact OD2-NH2 3.54Å; D498-R539 PolarHBondContact OD2-NH2 2.85Å; D498-R539 VanDerWaalsContact OD2-NH2 3.1Å
499	D	91	Very high	90.5	Very high	87 Å²	87	52.9 Å²	52.9	47%	0.465	27%	0.269	S	S	.	.	H	α-helix	trans	-78.8	-48.9	175.8	178.2	65.5	0	0	0	111.1	D497 K501 Q502 R503	D497-D499 WeakPolarHBondContact OD1-CA 3.46Å; D497-D499 PolarHBondContact OD1-N 3.48Å; D499-K501 PolarHBondContact O-N 3.45Å; D499-Q502 CarbonylContact O-C 3.6Å; D499-Q502 WeakPolarHBondContact O-CA 3.38Å; D499-Q502 WeakPolarHBondContact O-CB 3.5Å; D499-Q502 PolarHBondContact O-N 3.31Å; D499-R503 PolarHBondContact O-N 3.02Å; D499-R503 WeakPolarHBondContact OD2-CD 3.23Å; D499-R503 IonicContact OD2-NE 2.81Å; D499-R503 IonicContact OD2-NH1 3.15Å; D499-R503 PolarHBondContact OD2-NH1 2.87Å
500	V	92.6	Very high	90.9	Very high	18 Å²	18	49.8 Å²	49.8	11%	0.109	26%	0.258	C	S	.	.	H	α-helix	trans	-54.7	-44.5	173.1	174.3	0	0	0	0	109.7	L468 L493 D497 Q502 R503 V504	L468-V500 HydrophobicContact CD1-CG1 4.11Å; L468-V500 HydrophobicContact CD2-CG1 4.25Å; L493-V500 HydrophobicContact CB-CG1 4.04Å; L493-V500 WeakPolarHBondContact O-CG1 3.45Å; D497-V500 HydrophobicContact CB-CB 4.17Å; D497-V500 HydrophobicContact CB-CG2 4.19Å; D497-V500 PolarHBondContact OD1-N 3.12Å; V500-Q502 VanDerWaalsContact C-N 3.26Å; V500-Q502 PolarHBondContact O-N 2.9Å; V500-R503 PolarHBondContact O-N 2.86Å; V500-R503 VanDerWaalsContact O-N 3.16Å; V500-V504 HydrophobicContact CG1-CG2 4.13Å; V500-V504 VanDerWaalsContact O-CG2 3.28Å; V500-V504 WeakPolarHBondContact O-CG2 3.47Å; V500-V504 PolarHBondContact O-N 3.27Å
501	K	93.8	Very high	91.1	Very high	7 Å²	7	54.3 Å²	54.3	3%	0.03	28%	0.282	C	S	.	.	H	α-helix	trans	-54.2	-39.1	172.8	-75	-176.2	-147.8	100.1	0	113	A494 D497 D498 D499 N534 L535 N542	A494-K501 HydrophobicContact CB-CG 4.34Å; A494-K501 WeakPolarHBondContact O-CE 3.37Å; D497-K501 VanDerWaalsContact C-NZ 3.34Å; D497-K501 VanDerWaalsContact O-CE 3.29Å; D497-K501 WeakPolarHBondContact O-CE 2.94Å; D497-K501 WeakPolarHBondContact O-CG 3.35Å; D497-K501 PolarHBondContact O-NZ 3.32Å; D498-K501 IonicContact OD1-NZ 3.86Å; D498-K501 PolarHBondContact OD1-NZ 2.72Å; D499-K501 PolarHBondContact O-N 3.45Å; K501-N534 WeakPolarHBondContact CD-O 3.09Å; K501-N534 WeakPolarHBondContact CE-O 3.22Å; K501-L535 HydrophobicContact CB-CD2 4.31Å; K501-L535 HydrophobicContact CG-CD2 4.19Å; K501-N542 PolarHBondContact O-ND2 3.19Å
502	Q	95.4	Very high	91.5	Very high	28 Å²	28	54.3 Å²	54.3	13%	0.131	28%	0.281	C	S	.	.	H	α-helix	trans	-75.7	-39.6	176.7	-65	-35.8	-72.5	0	0	112.5	D498 D499 V500 R505 A506	D498-Q502 WeakPolarHBondContact O-CG 3.49Å; D498-Q502 PolarHBondContact O-N 3.28Å; D499-Q502 CarbonylContact O-C 3.6Å; D499-Q502 WeakPolarHBondContact O-CA 3.38Å; D499-Q502 WeakPolarHBondContact O-CB 3.5Å; D499-Q502 PolarHBondContact O-N 3.31Å; V500-Q502 VanDerWaalsContact C-N 3.26Å; V500-Q502 PolarHBondContact O-N 2.9Å; Q502-R505 WeakPolarHBondContact O-CB 3.16Å; Q502-R505 PolarHBondContact O-N 2.76Å; Q502-R505 VanDerWaalsContact O-N 3.15Å; Q502-A506 PolarHBondContact O-N 3.26Å
503	R	96.3	Very high	92.5	Very high	122 Å²	122	48.1 Å²	48.1	46%	0.46	25%	0.253	S	S	.	.	H	α-helix	trans	-67.9	-35.4	179.5	-70	167	67.2	-168.4	2.2	112	L468 D499 V500 R505 A506 L507	L468-R503 HydrophobicContact CD2-CB 3.54Å; D499-R503 PolarHBondContact O-N 3.02Å; D499-R503 WeakPolarHBondContact OD2-CD 3.23Å; D499-R503 IonicContact OD2-NE 2.81Å; D499-R503 IonicContact OD2-NH1 3.15Å; D499-R503 PolarHBondContact OD2-NH1 2.87Å; V500-R503 PolarHBondContact O-N 2.86Å; V500-R503 VanDerWaalsContact O-N 3.16Å; R503-R505 VanDerWaalsContact C-N 3.3Å; R503-R505 PolarHBondContact O-N 2.85Å; R503-A506 PolarHBondContact O-N 3.09Å; R503-L507 VanDerWaalsContact O-CB 3.31Å; R503-L507 WeakPolarHBondContact O-CB 3.15Å; R503-L507 VanDerWaalsContact O-CG 3.29Å; R503-L507 WeakPolarHBondContact O-CG 3.13Å; R503-L507 PolarHBondContact O-N 3.47Å
504	V	97.3	Very high	93.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-36.8	170.5	174.7	0	0	0	0	112.2	L468 I472 L490 V500 G508 G509 L535	L468-V504 HydrophobicContact CD1-CG2 3.88Å; L468-V504 HydrophobicContact CD2-CG2 4.26Å; L468-V504 HydrophobicContact CG-CG2 4.4Å; I472-V504 HydrophobicContact CD1-CB 4.41Å; I472-V504 HydrophobicContact CD1-CG1 4.4Å; I472-V504 HydrophobicContact CD1-CG2 4.21Å; L490-V504 HydrophobicContact CD1-CG2 3.69Å; L490-V504 HydrophobicContact CD2-CG1 4.15Å; L490-V504 HydrophobicContact CD2-CG2 4.36Å; L490-V504 HydrophobicContact CG-CG2 4.24Å; V500-V504 HydrophobicContact CG1-CG2 4.13Å; V500-V504 VanDerWaalsContact O-CG2 3.28Å; V500-V504 WeakPolarHBondContact O-CG2 3.47Å; V500-V504 PolarHBondContact O-N 3.27Å; V504-G508 PolarHBondContact O-N 3.31Å; V504-G509 PolarHBondContact O-N 2.69Å; V504-L535 HydrophobicContact CB-CD2 3.78Å; V504-L535 HydrophobicContact CG1-CD1 3.79Å; V504-L535 HydrophobicContact CG1-CD2 3.76Å; V504-L535 HydrophobicContact CG1-CG 4.46Å; V504-L535 HydrophobicContact CG2-CD2 4.23Å
505	R	97.5	Very high	93.6	Very high	86 Å²	86	49.3 Å²	49.3	33%	0.325	26%	0.264	S	S	.	.	H	α-helix	trans	-66.9	-48.9	171.3	176.7	176.2	62.9	133.4	-5.8	111.4	Q502 R503 L507 G508 I510 D541 N542 A545	Q502-R505 WeakPolarHBondContact O-CB 3.16Å; Q502-R505 PolarHBondContact O-N 2.76Å; Q502-R505 VanDerWaalsContact O-N 3.15Å; R503-R505 VanDerWaalsContact C-N 3.3Å; R503-R505 PolarHBondContact O-N 2.85Å; R505-L507 VanDerWaalsContact C-N 3.33Å; R505-L507 PolarHBondContact O-N 3.47Å; R505-G508 PolarHBondContact O-N 2.97Å; R505-I510 HydrophobicContact CB-CD1 3.76Å; R505-I510 HydrophobicContact CG-CD1 4.06Å; R505-D541 IonicContact CZ-OD2 2.58Å; R505-D541 IonicContact NH1-OD2 3.18Å; R505-D541 PolarHBondContact NH1-OD2 3.16Å; R505-D541 IonicContact NH2-OD2 3.87Å; R505-D541 PolarHBondContact NH2-OD2 3.32Å; R505-N542 WeakPolarHBondContact CB-OD1 3.39Å; R505-N542 VanDerWaalsContact CD-OD1 3.3Å; R505-N542 WeakPolarHBondContact CD-OD1 3.45Å; R505-N542 PolarHBondContact NE-OD1 3.19Å; R505-A545 HydrophobicContact CG-CB 4.01Å
506	A	97	Very high	94.4	Very high	89 Å²	89	46.5 Å²	46.5	74%	0.736	25%	0.254	S	S	*	.	H	α-helix	trans	-62	-38.9	-177.5	0	0	0	0	0	112.8	Q502 R503 G508	Q502-A506 PolarHBondContact O-N 3.26Å; R503-A506 PolarHBondContact O-N 3.09Å; A506-G508 PolarHBondContact O-N 3.1Å
507	L	97.1	Very high	95.4	Very high	78 Å²	78	41.9 Å²	41.9	41%	0.408	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	7.2	175.3	-64.7	167.6	0	0	0	113.3	L468 P469 I472 R503 R505 G509	L468-L507 HydrophobicContact CD2-CD1 4.18Å; L468-L507 HydrophobicContact CG-CD1 4.13Å; P469-L507 HydrophobicContact CB-CD1 4.47Å; P469-L507 HydrophobicContact CG-CD1 3.94Å; P469-L507 HydrophobicContact CG-CD2 4.27Å; I472-L507 HydrophobicContact CD1-CB 3.54Å; I472-L507 HydrophobicContact CD1-CD1 3.81Å; I472-L507 HydrophobicContact CD1-CG 4.33Å; R503-L507 VanDerWaalsContact O-CB 3.31Å; R503-L507 WeakPolarHBondContact O-CB 3.15Å; R503-L507 VanDerWaalsContact O-CG 3.29Å; R503-L507 WeakPolarHBondContact O-CG 3.13Å; R503-L507 PolarHBondContact O-N 3.47Å; R505-L507 VanDerWaalsContact C-N 3.33Å; R505-L507 PolarHBondContact O-N 3.47Å; L507-G509 VanDerWaalsContact C-N 3.25Å; L507-G509 PolarHBondContact O-N 3.27Å
508	G	96.7	Very high	95.9	Very high	24 Å²	24	43.3 Å²	43.3	25%	0.247	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	5.7	174.6	0	0	0	0	0	116	V504 R505 A506 I510 N511	V504-G508 PolarHBondContact O-N 3.31Å; R505-G508 PolarHBondContact O-N 2.97Å; A506-G508 PolarHBondContact O-N 3.1Å; G508-I510 PolarHBondContact O-N 3Å; G508-I510 VanDerWaalsContact O-N 3.13Å; G508-N511 PolarHBondContact O-N 3.38Å
509	G	97.9	Very high	96.3	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.1	-26.8	-175	0	0	0	0	0	114.5	V504 L507 N511 K512 L513	V504-G509 PolarHBondContact O-N 2.69Å; L507-G509 VanDerWaalsContact C-N 3.25Å; L507-G509 PolarHBondContact O-N 3.27Å; G509-N511 VanDerWaalsContact C-N 3.31Å; G509-N511 PolarHBondContact O-N 2.91Å; G509-K512 PolarHBondContact O-N 3.1Å; G509-K512 VanDerWaalsContact O-N 3.15Å; G509-L513 WeakPolarHBondContact O-CG 3.36Å; G509-L513 PolarHBondContact O-N 2.85Å
510	I	98.2	Very high	96.3	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-56.5	-42.2	173.3	-70.5	175.4	0	0	0	112	R505 G508 K512 L513 V514 L535 N542 A545 I546 A549	R505-I510 HydrophobicContact CB-CD1 3.76Å; R505-I510 HydrophobicContact CG-CD1 4.06Å; G508-I510 PolarHBondContact O-N 3Å; G508-I510 VanDerWaalsContact O-N 3.13Å; I510-K512 VanDerWaalsContact C-N 3.32Å; I510-K512 PolarHBondContact O-N 3.2Å; I510-L513 PolarHBondContact O-N 3.1Å; I510-V514 WeakPolarHBondContact O-CG2 3.49Å; I510-V514 PolarHBondContact O-N 3.49Å; I510-L535 HydrophobicContact CG1-CD1 4.24Å; I510-N542 HydrophobicContact CD1-CB 4.36Å; I510-A545 HydrophobicContact CD1-CB 3.77Å; I510-I546 HydrophobicContact CD1-CG1 4.35Å; I510-I546 HydrophobicContact CG2-CB 4.36Å; I510-I546 HydrophobicContact CG2-CG1 3.6Å; I510-A549 HydrophobicContact CG2-CB 4.16Å
511	N	98.1	Very high	96.3	Very high	95 Å²	95	47.4 Å²	47.4	51%	0.508	27%	0.265	S	S	.	.	H	α-helix	trans	-64.9	-39.3	178.7	-65.8	-61.3	0	0	0	111.4	G508 G509 V514 S515 A549	G508-N511 PolarHBondContact O-N 3.38Å; G509-N511 VanDerWaalsContact C-N 3.31Å; G509-N511 PolarHBondContact O-N 2.91Å; N511-V514 PolarHBondContact O-N 2.89Å; N511-S515 PolarHBondContact O-N 2.87Å; N511-S515 VanDerWaalsContact O-N 3.07Å; N511-A549 VanDerWaalsContact OD1-CB 3.24Å; N511-A549 WeakPolarHBondContact OD1-CB 3.36Å
512	K	97.9	Very high	96	Very high	39 Å²	39	49.7 Å²	49.7	17%	0.17	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-49.5	178.4	-59.6	-175.6	176.5	-156.3	0	110.8	I472 D473 L475 S476 G509 I510 V514 S515 L516	I472-K512 HydrophobicContact CG2-CD 4Å; I472-K512 WeakPolarHBondContact O-CD 3.46Å; I472-K512 WeakPolarHBondContact O-CE 3.08Å; I472-K512 PolarHBondContact O-NZ 3.36Å; D473-K512 IonicContact OD1-NZ 2.76Å; D473-K512 PolarHBondContact OD1-NZ 2.75Å; L475-K512 HydrophobicContact CB-CB 3.92Å; L475-K512 HydrophobicContact CB-CD 4.18Å; L475-K512 HydrophobicContact CD1-CB 3.96Å; S476-K512 VanDerWaalsContact OG-CD 3.29Å; S476-K512 WeakPolarHBondContact OG-CD 3.46Å; S476-K512 VanDerWaalsContact OG-CE 3.29Å; S476-K512 WeakPolarHBondContact OG-CE 3.43Å; S476-K512 PolarHBondContact OG-NZ 3.23Å; G509-K512 PolarHBondContact O-N 3.1Å; G509-K512 VanDerWaalsContact O-N 3.15Å; I510-K512 VanDerWaalsContact C-N 3.32Å; I510-K512 PolarHBondContact O-N 3.2Å; K512-V514 VanDerWaalsContact C-N 3.31Å; K512-V514 PolarHBondContact O-N 2.89Å; K512-S515 WeakPolarHBondContact O-CB 3.22Å; K512-S515 PolarHBondContact O-N 3.16Å; K512-S515 PolarHBondContact O-OG 3.04Å; K512-L516 PolarHBondContact O-N 2.94Å; K512-L516 VanDerWaalsContact O-N 3.1Å
513	L	98.4	Very high	95.7	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-56.9	-41.2	175.1	-69.9	167.9	0	0	0	112.7	L475 A487 L490 G509 I510 S515 L516 L517 A528 C531 L532 L535	L475-L513 HydrophobicContact CD1-CD2 3.94Å; L475-L513 HydrophobicContact CD1-CG 3.87Å; L475-L513 HydrophobicContact CD2-CD2 3.9Å; A487-L513 HydrophobicContact CB-CD2 4.24Å; L490-L513 HydrophobicContact CD2-CD1 4.16Å; L490-L513 HydrophobicContact CD2-CD2 4.48Å; G509-L513 WeakPolarHBondContact O-CG 3.36Å; G509-L513 PolarHBondContact O-N 2.85Å; I510-L513 PolarHBondContact O-N 3.1Å; L513-S515 VanDerWaalsContact C-N 3.33Å; L513-S515 PolarHBondContact O-N 2.87Å; L513-L516 PolarHBondContact O-N 3.28Å; L513-L517 PolarHBondContact O-N 3.2Å; L513-A528 HydrophobicContact CD2-CB 4.48Å; L513-C531 HydrophobicContact CD1-CB 4.21Å; L513-C531 VanDerWaalsContact CD1-SG 3.52Å; L513-C531 HydrophobicContact CD2-CB 4Å; L513-L532 HydrophobicContact CB-CD1 4.25Å; L513-L532 HydrophobicContact CB-CD2 3.97Å; L513-L532 HydrophobicContact CB-CG 4Å; L513-L532 HydrophobicContact CD1-CD2 4.31Å; L513-L532 HydrophobicContact CD1-CG 4.5Å; L513-L535 HydrophobicContact CD1-CD1 3.29Å
514	V	98.4	Very high	95.6	Very high	12 Å²	12	47.5 Å²	47.5	7%	0.073	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-36.8	175.3	169.4	0	0	0	0	111.9	I510 N511 K512 L516 L517 L532 A549 A554	I510-V514 WeakPolarHBondContact O-CG2 3.49Å; I510-V514 PolarHBondContact O-N 3.49Å; N511-V514 PolarHBondContact O-N 2.89Å; K512-V514 VanDerWaalsContact C-N 3.31Å; K512-V514 PolarHBondContact O-N 2.89Å; V514-L516 VanDerWaalsContact C-N 3.35Å; V514-L516 PolarHBondContact O-N 2.92Å; V514-L517 WeakPolarHBondContact O-CB 3.02Å; V514-L517 PolarHBondContact O-N 3.44Å; V514-L532 HydrophobicContact CG2-CD1 4.08Å; V514-L532 HydrophobicContact CG2-CD2 4.18Å; V514-A549 HydrophobicContact CB-CB 4.37Å; V514-A549 WeakPolarHBondContact CG1-O 3.43Å; V514-A549 HydrophobicContact CG2-CB 4.09Å; V514-A554 HydrophobicContact CG1-CB 4Å
515	S	97.2	Very high	95.5	Very high	62 Å²	62	48.1 Å²	48.1	43%	0.434	28%	0.278	S	S	.	.	H	α-helix	trans	-64.9	-36.4	175.1	74.1	0	0	0	0	113	N511 K512 L513 L517 S518	N511-S515 PolarHBondContact O-N 2.87Å; N511-S515 VanDerWaalsContact O-N 3.07Å; K512-S515 WeakPolarHBondContact O-CB 3.22Å; K512-S515 PolarHBondContact O-N 3.16Å; K512-S515 PolarHBondContact O-OG 3.04Å; L513-S515 VanDerWaalsContact C-N 3.33Å; L513-S515 PolarHBondContact O-N 2.87Å; S515-L517 PolarHBondContact O-N 3.23Å; S515-S518 PolarHBondContact O-N 3.17Å; S515-S518 PolarHBondContact O-OG 2.89Å
516	L	97.7	Very high	95.2	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-61.9	-27.6	176.8	-64.1	-176.6	0	0	0	113.3	L475 Q483 A487 K512 L513 V514 S518 I519 V524 A528	L475-L516 HydrophobicContact CB-CD1 4.4Å; L475-L516 HydrophobicContact CD2-CD1 3.87Å; Q483-L516 HydrophobicContact CB-CD1 4.46Å; Q483-L516 HydrophobicContact CB-CD2 4.09Å; Q483-L516 HydrophobicContact CG-CD2 4.01Å; A487-L516 HydrophobicContact CB-CD1 4.28Å; K512-L516 PolarHBondContact O-N 2.94Å; K512-L516 VanDerWaalsContact O-N 3.1Å; L513-L516 PolarHBondContact O-N 3.28Å; V514-L516 VanDerWaalsContact C-N 3.35Å; V514-L516 PolarHBondContact O-N 2.92Å; L516-S518 PolarHBondContact O-N 3.02Å; L516-S518 VanDerWaalsContact O-N 3.11Å; L516-I519 HydrophobicContact CD2-CD1 3.6Å; L516-I519 PolarHBondContact O-N 2.72Å; L516-I519 VanDerWaalsContact O-N 3.16Å; L516-V524 HydrophobicContact CB-CG1 3.93Å; L516-V524 HydrophobicContact CD1-CG1 4.36Å; L516-V524 HydrophobicContact CD2-CG1 4.09Å; L516-V524 HydrophobicContact CG-CG1 4.34Å; L516-A528 HydrophobicContact CB-CB 3.78Å; L516-A528 HydrophobicContact CD1-CB 4.39Å
517	L	97.5	Very high	94.9	Very high	7 Å²	7	44.3 Å²	44.3	4%	0.037	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.3	174.2	-60.2	177.9	0	0	0	113.9	L513 V514 S515 A528 A529 L532 A554 L555 L558	L513-L517 PolarHBondContact O-N 3.2Å; V514-L517 WeakPolarHBondContact O-CB 3.02Å; V514-L517 PolarHBondContact O-N 3.44Å; S515-L517 PolarHBondContact O-N 3.23Å; L517-A528 HydrophobicContact CD2-CB 3.94Å; L517-A529 HydrophobicContact CD2-CB 3.97Å; L517-L532 HydrophobicContact CD1-CD1 3.68Å; L517-L532 HydrophobicContact CD2-CD1 4.26Å; L517-L532 HydrophobicContact CG-CD1 4.08Å; L517-A554 HydrophobicContact CB-CB 4.14Å; L517-A554 HydrophobicContact CD1-CB 3.78Å; L517-L555 HydrophobicContact CD1-CD2 3.71Å; L517-L555 HydrophobicContact CD1-CG 3.87Å; L517-L555 HydrophobicContact CD2-CD2 4.44Å; L517-L558 HydrophobicContact CB-CD2 4.37Å; L517-L558 HydrophobicContact CD2-CD2 3.89Å
518	S	94.1	Very high	94.9	Very high	99 Å²	99	40.6 Å²	40.6	69%	0.692	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-3	178.8	69.9	0	0	0	0	114.3	S515 L516	S515-S518 PolarHBondContact O-N 3.17Å; S515-S518 PolarHBondContact O-OG 2.89Å; L516-S518 PolarHBondContact O-N 3.02Å; L516-S518 VanDerWaalsContact O-N 3.11Å
519	I	91.7	Very high	94.9	Very high	44 Å²	44	39.4 Å²	39.4	23%	0.226	22%	0.216	C	C	.	.	S	Bend	trans	-82.4	130	173.8	-60.5	-179.1	0	0	0	108.1	L516 I521 Q525	L516-I519 HydrophobicContact CD2-CD1 3.6Å; L516-I519 PolarHBondContact O-N 2.72Å; L516-I519 VanDerWaalsContact O-N 3.16Å; I519-I521 HydrophobicContact CG2-CB 4.25Å; I519-I521 HydrophobicContact CG2-CD1 3.85Å; I519-I521 HydrophobicContact CG2-CG1 3.94Å; I519-I521 PolarHBondContact O-N 3.47Å; I519-Q525 WeakPolarHBondContact O-CG 3.33Å; I519-Q525 PolarHBondContact O-NE2 3.21Å
520	D	92.2	Very high	94.5	Very high	153 Å²	153	39.4 Å²	39.4	82%	0.818	22%	0.216	S	C	*	.	S	Bend	trans	-81.5	58	-173.9	-159.1	27	0	0	0	112.6
521	I	91.6	Very high	94.4	Very high	45 Å²	45	39.2 Å²	39.2	23%	0.231	22%	0.215	C	C	.	.			trans	-136.3	109.9	-179.1	-62	175.9	0	0	0	108.2	N480 I519 E523 V524 Q525	N480-I521 HydrophobicContact CB-CD1 3.53Å; N480-I521 VanDerWaalsContact ND2-CD1 3.32Å; N480-I521 WeakPolarHBondContact ND2-CD1 3.27Å; I519-I521 HydrophobicContact CG2-CB 4.25Å; I519-I521 HydrophobicContact CG2-CD1 3.85Å; I519-I521 HydrophobicContact CG2-CG1 3.94Å; I519-I521 PolarHBondContact O-N 3.47Å; I521-E523 VanDerWaalsContact C-N 3.32Å; I521-E523 PolarHBondContact O-N 3.13Å; I521-V524 HydrophobicContact CB-CB 4.15Å; I521-V524 HydrophobicContact CB-CG2 4.09Å; I521-V524 HydrophobicContact CG2-CB 4.16Å; I521-V524 HydrophobicContact CG2-CG2 3.75Å; I521-V524 PolarHBondContact O-N 2.96Å; I521-Q525 WeakPolarHBondContact O-CG 3.46Å; I521-Q525 PolarHBondContact O-N 3.29Å
522	P	88.2	Confident	94.4	Very high	54 Å²	54	34.8 Å²	34.8	35%	0.351	19%	0.191	S	C	.	.	H	α-helix	trans	-53.6	-40.7	-172.1	-32.3	38.2	0	0	0	115.4	Q525 R526 E564 I567	P522-Q525 PolarHBondContact O-N 3.16Å; P522-R526 VanDerWaalsContact O-CB 3.25Å; P522-R526 WeakPolarHBondContact O-CB 3.38Å; P522-R526 PolarHBondContact O-N 3.03Å; P522-E564 HydrophobicContact CB-CG 4.31Å; P522-E564 HydrophobicContact CG-CG 4.49Å; P522-I567 HydrophobicContact CB-CD1 4.01Å; P522-I567 WeakPolarHBondContact O-CD1 3.47Å
523	E	87.9	Confident	94.2	Very high	104 Å²	104	35.6 Å²	35.6	49%	0.486	19%	0.193	S	C	.	.	H	α-helix	trans	-71.7	-37.8	-176.8	-57.9	80.9	179.1	0	0	111.9	M484 I521 N527	M484-E523 HydrophobicContact CG-CB 3.91Å; M484-E523 HydrophobicContact SD-CB 3.51Å; M484-E523 VanDerWaalsContact SD-CB 3.51Å; M484-E523 HydrophobicContact SD-CG 4.18Å; I521-E523 VanDerWaalsContact C-N 3.32Å; I521-E523 PolarHBondContact O-N 3.13Å; E523-N527 WeakPolarHBondContact O-CB 3.23Å; E523-N527 VanDerWaalsContact O-CG 3.28Å; E523-N527 PolarHBondContact O-N 2.74Å; E523-N527 PolarHBondContact O-OD1 3.23Å
524	V	94.3	Very high	93.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.6	-48	173.7	174.6	0	0	0	0	109.9	N480 Q483 M484 L516 I521 R526 A528	N480-V524 HydrophobicContact CB-CG2 4.43Å; Q483-V524 HydrophobicContact CB-CG1 4.46Å; M484-V524 HydrophobicContact CB-CG2 3.87Å; L516-V524 HydrophobicContact CB-CG1 3.93Å; L516-V524 HydrophobicContact CD1-CG1 4.36Å; L516-V524 HydrophobicContact CD2-CG1 4.09Å; L516-V524 HydrophobicContact CG-CG1 4.34Å; I521-V524 HydrophobicContact CB-CB 4.15Å; I521-V524 HydrophobicContact CB-CG2 4.09Å; I521-V524 HydrophobicContact CG2-CB 4.16Å; I521-V524 HydrophobicContact CG2-CG2 3.75Å; I521-V524 PolarHBondContact O-N 2.96Å; V524-R526 PolarHBondContact O-N 3.27Å; V524-A528 WeakPolarHBondContact O-CB 3.33Å; V524-A528 PolarHBondContact O-N 2.65Å
525	Q	96.1	Very high	93.8	Very high	13 Å²	13	36.4 Å²	36.4	6%	0.061	20%	0.197	C	C	.	.	H	α-helix	trans	-57.9	-46.5	176	-72	174.3	2.2	0	0	111.8	I519 I521 P522 A529 L558 I567	I519-Q525 WeakPolarHBondContact O-CG 3.33Å; I519-Q525 PolarHBondContact O-NE2 3.21Å; I521-Q525 WeakPolarHBondContact O-CG 3.46Å; I521-Q525 PolarHBondContact O-N 3.29Å; P522-Q525 PolarHBondContact O-N 3.16Å; Q525-A529 VanDerWaalsContact O-CB 3.29Å; Q525-A529 WeakPolarHBondContact O-CB 3.42Å; Q525-A529 PolarHBondContact O-N 2.89Å; Q525-L558 HydrophobicContact CB-CD2 4.31Å; Q525-L558 HydrophobicContact CG-CD1 4.32Å; Q525-I567 HydrophobicContact CB-CD1 3.94Å
526	R	90.4	Very high	93.7	Very high	59 Å²	59	33.5 Å²	33.5	22%	0.223	18%	0.176	C	C	.	.	H	α-helix	trans	-62.3	-52.6	-179.9	-171	-177.4	176.4	-169	-3.2	111.6	P522 V524 A528 A529 G530 I567 E570	P522-R526 VanDerWaalsContact O-CB 3.25Å; P522-R526 WeakPolarHBondContact O-CB 3.38Å; P522-R526 PolarHBondContact O-N 3.03Å; V524-R526 PolarHBondContact O-N 3.27Å; R526-A528 VanDerWaalsContact C-N 3.3Å; R526-A528 PolarHBondContact O-N 2.8Å; R526-A529 PolarHBondContact O-N 3.1Å; R526-G530 PolarHBondContact O-N 3.18Å; R526-I567 HydrophobicContact CB-CG1 4.02Å; R526-I567 HydrophobicContact CG-CG1 4.5Å; R526-E570 HydrophobicContact CG-CG 4.1Å
527	N	91.4	Very high	93.2	Very high	36 Å²	36	39.3 Å²	39.3	19%	0.193	20%	0.199	C	C	.	.	H	α-helix	trans	-65.5	-36.1	-178	-69.5	4.1	0	0	0	111.2	M484 A487 E523 C531	M484-N527 PolarHBondContact O-ND2 2.89Å; A487-N527 HydrophobicContact CB-CB 3.77Å; E523-N527 WeakPolarHBondContact O-CB 3.23Å; E523-N527 VanDerWaalsContact O-CG 3.28Å; E523-N527 PolarHBondContact O-N 2.74Å; E523-N527 PolarHBondContact O-OD1 3.23Å; N527-C531 VanDerWaalsContact O-CB 3.22Å; N527-C531 WeakPolarHBondContact O-CB 3.29Å; N527-C531 PolarHBondContact O-N 3.48Å
528	A	98	Very high	92.4	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.4	-44	172.9	0	0	0	0	0	112.2	L513 L516 L517 V524 R526 C531 L532	L513-A528 HydrophobicContact CD2-CB 4.48Å; L516-A528 HydrophobicContact CB-CB 3.78Å; L516-A528 HydrophobicContact CD1-CB 4.39Å; L517-A528 HydrophobicContact CD2-CB 3.94Å; V524-A528 WeakPolarHBondContact O-CB 3.33Å; V524-A528 PolarHBondContact O-N 2.65Å; R526-A528 VanDerWaalsContact C-N 3.3Å; R526-A528 PolarHBondContact O-N 2.8Å; A528-C531 PolarHBondContact O-N 3.41Å; A528-L532 WeakPolarHBondContact O-CB 3.3Å; A528-L532 WeakPolarHBondContact O-CD1 2.73Å; A528-L532 VanDerWaalsContact O-CG 3.23Å; A528-L532 WeakPolarHBondContact O-CG 3.27Å; A528-L532 PolarHBondContact O-N 3.28Å
529	A	96.6	Very high	91.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-42.8	177	0	0	0	0	0	112.3	L517 Q525 R526 L532 R533 E570 V571	L517-A529 HydrophobicContact CD2-CB 3.97Å; Q525-A529 VanDerWaalsContact O-CB 3.29Å; Q525-A529 WeakPolarHBondContact O-CB 3.42Å; Q525-A529 PolarHBondContact O-N 2.89Å; R526-A529 PolarHBondContact O-N 3.1Å; A529-L532 PolarHBondContact O-N 2.84Å; A529-R533 WeakPolarHBondContact O-CB 3.19Å; A529-R533 PolarHBondContact O-N 2.94Å; A529-E570 HydrophobicContact CB-CB 3.8Å; A529-V571 HydrophobicContact CB-CG2 3.96Å
530	G	87.9	Confident	92	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.1	-40.1	175.6	0	0	0	0	0	112.9	R526 R533 N534	R526-G530 PolarHBondContact O-N 3.18Å; G530-R533 WeakPolarHBondContact O-CB 3.46Å; G530-R533 PolarHBondContact O-N 2.95Å; G530-N534 PolarHBondContact O-N 2.53Å; G530-N534 VanDerWaalsContact O-N 3.07Å
531	C	96.5	Very high	92.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.3	-45.3	170.8	-170.3	0	0	0	0	111.2	Q491 L513 N527 A528 R533 N534 L535	Q491-C531 HydrophobicContact CB-CB 3.85Å; L513-C531 HydrophobicContact CD1-CB 4.21Å; L513-C531 VanDerWaalsContact CD1-SG 3.52Å; L513-C531 HydrophobicContact CD2-CB 4Å; N527-C531 VanDerWaalsContact O-CB 3.22Å; N527-C531 WeakPolarHBondContact O-CB 3.29Å; N527-C531 PolarHBondContact O-N 3.48Å; A528-C531 PolarHBondContact O-N 3.41Å; C531-R533 VanDerWaalsContact C-N 3.34Å; C531-R533 PolarHBondContact O-N 2.97Å; C531-N534 PolarHBondContact O-N 3.01Å; C531-L535 WeakPolarHBondContact O-CB 3.39Å; C531-L535 VanDerWaalsContact O-CG 3.26Å; C531-L535 WeakPolarHBondContact O-CG 3.26Å; C531-L535 PolarHBondContact O-N 3.16Å
532	L	98.3	Very high	92.4	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-63.4	-36.9	176.2	-72.6	166.6	0	0	0	112.6	L513 V514 L517 A528 A529 L535 C536 I546	L513-L532 HydrophobicContact CB-CD1 4.25Å; L513-L532 HydrophobicContact CB-CD2 3.97Å; L513-L532 HydrophobicContact CB-CG 4Å; L513-L532 HydrophobicContact CD1-CD2 4.31Å; L513-L532 HydrophobicContact CD1-CG 4.5Å; V514-L532 HydrophobicContact CG2-CD1 4.08Å; V514-L532 HydrophobicContact CG2-CD2 4.18Å; L517-L532 HydrophobicContact CD1-CD1 3.68Å; L517-L532 HydrophobicContact CD2-CD1 4.26Å; L517-L532 HydrophobicContact CG-CD1 4.08Å; A528-L532 WeakPolarHBondContact O-CB 3.3Å; A528-L532 WeakPolarHBondContact O-CD1 2.73Å; A528-L532 VanDerWaalsContact O-CG 3.23Å; A528-L532 WeakPolarHBondContact O-CG 3.27Å; A528-L532 PolarHBondContact O-N 3.28Å; A529-L532 PolarHBondContact O-N 2.84Å; L532-L535 PolarHBondContact O-N 3.02Å; L532-C536 WeakPolarHBondContact O-CB 3.27Å; L532-C536 PolarHBondContact O-N 3.25Å; L532-C536 PolarHBondContact O-SG 3.08Å; L532-I546 HydrophobicContact CD2-CD1 3.94Å; L532-I546 HydrophobicContact CD2-CG1 3.9Å
533	R	94.5	Very high	92.9	Very high	57 Å²	57	35.1 Å²	35.1	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-58.8	-43.9	172.5	176	-174.3	174.2	176.5	-3.3	111.8	A529 G530 C531 C536 Y537 E569 E570 A574 N577	A529-R533 WeakPolarHBondContact O-CB 3.19Å; A529-R533 PolarHBondContact O-N 2.94Å; G530-R533 WeakPolarHBondContact O-CB 3.46Å; G530-R533 PolarHBondContact O-N 2.95Å; C531-R533 VanDerWaalsContact C-N 3.34Å; C531-R533 PolarHBondContact O-N 2.97Å; R533-C536 PolarHBondContact O-SG 3.04Å; R533-Y537 PolarHBondContact O-N 3.09Å; R533-E569 IonicContact NH1-OE1 3.85Å; R533-E570 WeakPolarHBondContact CD-OE2 3.11Å; R533-E570 IonicContact CZ-OE2 3.8Å; R533-E570 IonicContact NE-OE2 3.81Å; R533-E570 IonicContact NH1-OE1 3.51Å; R533-E570 IonicContact NH1-OE2 3.65Å; R533-E570 PolarHBondContact NH1-OE2 3.43Å; R533-A574 HydrophobicContact CB-CB 4.03Å; R533-N577 PolarHBondContact O-ND2 3.01Å
534	N	91.4	Very high	93.3	Very high	27 Å²	27	34 Å²	34	14%	0.144	16%	0.158	C	C	.	.	H	α-helix	trans	-70.1	-45.3	176	-74.6	0.9	0	0	0	111.6	Q491 A494 K501 G530 C531 C536 Y537	Q491-N534 PolarHBondContact O-ND2 3.12Å; A494-N534 HydrophobicContact CB-CB 4.24Å; K501-N534 WeakPolarHBondContact CD-O 3.09Å; K501-N534 WeakPolarHBondContact CE-O 3.22Å; G530-N534 PolarHBondContact O-N 2.53Å; G530-N534 VanDerWaalsContact O-N 3.07Å; C531-N534 PolarHBondContact O-N 3.01Å; N534-C536 VanDerWaalsContact C-N 3.28Å; N534-C536 PolarHBondContact O-N 3.15Å; N534-Y537 WeakPolarHBondContact O-CB 3.44Å; N534-Y537 PolarHBondContact O-N 3.23Å; N534-Y537 VanDerWaalsContact O-N 3.16Å
535	L	96.6	Very high	93.5	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-30.9	178.9	-71.1	169.8	0	0	0	113.6	A494 K501 V504 I510 L513 C531 L532 N542	A494-L535 HydrophobicContact CB-CD2 3.83Å; A494-L535 HydrophobicContact CB-CG 4.18Å; K501-L535 HydrophobicContact CB-CD2 4.31Å; K501-L535 HydrophobicContact CG-CD2 4.19Å; V504-L535 HydrophobicContact CB-CD2 3.78Å; V504-L535 HydrophobicContact CG1-CD1 3.79Å; V504-L535 HydrophobicContact CG1-CD2 3.76Å; V504-L535 HydrophobicContact CG1-CG 4.46Å; V504-L535 HydrophobicContact CG2-CD2 4.23Å; I510-L535 HydrophobicContact CG1-CD1 4.24Å; L513-L535 HydrophobicContact CD1-CD1 3.29Å; C531-L535 WeakPolarHBondContact O-CB 3.39Å; C531-L535 VanDerWaalsContact O-CG 3.26Å; C531-L535 WeakPolarHBondContact O-CG 3.26Å; C531-L535 PolarHBondContact O-N 3.16Å; L532-L535 PolarHBondContact O-N 3.02Å; L535-N542 WeakPolarHBondContact O-CB 3.48Å; L535-N542 PolarHBondContact O-ND2 2.81Å
536	C	95.1	Very high	93.5	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.007	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-2.6	178.4	74.9	0	0	0	0	114.1	L532 R533 N534 K543 I546 N577 L578	L532-C536 WeakPolarHBondContact O-CB 3.27Å; L532-C536 PolarHBondContact O-N 3.25Å; L532-C536 PolarHBondContact O-SG 3.08Å; R533-C536 PolarHBondContact O-SG 3.04Å; N534-C536 VanDerWaalsContact C-N 3.28Å; N534-C536 PolarHBondContact O-N 3.15Å; C536-K543 HydrophobicContact CB-CG 4.15Å; C536-K543 WeakPolarHBondContact O-CE 3.28Å; C536-I546 HydrophobicContact CB-CD1 3.65Å; C536-N577 HydrophobicContact CB-CB 4.44Å; C536-N577 WeakPolarHBondContact SG-CB 3.44Å; C536-L578 HydrophobicContact CB-CD2 3.78Å; C536-L578 HydrophobicContact CB-CG 4.05Å
537	Y	87	Confident	93.8	Very high	125 Å²	125	33.9 Å²	33.9	49%	0.49	16%	0.163	S	C	.	.	S	Bend	trans	-79.3	129.7	171.6	-169.9	-101.6	0	0	0	110.7	R533 N534	R533-Y537 PolarHBondContact O-N 3.09Å; N534-Y537 WeakPolarHBondContact O-CB 3.44Å; N534-Y537 PolarHBondContact O-N 3.23Å; N534-Y537 VanDerWaalsContact O-N 3.16Å
538	G	81.3	Confident	94.1	Very high	42 Å²	42	39.6 Å²	39.6	43%	0.433	19%	0.188	S	C	.	.	S	Bend	trans	94.4	-120.1	-173.2	0	0	0	0	0	113	K543	G538-K543 WeakPolarHBondContact O-CE 3.48Å; G538-K543 PolarHBondContact O-NZ 2.82Å
539	R	83.5	Confident	94.1	Very high	134 Å²	134	40.3 Å²	40.3	51%	0.506	19%	0.194	S	C	.	.			trans	-65.2	137.3	-166.4	-54.2	-174	-165	-168.1	5.3	113.5	D498 D541	D498-R539 IonicContact OD2-CZ 3.79Å; D498-R539 IonicContact OD2-NE 3.85Å; D498-R539 PolarHBondContact OD2-NE 2.97Å; D498-R539 IonicContact OD2-NH2 3.54Å; D498-R539 PolarHBondContact OD2-NH2 2.85Å; D498-R539 VanDerWaalsContact OD2-NH2 3.1Å; R539-D541 PolarHBondContact O-N 3.07Å
540	D	92.8	Very high	94.1	Very high	53 Å²	53	45.8 Å²	45.8	28%	0.283	22%	0.224	S	C	.	.	H	α-helix	trans	-64.1	-21.8	177.8	-81.7	10.4	0	0	0	114.1	N542 K543 R544 C581	D540-N542 VanDerWaalsContact C-N 3.33Å; D540-N542 PolarHBondContact O-N 3.45Å; D540-K543 WeakPolarHBondContact O-CA 3.44Å; D540-K543 WeakPolarHBondContact O-CB 3.45Å; D540-K543 PolarHBondContact O-N 3.03Å; D540-K543 WeakPolarHBondContact OD1-CD 3.26Å; D540-K543 WeakPolarHBondContact OD1-CE 3.27Å; D540-K543 IonicContact OD1-NZ 3.24Å; D540-K543 PolarHBondContact OD1-NZ 2.86Å; D540-R544 PolarHBondContact O-N 2.88Å; D540-R544 IonicContact OD2-NH2 2.67Å; D540-C581 PolarHBondContact OD2-SG 3.48Å
541	D	96.1	Very high	94.6	Very high	72 Å²	72	45.8 Å²	45.8	39%	0.385	22%	0.224	S	C	.	.	H	α-helix	trans	-55.4	-43.5	179.6	-99.6	41.4	0	0	0	113.4	R505 R539 A545	R505-D541 IonicContact CZ-OD2 2.58Å; R505-D541 IonicContact NH1-OD2 3.18Å; R505-D541 PolarHBondContact NH1-OD2 3.16Å; R505-D541 IonicContact NH2-OD2 3.87Å; R505-D541 PolarHBondContact NH2-OD2 3.32Å; R539-D541 PolarHBondContact O-N 3.07Å; D541-A545 PolarHBondContact O-N 3.43Å; D541-A545 VanDerWaalsContact O-N 3.08Å
542	N	96.6	Very high	94.6	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-72.8	-34	175	-77.1	11.5	0	0	0	111.8	K501 R505 I510 L535 D540 R544 A545 I546	K501-N542 PolarHBondContact O-ND2 3.19Å; R505-N542 WeakPolarHBondContact CB-OD1 3.39Å; R505-N542 VanDerWaalsContact CD-OD1 3.3Å; R505-N542 WeakPolarHBondContact CD-OD1 3.45Å; R505-N542 PolarHBondContact NE-OD1 3.19Å; I510-N542 HydrophobicContact CD1-CB 4.36Å; L535-N542 WeakPolarHBondContact O-CB 3.48Å; L535-N542 PolarHBondContact O-ND2 2.81Å; D540-N542 VanDerWaalsContact C-N 3.33Å; D540-N542 PolarHBondContact O-N 3.45Å; N542-R544 VanDerWaalsContact C-N 3.34Å; N542-R544 PolarHBondContact O-N 3.22Å; N542-A545 PolarHBondContact O-N 3.1Å; N542-I546 VanDerWaalsContact O-CG1 3.29Å; N542-I546 WeakPolarHBondContact O-CG1 3.34Å; N542-I546 PolarHBondContact O-N 3.5Å
543	K	97.6	Very high	94.6	Very high	11 Å²	11	48.8 Å²	48.8	5%	0.048	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-43.2	176.5	-51	177.8	-164.2	155.4	0	110.6	C536 G538 D540 I546 M547 L578 S580 C581 I584	C536-K543 HydrophobicContact CB-CG 4.15Å; C536-K543 WeakPolarHBondContact O-CE 3.28Å; G538-K543 WeakPolarHBondContact O-CE 3.48Å; G538-K543 PolarHBondContact O-NZ 2.82Å; D540-K543 WeakPolarHBondContact O-CA 3.44Å; D540-K543 WeakPolarHBondContact O-CB 3.45Å; D540-K543 PolarHBondContact O-N 3.03Å; D540-K543 WeakPolarHBondContact OD1-CD 3.26Å; D540-K543 WeakPolarHBondContact OD1-CE 3.27Å; D540-K543 IonicContact OD1-NZ 3.24Å; D540-K543 PolarHBondContact OD1-NZ 2.86Å; K543-I546 PolarHBondContact O-N 3.5Å; K543-M547 PolarHBondContact O-N 2.89Å; K543-L578 HydrophobicContact CB-CD2 3.75Å; K543-L578 HydrophobicContact CG-CD2 4.14Å; K543-S580 PolarHBondContact NZ-OG 2.65Å; K543-C581 HydrophobicContact CB-CB 4.4Å; K543-C581 HydrophobicContact CD-CB 3.98Å; K543-I584 VanDerWaalsContact C-CD1 3.49Å; K543-I584 HydrophobicContact CB-CD1 3.6Å; K543-I584 VanDerWaalsContact O-CD1 3.32Å; K543-I584 WeakPolarHBondContact O-CD1 3.48Å
544	R	97.2	Very high	94.8	Very high	81 Å²	81	47.1 Å²	47.1	31%	0.306	24%	0.24	S	C	.	.	H	α-helix	trans	-65.8	-40.6	174	-68.7	-172.9	-175.7	93.3	11.1	112.3	D540 N542 I546 M547 Q548 D583	D540-R544 PolarHBondContact O-N 2.88Å; D540-R544 IonicContact OD2-NH2 2.67Å; N542-R544 VanDerWaalsContact C-N 3.34Å; N542-R544 PolarHBondContact O-N 3.22Å; R544-I546 PolarHBondContact O-N 2.74Å; R544-M547 WeakPolarHBondContact O-CB 3.22Å; R544-M547 PolarHBondContact O-N 3.2Å; R544-Q548 VanDerWaalsContact O-CG 3.3Å; R544-Q548 WeakPolarHBondContact O-CG 3.31Å; R544-Q548 PolarHBondContact O-N 3.01Å; R544-D583 IonicContact CZ-OD2 3.62Å; R544-D583 VanDerWaalsContact CZ-OD2 3.26Å; R544-D583 IonicContact NE-OD2 2.79Å; R544-D583 PolarHBondContact NE-OD2 3.32Å; R544-D583 IonicContact NH2-OD2 2.75Å; R544-D583 PolarHBondContact NH2-OD2 3.04Å
545	A	97.5	Very high	95.1	Very high	15 Å²	15	45.8 Å²	45.8	12%	0.124	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-41	174.7	0	0	0	0	0	112.5	R505 I510 D541 N542 M547 Q548 A549	R505-A545 HydrophobicContact CG-CB 4.01Å; I510-A545 HydrophobicContact CD1-CB 3.77Å; D541-A545 PolarHBondContact O-N 3.43Å; D541-A545 VanDerWaalsContact O-N 3.08Å; N542-A545 PolarHBondContact O-N 3.1Å; A545-M547 VanDerWaalsContact C-N 3.34Å; A545-M547 PolarHBondContact O-N 3.14Å; A545-Q548 PolarHBondContact O-N 2.93Å; A545-A549 WeakPolarHBondContact O-CB 3.3Å; A545-A549 PolarHBondContact O-N 3.2Å
546	I	98	Very high	95.2	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64	-38.8	174.7	-68.3	163.5	0	0	0	111.2	I510 L532 C536 N542 K543 R544 A549 G551 L578	I510-I546 HydrophobicContact CD1-CG1 4.35Å; I510-I546 HydrophobicContact CG2-CB 4.36Å; I510-I546 HydrophobicContact CG2-CG1 3.6Å; L532-I546 HydrophobicContact CD2-CD1 3.94Å; L532-I546 HydrophobicContact CD2-CG1 3.9Å; C536-I546 HydrophobicContact CB-CD1 3.65Å; N542-I546 VanDerWaalsContact O-CG1 3.29Å; N542-I546 WeakPolarHBondContact O-CG1 3.34Å; N542-I546 PolarHBondContact O-N 3.5Å; K543-I546 PolarHBondContact O-N 3.5Å; R544-I546 PolarHBondContact O-N 2.74Å; I546-A549 PolarHBondContact O-N 3.17Å; I546-G551 VanDerWaalsContact O-CA 3.3Å; I546-G551 WeakPolarHBondContact O-CA 3.47Å; I546-G551 PolarHBondContact O-N 2.96Å; I546-L578 HydrophobicContact CB-CD2 4.12Å; I546-L578 HydrophobicContact CD1-CD2 4.17Å; I546-L578 HydrophobicContact CG2-CD1 4.09Å; I546-L578 HydrophobicContact CG2-CD2 4.07Å
547	M	96.7	Very high	95.3	Very high	55 Å²	55	49.8 Å²	49.8	27%	0.271	25%	0.254	S	S	.	.	H	α-helix	trans	-63.8	-45.8	172.5	178.9	173.7	69.3	0	0	112.2	K543 R544 A545 A549 N550 L552 I584 P587	K543-M547 PolarHBondContact O-N 2.89Å; R544-M547 WeakPolarHBondContact O-CB 3.22Å; R544-M547 PolarHBondContact O-N 3.2Å; A545-M547 VanDerWaalsContact C-N 3.34Å; A545-M547 PolarHBondContact O-N 3.14Å; M547-A549 VanDerWaalsContact C-N 3.25Å; M547-A549 PolarHBondContact O-N 3.26Å; M547-N550 PolarHBondContact O-N 2.99Å; M547-N550 VanDerWaalsContact O-N 3.09Å; M547-L552 HydrophobicContact CB-CD1 4Å; M547-L552 HydrophobicContact CB-CG 4.27Å; M547-L552 HydrophobicContact CG-CD1 3.66Å; M547-L552 HydrophobicContact CG-CG 4.35Å; M547-L552 HydrophobicContact SD-CD1 4.03Å; M547-I584 HydrophobicContact CB-CD1 4.39Å; M547-I584 HydrophobicContact CB-CG1 4.46Å; M547-I584 HydrophobicContact CE-CG1 4.27Å; M547-I584 HydrophobicContact SD-CG1 3.84Å; M547-P587 HydrophobicContact SD-CG 4.39Å
548	Q	97.1	Very high	95.8	Very high	155 Å²	155	44.1 Å²	44.1	72%	0.724	23%	0.232	S	C	*	.	H	α-helix	trans	-62.4	-31.8	177.9	-72.7	166.9	-16.6	0	0	112.6	R544 A545 N550	R544-Q548 VanDerWaalsContact O-CG 3.3Å; R544-Q548 WeakPolarHBondContact O-CG 3.31Å; R544-Q548 PolarHBondContact O-N 3.01Å; A545-Q548 PolarHBondContact O-N 2.93Å; Q548-N550 PolarHBondContact O-N 3.41Å
549	A	97.3	Very high	96.5	Very high	16 Å²	16	42.3 Å²	42.3	13%	0.132	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	7.4	174.3	0	0	0	0	0	114.4	I510 N511 V514 A545 I546 M547 G551	I510-A549 HydrophobicContact CG2-CB 4.16Å; N511-A549 VanDerWaalsContact OD1-CB 3.24Å; N511-A549 WeakPolarHBondContact OD1-CB 3.36Å; V514-A549 HydrophobicContact CB-CB 4.37Å; V514-A549 WeakPolarHBondContact CG1-O 3.43Å; V514-A549 HydrophobicContact CG2-CB 4.09Å; A545-A549 WeakPolarHBondContact O-CB 3.3Å; A545-A549 PolarHBondContact O-N 3.2Å; I546-A549 PolarHBondContact O-N 3.17Å; M547-A549 VanDerWaalsContact C-N 3.25Å; M547-A549 PolarHBondContact O-N 3.26Å; A549-G551 PolarHBondContact O-N 3.26Å
550	N	97.4	Very high	97	Very high	114 Å²	114	40.5 Å²	40.5	61%	0.61	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.8	16.3	-167.7	-83.3	-23	0	0	0	115	M547 Q548 L552 V553 A554	M547-N550 PolarHBondContact O-N 2.99Å; M547-N550 VanDerWaalsContact O-N 3.09Å; Q548-N550 PolarHBondContact O-N 3.41Å; N550-L552 PolarHBondContact O-N 3.34Å; N550-L552 VanDerWaalsContact O-N 3.15Å; N550-V553 PolarHBondContact O-N 2.86Å; N550-A554 PolarHBondContact O-N 3.19Å
551	G	97.8	Very high	97	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.8	-27.9	-177.8	0	0	0	0	0	114.4	I546 A549 V553 A554 L555	I546-G551 VanDerWaalsContact O-CA 3.3Å; I546-G551 WeakPolarHBondContact O-CA 3.47Å; I546-G551 PolarHBondContact O-N 2.96Å; A549-G551 PolarHBondContact O-N 3.26Å; G551-V553 VanDerWaalsContact C-N 3.34Å; G551-V553 PolarHBondContact O-N 3.16Å; G551-A554 PolarHBondContact O-N 3.18Å; G551-L555 VanDerWaalsContact O-CB 3.31Å; G551-L555 WeakPolarHBondContact O-CB 3.46Å; G551-L555 VanDerWaalsContact O-CG 3.23Å; G551-L555 WeakPolarHBondContact O-CG 3.36Å; G551-L555 PolarHBondContact O-N 3.44Å
552	L	97.5	Very high	96.7	Very high	8 Å²	8	39.9 Å²	39.9	4%	0.042	21%	0.213	C	C	.	.	H	α-helix	trans	-62.7	-40.1	172.2	-61.8	-179.2	0	0	0	112.3	M547 N550 A556 L578 I584 P587 I588 L591	M547-L552 HydrophobicContact CB-CD1 4Å; M547-L552 HydrophobicContact CB-CG 4.27Å; M547-L552 HydrophobicContact CG-CD1 3.66Å; M547-L552 HydrophobicContact CG-CG 4.35Å; M547-L552 HydrophobicContact SD-CD1 4.03Å; N550-L552 PolarHBondContact O-N 3.34Å; N550-L552 VanDerWaalsContact O-N 3.15Å; L552-A556 WeakPolarHBondContact O-CB 3.27Å; L552-A556 PolarHBondContact O-N 3.03Å; L552-L578 HydrophobicContact CD2-CB 4.48Å; L552-L578 HydrophobicContact CD2-CD1 3.93Å; L552-I584 HydrophobicContact CD1-CG2 3.94Å; L552-I584 HydrophobicContact CD2-CG2 3.89Å; L552-P587 HydrophobicContact CD1-CB 3.71Å; L552-I588 HydrophobicContact CD2-CD1 4.15Å; L552-I588 HydrophobicContact CD2-CG1 4Å; L552-L591 HydrophobicContact CB-CD1 3.85Å
553	V	98	Very high	96.1	Very high	56 Å²	56	45.1 Å²	45.1	34%	0.339	25%	0.247	S	C	.	.	H	α-helix	trans	-72.7	-41	179.3	-178.3	0	0	0	0	110.2	N550 G551 A556 N557 L591	N550-V553 PolarHBondContact O-N 2.86Å; G551-V553 VanDerWaalsContact C-N 3.34Å; G551-V553 PolarHBondContact O-N 3.16Å; V553-A556 PolarHBondContact O-N 3.13Å; V553-N557 WeakPolarHBondContact O-CB 3.42Å; V553-N557 PolarHBondContact O-N 3.39Å; V553-N557 PolarHBondContact O-ND2 3.36Å; V553-L591 HydrophobicContact CG2-CD1 4.07Å; V553-L591 HydrophobicContact CG2-CD2 4.31Å
554	A	98.1	Very high	95.3	Very high	22 Å²	22	48.9 Å²	48.9	18%	0.182	27%	0.265	C	S	.	.	H	α-helix	trans	-60.6	-51.9	175.2	0	0	0	0	0	111.8	V514 L517 N550 G551 A556 N557 L558	V514-A554 HydrophobicContact CG1-CB 4Å; L517-A554 HydrophobicContact CB-CB 4.14Å; L517-A554 HydrophobicContact CD1-CB 3.78Å; N550-A554 PolarHBondContact O-N 3.19Å; G551-A554 PolarHBondContact O-N 3.18Å; A554-A556 PolarHBondContact O-N 3.41Å; A554-N557 PolarHBondContact O-N 2.99Å; A554-L558 WeakPolarHBondContact O-CB 3.34Å; A554-L558 PolarHBondContact O-N 2.82Å
555	L	98.5	Very high	94.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.1	-41.8	175.7	-70	170.3	0	0	0	112	L517 G551 N557 L559 V571 A574 L575 L578	L517-L555 HydrophobicContact CD1-CD2 3.71Å; L517-L555 HydrophobicContact CD1-CG 3.87Å; L517-L555 HydrophobicContact CD2-CD2 4.44Å; G551-L555 VanDerWaalsContact O-CB 3.31Å; G551-L555 WeakPolarHBondContact O-CB 3.46Å; G551-L555 VanDerWaalsContact O-CG 3.23Å; G551-L555 WeakPolarHBondContact O-CG 3.36Å; G551-L555 PolarHBondContact O-N 3.44Å; L555-N557 VanDerWaalsContact C-N 3.34Å; L555-N557 PolarHBondContact O-N 2.86Å; L555-L559 VanDerWaalsContact O-CB 3.27Å; L555-L559 WeakPolarHBondContact O-CB 3.4Å; L555-L559 PolarHBondContact O-N 3.41Å; L555-V571 HydrophobicContact CB-CG1 4.18Å; L555-V571 HydrophobicContact CD2-CB 4.37Å; L555-V571 HydrophobicContact CD2-CG1 4.11Å; L555-V571 HydrophobicContact CD2-CG2 3.96Å; L555-V571 WeakPolarHBondContact O-CG1 3.34Å; L555-A574 HydrophobicContact CD1-CB 4.13Å; L555-A574 HydrophobicContact CD2-CB 4.41Å; L555-L575 HydrophobicContact CB-CD2 4.19Å; L555-L575 HydrophobicContact CB-CG 4.33Å; L555-L575 HydrophobicContact CD1-CD2 4.39Å; L555-L578 HydrophobicContact CD1-CD1 3.64Å
556	A	97.7	Very high	93.9	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.1	-30.5	178.9	0	0	0	0	0	113.6	L552 V553 A554 K560 L591 C592	L552-A556 WeakPolarHBondContact O-CB 3.27Å; L552-A556 PolarHBondContact O-N 3.03Å; V553-A556 PolarHBondContact O-N 3.13Å; A554-A556 PolarHBondContact O-N 3.41Å; A556-K560 WeakPolarHBondContact O-CD 3.34Å; A556-K560 WeakPolarHBondContact O-CE 3.26Å; A556-K560 WeakPolarHBondContact O-CG 3.5Å; A556-L591 HydrophobicContact CB-CB 3.8Å; A556-L591 HydrophobicContact CB-CD1 4.43Å; A556-C592 WeakPolarHBondContact CB-SG 3.47Å
557	N	97.3	Very high	93.4	Very high	86 Å²	86	50.1 Å²	50.1	46%	0.46	28%	0.277	S	S	.	.	H	α-helix	trans	-76.7	-47.8	174.6	-71.9	-11.1	0	0	0	110.4	V553 A554 L555 L559 K560 S561	V553-N557 WeakPolarHBondContact O-CB 3.42Å; V553-N557 PolarHBondContact O-N 3.39Å; V553-N557 PolarHBondContact O-ND2 3.36Å; A554-N557 PolarHBondContact O-N 2.99Å; L555-N557 VanDerWaalsContact C-N 3.34Å; L555-N557 PolarHBondContact O-N 2.86Å; N557-L559 VanDerWaalsContact C-N 3.29Å; N557-L559 PolarHBondContact O-N 3.49Å; N557-K560 WeakPolarHBondContact O-CA 3.46Å; N557-K560 WeakPolarHBondContact O-CB 3.21Å; N557-K560 PolarHBondContact O-N 2.9Å; N557-S561 PolarHBondContact O-N 2.98Å; N557-S561 PolarHBondContact O-OG 3.08Å
558	L	97	Very high	93	Very high	6 Å²	6	48 Å²	48	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-57.6	-41.9	178.1	-176.4	58.6	0	0	0	111.9	L517 Q525 A554 K560 S561 T562 I567 V571	L517-L558 HydrophobicContact CB-CD2 4.37Å; L517-L558 HydrophobicContact CD2-CD2 3.89Å; Q525-L558 HydrophobicContact CB-CD2 4.31Å; Q525-L558 HydrophobicContact CG-CD1 4.32Å; A554-L558 WeakPolarHBondContact O-CB 3.34Å; A554-L558 PolarHBondContact O-N 2.82Å; L558-K560 PolarHBondContact O-N 2.91Å; L558-S561 PolarHBondContact O-N 3.1Å; L558-T562 HydrophobicContact CD1-CG2 4.44Å; L558-T562 WeakPolarHBondContact O-CB 3.06Å; L558-T562 VanDerWaalsContact O-CG2 3.26Å; L558-T562 WeakPolarHBondContact O-CG2 3.5Å; L558-T562 PolarHBondContact O-N 3.28Å; L558-I567 HydrophobicContact CD1-CG2 4.15Å; L558-I567 HydrophobicContact CD2-CG2 3.74Å; L558-I567 HydrophobicContact CG-CG2 3.88Å; L558-V571 HydrophobicContact CD2-CG2 3.76Å; L558-V571 HydrophobicContact CG-CG2 4.12Å
559	L	96.3	Very high	92.3	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-55.8	-33	172.6	-177.7	61.1	0	0	0	113.4	L555 N557 V568 V571 T572 L575 H595 L596 I600	L555-L559 VanDerWaalsContact O-CB 3.27Å; L555-L559 WeakPolarHBondContact O-CB 3.4Å; L555-L559 PolarHBondContact O-N 3.41Å; N557-L559 VanDerWaalsContact C-N 3.29Å; N557-L559 PolarHBondContact O-N 3.49Å; L559-V568 HydrophobicContact CD1-CG1 3.89Å; L559-V571 HydrophobicContact CB-CG1 3.85Å; L559-V571 HydrophobicContact CD1-CG1 4.31Å; L559-T572 HydrophobicContact CD1-CG2 3.85Å; L559-L575 HydrophobicContact CD2-CD1 3.88Å; L559-H595 PolarHBondContact O-NE2 3.12Å; L559-L596 HydrophobicContact CD2-CD2 3.98Å; L559-L596 HydrophobicContact CD2-CG 4.44Å; L559-I600 HydrophobicContact CD1-CD1 4.32Å
560	K	94.7	Very high	92	Very high	96 Å²	96	41.4 Å²	41.4	42%	0.417	23%	0.234	S	C	.	.	H	α-helix	trans	-90.4	-22.4	-176.9	-65.7	163.9	-167.3	165	0	113.2	A556 N557 L558 L591 H595	A556-K560 WeakPolarHBondContact O-CD 3.34Å; A556-K560 WeakPolarHBondContact O-CE 3.26Å; A556-K560 WeakPolarHBondContact O-CG 3.5Å; N557-K560 WeakPolarHBondContact O-CA 3.46Å; N557-K560 WeakPolarHBondContact O-CB 3.21Å; N557-K560 PolarHBondContact O-N 2.9Å; L558-K560 PolarHBondContact O-N 2.91Å; K560-L591 VanDerWaalsContact CE-O 3.23Å; K560-L591 WeakPolarHBondContact CE-O 3.29Å; K560-L591 PolarHBondContact NZ-O 3.2Å; K560-H595 HydrophobicContact CG-CB 4.3Å
561	S	93.4	Very high	92	Very high	91 Å²	91	36 Å²	36	64%	0.636	21%	0.205	S	C	*	.	H	α-helix	trans	-105.8	-28.5	-172.5	63	0	0	0	0	114.3	N557 L558	N557-S561 PolarHBondContact O-N 2.98Å; N557-S561 PolarHBondContact O-OG 3.08Å; L558-S561 PolarHBondContact O-N 3.1Å
562	T	89.3	Confident	91.8	Very high	22 Å²	22	36 Å²	36	14%	0.135	21%	0.205	C	C	.	.			trans	-80.2	133.5	-174.5	-163	0	0	0	0	112.4	L558 E564 I567 V568	L558-T562 HydrophobicContact CD1-CG2 4.44Å; L558-T562 WeakPolarHBondContact O-CB 3.06Å; L558-T562 VanDerWaalsContact O-CG2 3.26Å; L558-T562 WeakPolarHBondContact O-CG2 3.5Å; L558-T562 PolarHBondContact O-N 3.28Å; T562-E564 VanDerWaalsContact C-N 3.29Å; T562-E564 PolarHBondContact OG1-N 2.97Å; T562-I567 HydrophobicContact CG2-CB 3.99Å; T562-I567 HydrophobicContact CG2-CG2 3.95Å; T562-V568 HydrophobicContact CG2-CG2 3.66Å
563	P	84.7	Confident	91.4	Very high	111 Å²	111	35.7 Å²	35.7	72%	0.721	20%	0.204	S	C	*	.			trans	-80.2	-13.8	166.8	34.7	-34.9	0	0	0	112.1	V565	P563-V565 PolarHBondContact O-N 3.48Å
564	E	81.1	Confident	91.4	Very high	90 Å²	90	33 Å²	33	42%	0.421	19%	0.188	S	C	.	.			trans	-78	105.5	-168.7	-70	-57.6	144.8	0	0	112	P522 T562 L566 I567 V568	P522-E564 HydrophobicContact CB-CG 4.31Å; P522-E564 HydrophobicContact CG-CG 4.49Å; T562-E564 VanDerWaalsContact C-N 3.29Å; T562-E564 PolarHBondContact OG1-N 2.97Å; E564-L566 PolarHBondContact O-N 3.44Å; E564-L566 VanDerWaalsContact O-N 3.12Å; E564-I567 HydrophobicContact CB-CB 4.1Å; E564-I567 HydrophobicContact CB-CD1 3.71Å; E564-I567 HydrophobicContact CB-CG1 3.73Å; E564-I567 HydrophobicContact CG-CD1 4.16Å; E564-I567 WeakPolarHBondContact O-CA 3.43Å; E564-I567 WeakPolarHBondContact O-CB 3.47Å; E564-I567 PolarHBondContact O-N 2.94Å; E564-V568 PolarHBondContact O-N 3.28Å
565	V	82.6	Confident	91.4	Very high	57 Å²	57	32 Å²	32	35%	0.345	18%	0.179	S	C	.	.	H	α-helix	trans	-50	-40.5	-178.9	177.7	0	0	0	0	112.2	P563 I567 V568 E569 P619 I622	P563-V565 PolarHBondContact O-N 3.48Å; V565-I567 VanDerWaalsContact C-N 3.32Å; V565-I567 PolarHBondContact O-N 2.62Å; V565-V568 PolarHBondContact O-N 3.29Å; V565-E569 PolarHBondContact O-N 2.86Å; V565-P619 HydrophobicContact CG1-CG 3.47Å; V565-P619 VanDerWaalsContact CG1-CG 3.47Å; V565-I622 HydrophobicContact CG1-CD1 3.82Å; V565-I622 WeakPolarHBondContact O-CD1 3.36Å
566	L	81.1	Confident	91.3	Very high	61 Å²	61	34.1 Å²	34.1	32%	0.319	19%	0.187	S	C	.	.	H	α-helix	trans	-73.2	-22.5	-179.4	-61.3	173.9	0	0	0	113	E564 E570	E564-L566 PolarHBondContact O-N 3.44Å; E564-L566 VanDerWaalsContact O-N 3.12Å; L566-E570 WeakPolarHBondContact O-CG 3.38Å; L566-E570 PolarHBondContact O-N 3.07Å
567	I	87.6	Confident	91.2	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.015	20%	0.196	C	C	.	.	H	α-helix	trans	-79.5	-42.6	170.3	-57.1	-177.8	0	0	0	109.7	P522 Q525 R526 L558 T562 E564 V565 E569 E570 V571	P522-I567 HydrophobicContact CB-CD1 4.01Å; P522-I567 WeakPolarHBondContact O-CD1 3.47Å; Q525-I567 HydrophobicContact CB-CD1 3.94Å; R526-I567 HydrophobicContact CB-CG1 4.02Å; R526-I567 HydrophobicContact CG-CG1 4.5Å; L558-I567 HydrophobicContact CD1-CG2 4.15Å; L558-I567 HydrophobicContact CD2-CG2 3.74Å; L558-I567 HydrophobicContact CG-CG2 3.88Å; T562-I567 HydrophobicContact CG2-CB 3.99Å; T562-I567 HydrophobicContact CG2-CG2 3.95Å; E564-I567 HydrophobicContact CB-CB 4.1Å; E564-I567 HydrophobicContact CB-CD1 3.71Å; E564-I567 HydrophobicContact CB-CG1 3.73Å; E564-I567 HydrophobicContact CG-CD1 4.16Å; E564-I567 WeakPolarHBondContact O-CA 3.43Å; E564-I567 WeakPolarHBondContact O-CB 3.47Å; E564-I567 PolarHBondContact O-N 2.94Å; V565-I567 VanDerWaalsContact C-N 3.32Å; V565-I567 PolarHBondContact O-N 2.62Å; I567-E569 PolarHBondContact O-N 3.35Å; I567-E570 PolarHBondContact O-N 3.35Å; I567-V571 HydrophobicContact CG2-CG2 3.97Å; I567-V571 VanDerWaalsContact O-CB 3.31Å; I567-V571 WeakPolarHBondContact O-CB 3.16Å; I567-V571 WeakPolarHBondContact O-CG2 3.37Å; I567-V571 PolarHBondContact O-N 3.28Å
568	V	89.2	Confident	91.2	Very high	10 Å²	10	31.7 Å²	31.7	6%	0.061	17%	0.174	C	C	.	.	H	α-helix	trans	-57.3	-37	173.8	-179.5	0	0	0	0	111	L559 T562 E564 V565 T572 I600 I622	L559-V568 HydrophobicContact CD1-CG1 3.89Å; T562-V568 HydrophobicContact CG2-CG2 3.66Å; E564-V568 PolarHBondContact O-N 3.28Å; V565-V568 PolarHBondContact O-N 3.29Å; V568-T572 HydrophobicContact CG1-CG2 4.29Å; V568-T572 WeakPolarHBondContact O-CB 3.31Å; V568-T572 VanDerWaalsContact O-CG2 3.27Å; V568-T572 WeakPolarHBondContact O-CG2 3.49Å; V568-T572 PolarHBondContact O-N 3.03Å; V568-T572 PolarHBondContact O-OG1 3.27Å; V568-I600 HydrophobicContact CG1-CD1 4.45Å; V568-I622 HydrophobicContact CB-CD1 3.99Å; V568-I622 HydrophobicContact CG1-CD1 3.89Å; V568-I622 HydrophobicContact CG1-CG2 3.72Å
569	E	82.9	Confident	91.2	Very high	27 Å²	27	31.4 Å²	31.4	13%	0.126	17%	0.173	C	C	.	.	H	α-helix	trans	-63.3	-52.8	174.6	-162.5	-164.2	113.3	0	0	112.9	R533 V565 I567 V571 T572 G573 L621 I622	R533-E569 IonicContact NH1-OE1 3.85Å; V565-E569 PolarHBondContact O-N 2.86Å; I567-E569 PolarHBondContact O-N 3.35Å; E569-V571 VanDerWaalsContact C-N 3.35Å; E569-V571 PolarHBondContact O-N 2.99Å; E569-T572 PolarHBondContact O-N 3.18Å; E569-T572 PolarHBondContact O-OG1 3.2Å; E569-T572 VanDerWaalsContact O-OG1 3.07Å; E569-G573 PolarHBondContact O-N 3.32Å; E569-L621 HydrophobicContact CG-CD2 3.96Å; E569-L621 HydrophobicContact CG-CG 3.89Å; E569-L621 VanDerWaalsContact OE1-CD2 3.27Å; E569-L621 WeakPolarHBondContact OE1-CD2 3.37Å; E569-I622 HydrophobicContact CB-CD1 4.12Å; E569-I622 HydrophobicContact CB-CG1 4.01Å; E569-I622 HydrophobicContact CG-CG1 4.15Å
570	E	90	Very high	91	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.028	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-41.3	179.6	-62.8	-64.5	-179.4	0	0	111.8	R526 A529 R533 L566 I567 G573 A574	R526-E570 HydrophobicContact CG-CG 4.1Å; A529-E570 HydrophobicContact CB-CB 3.8Å; R533-E570 WeakPolarHBondContact CD-OE2 3.11Å; R533-E570 IonicContact CZ-OE2 3.8Å; R533-E570 IonicContact NE-OE2 3.81Å; R533-E570 IonicContact NH1-OE1 3.51Å; R533-E570 IonicContact NH1-OE2 3.65Å; R533-E570 PolarHBondContact NH1-OE2 3.43Å; L566-E570 WeakPolarHBondContact O-CG 3.38Å; L566-E570 PolarHBondContact O-N 3.07Å; I567-E570 PolarHBondContact O-N 3.35Å; E570-G573 PolarHBondContact O-N 2.76Å; E570-A574 WeakPolarHBondContact O-CB 3.1Å; E570-A574 PolarHBondContact O-N 2.68Å
571	V	96.9	Very high	91.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.1	-42.2	178.4	171.8	0	0	0	0	111.6	A529 L555 L558 L559 I567 E569 A574 L575	A529-V571 HydrophobicContact CB-CG2 3.96Å; L555-V571 HydrophobicContact CB-CG1 4.18Å; L555-V571 HydrophobicContact CD2-CB 4.37Å; L555-V571 HydrophobicContact CD2-CG1 4.11Å; L555-V571 HydrophobicContact CD2-CG2 3.96Å; L555-V571 WeakPolarHBondContact O-CG1 3.34Å; L558-V571 HydrophobicContact CD2-CG2 3.76Å; L558-V571 HydrophobicContact CG-CG2 4.12Å; L559-V571 HydrophobicContact CB-CG1 3.85Å; L559-V571 HydrophobicContact CD1-CG1 4.31Å; I567-V571 HydrophobicContact CG2-CG2 3.97Å; I567-V571 VanDerWaalsContact O-CB 3.31Å; I567-V571 WeakPolarHBondContact O-CB 3.16Å; I567-V571 WeakPolarHBondContact O-CG2 3.37Å; I567-V571 PolarHBondContact O-N 3.28Å; E569-V571 VanDerWaalsContact C-N 3.35Å; E569-V571 PolarHBondContact O-N 2.99Å; V571-A574 PolarHBondContact O-N 3.34Å; V571-L575 HydrophobicContact CG1-CD1 3.99Å; V571-L575 WeakPolarHBondContact O-CB 3.47Å; V571-L575 VanDerWaalsContact O-CG 3.29Å; V571-L575 WeakPolarHBondContact O-CG 3.48Å; V571-L575 PolarHBondContact O-N 3.47Å
572	T	94.7	Very high	91	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-70.1	-33	174.1	55.8	0	0	0	0	112.3	L559 V568 E569 W576 I600 I622 N625	L559-T572 HydrophobicContact CD1-CG2 3.85Å; V568-T572 HydrophobicContact CG1-CG2 4.29Å; V568-T572 WeakPolarHBondContact O-CB 3.31Å; V568-T572 VanDerWaalsContact O-CG2 3.27Å; V568-T572 WeakPolarHBondContact O-CG2 3.49Å; V568-T572 PolarHBondContact O-N 3.03Å; V568-T572 PolarHBondContact O-OG1 3.27Å; E569-T572 PolarHBondContact O-N 3.18Å; E569-T572 PolarHBondContact O-OG1 3.2Å; E569-T572 VanDerWaalsContact O-OG1 3.07Å; T572-W576 WeakPolarHBondContact O-CB 3.41Å; T572-W576 PolarHBondContact O-N 3.25Å; T572-I600 HydrophobicContact CG2-CD1 4.28Å; T572-I622 HydrophobicContact CG2-CG2 4.29Å; T572-N625 WeakPolarHBondContact OG1-CB 3.23Å; T572-N625 PolarHBondContact OG1-ND2 2.94Å
573	G	89.3	Confident	91.2	Very high	3 Å²	3	33.1 Å²	33.1	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-49	170.9	0	0	0	0	0	112.3	E569 E570 W576 N577 N625	E569-G573 PolarHBondContact O-N 3.32Å; E570-G573 PolarHBondContact O-N 2.76Å; G573-W576 PolarHBondContact O-N 3.17Å; G573-N577 PolarHBondContact O-N 3.35Å; G573-N625 PolarHBondContact N-ND2 2.76Å
574	A	97.1	Very high	91.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.3	-46.9	175.7	0	0	0	0	0	111.8	R533 L555 E570 V571 W576 N577 L578	R533-A574 HydrophobicContact CB-CB 4.03Å; L555-A574 HydrophobicContact CD1-CB 4.13Å; L555-A574 HydrophobicContact CD2-CB 4.41Å; E570-A574 WeakPolarHBondContact O-CB 3.1Å; E570-A574 PolarHBondContact O-N 2.68Å; V571-A574 PolarHBondContact O-N 3.34Å; A574-W576 VanDerWaalsContact C-N 3.32Å; A574-W576 PolarHBondContact O-N 3.09Å; A574-N577 PolarHBondContact O-N 3.41Å; A574-L578 WeakPolarHBondContact O-CB 3.13Å; A574-L578 WeakPolarHBondContact O-CD1 3.48Å; A574-L578 WeakPolarHBondContact O-CG 3.29Å; A574-L578 PolarHBondContact O-N 3.46Å
575	L	98.4	Very high	92.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.8	-34.1	176.9	-73.5	170.3	0	0	0	112.5	L555 L559 V571 S579 I588 I629	L555-L575 HydrophobicContact CB-CD2 4.19Å; L555-L575 HydrophobicContact CB-CG 4.33Å; L555-L575 HydrophobicContact CD1-CD2 4.39Å; L559-L575 HydrophobicContact CD2-CD1 3.88Å; V571-L575 HydrophobicContact CG1-CD1 3.99Å; V571-L575 WeakPolarHBondContact O-CB 3.47Å; V571-L575 VanDerWaalsContact O-CG 3.29Å; V571-L575 WeakPolarHBondContact O-CG 3.48Å; V571-L575 PolarHBondContact O-N 3.47Å; L575-S579 VanDerWaalsContact O-CB 3.24Å; L575-S579 WeakPolarHBondContact O-CB 3.09Å; L575-S579 PolarHBondContact O-N 3.37Å; L575-S579 PolarHBondContact O-OG 3.31Å; L575-I588 HydrophobicContact CD2-CD1 4.06Å; L575-I588 HydrophobicContact CD2-CG1 4.24Å; L575-I629 HydrophobicContact CB-CD1 3.61Å; L575-I629 HydrophobicContact CB-CG1 4.16Å
576	W	96.1	Very high	93.2	Very high	45 Å²	45	23.9 Å²	23.9	17%	0.17	13%	0.126	C	C	.	.	H	α-helix	trans	-65.8	-49.4	175.2	-169.4	11.3	0	0	0	111	T572 G573 A574 L578 S579 R624 N625 G628 I629 K670 N674	T572-W576 WeakPolarHBondContact O-CB 3.41Å; T572-W576 PolarHBondContact O-N 3.25Å; G573-W576 PolarHBondContact O-N 3.17Å; A574-W576 VanDerWaalsContact C-N 3.32Å; A574-W576 PolarHBondContact O-N 3.09Å; W576-L578 PolarHBondContact O-N 3.18Å; W576-S579 PolarHBondContact O-N 3.39Å; W576-S579 PolarHBondContact O-OG 2.85Å; W576-R624 HydrophobicContact CH2-CG 4.15Å; W576-R624 HydrophobicContact CZ3-CG 4.14Å; W576-N625 HydrophobicContact CE3-CB 4.19Å; W576-N625 WeakPolarHBondContact CZ3-OD1 3.31Å; W576-G628 VanDerWaalsContact CD1-C 3.45Å; W576-G628 PolarHBondContact NE1-O 3Å; W576-I629 HydrophobicContact CB-CG1 3.87Å; W576-I629 HydrophobicContact CG-CG1 4.48Å; W576-K670 HydrophobicContact CH2-CG 4.31Å; W576-N674 WeakPolarHBondContact CH2-ND2 3.47Å; W576-N674 VanDerWaalsContact CZ2-ND2 3.28Å; W576-N674 WeakPolarHBondContact CZ2-ND2 3.32Å
577	N	94.9	Very high	94	Very high	35 Å²	35	22.8 Å²	22.8	19%	0.187	12%	0.122	C	C	.	.	H	α-helix	trans	-57	-47	174.8	-75.7	-8.8	0	0	0	111.9	R533 C536 G573 A574 S579 S580	R533-N577 PolarHBondContact O-ND2 3.01Å; C536-N577 HydrophobicContact CB-CB 4.44Å; C536-N577 WeakPolarHBondContact SG-CB 3.44Å; G573-N577 PolarHBondContact O-N 3.35Å; A574-N577 PolarHBondContact O-N 3.41Å; N577-S579 PolarHBondContact O-N 3.37Å; N577-S580 WeakPolarHBondContact O-CB 3.43Å; N577-S580 PolarHBondContact O-N 3.09Å; N577-S580 PolarHBondContact O-OG 2.79Å
578	L	98.1	Very high	94.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.6	-42	177.7	-71	165.5	0	0	0	112.4	C536 K543 I546 L552 L555 A574 W576 S580 C581 I584 I588	C536-L578 HydrophobicContact CB-CD2 3.78Å; C536-L578 HydrophobicContact CB-CG 4.05Å; K543-L578 HydrophobicContact CB-CD2 3.75Å; K543-L578 HydrophobicContact CG-CD2 4.14Å; I546-L578 HydrophobicContact CB-CD2 4.12Å; I546-L578 HydrophobicContact CD1-CD2 4.17Å; I546-L578 HydrophobicContact CG2-CD1 4.09Å; I546-L578 HydrophobicContact CG2-CD2 4.07Å; L552-L578 HydrophobicContact CD2-CB 4.48Å; L552-L578 HydrophobicContact CD2-CD1 3.93Å; L555-L578 HydrophobicContact CD1-CD1 3.64Å; A574-L578 WeakPolarHBondContact O-CB 3.13Å; A574-L578 WeakPolarHBondContact O-CD1 3.48Å; A574-L578 WeakPolarHBondContact O-CG 3.29Å; A574-L578 PolarHBondContact O-N 3.46Å; W576-L578 PolarHBondContact O-N 3.18Å; L578-S580 PolarHBondContact O-N 2.77Å; L578-S580 VanDerWaalsContact O-N 3.08Å; L578-C581 PolarHBondContact O-N 3.38Å; L578-I584 HydrophobicContact CB-CG2 4.22Å; L578-I584 HydrophobicContact CD2-CD1 4.45Å; L578-I588 HydrophobicContact CB-CD1 3.99Å
579	S	96.7	Very high	94.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-11.5	-179.4	71.6	0	0	0	0	114.9	L575 W576 N577 C581 K585 N632	L575-S579 VanDerWaalsContact O-CB 3.24Å; L575-S579 WeakPolarHBondContact O-CB 3.09Å; L575-S579 PolarHBondContact O-N 3.37Å; L575-S579 PolarHBondContact O-OG 3.31Å; W576-S579 PolarHBondContact O-N 3.39Å; W576-S579 PolarHBondContact O-OG 2.85Å; N577-S579 PolarHBondContact O-N 3.37Å; S579-C581 VanDerWaalsContact C-N 3.34Å; S579-K585 WeakPolarHBondContact O-CE 3.45Å; S579-K585 WeakPolarHBondContact O-CG 3.38Å; S579-N632 WeakPolarHBondContact O-CB 3.14Å; S579-N632 VanDerWaalsContact OG-CB 3.3Å; S579-N632 WeakPolarHBondContact OG-CB 3.28Å; S579-N632 PolarHBondContact OG-ND2 3.09Å
580	S	93.6	Very high	95.5	Very high	52 Å²	52	28.7 Å²	28.7	36%	0.364	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-38.4	172.6	63.3	0	0	0	0	112.3	K543 N577 L578 K585	K543-S580 PolarHBondContact NZ-OG 2.65Å; N577-S580 WeakPolarHBondContact O-CB 3.43Å; N577-S580 PolarHBondContact O-N 3.09Å; N577-S580 PolarHBondContact O-OG 2.79Å; L578-S580 PolarHBondContact O-N 2.77Å; L578-S580 VanDerWaalsContact O-N 3.08Å; S580-K585 WeakPolarHBondContact O-CE 3.18Å
581	C	95.3	Very high	95.8	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	-70.1	129.2	-178.9	-176.5	0	0	0	0	111	D540 K543 L578 S579 D583 I584	D540-C581 PolarHBondContact OD2-SG 3.48Å; K543-C581 HydrophobicContact CB-CB 4.4Å; K543-C581 HydrophobicContact CD-CB 3.98Å; L578-C581 PolarHBondContact O-N 3.38Å; S579-C581 VanDerWaalsContact C-N 3.34Å; C581-D583 VanDerWaalsContact C-N 3.35Å; C581-D583 PolarHBondContact O-N 3.16Å; C581-I584 HydrophobicContact CB-CB 4.28Å; C581-I584 HydrophobicContact CB-CD1 3.87Å; C581-I584 HydrophobicContact CB-CG1 4.14Å; C581-I584 PolarHBondContact O-N 2.89Å
582	H	92.2	Very high	95.8	Very high	123 Å²	123	30.9 Å²	30.9	57%	0.569	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-52.6	-49.8	-176.2	172.8	-92.3	0	0	0	112.9	I584 K585	H582-I584 PolarHBondContact O-N 3.11Å; H582-I584 VanDerWaalsContact O-N 3.12Å; H582-K585 PolarHBondContact O-N 3.49Å
583	D	93.7	Very high	95.9	Very high	72 Å²	72	31 Å²	31	39%	0.385	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-67.7	-17.8	-170.4	-42.5	-36.3	0	0	0	112.9	R544 C581	R544-D583 IonicContact CZ-OD2 3.62Å; R544-D583 VanDerWaalsContact CZ-OD2 3.26Å; R544-D583 IonicContact NE-OD2 2.79Å; R544-D583 PolarHBondContact NE-OD2 3.32Å; R544-D583 IonicContact NH2-OD2 2.75Å; R544-D583 PolarHBondContact NH2-OD2 3.04Å; C581-D583 VanDerWaalsContact C-N 3.35Å; C581-D583 PolarHBondContact O-N 3.16Å
584	I	97	Very high	96.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-96.6	-16.2	-174.1	-63.7	-179.7	0	0	0	111.8	K543 M547 L552 L578 C581 H582 S586 P587 I588	K543-I584 VanDerWaalsContact C-CD1 3.49Å; K543-I584 HydrophobicContact CB-CD1 3.6Å; K543-I584 VanDerWaalsContact O-CD1 3.32Å; K543-I584 WeakPolarHBondContact O-CD1 3.48Å; M547-I584 HydrophobicContact CB-CD1 4.39Å; M547-I584 HydrophobicContact CB-CG1 4.46Å; M547-I584 HydrophobicContact CE-CG1 4.27Å; M547-I584 HydrophobicContact SD-CG1 3.84Å; L552-I584 HydrophobicContact CD1-CG2 3.94Å; L552-I584 HydrophobicContact CD2-CG2 3.89Å; L578-I584 HydrophobicContact CB-CG2 4.22Å; L578-I584 HydrophobicContact CD2-CD1 4.45Å; C581-I584 HydrophobicContact CB-CB 4.28Å; C581-I584 HydrophobicContact CB-CD1 3.87Å; C581-I584 HydrophobicContact CB-CG1 4.14Å; C581-I584 PolarHBondContact O-N 2.89Å; H582-I584 PolarHBondContact O-N 3.11Å; H582-I584 VanDerWaalsContact O-N 3.12Å; I584-S586 PolarHBondContact O-N 3.32Å; I584-P587 WeakPolarHBondContact O-CD 3.4Å; I584-I588 HydrophobicContact CG2-CD1 3.56Å; I584-I588 HydrophobicContact CG2-CG1 3.89Å; I584-I588 WeakPolarHBondContact O-CG1 3.43Å; I584-I588 PolarHBondContact O-N 2.96Å
585	K	97.2	Very high	96.1	Very high	26 Å²	26	37.4 Å²	37.4	11%	0.113	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-42.6	-173.8	-71.9	169	-177.4	178.5	0	113.9	S579 S580 H582 I588 F589 N632 I633 T635 A636	S579-K585 WeakPolarHBondContact O-CE 3.45Å; S579-K585 WeakPolarHBondContact O-CG 3.38Å; S580-K585 WeakPolarHBondContact O-CE 3.18Å; H582-K585 PolarHBondContact O-N 3.49Å; K585-I588 PolarHBondContact O-N 2.95Å; K585-F589 WeakPolarHBondContact O-CB 3.39Å; K585-F589 PolarHBondContact O-N 2.94Å; K585-N632 WeakPolarHBondContact CD-O 3.25Å; K585-I633 HydrophobicContact CB-CG2 4.43Å; K585-I633 WeakPolarHBondContact O-CG2 3.42Å; K585-T635 PolarHBondContact NZ-OG1 3.05Å; K585-A636 HydrophobicContact CB-CB 3.76Å
586	S	96.5	Very high	96	Very high	39 Å²	39	37.4 Å²	37.4	27%	0.273	19%	0.193	S	C	.	.	H	α-helix	trans	-67.7	-47	177.8	-56.2	0	0	0	0	112	I584 I588 F589 E590	I584-S586 PolarHBondContact O-N 3.32Å; S586-I588 PolarHBondContact O-N 2.91Å; S586-F589 WeakPolarHBondContact O-CA 3.49Å; S586-F589 WeakPolarHBondContact O-CB 3.41Å; S586-F589 PolarHBondContact O-N 3.17Å; S586-F589 VanDerWaalsContact O-N 3.07Å; S586-E590 WeakPolarHBondContact O-CG 3.41Å; S586-E590 PolarHBondContact O-N 3.45Å
587	P	97.1	Very high	96	Very high	37 Å²	37	35.2 Å²	35.2	24%	0.24	19%	0.185	C	C	.	.	H	α-helix	trans	-52.8	-44.8	169.9	-31.2	36.3	0	0	0	114.8	M547 L552 I584 F589 E590 L591	M547-P587 HydrophobicContact SD-CG 4.39Å; L552-P587 HydrophobicContact CD1-CB 3.71Å; I584-P587 WeakPolarHBondContact O-CD 3.4Å; P587-F589 VanDerWaalsContact C-N 3.33Å; P587-F589 PolarHBondContact O-N 2.75Å; P587-E590 PolarHBondContact O-N 2.96Å; P587-L591 VanDerWaalsContact O-CB 3.29Å; P587-L591 WeakPolarHBondContact O-CB 3.06Å; P587-L591 VanDerWaalsContact O-CG 3.26Å; P587-L591 WeakPolarHBondContact O-CG 3.37Å; P587-L591 PolarHBondContact O-N 3.37Å
588	I	97.7	Very high	95.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-67	-35.2	176.6	-68	-179.9	0	0	0	111.5	L552 L575 L578 I584 K585 S586 C592 I629 I633	L552-I588 HydrophobicContact CD2-CD1 4.15Å; L552-I588 HydrophobicContact CD2-CG1 4Å; L575-I588 HydrophobicContact CD2-CD1 4.06Å; L575-I588 HydrophobicContact CD2-CG1 4.24Å; L578-I588 HydrophobicContact CB-CD1 3.99Å; I584-I588 HydrophobicContact CG2-CD1 3.56Å; I584-I588 HydrophobicContact CG2-CG1 3.89Å; I584-I588 WeakPolarHBondContact O-CG1 3.43Å; I584-I588 PolarHBondContact O-N 2.96Å; K585-I588 PolarHBondContact O-N 2.95Å; S586-I588 PolarHBondContact O-N 2.91Å; I588-C592 HydrophobicContact CG2-CB 4.38Å; I588-C592 WeakPolarHBondContact O-CB 3.35Å; I588-C592 PolarHBondContact O-N 3.01Å; I588-I629 HydrophobicContact CG2-CG2 3.6Å; I588-I633 HydrophobicContact CB-CG2 4.06Å; I588-I633 HydrophobicContact CG2-CG2 3.84Å
589	F	97.4	Very high	95.6	Very high	16 Å²	16	42.6 Å²	42.6	7%	0.07	22%	0.219	C	C	.	.	H	α-helix	trans	-62	-48.1	174.1	174	-91.8	0	0	0	112.1	K585 S586 P587 S593 I633 L643 L644	K585-F589 WeakPolarHBondContact O-CB 3.39Å; K585-F589 PolarHBondContact O-N 2.94Å; S586-F589 WeakPolarHBondContact O-CA 3.49Å; S586-F589 WeakPolarHBondContact O-CB 3.41Å; S586-F589 PolarHBondContact O-N 3.17Å; S586-F589 VanDerWaalsContact O-N 3.07Å; P587-F589 VanDerWaalsContact C-N 3.33Å; P587-F589 PolarHBondContact O-N 2.75Å; F589-S593 WeakPolarHBondContact CE2-OG 3.36Å; F589-S593 WeakPolarHBondContact O-CB 3.46Å; F589-S593 PolarHBondContact O-N 2.95Å; F589-S593 VanDerWaalsContact O-N 3.17Å; F589-S593 PolarHBondContact O-OG 2.52Å; F589-I633 HydrophobicContact CB-CB 4.19Å; F589-I633 HydrophobicContact CB-CD1 4.23Å; F589-I633 HydrophobicContact CD2-CD1 4.02Å; F589-I633 HydrophobicContact CD2-CG1 4.33Å; F589-L643 HydrophobicContact CE1-CB 4.28Å; F589-L643 HydrophobicContact CE1-CD1 3.76Å; F589-L643 HydrophobicContact CE2-CB 4.33Å; F589-L643 HydrophobicContact CZ-CB 3.52Å; F589-L643 HydrophobicContact CZ-CD1 3.88Å; F589-L643 HydrophobicContact CZ-CG 4.37Å; F589-L644 HydrophobicContact CD2-CD2 4.48Å; F589-L644 HydrophobicContact CD2-CG 4.46Å; F589-L644 HydrophobicContact CE2-CD2 4.03Å; F589-L644 HydrophobicContact CE2-CG 3.95Å
590	E	96.3	Very high	95.3	Very high	149 Å²	149	42.8 Å²	42.8	70%	0.696	22%	0.219	S	C	*	.	H	α-helix	trans	-67	-40.3	-179.9	-70.3	165.4	-159	0	0	112.2	S586 P587	S586-E590 WeakPolarHBondContact O-CG 3.41Å; S586-E590 PolarHBondContact O-N 3.45Å; P587-E590 PolarHBondContact O-N 2.96Å
591	L	97	Very high	95.4	Very high	51 Å²	51	40.3 Å²	40.3	27%	0.267	20%	0.202	S	C	.	.	H	α-helix	trans	-80.5	-35.6	-177.1	-69.6	170.8	0	0	0	114	L552 V553 A556 K560 P587	L552-L591 HydrophobicContact CB-CD1 3.85Å; V553-L591 HydrophobicContact CG2-CD1 4.07Å; V553-L591 HydrophobicContact CG2-CD2 4.31Å; A556-L591 HydrophobicContact CB-CB 3.8Å; A556-L591 HydrophobicContact CB-CD1 4.43Å; K560-L591 VanDerWaalsContact CE-O 3.23Å; K560-L591 WeakPolarHBondContact CE-O 3.29Å; K560-L591 PolarHBondContact NZ-O 3.2Å; P587-L591 VanDerWaalsContact O-CB 3.29Å; P587-L591 WeakPolarHBondContact O-CB 3.06Å; P587-L591 VanDerWaalsContact O-CG 3.26Å; P587-L591 WeakPolarHBondContact O-CG 3.37Å; P587-L591 PolarHBondContact O-N 3.37Å
592	C	96	Very high	95.3	Very high	1 Å²	1	41 Å²	41	1%	0.007	21%	0.206	C	C	.	.	H	α-helix	trans	-123.9	-17.7	-164.2	-60.1	0	0	0	0	115.8	A556 I588 D594 H595 L596	A556-C592 WeakPolarHBondContact CB-SG 3.47Å; I588-C592 HydrophobicContact CG2-CB 4.38Å; I588-C592 WeakPolarHBondContact O-CB 3.35Å; I588-C592 PolarHBondContact O-N 3.01Å; C592-D594 VanDerWaalsContact C-N 3.33Å; C592-D594 PolarHBondContact O-N 3.24Å; C592-H595 PolarHBondContact O-N 2.88Å; C592-L596 HydrophobicContact CB-CD1 3.68Å; C592-L596 HydrophobicContact CB-CG 4.07Å; C592-L596 WeakPolarHBondContact O-CG 3.04Å; C592-L596 PolarHBondContact O-N 3.01Å
593	S	95.9	Very high	95.1	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-34.1	-164.5	68.1	0	0	0	0	114.8	F589 V597 K647	F589-S593 WeakPolarHBondContact CE2-OG 3.36Å; F589-S593 WeakPolarHBondContact O-CB 3.46Å; F589-S593 PolarHBondContact O-N 2.95Å; F589-S593 VanDerWaalsContact O-N 3.17Å; F589-S593 PolarHBondContact O-OG 2.52Å; S593-V597 WeakPolarHBondContact O-CB 3.39Å; S593-V597 VanDerWaalsContact O-CG2 3.32Å; S593-V597 WeakPolarHBondContact O-CG2 3.48Å; S593-V597 PolarHBondContact O-N 2.86Å; S593-K647 WeakPolarHBondContact OG-CE 3.35Å; S593-K647 PolarHBondContact OG-NZ 2.88Å
594	D	95.2	Very high	94.8	Very high	93 Å²	93	34.9 Å²	34.9	50%	0.497	18%	0.179	S	C	.	.	H	α-helix	trans	-69.4	-44.5	176.4	-74	-64.8	0	0	0	112.8	C592 V597 Q598 K647	C592-D594 VanDerWaalsContact C-N 3.33Å; C592-D594 PolarHBondContact O-N 3.24Å; D594-V597 PolarHBondContact O-N 2.88Å; D594-Q598 VanDerWaalsContact O-CB 3.3Å; D594-Q598 WeakPolarHBondContact O-CB 3.29Å; D594-Q598 WeakPolarHBondContact O-CG 3.49Å; D594-Q598 PolarHBondContact O-N 2.58Å; D594-K647 IonicContact OD1-NZ 2.7Å; D594-K647 PolarHBondContact OD1-NZ 2.89Å; D594-K647 IonicContact OD2-NZ 2.82Å; D594-K647 PolarHBondContact OD2-NZ 3.23Å; D594-K647 VanDerWaalsContact OD2-NZ 3.1Å
595	H	95.3	Very high	94.3	Very high	43 Å²	43	34.9 Å²	34.9	20%	0.199	18%	0.179	C	C	.	.	H	α-helix	trans	-66.4	-47.4	178.7	-174.4	100.4	0	0	0	111	L559 K560 C592 V597 Q599	L559-H595 PolarHBondContact O-NE2 3.12Å; K560-H595 HydrophobicContact CG-CB 4.3Å; C592-H595 PolarHBondContact O-N 2.88Å; H595-V597 VanDerWaalsContact C-N 3.26Å; H595-V597 PolarHBondContact O-N 3.09Å; H595-Q599 WeakPolarHBondContact O-CA 3.33Å; H595-Q599 VanDerWaalsContact O-CB 3.31Å; H595-Q599 WeakPolarHBondContact O-CB 3.43Å; H595-Q599 PolarHBondContact O-N 2.97Å
596	L	96.5	Very high	93.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.	I	π-helix	trans	-56.5	-40.1	177.6	-68.5	169.3	0	0	0	112.2	L559 C592 I600 I601 A626 I629 V630	L559-L596 HydrophobicContact CD2-CD2 3.98Å; L559-L596 HydrophobicContact CD2-CG 4.44Å; C592-L596 HydrophobicContact CB-CD1 3.68Å; C592-L596 HydrophobicContact CB-CG 4.07Å; C592-L596 WeakPolarHBondContact O-CG 3.04Å; C592-L596 PolarHBondContact O-N 3.01Å; L596-I600 HydrophobicContact CD2-CD1 4.25Å; L596-I601 WeakPolarHBondContact O-CG1 3.32Å; L596-I601 PolarHBondContact O-N 3.45Å; L596-A626 HydrophobicContact CD2-CB 4.08Å; L596-I629 HydrophobicContact CD1-CB 4.07Å; L596-I629 HydrophobicContact CD1-CD1 4.24Å; L596-I629 HydrophobicContact CD1-CG2 3.55Å; L596-I629 HydrophobicContact CD2-CD1 3.9Å; L596-V630 HydrophobicContact CB-CG2 4.03Å; L596-V630 HydrophobicContact CD1-CG2 4.27Å
597	V	96	Very high	92.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.197	C	C	.	.	I	π-helix	trans	-79.6	-51.3	-178.9	168.5	0	0	0	0	112.2	S593 D594 H595 I601 I602 V630 K647 L650	S593-V597 WeakPolarHBondContact O-CB 3.39Å; S593-V597 VanDerWaalsContact O-CG2 3.32Å; S593-V597 WeakPolarHBondContact O-CG2 3.48Å; S593-V597 PolarHBondContact O-N 2.86Å; D594-V597 PolarHBondContact O-N 2.88Å; H595-V597 VanDerWaalsContact C-N 3.26Å; H595-V597 PolarHBondContact O-N 3.09Å; V597-I601 HydrophobicContact CG2-CD1 4.44Å; V597-I602 HydrophobicContact CG1-CD1 3.6Å; V597-I602 HydrophobicContact CG1-CG1 4.15Å; V597-I602 WeakPolarHBondContact O-CB 3.25Å; V597-I602 VanDerWaalsContact O-CG1 3.31Å; V597-I602 WeakPolarHBondContact O-CG1 2.98Å; V597-I602 PolarHBondContact O-N 2.87Å; V597-V630 HydrophobicContact CG2-CG1 4.47Å; V597-V630 HydrophobicContact CG2-CG2 4.22Å; V597-K647 HydrophobicContact CB-CD 3.92Å; V597-K647 HydrophobicContact CG1-CB 4.17Å; V597-K647 HydrophobicContact CG1-CD 3.92Å; V597-K647 HydrophobicContact CG2-CD 4.02Å; V597-L650 HydrophobicContact CG1-CB 4.02Å; V597-L650 HydrophobicContact CG1-CD1 4.02Å; V597-L650 HydrophobicContact CG1-CD2 4.3Å; V597-L650 HydrophobicContact CG1-CG 4.32Å; V597-L650 HydrophobicContact CG2-CD1 4.11Å; V597-L650 HydrophobicContact CG2-CD2 4.02Å
598	Q	93	Very high	90.9	Very high	74 Å²	74	38.3 Å²	38.3	35%	0.346	20%	0.195	S	C	.	.	I	π-helix	trans	-83.6	-27.4	-170.8	-61.6	-63.4	-24.3	0	0	114	D594 P603 D648	D594-Q598 VanDerWaalsContact O-CB 3.3Å; D594-Q598 WeakPolarHBondContact O-CB 3.29Å; D594-Q598 WeakPolarHBondContact O-CG 3.49Å; D594-Q598 PolarHBondContact O-N 2.58Å; Q598-P603 WeakPolarHBondContact O-CD 3.4Å; Q598-P603 WeakPolarHBondContact O-CG 3.38Å; Q598-D648 PolarHBondContact NE2-O 3.24Å
599	Q	91.5	Very high	89	Confident	116 Å²	116	42.1 Å²	42.1	54%	0.542	22%	0.218	S	C	.	.	I	π-helix	trans	-105.1	-18.4	-176.4	-53.9	-58.4	-49.2	0	0	113.8	H595	H595-Q599 WeakPolarHBondContact O-CA 3.33Å; H595-Q599 VanDerWaalsContact O-CB 3.31Å; H595-Q599 WeakPolarHBondContact O-CB 3.43Å; H595-Q599 PolarHBondContact O-N 2.97Å
600	I	92.2	Very high	86.9	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.015	24%	0.242	C	C	.	.	I	π-helix	trans	-118.7	-61.8	-179.5	-51.2	-178.5	0	0	0	111.8	L559 V568 T572 L596 H604 I622 A626	L559-I600 HydrophobicContact CD1-CD1 4.32Å; V568-I600 HydrophobicContact CG1-CD1 4.45Å; T572-I600 HydrophobicContact CG2-CD1 4.28Å; L596-I600 HydrophobicContact CD2-CD1 4.25Å; I600-H604 VanDerWaalsContact O-CB 3.31Å; I600-H604 WeakPolarHBondContact O-CB 3.42Å; I600-H604 PolarHBondContact O-N 3.44Å; I600-I622 HydrophobicContact CD1-CG2 4.14Å; I600-I622 HydrophobicContact CG2-CG2 4.01Å; I600-A626 HydrophobicContact CB-CB 4.22Å; I600-A626 HydrophobicContact CD1-CB 4.42Å; I600-A626 HydrophobicContact CG2-CB 3.74Å
601	I	94.2	Very high	84.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.245	C	C	.	.	I	π-helix	trans	-67.2	-55.5	-170.9	-67.1	170	0	0	0	112	L596 V597 H604 C605 F623 A626 T627 V630 L650 L654	L596-I601 WeakPolarHBondContact O-CG1 3.32Å; L596-I601 PolarHBondContact O-N 3.45Å; V597-I601 HydrophobicContact CG2-CD1 4.44Å; I601-H604 PolarHBondContact O-N 3.12Å; I601-C605 WeakPolarHBondContact O-CB 3.29Å; I601-C605 PolarHBondContact O-N 3.45Å; I601-C605 PolarHBondContact O-SG 3.07Å; I601-F623 HydrophobicContact CB-CE2 4.31Å; I601-F623 HydrophobicContact CG1-CD2 4.48Å; I601-F623 HydrophobicContact CG1-CE2 4.38Å; I601-F623 HydrophobicContact CG2-CE2 4.06Å; I601-A626 HydrophobicContact CD1-CB 4.39Å; I601-A626 HydrophobicContact CG1-CB 4.06Å; I601-T627 HydrophobicContact CD1-CG2 4.18Å; I601-T627 HydrophobicContact CG1-CG2 4.09Å; I601-V630 HydrophobicContact CD1-CB 4.07Å; I601-V630 HydrophobicContact CD1-CG2 3.66Å; I601-L650 HydrophobicContact CG2-CD1 3.93Å; I601-L654 HydrophobicContact CG2-CD2 4.22Å
602	I	92.8	Very high	81.7	Confident	16 Å²	16	47 Å²	47	8%	0.082	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-46.1	-176.6	-66.9	169.1	0	0	0	111.7	V597 H604 C605 N606 D648	V597-I602 HydrophobicContact CG1-CD1 3.6Å; V597-I602 HydrophobicContact CG1-CG1 4.15Å; V597-I602 WeakPolarHBondContact O-CB 3.25Å; V597-I602 VanDerWaalsContact O-CG1 3.31Å; V597-I602 WeakPolarHBondContact O-CG1 2.98Å; V597-I602 PolarHBondContact O-N 2.87Å; I602-H604 PolarHBondContact O-N 3.32Å; I602-C605 PolarHBondContact O-N 2.87Å; I602-N606 WeakPolarHBondContact O-CB 3.37Å; I602-N606 VanDerWaalsContact O-CG 3.24Å; I602-N606 PolarHBondContact O-N 3.28Å; I602-N606 PolarHBondContact O-ND2 3.47Å; I602-D648 VanDerWaalsContact CD1-O 3.26Å; I602-D648 WeakPolarHBondContact CD1-O 3.35Å
603	P	89.7	Confident	78.6	Confident	48 Å²	48	48.3 Å²	48.3	31%	0.312	27%	0.274	S	S	.	.	H	α-helix	trans	-58.8	-46.9	175.6	-28.1	37.9	0	0	0	113.8	Q598 C605 N606 L607	Q598-P603 WeakPolarHBondContact O-CD 3.4Å; Q598-P603 WeakPolarHBondContact O-CG 3.38Å; P603-C605 PolarHBondContact O-N 3.38Å; P603-N606 PolarHBondContact O-N 3.19Å; P603-L607 WeakPolarHBondContact O-CG 3.29Å; P603-L607 PolarHBondContact O-N 2.78Å
604	H	87	Confident	75.5	Confident	18 Å²	18	54.6 Å²	54.6	8%	0.083	30%	0.303	C	S	.	.	H	α-helix	trans	-64.9	-39.9	-180	-169.4	103.3	0	0	0	111.8	I600 I601 I602 L607 C608 Q618 F623	I600-H604 VanDerWaalsContact O-CB 3.31Å; I600-H604 WeakPolarHBondContact O-CB 3.42Å; I600-H604 PolarHBondContact O-N 3.44Å; I601-H604 PolarHBondContact O-N 3.12Å; I602-H604 PolarHBondContact O-N 3.32Å; H604-L607 PolarHBondContact O-N 3.48Å; H604-C608 PolarHBondContact O-N 3Å; H604-C608 PolarHBondContact O-SG 2.87Å; H604-Q618 PolarHBondContact CE1-O 2.94Å; H604-Q618 VanDerWaalsContact CE1-O 3.28Å; H604-Q618 PolarHBondContact ND1-O 3.23Å; H604-F623 HydrophobicContact CB-CB 4.35Å; H604-F623 HydrophobicContact CB-CD2 3.55Å; H604-F623 HydrophobicContact CB-CE2 4.06Å; H604-F623 HydrophobicContact CB-CG 4.1Å; H604-F623 AromaticContact CD2-CD1 3.55Å; H604-F623 AromaticContact CD2-CD2 3.56Å; H604-F623 AromaticContact CD2-CE1 3.96Å; H604-F623 AromaticContact CD2-CE2 3.94Å; H604-F623 AromaticContact CD2-CG 3.33Å; H604-F623 WeakPolarHBondContact CD2-CG 3.21Å; H604-F623 AromaticContact CG-CD2 3.62Å; H604-F623 AromaticContact CG-CG 3.63Å; H604-F623 AromaticContact NE2-CD1 3.72Å; H604-F623 AromaticContact NE2-CG 3.73Å
605	C	86.9	Confident	72.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63	-38.5	173	-73.5	0	0	0	0	113.4	I601 I602 P603 C608 S653	I601-C605 WeakPolarHBondContact O-CB 3.29Å; I601-C605 PolarHBondContact O-N 3.45Å; I601-C605 PolarHBondContact O-SG 3.07Å; I602-C605 PolarHBondContact O-N 2.87Å; P603-C605 PolarHBondContact O-N 3.38Å; C605-C608 WeakPolarHBondContact O-CB 3.24Å; C605-C608 PolarHBondContact O-N 2.91Å; C605-S653 VanDerWaalsContact CB-CB 3.49Å; C605-S653 WeakPolarHBondContact CB-O 3.19Å; C605-S653 VanDerWaalsContact SG-C 3.52Å; C605-S653 PolarHBondContact SG-O 2.83Å
606	N	79	Confident	70.2	Confident	81 Å²	81	57 Å²	57	43%	0.433	33%	0.334	S	S	.	.	H	α-helix	trans	-70.9	-35.4	177.7	-71.1	-20.9	0	0	0	111.9	I602 P603 C608 T609	I602-N606 WeakPolarHBondContact O-CB 3.37Å; I602-N606 VanDerWaalsContact O-CG 3.24Å; I602-N606 PolarHBondContact O-N 3.28Å; I602-N606 PolarHBondContact O-ND2 3.47Å; P603-N606 PolarHBondContact O-N 3.19Å; N606-C608 PolarHBondContact O-N 2.88Å; N606-T609 PolarHBondContact O-N 2.92Å; N606-T609 PolarHBondContact O-OG1 3.04Å; N606-T609 VanDerWaalsContact O-OG1 3.12Å
607	L	72.7	Confident	67.8	Low	63 Å²	63	60 Å²	60	33%	0.33	35%	0.352	S	S	.	.	H	α-helix	trans	-64.5	-25.7	172	-70.1	169.4	0	0	0	112.3	P603 H604 T609 M610 V617	P603-L607 WeakPolarHBondContact O-CG 3.29Å; P603-L607 PolarHBondContact O-N 2.78Å; H604-L607 PolarHBondContact O-N 3.48Å; L607-T609 PolarHBondContact O-N 3.09Å; L607-M610 PolarHBondContact O-N 2.92Å; L607-V617 HydrophobicContact CD1-CG2 4.38Å
608	C	66	Low	65.9	Low	29 Å²	29	62.9 Å²	62.9	20%	0.196	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.8	177.5	-66.1	0	0	0	0	114.9	H604 C605 N606 S660	H604-C608 PolarHBondContact O-N 3Å; H604-C608 PolarHBondContact O-SG 2.87Å; C605-C608 WeakPolarHBondContact O-CB 3.24Å; C605-C608 PolarHBondContact O-N 2.91Å; N606-C608 PolarHBondContact O-N 2.88Å; C608-S660 PolarHBondContact O-OG 2.91Å
609	T	58.7	Low	64.6	Low	80 Å²	80	61.1 Å²	61.1	49%	0.491	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-9.9	176	51.1	0	0	0	0	114.4	N606 L607 T656	N606-T609 PolarHBondContact O-N 2.92Å; N606-T609 PolarHBondContact O-OG1 3.04Å; N606-T609 VanDerWaalsContact O-OG1 3.12Å; L607-T609 PolarHBondContact O-N 3.09Å; T609-T656 HydrophobicContact CG2-CG2 3.32Å
610	M	54	Low	63.8	Low	114 Å²	114	59.7 Å²	59.7	56%	0.562	36%	0.361	S	S	*	.			trans	-88.2	109.5	177.9	-62.9	-63.5	100.7	0	0	109.7	L607 T612	L607-M610 PolarHBondContact O-N 2.92Å; M610-T612 PolarHBondContact O-N 3.09Å
611	S	45.9	Very low	63	Low	110 Å²	110	61.8 Å²	61.8	77%	0.769	37%	0.372	S	S	*	.	S	Bend	trans	-73.7	2.2	177.2	56.2	0	0	0	0	114.3
612	T	37	Very low	62.7	Low	96 Å²	96	61.8 Å²	61.8	59%	0.589	37%	0.372	S	S	*	.	S	Bend	trans	-122.9	123	-176.6	55.4	0	0	0	0	109.8	M610	M610-T612 PolarHBondContact O-N 3.09Å
613	G	30.6	Very low	62.5	Low	27 Å²	27	61 Å²	61	28%	0.278	37%	0.368	S	S	.	.			trans	-79.8	174.3	-172.6	0	0	0	0	0	115.7	S53	S53-G613 CarbonylContact O-C 3.53Å; S53-G613 VanDerWaalsContact O-CA 3.28Å; S53-G613 WeakPolarHBondContact O-CA 3.15Å
614	H	32.3	Very low	62.5	Low	136 Å²	136	62.6 Å²	62.6	63%	0.63	37%	0.368	S	S	*	.			trans	97.4	134.8	-173.1	-62.7	-69	0	0	0	115.6
615	P	35.7	Very low	62.7	Low	106 Å²	106	61.9 Å²	61.9	69%	0.688	37%	0.365	S	S	*	.	S	Bend	cis	-116.3	162.4	-22.7	38.8	-26.5	0	0	0	113.1
616	A	42.5	Very low	63.1	Low	80 Å²	80	61.9 Å²	61.9	66%	0.661	37%	0.365	S	S	*	.			trans	50	82.4	168.5	0	0	0	0	0	115.8	Q618	A616-Q618 PolarHBondContact O-N 2.99Å
617	V	45.1	Very low	64	Low	64 Å²	64	58 Å²	58	39%	0.388	34%	0.344	S	S	.	.			trans	-64.5	108.5	161.4	177.7	0	0	0	0	107.8	L607 P619	L607-V617 HydrophobicContact CD1-CG2 4.38Å; V617-P619 VanDerWaalsContact O-CD 3.31Å; V617-P619 WeakPolarHBondContact O-CD 3.35Å; V617-P619 VanDerWaalsContact O-N 3.14Å
618	Q	57.6	Low	65	Low	59 Å²	59	55 Å²	55	28%	0.276	33%	0.328	S	S	.	.			trans	-53.3	119	164	-77.5	-69.6	-14.3	0	0	107.7	H604 A616	H604-Q618 PolarHBondContact CE1-O 2.94Å; H604-Q618 VanDerWaalsContact CE1-O 3.28Å; H604-Q618 PolarHBondContact ND1-O 3.23Å; A616-Q618 PolarHBondContact O-N 2.99Å
619	P	65.9	Low	66.6	Low	37 Å²	37	53.7 Å²	53.7	24%	0.24	32%	0.319	C	S	.	.			trans	-48.2	144.7	-168.5	-33.7	33.7	0	0	0	113.8	V565 V617 L621 I622 F623	V565-P619 HydrophobicContact CG1-CG 3.47Å; V565-P619 VanDerWaalsContact CG1-CG 3.47Å; V617-P619 VanDerWaalsContact O-CD 3.31Å; V617-P619 WeakPolarHBondContact O-CD 3.35Å; V617-P619 VanDerWaalsContact O-N 3.14Å; P619-L621 PolarHBondContact O-N 2.91Å; P619-I622 HydrophobicContact CB-CG1 4.29Å; P619-I622 HydrophobicContact CG-CD1 4.25Å; P619-I622 WeakPolarHBondContact O-CB 3.4Å; P619-I622 PolarHBondContact O-N 2.94Å; P619-F623 PolarHBondContact O-N 3.34Å
620	P	74.1	Confident	68.5	Low	86 Å²	86	49.9 Å²	49.9	56%	0.558	30%	0.296	S	S	*	.	H	α-helix	trans	-52.2	-29.9	-179.2	-28.9	35.7	0	0	0	113.9	F623 R624	P620-F623 PolarHBondContact O-N 3.47Å; P620-R624 VanDerWaalsContact O-CB 3.28Å; P620-R624 WeakPolarHBondContact O-CB 3.45Å; P620-R624 PolarHBondContact O-N 3.02Å
621	L	76.2	Confident	70.5	Confident	47 Å²	47	45.4 Å²	45.4	25%	0.246	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-41.3	173.8	-178.3	46.4	0	0	0	113	E569 P619 R624 N625	E569-L621 HydrophobicContact CG-CD2 3.96Å; E569-L621 HydrophobicContact CG-CG 3.89Å; E569-L621 VanDerWaalsContact OE1-CD2 3.27Å; E569-L621 WeakPolarHBondContact OE1-CD2 3.37Å; P619-L621 PolarHBondContact O-N 2.91Å; L621-R624 VanDerWaalsContact CD1-CZ 3.45Å; L621-R624 WeakPolarHBondContact O-CB 3.34Å; L621-R624 PolarHBondContact O-N 2.92Å; L621-N625 WeakPolarHBondContact O-CB 3.2Å; L621-N625 PolarHBondContact O-N 2.62Å; L621-N625 PolarHBondContact O-ND2 2.89Å; L621-N625 PolarHBondContact O-OD1 3.14Å
622	I	86.3	Confident	73	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.2	-41	176.4	-57.9	-171.3	0	0	0	110.5	V565 V568 E569 T572 I600 P619 N625 A626	V565-I622 HydrophobicContact CG1-CD1 3.82Å; V565-I622 WeakPolarHBondContact O-CD1 3.36Å; V568-I622 HydrophobicContact CB-CD1 3.99Å; V568-I622 HydrophobicContact CG1-CD1 3.89Å; V568-I622 HydrophobicContact CG1-CG2 3.72Å; E569-I622 HydrophobicContact CB-CD1 4.12Å; E569-I622 HydrophobicContact CB-CG1 4.01Å; E569-I622 HydrophobicContact CG-CG1 4.15Å; T572-I622 HydrophobicContact CG2-CG2 4.29Å; I600-I622 HydrophobicContact CD1-CG2 4.14Å; I600-I622 HydrophobicContact CG2-CG2 4.01Å; P619-I622 HydrophobicContact CB-CG1 4.29Å; P619-I622 HydrophobicContact CG-CD1 4.25Å; P619-I622 WeakPolarHBondContact O-CB 3.4Å; P619-I622 PolarHBondContact O-N 2.94Å; I622-N625 PolarHBondContact O-N 3.03Å; I622-A626 WeakPolarHBondContact O-CB 2.94Å; I622-A626 PolarHBondContact O-N 3.18Å
623	F	89.9	Confident	75.8	Confident	1 Å²	1	37.2 Å²	37.2	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-64.8	-41.7	173.3	177.9	-105.4	0	0	0	112.5	I601 H604 P619 P620 N625 A626 T627 Y657 T671	I601-F623 HydrophobicContact CB-CE2 4.31Å; I601-F623 HydrophobicContact CG1-CD2 4.48Å; I601-F623 HydrophobicContact CG1-CE2 4.38Å; I601-F623 HydrophobicContact CG2-CE2 4.06Å; H604-F623 HydrophobicContact CB-CB 4.35Å; H604-F623 HydrophobicContact CB-CD2 3.55Å; H604-F623 HydrophobicContact CB-CE2 4.06Å; H604-F623 HydrophobicContact CB-CG 4.1Å; H604-F623 AromaticContact CD2-CD1 3.55Å; H604-F623 AromaticContact CD2-CD2 3.56Å; H604-F623 AromaticContact CD2-CE1 3.96Å; H604-F623 AromaticContact CD2-CE2 3.94Å; H604-F623 AromaticContact CD2-CG 3.33Å; H604-F623 WeakPolarHBondContact CD2-CG 3.21Å; H604-F623 AromaticContact CG-CD2 3.62Å; H604-F623 AromaticContact CG-CG 3.63Å; H604-F623 AromaticContact NE2-CD1 3.72Å; H604-F623 AromaticContact NE2-CG 3.73Å; P619-F623 PolarHBondContact O-N 3.34Å; P620-F623 PolarHBondContact O-N 3.47Å; F623-N625 PolarHBondContact O-N 2.9Å; F623-A626 PolarHBondContact O-N 2.93Å; F623-T627 HydrophobicContact CD1-CG2 4.46Å; F623-T627 HydrophobicContact CD2-CG2 4.23Å; F623-T627 HydrophobicContact CE1-CG2 4.07Å; F623-T627 HydrophobicContact CE2-CG2 3.85Å; F623-T627 HydrophobicContact CZ-CG2 3.75Å; F623-T627 WeakPolarHBondContact O-CB 3.5Å; F623-T627 WeakPolarHBondContact O-CG2 3.4Å; F623-T627 PolarHBondContact O-N 2.94Å; F623-T627 PolarHBondContact O-OG1 3.48Å; F623-Y657 HydrophobicContact CD1-CE2 4.3Å; F623-Y657 HydrophobicContact CE1-CD1 4.38Å; F623-Y657 AromaticContact CE1-CD2 3.62Å; F623-Y657 HydrophobicContact CE1-CD2 3.62Å; F623-Y657 HydrophobicContact CE1-CE1 4.32Å; F623-Y657 AromaticContact CE1-CE2 3.56Å; F623-Y657 HydrophobicContact CE1-CE2 3.56Å; F623-Y657 HydrophobicContact CE1-CG 4.05Å; F623-Y657 AromaticContact CE1-CZ 3.94Å; F623-Y657 AromaticContact CZ-CD2 3.86Å; F623-Y657 HydrophobicContact CZ-CD2 3.86Å; F623-Y657 HydrophobicContact CZ-CE2 4.29Å; F623-Y657 HydrophobicContact CZ-CG 4.07Å; F623-T671 HydrophobicContact CD1-CG2 3.55Å; F623-T671 HydrophobicContact CE1-CG2 3.47Å; F623-T671 VanDerWaalsContact CE1-CG2 3.47Å
624	R	88.2	Confident	79	Confident	81 Å²	81	36 Å²	36	31%	0.306	21%	0.205	S	C	.	.	H	α-helix	trans	-58.3	-45.8	172.6	-173.4	-175.2	79.7	168.3	8.2	111.4	W576 P620 L621 T627 G628 N674	W576-R624 HydrophobicContact CH2-CG 4.15Å; W576-R624 HydrophobicContact CZ3-CG 4.14Å; P620-R624 VanDerWaalsContact O-CB 3.28Å; P620-R624 WeakPolarHBondContact O-CB 3.45Å; P620-R624 PolarHBondContact O-N 3.02Å; L621-R624 VanDerWaalsContact CD1-CZ 3.45Å; L621-R624 WeakPolarHBondContact O-CB 3.34Å; L621-R624 PolarHBondContact O-N 2.92Å; R624-T627 PolarHBondContact O-OG1 3.07Å; R624-G628 PolarHBondContact O-N 2.97Å; R624-N674 PolarHBondContact O-ND2 3.3Å
625	N	91.6	Very high	81.9	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-47.4	178.2	-63.6	-10.6	0	0	0	111.1	T572 G573 W576 L621 I622 F623 G628 I629	T572-N625 WeakPolarHBondContact OG1-CB 3.23Å; T572-N625 PolarHBondContact OG1-ND2 2.94Å; G573-N625 PolarHBondContact N-ND2 2.76Å; W576-N625 HydrophobicContact CE3-CB 4.19Å; W576-N625 WeakPolarHBondContact CZ3-OD1 3.31Å; L621-N625 WeakPolarHBondContact O-CB 3.2Å; L621-N625 PolarHBondContact O-N 2.62Å; L621-N625 PolarHBondContact O-ND2 2.89Å; L621-N625 PolarHBondContact O-OD1 3.14Å; I622-N625 PolarHBondContact O-N 3.03Å; F623-N625 PolarHBondContact O-N 2.9Å; N625-G628 CarbonylContact O-C 3.59Å; N625-G628 WeakPolarHBondContact O-CA 3.41Å; N625-G628 PolarHBondContact O-N 3.05Å; N625-G628 VanDerWaalsContact O-N 3.13Å; N625-I629 WeakPolarHBondContact O-CG1 3.14Å; N625-I629 PolarHBondContact O-N 3.23Å
626	A	96.7	Very high	84.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.8	-45.6	179.5	0	0	0	0	0	112.9	L596 I600 I601 I622 F623 G628 I629 V630	L596-A626 HydrophobicContact CD2-CB 4.08Å; I600-A626 HydrophobicContact CB-CB 4.22Å; I600-A626 HydrophobicContact CD1-CB 4.42Å; I600-A626 HydrophobicContact CG2-CB 3.74Å; I601-A626 HydrophobicContact CD1-CB 4.39Å; I601-A626 HydrophobicContact CG1-CB 4.06Å; I622-A626 WeakPolarHBondContact O-CB 2.94Å; I622-A626 PolarHBondContact O-N 3.18Å; F623-A626 PolarHBondContact O-N 2.93Å; A626-G628 VanDerWaalsContact C-N 3.27Å; A626-G628 PolarHBondContact O-N 3.36Å; A626-I629 PolarHBondContact O-N 3.4Å; A626-V630 WeakPolarHBondContact O-CG2 3.13Å; A626-V630 PolarHBondContact O-N 2.91Å
627	T	96.1	Very high	86.8	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-35.5	173.4	51.6	0	0	0	0	111.8	I601 F623 R624 V630 L631 L654 V675	I601-T627 HydrophobicContact CD1-CG2 4.18Å; I601-T627 HydrophobicContact CG1-CG2 4.09Å; F623-T627 HydrophobicContact CD1-CG2 4.46Å; F623-T627 HydrophobicContact CD2-CG2 4.23Å; F623-T627 HydrophobicContact CE1-CG2 4.07Å; F623-T627 HydrophobicContact CE2-CG2 3.85Å; F623-T627 HydrophobicContact CZ-CG2 3.75Å; F623-T627 WeakPolarHBondContact O-CB 3.5Å; F623-T627 WeakPolarHBondContact O-CG2 3.4Å; F623-T627 PolarHBondContact O-N 2.94Å; F623-T627 PolarHBondContact O-OG1 3.48Å; R624-T627 PolarHBondContact O-OG1 3.07Å; T627-V630 PolarHBondContact O-N 2.85Å; T627-L631 VanDerWaalsContact O-CB 3.22Å; T627-L631 WeakPolarHBondContact O-CB 3.47Å; T627-L631 PolarHBondContact O-N 2.85Å; T627-L654 HydrophobicContact CG2-CD2 4.48Å; T627-V675 HydrophobicContact CG2-CG2 3.99Å
628	G	95.4	Very high	89	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65	-41.5	173.3	0	0	0	0	0	114.4	W576 R624 N625 A626 N632 N674	W576-G628 VanDerWaalsContact CD1-C 3.45Å; W576-G628 PolarHBondContact NE1-O 3Å; R624-G628 PolarHBondContact O-N 2.97Å; N625-G628 CarbonylContact O-C 3.59Å; N625-G628 WeakPolarHBondContact O-CA 3.41Å; N625-G628 PolarHBondContact O-N 3.05Å; N625-G628 VanDerWaalsContact O-N 3.13Å; A626-G628 VanDerWaalsContact C-N 3.27Å; A626-G628 PolarHBondContact O-N 3.36Å; G628-N632 PolarHBondContact O-N 3.48Å; G628-N674 WeakPolarHBondContact CA-ND2 3.41Å; G628-N674 PolarHBondContact N-ND2 3.5Å
629	I	98.4	Very high	90.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.4	-49.2	172.8	-61.7	158.8	0	0	0	110.2	L575 W576 I588 L596 N625 A626 L631 N632 I633	L575-I629 HydrophobicContact CB-CD1 3.61Å; L575-I629 HydrophobicContact CB-CG1 4.16Å; W576-I629 HydrophobicContact CB-CG1 3.87Å; W576-I629 HydrophobicContact CG-CG1 4.48Å; I588-I629 HydrophobicContact CG2-CG2 3.6Å; L596-I629 HydrophobicContact CD1-CB 4.07Å; L596-I629 HydrophobicContact CD1-CD1 4.24Å; L596-I629 HydrophobicContact CD1-CG2 3.55Å; L596-I629 HydrophobicContact CD2-CD1 3.9Å; N625-I629 WeakPolarHBondContact O-CG1 3.14Å; N625-I629 PolarHBondContact O-N 3.23Å; A626-I629 PolarHBondContact O-N 3.4Å; I629-L631 VanDerWaalsContact C-N 3.33Å; I629-L631 PolarHBondContact O-N 3.36Å; I629-N632 PolarHBondContact O-N 2.97Å; I629-N632 VanDerWaalsContact O-N 3.09Å; I629-I633 HydrophobicContact CG2-CG2 4.33Å; I629-I633 PolarHBondContact O-N 3.32Å
630	V	98.2	Very high	91.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.7	-35.6	-176.9	178.6	0	0	0	0	111.5	L596 V597 I601 A626 T627 I633 S634 L644 L678	L596-V630 HydrophobicContact CB-CG2 4.03Å; L596-V630 HydrophobicContact CD1-CG2 4.27Å; V597-V630 HydrophobicContact CG2-CG1 4.47Å; V597-V630 HydrophobicContact CG2-CG2 4.22Å; I601-V630 HydrophobicContact CD1-CB 4.07Å; I601-V630 HydrophobicContact CD1-CG2 3.66Å; A626-V630 WeakPolarHBondContact O-CG2 3.13Å; A626-V630 PolarHBondContact O-N 2.91Å; T627-V630 PolarHBondContact O-N 2.85Å; V630-I633 HydrophobicContact CG2-CD1 4.34Å; V630-I633 WeakPolarHBondContact O-CG1 3.26Å; V630-S634 WeakPolarHBondContact O-CB 3.41Å; V630-S634 PolarHBondContact O-N 3.04Å; V630-S634 VanDerWaalsContact O-N 3.07Å; V630-L644 HydrophobicContact CG1-CD1 4.19Å; V630-L644 HydrophobicContact CG1-CD2 3.89Å; V630-L678 HydrophobicContact CB-CD2 4.12Å; V630-L678 HydrophobicContact CG1-CD1 3.97Å; V630-L678 HydrophobicContact CG1-CD2 3.67Å
631	L	97.7	Very high	92.8	Very high	20 Å²	20	22.1 Å²	22.1	11%	0.105	12%	0.124	C	C	.	.	H	α-helix	trans	-54.6	-55	165.9	166.5	57.5	0	0	0	111.2	T627 I629 S634 C677 L678 N681	T627-L631 VanDerWaalsContact O-CB 3.22Å; T627-L631 WeakPolarHBondContact O-CB 3.47Å; T627-L631 PolarHBondContact O-N 2.85Å; I629-L631 VanDerWaalsContact C-N 3.33Å; I629-L631 PolarHBondContact O-N 3.36Å; L631-S634 WeakPolarHBondContact O-CB 3.38Å; L631-S634 PolarHBondContact O-N 2.88Å; L631-S634 PolarHBondContact O-OG 3.49Å; L631-C677 HydrophobicContact CD1-CB 3.52Å; L631-C677 HydrophobicContact CD2-CB 3.7Å; L631-C677 HydrophobicContact CG-CB 4.28Å; L631-L678 HydrophobicContact CB-CB 4.34Å; L631-N681 WeakPolarHBondContact CD1-ND2 3.5Å
632	N	96.8	Very high	93.6	Very high	35 Å²	35	23.6 Å²	23.6	19%	0.187	13%	0.128	C	C	.	.	H	α-helix	trans	-62.7	-47.1	-176.3	-83.8	-14.2	0	0	0	112.7	S579 K585 G628 I629 S634 T635	S579-N632 WeakPolarHBondContact O-CB 3.14Å; S579-N632 VanDerWaalsContact OG-CB 3.3Å; S579-N632 WeakPolarHBondContact OG-CB 3.28Å; S579-N632 PolarHBondContact OG-ND2 3.09Å; K585-N632 WeakPolarHBondContact CD-O 3.25Å; G628-N632 PolarHBondContact O-N 3.48Å; I629-N632 PolarHBondContact O-N 2.97Å; I629-N632 VanDerWaalsContact O-N 3.09Å; N632-S634 VanDerWaalsContact C-N 3.28Å; N632-S634 PolarHBondContact O-N 3.47Å; N632-T635 WeakPolarHBondContact O-CB 3.33Å; N632-T635 PolarHBondContact O-N 2.76Å; N632-T635 PolarHBondContact O-OG1 2.85Å
633	I	97.4	Very high	94	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-67.9	-25.7	179.1	70.3	-168.2	0	0	0	112.9	K585 I588 F589 I629 V630 T635 A636	K585-I633 HydrophobicContact CB-CG2 4.43Å; K585-I633 WeakPolarHBondContact O-CG2 3.42Å; I588-I633 HydrophobicContact CB-CG2 4.06Å; I588-I633 HydrophobicContact CG2-CG2 3.84Å; F589-I633 HydrophobicContact CB-CB 4.19Å; F589-I633 HydrophobicContact CB-CD1 4.23Å; F589-I633 HydrophobicContact CD2-CD1 4.02Å; F589-I633 HydrophobicContact CD2-CG1 4.33Å; I629-I633 HydrophobicContact CG2-CG2 4.33Å; I629-I633 PolarHBondContact O-N 3.32Å; V630-I633 HydrophobicContact CG2-CD1 4.34Å; V630-I633 WeakPolarHBondContact O-CG1 3.26Å; I633-T635 PolarHBondContact O-N 2.78Å; I633-T635 VanDerWaalsContact O-N 3.14Å; I633-A636 WeakPolarHBondContact O-CB 3.5Å; I633-A636 PolarHBondContact O-N 3.39Å
634	S	96.3	Very high	94.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.6	-17.3	171.1	79.3	0	0	0	0	113.2	V630 L631 N632 R641 N681	V630-S634 WeakPolarHBondContact O-CB 3.41Å; V630-S634 PolarHBondContact O-N 3.04Å; V630-S634 VanDerWaalsContact O-N 3.07Å; L631-S634 WeakPolarHBondContact O-CB 3.38Å; L631-S634 PolarHBondContact O-N 2.88Å; L631-S634 PolarHBondContact O-OG 3.49Å; N632-S634 VanDerWaalsContact C-N 3.28Å; N632-S634 PolarHBondContact O-N 3.47Å; S634-R641 WeakPolarHBondContact O-CD 3.44Å; S634-R641 WeakPolarHBondContact O-CG 3.25Å; S634-R641 PolarHBondContact O-NH1 3.42Å; S634-N681 WeakPolarHBondContact OG-CB 3.3Å; S634-N681 PolarHBondContact OG-ND2 2.91Å
635	T	94.5	Very high	94.6	Very high	63 Å²	63	24.2 Å²	24.2	39%	0.387	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-8	173.9	69.2	0	0	0	0	114.1	K585 N632 I633 N681	K585-T635 PolarHBondContact NZ-OG1 3.05Å; N632-T635 WeakPolarHBondContact O-CB 3.33Å; N632-T635 PolarHBondContact O-N 2.76Å; N632-T635 PolarHBondContact O-OG1 2.85Å; I633-T635 PolarHBondContact O-N 2.78Å; I633-T635 VanDerWaalsContact O-N 3.14Å; T635-N681 WeakPolarHBondContact CG2-ND2 3.32Å
636	A	90.2	Very high	94.7	Very high	18 Å²	18	27.9 Å²	27.9	15%	0.149	16%	0.156	C	C	.	.	S	Bend	trans	-62	-55.4	-172.1	0	0	0	0	0	113.5	K585 I633	K585-A636 HydrophobicContact CB-CB 3.76Å; I633-A636 WeakPolarHBondContact O-CB 3.5Å; I633-A636 PolarHBondContact O-N 3.39Å
637	N	90.8	Very high	94.5	Very high	54 Å²	54	28.9 Å²	28.9	29%	0.289	16%	0.161	S	C	.	.			trans	-167.8	169.7	-176.4	60	77	0	0	0	110.6	A639 S640 R641	N637-A639 VanDerWaalsContact C-N 3.31Å; N637-A639 PolarHBondContact O-N 2.86Å; N637-A639 WeakPolarHBondContact OD1-CA 3.39Å; N637-A639 WeakPolarHBondContact OD1-CB 3.48Å; N637-A639 PolarHBondContact OD1-N 2.75Å; N637-S640 PolarHBondContact ND2-OG 3.34Å; N637-S640 VanDerWaalsContact ND2-OG 3.09Å; N637-S640 PolarHBondContact OD1-N 3Å; N637-S640 PolarHBondContact OD1-OG 2.93Å; N637-R641 PolarHBondContact O-N 3.05Å; N637-R641 PolarHBondContact O-NH1 2.85Å
638	D	90.3	Very high	94.4	Very high	56 Å²	56	32.9 Å²	32.9	30%	0.299	18%	0.182	S	C	.	.	H	α-helix	trans	-65.1	-30.9	-178.5	-71.6	42.9	0	0	0	113	R641 K642 R685 L689	D638-R641 PolarHBondContact O-N 2.84Å; D638-R641 IonicContact OD1-CZ 2.9Å; D638-R641 IonicContact OD1-NH2 3.83Å; D638-R641 PolarHBondContact OD1-NH2 2.83Å; D638-R641 IonicContact OD2-NH2 2.64Å; D638-R641 PolarHBondContact OD2-NH2 3Å; D638-K642 PolarHBondContact O-N 2.88Å; D638-R685 IonicContact OD2-CZ 2.68Å; D638-R685 IonicContact OD2-NH1 3.7Å; D638-R685 PolarHBondContact OD2-NH1 3.31Å; D638-L689 HydrophobicContact CB-CD1 4.44Å
639	A	91.2	Very high	94.2	Very high	61 Å²	61	34.1 Å²	34.1	50%	0.504	20%	0.195	S	C	.	.	H	α-helix	trans	-72.1	-44.2	179.8	0	0	0	0	0	112.1	N637 R641 K642 L643	N637-A639 VanDerWaalsContact C-N 3.31Å; N637-A639 PolarHBondContact O-N 2.86Å; N637-A639 WeakPolarHBondContact OD1-CA 3.39Å; N637-A639 WeakPolarHBondContact OD1-CB 3.48Å; N637-A639 PolarHBondContact OD1-N 2.75Å; A639-R641 VanDerWaalsContact C-N 3.27Å; A639-R641 PolarHBondContact O-N 3.08Å; A639-K642 PolarHBondContact O-N 3.43Å; A639-K642 VanDerWaalsContact O-N 3.16Å; A639-L643 WeakPolarHBondContact O-CG 3.24Å; A639-L643 PolarHBondContact O-N 2.87Å
640	S	92.5	Very high	94.2	Very high	6 Å²	6	34.1 Å²	34.1	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-59.5	-37	173.1	-58.5	0	0	0	0	111.7	N637 L644	N637-S640 PolarHBondContact ND2-OG 3.34Å; N637-S640 VanDerWaalsContact ND2-OG 3.09Å; N637-S640 PolarHBondContact OD1-N 3Å; N637-S640 PolarHBondContact OD1-OG 2.93Å; S640-L644 VanDerWaalsContact O-CG 3.31Å; S640-L644 WeakPolarHBondContact O-CG 3.36Å; S640-L644 PolarHBondContact O-N 3.27Å
641	R	94.4	Very high	94.1	Very high	19 Å²	19	34.5 Å²	34.5	7%	0.072	20%	0.198	C	C	.	.	H	α-helix	trans	-67.6	-41.1	173.6	-72.5	-164.3	-61.1	-73.1	-1.4	113.2	S634 N637 D638 A639 L644 R645 N681	S634-R641 WeakPolarHBondContact O-CD 3.44Å; S634-R641 WeakPolarHBondContact O-CG 3.25Å; S634-R641 PolarHBondContact O-NH1 3.42Å; N637-R641 PolarHBondContact O-N 3.05Å; N637-R641 PolarHBondContact O-NH1 2.85Å; D638-R641 PolarHBondContact O-N 2.84Å; D638-R641 IonicContact OD1-CZ 2.9Å; D638-R641 IonicContact OD1-NH2 3.83Å; D638-R641 PolarHBondContact OD1-NH2 2.83Å; D638-R641 IonicContact OD2-NH2 2.64Å; D638-R641 PolarHBondContact OD2-NH2 3Å; A639-R641 VanDerWaalsContact C-N 3.27Å; A639-R641 PolarHBondContact O-N 3.08Å; R641-L644 PolarHBondContact O-N 2.97Å; R641-R645 WeakPolarHBondContact O-CG 3.27Å; R641-R645 PolarHBondContact O-N 3.32Å; R641-R645 VanDerWaalsContact O-N 3.1Å; R641-N681 WeakPolarHBondContact CD-O 3.49Å
642	K	92.5	Very high	93.9	Very high	78 Å²	78	37.7 Å²	37.7	34%	0.339	21%	0.212	S	C	.	.	H	α-helix	trans	-60	-51.4	173.5	177.6	171.5	179.3	85.8	0	110.7	D638 A639 L644 R645 D646 L689 E690	D638-K642 PolarHBondContact O-N 2.88Å; A639-K642 PolarHBondContact O-N 3.43Å; A639-K642 VanDerWaalsContact O-N 3.16Å; K642-L644 PolarHBondContact O-N 2.83Å; K642-R645 CarbonylContact O-C 3.55Å; K642-R645 WeakPolarHBondContact O-CA 3.44Å; K642-R645 VanDerWaalsContact O-CB 3.29Å; K642-R645 WeakPolarHBondContact O-CB 3.31Å; K642-R645 PolarHBondContact O-N 3Å; K642-D646 WeakPolarHBondContact CG-OD2 3.49Å; K642-D646 PolarHBondContact O-N 2.64Å; K642-L689 PolarHBondContact NZ-O 2.74Å; K642-E690 IonicContact NZ-OE2 3.1Å; K642-E690 PolarHBondContact NZ-OE2 3.11Å
643	L	94.1	Very high	93.9	Very high	86 Å²	86	36.1 Å²	36.1	45%	0.45	20%	0.204	S	C	.	.	H	α-helix	trans	-63.3	-27	179.6	-66.7	172.2	0	0	0	113.4	F589 A639 K647	F589-L643 HydrophobicContact CE1-CB 4.28Å; F589-L643 HydrophobicContact CE1-CD1 3.76Å; F589-L643 HydrophobicContact CE2-CB 4.33Å; F589-L643 HydrophobicContact CZ-CB 3.52Å; F589-L643 HydrophobicContact CZ-CD1 3.88Å; F589-L643 HydrophobicContact CZ-CG 4.37Å; A639-L643 WeakPolarHBondContact O-CG 3.24Å; A639-L643 PolarHBondContact O-N 2.87Å; L643-K647 WeakPolarHBondContact O-CG 3.41Å; L643-K647 PolarHBondContact O-N 3.41Å
644	L	96.2	Very high	93.8	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-70.2	-37.8	168.7	-74.5	173.2	0	0	0	112.8	F589 V630 S640 R641 K642 D646 K647 L650 L682	F589-L644 HydrophobicContact CD2-CD2 4.48Å; F589-L644 HydrophobicContact CD2-CG 4.46Å; F589-L644 HydrophobicContact CE2-CD2 4.03Å; F589-L644 HydrophobicContact CE2-CG 3.95Å; V630-L644 HydrophobicContact CG1-CD1 4.19Å; V630-L644 HydrophobicContact CG1-CD2 3.89Å; S640-L644 VanDerWaalsContact O-CG 3.31Å; S640-L644 WeakPolarHBondContact O-CG 3.36Å; S640-L644 PolarHBondContact O-N 3.27Å; R641-L644 PolarHBondContact O-N 2.97Å; K642-L644 PolarHBondContact O-N 2.83Å; L644-D646 VanDerWaalsContact C-N 3.31Å; L644-K647 PolarHBondContact O-N 2.93Å; L644-L650 HydrophobicContact CB-CD2 4.41Å; L644-L650 HydrophobicContact CD2-CD2 4.29Å; L644-L650 WeakPolarHBondContact O-CD2 3.01Å; L644-L682 HydrophobicContact CB-CD2 3.77Å; L644-L682 HydrophobicContact CD1-CD2 4.48Å
645	R	94.9	Very high	93.8	Very high	8 Å²	8	36.7 Å²	36.7	3%	0.03	21%	0.207	C	C	.	.	H	α-helix	trans	-66.6	-33.9	173.2	-67.6	165.2	179.5	148.4	4.5	112.2	R641 K642 K647 L682 Y684 E690 N742 I743	R641-R645 WeakPolarHBondContact O-CG 3.27Å; R641-R645 PolarHBondContact O-N 3.32Å; R641-R645 VanDerWaalsContact O-N 3.1Å; K642-R645 CarbonylContact O-C 3.55Å; K642-R645 WeakPolarHBondContact O-CA 3.44Å; K642-R645 VanDerWaalsContact O-CB 3.29Å; K642-R645 WeakPolarHBondContact O-CB 3.31Å; K642-R645 PolarHBondContact O-N 3Å; R645-K647 PolarHBondContact O-N 3.08Å; R645-L682 HydrophobicContact CG-CD2 4.15Å; R645-L682 VanDerWaalsContact CZ-O 3.25Å; R645-L682 PolarHBondContact NE-O 2.91Å; R645-L682 PolarHBondContact NH2-O 3.48Å; R645-Y684 PolarHBondContact NH2-O 3.32Å; R645-E690 WeakPolarHBondContact CD-OE1 3.35Å; R645-E690 IonicContact CZ-OE1 3.8Å; R645-E690 IonicContact NE-OE1 3.22Å; R645-E690 IonicContact NH1-OE1 2.72Å; R645-E690 PolarHBondContact NH1-OE1 2.84Å; R645-N742 WeakPolarHBondContact O-CB 3.24Å; R645-N742 PolarHBondContact O-ND2 2.79Å; R645-I743 HydrophobicContact CB-CG2 3.55Å; R645-I743 HydrophobicContact CG-CG2 3.72Å
646	D	93.2	Very high	93.8	Very high	80 Å²	80	34.8 Å²	34.8	43%	0.428	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.3	177.4	-65.9	-33.5	0	0	0	112.6	K642 L644 D648 N742	K642-D646 WeakPolarHBondContact CG-OD2 3.49Å; K642-D646 PolarHBondContact O-N 2.64Å; L644-D646 VanDerWaalsContact C-N 3.31Å; D646-D648 PolarHBondContact O-N 2.72Å; D646-N742 PolarHBondContact O-ND2 3.08Å
647	K	94.1	Very high	94	Very high	22 Å²	22	35.2 Å²	35.2	10%	0.096	19%	0.194	C	C	.	.	S	Bend	trans	-72.5	112.4	171.9	-58.5	-161.8	-167.3	-63.9	0	110.4	S593 D594 V597 L643 L644 R645 L650	S593-K647 WeakPolarHBondContact OG-CE 3.35Å; S593-K647 PolarHBondContact OG-NZ 2.88Å; D594-K647 IonicContact OD1-NZ 2.7Å; D594-K647 PolarHBondContact OD1-NZ 2.89Å; D594-K647 IonicContact OD2-NZ 2.82Å; D594-K647 PolarHBondContact OD2-NZ 3.23Å; D594-K647 VanDerWaalsContact OD2-NZ 3.1Å; V597-K647 HydrophobicContact CB-CD 3.92Å; V597-K647 HydrophobicContact CG1-CB 4.17Å; V597-K647 HydrophobicContact CG1-CD 3.92Å; V597-K647 HydrophobicContact CG2-CD 4.02Å; L643-K647 WeakPolarHBondContact O-CG 3.41Å; L643-K647 PolarHBondContact O-N 3.41Å; L644-K647 PolarHBondContact O-N 2.93Å; R645-K647 PolarHBondContact O-N 3.08Å; K647-L650 HydrophobicContact CB-CB 4.47Å; K647-L650 PolarHBondContact O-N 3.26Å
648	D	92.7	Very high	94.2	Very high	84 Å²	84	32.9 Å²	32.9	45%	0.449	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	150.4	179	-148.7	-24	0	0	0	111.6	Q598 I602 D646 L650 R741	Q598-D648 PolarHBondContact NE2-O 3.24Å; I602-D648 VanDerWaalsContact CD1-O 3.26Å; I602-D648 WeakPolarHBondContact CD1-O 3.35Å; D646-D648 PolarHBondContact O-N 2.72Å; D648-L650 PolarHBondContact O-N 3.3Å; D648-R741 IonicContact OD2-CZ 2.7Å; D648-R741 IonicContact OD2-NE 3.48Å; D648-R741 IonicContact OD2-NH2 2.75Å; D648-R741 PolarHBondContact OD2-NH2 3.07Å
649	G	92.8	Very high	94.5	Very high	25 Å²	25	33.4 Å²	33.4	26%	0.258	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	72	-23.9	-177.5	0	0	0	0	0	116.9	Q652 S653	G649-Q652 PolarHBondContact O-N 3.22Å; G649-S653 VanDerWaalsContact O-CB 3.28Å; G649-S653 WeakPolarHBondContact O-CB 3.43Å; G649-S653 PolarHBondContact O-N 3.19Å; G649-S653 PolarHBondContact O-OG 2.92Å
650	L	96.6	Very high	94.4	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-54.6	-169.4	177	58.9	0	0	0	113.6	V597 I601 L644 K647 D648 Q652 S653 L654	V597-L650 HydrophobicContact CG1-CB 4.02Å; V597-L650 HydrophobicContact CG1-CD1 4.02Å; V597-L650 HydrophobicContact CG1-CD2 4.3Å; V597-L650 HydrophobicContact CG1-CG 4.32Å; V597-L650 HydrophobicContact CG2-CD1 4.11Å; V597-L650 HydrophobicContact CG2-CD2 4.02Å; I601-L650 HydrophobicContact CG2-CD1 3.93Å; L644-L650 HydrophobicContact CB-CD2 4.41Å; L644-L650 HydrophobicContact CD2-CD2 4.29Å; L644-L650 WeakPolarHBondContact O-CD2 3.01Å; K647-L650 HydrophobicContact CB-CB 4.47Å; K647-L650 PolarHBondContact O-N 3.26Å; D648-L650 PolarHBondContact O-N 3.3Å; L650-Q652 VanDerWaalsContact C-N 3.31Å; L650-Q652 PolarHBondContact O-N 3.49Å; L650-S653 WeakPolarHBondContact O-CB 3.34Å; L650-S653 PolarHBondContact O-N 3.47Å; L650-L654 HydrophobicContact CD1-CD1 3.83Å; L650-L654 HydrophobicContact CD1-CG 4.05Å; L650-L654 HydrophobicContact CG-CD1 4.06Å; L650-L654 WeakPolarHBondContact O-CG 3.2Å; L650-L654 PolarHBondContact O-N 3.48Å
651	A	95.9	Very high	94.3	Very high	7 Å²	7	30.7 Å²	30.7	6%	0.058	16%	0.159	C	C	.	.	H	α-helix	trans	-65.3	-36.1	-177.2	0	0	0	0	0	112.1	V655 N742 P745 L746	A651-V655 WeakPolarHBondContact O-CG2 3.27Å; A651-V655 PolarHBondContact O-N 3.25Å; A651-N742 VanDerWaalsContact CB-O 3.32Å; A651-N742 WeakPolarHBondContact CB-O 3.1Å; A651-P745 HydrophobicContact CB-CB 4.33Å; A651-P745 HydrophobicContact CB-CG 4.46Å; A651-L746 HydrophobicContact CB-CD2 3.91Å; A651-L746 HydrophobicContact CB-CG 4.15Å
652	Q	95	Very high	94.1	Very high	87 Å²	87	33 Å²	33	41%	0.407	17%	0.17	S	C	.	.	H	α-helix	trans	-64.2	-46.6	174.4	-177.2	55.9	66.1	0	0	110.8	G649 L650 L654 V655 T656 P745	G649-Q652 PolarHBondContact O-N 3.22Å; L650-Q652 VanDerWaalsContact C-N 3.31Å; L650-Q652 PolarHBondContact O-N 3.49Å; Q652-L654 VanDerWaalsContact C-N 3.35Å; Q652-L654 PolarHBondContact O-N 2.84Å; Q652-V655 PolarHBondContact O-N 2.98Å; Q652-T656 PolarHBondContact NE2-OG1 2.68Å; Q652-T656 WeakPolarHBondContact O-CB 3.44Å; Q652-T656 PolarHBondContact O-N 3.48Å; Q652-T656 PolarHBondContact O-OG1 3.36Å; Q652-P745 HydrophobicContact CB-CB 4.44Å; Q652-P745 HydrophobicContact CB-CG 3.86Å
653	S	95.3	Very high	94.1	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-58.4	-44.2	-179.7	-63.4	0	0	0	0	112.4	C605 G649 L650 T656 Y657	C605-S653 VanDerWaalsContact CB-CB 3.49Å; C605-S653 WeakPolarHBondContact CB-O 3.19Å; C605-S653 VanDerWaalsContact SG-C 3.52Å; C605-S653 PolarHBondContact SG-O 2.83Å; G649-S653 VanDerWaalsContact O-CB 3.28Å; G649-S653 WeakPolarHBondContact O-CB 3.43Å; G649-S653 PolarHBondContact O-N 3.19Å; G649-S653 PolarHBondContact O-OG 2.92Å; L650-S653 WeakPolarHBondContact O-CB 3.34Å; L650-S653 PolarHBondContact O-N 3.47Å; S653-T656 WeakPolarHBondContact O-CB 3.17Å; S653-T656 PolarHBondContact O-N 3.43Å; S653-Y657 PolarHBondContact O-N 3.42Å
654	L	96.9	Very high	93.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.3	-40.5	177.1	-67.3	169.6	0	0	0	112.5	I601 T627 L650 Q652 Y657 L658 V675 L678 L679 L682	I601-L654 HydrophobicContact CG2-CD2 4.22Å; T627-L654 HydrophobicContact CG2-CD2 4.48Å; L650-L654 HydrophobicContact CD1-CD1 3.83Å; L650-L654 HydrophobicContact CD1-CG 4.05Å; L650-L654 HydrophobicContact CG-CD1 4.06Å; L650-L654 WeakPolarHBondContact O-CG 3.2Å; L650-L654 PolarHBondContact O-N 3.48Å; Q652-L654 VanDerWaalsContact C-N 3.35Å; Q652-L654 PolarHBondContact O-N 2.84Å; L654-Y657 PolarHBondContact O-N 3.28Å; L654-L658 PolarHBondContact O-N 3.08Å; L654-V675 HydrophobicContact CB-CG1 4.09Å; L654-V675 HydrophobicContact CD2-CB 4.47Å; L654-V675 HydrophobicContact CD2-CG1 4.01Å; L654-V675 HydrophobicContact CD2-CG2 4.04Å; L654-V675 WeakPolarHBondContact O-CG1 3.47Å; L654-L678 HydrophobicContact CD1-CD2 3.62Å; L654-L678 HydrophobicContact CD1-CG 3.84Å; L654-L678 HydrophobicContact CD2-CD2 3.98Å; L654-L678 HydrophobicContact CG-CD2 4.47Å; L654-L679 HydrophobicContact CB-CD1 4.19Å; L654-L679 HydrophobicContact CB-CD2 3.77Å; L654-L679 HydrophobicContact CB-CG 4Å; L654-L679 HydrophobicContact CD1-CD2 4.2Å; L654-L679 HydrophobicContact CD1-CG 4.42Å; L654-L682 HydrophobicContact CD1-CD1 3.91Å
655	V	96.2	Very high	93.2	Very high	11 Å²	11	45.7 Å²	45.7	7%	0.067	22%	0.224	C	C	.	.	H	α-helix	trans	-67.8	-41	174.7	172.5	0	0	0	0	111.2	A651 Q652 Y657 L658 Q659 L679 P745 T751 L754	A651-V655 WeakPolarHBondContact O-CG2 3.27Å; A651-V655 PolarHBondContact O-N 3.25Å; Q652-V655 PolarHBondContact O-N 2.98Å; V655-Y657 VanDerWaalsContact C-N 3.31Å; V655-Y657 PolarHBondContact O-N 2.9Å; V655-L658 PolarHBondContact O-N 3.33Å; V655-L658 VanDerWaalsContact O-N 3.17Å; V655-Q659 PolarHBondContact O-N 2.79Å; V655-L679 HydrophobicContact CG2-CD1 4.41Å; V655-L679 HydrophobicContact CG2-CD2 4.06Å; V655-P745 HydrophobicContact CG2-CB 4.23Å; V655-T751 HydrophobicContact CG1-CG2 4.27Å; V655-T751 HydrophobicContact CG2-CG2 3.74Å; V655-L754 HydrophobicContact CG1-CD1 4.1Å
656	T	94.4	Very high	92.7	Very high	23 Å²	23	47.7 Å²	47.7	14%	0.141	24%	0.235	C	C	.	.	H	α-helix	trans	-59.4	-39.5	174.3	-65.8	0	0	0	0	111.9	T609 Q652 S653 Q659 S660	T609-T656 HydrophobicContact CG2-CG2 3.32Å; Q652-T656 PolarHBondContact NE2-OG1 2.68Å; Q652-T656 WeakPolarHBondContact O-CB 3.44Å; Q652-T656 PolarHBondContact O-N 3.48Å; Q652-T656 PolarHBondContact O-OG1 3.36Å; S653-T656 WeakPolarHBondContact O-CB 3.17Å; S653-T656 PolarHBondContact O-N 3.43Å; T656-Q659 PolarHBondContact O-N 2.9Å; T656-S660 PolarHBondContact O-N 3.46Å; T656-S660 VanDerWaalsContact O-N 3.12Å
657	Y	94.7	Very high	92.6	Very high	28 Å²	28	45.3 Å²	45.3	11%	0.11	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-44.1	173.5	179.8	-93.2	0	0	0	112	F623 S653 L654 V655 Q659 S660 A661 T671 V672 V675	F623-Y657 HydrophobicContact CD1-CE2 4.3Å; F623-Y657 HydrophobicContact CE1-CD1 4.38Å; F623-Y657 AromaticContact CE1-CD2 3.62Å; F623-Y657 HydrophobicContact CE1-CD2 3.62Å; F623-Y657 HydrophobicContact CE1-CE1 4.32Å; F623-Y657 AromaticContact CE1-CE2 3.56Å; F623-Y657 HydrophobicContact CE1-CE2 3.56Å; F623-Y657 HydrophobicContact CE1-CG 4.05Å; F623-Y657 AromaticContact CE1-CZ 3.94Å; F623-Y657 AromaticContact CZ-CD2 3.86Å; F623-Y657 HydrophobicContact CZ-CD2 3.86Å; F623-Y657 HydrophobicContact CZ-CE2 4.29Å; F623-Y657 HydrophobicContact CZ-CG 4.07Å; S653-Y657 PolarHBondContact O-N 3.42Å; L654-Y657 PolarHBondContact O-N 3.28Å; V655-Y657 VanDerWaalsContact C-N 3.31Å; V655-Y657 PolarHBondContact O-N 2.9Å; Y657-Q659 VanDerWaalsContact C-N 3.29Å; Y657-Q659 PolarHBondContact O-N 2.89Å; Y657-S660 PolarHBondContact O-N 3.24Å; Y657-A661 HydrophobicContact CE1-CB 4.43Å; Y657-A661 WeakPolarHBondContact O-CB 3.46Å; Y657-A661 PolarHBondContact O-N 3.27Å; Y657-T671 HydrophobicContact CE1-CG2 3.84Å; Y657-T671 HydrophobicContact CE2-CG2 4.33Å; Y657-T671 WeakPolarHBondContact OH-CB 3.5Å; Y657-T671 VanDerWaalsContact OH-CG2 3.24Å; Y657-T671 WeakPolarHBondContact OH-CG2 3.28Å; Y657-V672 HydrophobicContact CE1-CG2 4.26Å; Y657-V675 HydrophobicContact CD1-CB 4.29Å; Y657-V675 HydrophobicContact CD1-CG1 4.24Å; Y657-V675 HydrophobicContact CD1-CG2 3.82Å; Y657-V675 HydrophobicContact CE1-CG2 4.19Å
658	L	95.2	Very high	92	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-32.5	176.1	-67.9	-173.2	0	0	0	113.1	L654 V655 A661 F662 V672 V675 V676 L679 L754 L758	L654-L658 PolarHBondContact O-N 3.08Å; V655-L658 PolarHBondContact O-N 3.33Å; V655-L658 VanDerWaalsContact O-N 3.17Å; L658-A661 PolarHBondContact O-N 3.32Å; L658-F662 VanDerWaalsContact O-CB 3.31Å; L658-F662 WeakPolarHBondContact O-CB 3.25Å; L658-F662 PolarHBondContact O-N 3.12Å; L658-V672 HydrophobicContact CD2-CG1 4.17Å; L658-V675 HydrophobicContact CD1-CG1 4.29Å; L658-V675 HydrophobicContact CD2-CB 4.24Å; L658-V675 HydrophobicContact CD2-CG1 3.75Å; L658-V675 HydrophobicContact CG-CG1 3.74Å; L658-V676 HydrophobicContact CD1-CG2 3.89Å; L658-V676 HydrophobicContact CD2-CG2 3.77Å; L658-L679 HydrophobicContact CD1-CD1 3.45Å; L658-L679 VanDerWaalsContact CD1-CD1 3.45Å; L658-L679 HydrophobicContact CG-CD1 4.22Å; L658-L754 HydrophobicContact CB-CD1 4.18Å; L658-L758 HydrophobicContact CD1-CD1 4.22Å
659	Q	94.8	Very high	91.5	Very high	67 Å²	67	44.2 Å²	44.2	31%	0.313	22%	0.219	S	C	.	.	H	α-helix	trans	-62.4	-47.8	172	-177.6	60.8	41.2	0	0	111.1	V655 T656 Y657 A661 F662 E663 L754	V655-Q659 PolarHBondContact O-N 2.79Å; T656-Q659 PolarHBondContact O-N 2.9Å; Y657-Q659 VanDerWaalsContact C-N 3.29Å; Y657-Q659 PolarHBondContact O-N 2.89Å; Q659-A661 VanDerWaalsContact C-N 3.34Å; Q659-A661 PolarHBondContact O-N 2.91Å; Q659-F662 PolarHBondContact O-N 3.5Å; Q659-E663 WeakPolarHBondContact CG-OE1 3.19Å; Q659-E663 PolarHBondContact NE2-OE1 3.47Å; Q659-E663 WeakPolarHBondContact O-CG 3.12Å; Q659-E663 PolarHBondContact O-N 2.91Å; Q659-L754 HydrophobicContact CB-CD1 4.24Å
660	S	91	Very high	91	Very high	5 Å²	5	47.7 Å²	47.7	4%	0.035	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-36.6	176.6	-161.9	0	0	0	0	112.7	C608 T656 Y657 K664	C608-S660 PolarHBondContact O-OG 2.91Å; T656-S660 PolarHBondContact O-N 3.46Å; T656-S660 VanDerWaalsContact O-N 3.12Å; Y657-S660 PolarHBondContact O-N 3.24Å; S660-K664 WeakPolarHBondContact O-CB 3.4Å; S660-K664 WeakPolarHBondContact O-CD 3.43Å; S660-K664 VanDerWaalsContact O-CG 3.27Å; S660-K664 WeakPolarHBondContact O-CG 3.42Å; S660-K664 PolarHBondContact O-N 2.94Å; S660-K664 PolarHBondContact OG-NZ 3.06Å
661	A	89.3	Confident	90.6	Very high	5 Å²	5	48.4 Å²	48.4	4%	0.041	23%	0.231	C	C	.	.	H	α-helix	trans	-66.6	-44.6	175.4	0	0	0	0	0	111.6	Y657 L658 Q659 E663 K664 K665 D666 V672	Y657-A661 HydrophobicContact CE1-CB 4.43Å; Y657-A661 WeakPolarHBondContact O-CB 3.46Å; Y657-A661 PolarHBondContact O-N 3.27Å; L658-A661 PolarHBondContact O-N 3.32Å; Q659-A661 VanDerWaalsContact C-N 3.34Å; Q659-A661 PolarHBondContact O-N 2.91Å; A661-E663 PolarHBondContact O-N 3.17Å; A661-K664 CarbonylContact O-C 3.54Å; A661-K664 PolarHBondContact O-N 3.49Å; A661-K665 PolarHBondContact O-N 2.56Å; A661-D666 CarbonylContact C-O 3.56Å; A661-D666 HydrophobicContact CB-CB 4.38Å; A661-D666 WeakPolarHBondContact CB-O 3.07Å; A661-D666 PolarHBondContact O-N 2.85Å; A661-V672 HydrophobicContact CB-CG2 3.89Å
662	F	91.4	Very high	90.4	Very high	67 Å²	67	48 Å²	48	29%	0.294	23%	0.228	S	C	.	.	H	α-helix	trans	-58.7	-44.2	173.7	170	-93.7	0	0	0	112.4	L658 Q659 K664 K665 F667 L754 A757	L658-F662 VanDerWaalsContact O-CB 3.31Å; L658-F662 WeakPolarHBondContact O-CB 3.25Å; L658-F662 PolarHBondContact O-N 3.12Å; Q659-F662 PolarHBondContact O-N 3.5Å; F662-K664 VanDerWaalsContact C-N 3.32Å; F662-K664 PolarHBondContact O-N 3.45Å; F662-K665 PolarHBondContact O-N 3.4Å; F662-K665 VanDerWaalsContact O-N 3.14Å; F662-F667 AromaticContact CD2-CE1 3.88Å; F662-F667 HydrophobicContact CD2-CE1 3.88Å; F662-L754 HydrophobicContact CB-CD2 3.69Å; F662-L754 HydrophobicContact CD1-CD2 4.44Å; F662-L754 HydrophobicContact CG-CD2 3.98Å; F662-A757 HydrophobicContact CD2-CB 3.52Å; F662-A757 HydrophobicContact CE2-CB 3.45Å; F662-A757 VanDerWaalsContact CE2-CB 3.45Å
663	E	90.8	Very high	90.2	Very high	125 Å²	125	44.1 Å²	44.1	58%	0.584	21%	0.21	S	C	*	.	H	α-helix	trans	-62.4	-37.1	175.9	-73.7	162	-175.1	0	0	112.6	Q659 A661 K665	Q659-E663 WeakPolarHBondContact CG-OE1 3.19Å; Q659-E663 PolarHBondContact NE2-OE1 3.47Å; Q659-E663 WeakPolarHBondContact O-CG 3.12Å; Q659-E663 PolarHBondContact O-N 2.91Å; A661-E663 PolarHBondContact O-N 3.17Å; E663-K665 VanDerWaalsContact C-N 3.3Å
664	K	84.4	Confident	90.2	Very high	142 Å²	142	44.1 Å²	44.1	62%	0.617	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-2.7	175.9	-69.5	163.8	-177.2	154.3	0	114.1	S660 A661 F662 D666	S660-K664 WeakPolarHBondContact O-CB 3.4Å; S660-K664 WeakPolarHBondContact O-CD 3.43Å; S660-K664 VanDerWaalsContact O-CG 3.27Å; S660-K664 WeakPolarHBondContact O-CG 3.42Å; S660-K664 PolarHBondContact O-N 2.94Å; S660-K664 PolarHBondContact OG-NZ 3.06Å; A661-K664 CarbonylContact O-C 3.54Å; A661-K664 PolarHBondContact O-N 3.49Å; F662-K664 VanDerWaalsContact C-N 3.32Å; F662-K664 PolarHBondContact O-N 3.45Å; K664-D666 PolarHBondContact O-N 2.96Å
665	K	88.6	Confident	90.2	Very high	166 Å²	166	44.1 Å²	44.1	72%	0.722	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	24.2	-171.3	-52.5	174	-174	167.7	0	114.5	A661 F662 E663 F667	A661-K665 PolarHBondContact O-N 2.56Å; F662-K665 PolarHBondContact O-N 3.4Å; F662-K665 VanDerWaalsContact O-N 3.14Å; E663-K665 VanDerWaalsContact C-N 3.3Å; K665-F667 HydrophobicContact CB-CE2 3.89Å; K665-F667 HydrophobicContact CB-CZ 4.06Å; K665-F667 HydrophobicContact CG-CZ 4.41Å; K665-F667 WeakPolarHBondContact O-CD2 3.5Å; K665-F667 PolarHBondContact O-N 3.04Å
666	D	84.3	Confident	90.3	Very high	49 Å²	49	43.6 Å²	43.6	26%	0.262	21%	0.207	S	C	.	.			trans	-81.8	106.3	166.7	177.7	17.8	0	0	0	109.3	A661 K664 D668 S669	A661-D666 CarbonylContact C-O 3.56Å; A661-D666 HydrophobicContact CB-CB 4.38Å; A661-D666 WeakPolarHBondContact CB-O 3.07Å; A661-D666 PolarHBondContact O-N 2.85Å; K664-D666 PolarHBondContact O-N 2.96Å; D666-D668 PolarHBondContact OD1-N 2.73Å; D666-S669 WeakPolarHBondContact OD1-CB 3.22Å; D666-S669 PolarHBondContact OD1-N 2.76Å; D666-S669 PolarHBondContact OD1-OG 3.02Å; D666-S669 WeakPolarHBondContact OD2-CB 3.22Å; D666-S669 PolarHBondContact OD2-OG 2.97Å
667	F	90	Very high	90.4	Very high	30 Å²	30	43.1 Å²	43.1	13%	0.132	20%	0.204	C	C	.	.			trans	-111.2	-17	178.3	-52.4	-57.7	0	0	0	113.3	F662 K665 L758 N761	F662-F667 AromaticContact CD2-CE1 3.88Å; F662-F667 HydrophobicContact CD2-CE1 3.88Å; K665-F667 HydrophobicContact CB-CE2 3.89Å; K665-F667 HydrophobicContact CB-CZ 4.06Å; K665-F667 HydrophobicContact CG-CZ 4.41Å; K665-F667 WeakPolarHBondContact O-CD2 3.5Å; K665-F667 PolarHBondContact O-N 3.04Å; F667-L758 HydrophobicContact CB-CD2 4.34Å; F667-L758 HydrophobicContact CD1-CD2 4.18Å; F667-N761 HydrophobicContact CD1-CB 4.27Å; F667-N761 HydrophobicContact CD2-CB 3.52Å; F667-N761 HydrophobicContact CE1-CB 4.26Å; F667-N761 HydrophobicContact CE2-CB 3.52Å; F667-N761 HydrophobicContact CG-CB 3.91Å; F667-N761 HydrophobicContact CZ-CB 3.89Å
668	D	82.4	Confident	90.6	Very high	47 Å²	47	41.8 Å²	41.8	25%	0.251	20%	0.199	S	C	.	.	S	Bend	trans	-124.5	-8.7	-162.1	-75.2	-29.4	0	0	0	114.3	D666 S762 T763 N764	D666-D668 PolarHBondContact OD1-N 2.73Å; D668-S762 VanDerWaalsContact OD1-CA 3.29Å; D668-S762 WeakPolarHBondContact OD1-CA 3.49Å; D668-S762 VanDerWaalsContact OD1-CB 3.31Å; D668-S762 WeakPolarHBondContact OD1-CB 3.23Å; D668-S762 PolarHBondContact OD1-OG 2.84Å; D668-T763 PolarHBondContact OD1-N 2.85Å; D668-T763 WeakPolarHBondContact OD2-CB 3.32Å; D668-T763 PolarHBondContact OD2-N 3.37Å; D668-T763 PolarHBondContact OD2-OG1 3.05Å; D668-N764 HydrophobicContact CB-CB 4.03Å; D668-N764 PolarHBondContact O-ND2 2.92Å; D668-N764 WeakPolarHBondContact OD1-CB 3.4Å; D668-N764 PolarHBondContact OD1-N 3.49Å
669	S	81.1	Confident	90.7	Very high	37 Å²	37	41.6 Å²	41.6	26%	0.259	20%	0.198	S	C	.	.	S	Bend	trans	-61	154.1	-178.6	79.4	0	0	0	0	113.3	D666 T671 V672 V673	D666-S669 WeakPolarHBondContact OD1-CB 3.22Å; D666-S669 PolarHBondContact OD1-N 2.76Å; D666-S669 PolarHBondContact OD1-OG 3.02Å; D666-S669 WeakPolarHBondContact OD2-CB 3.22Å; D666-S669 PolarHBondContact OD2-OG 2.97Å; S669-T671 PolarHBondContact O-N 2.85Å; S669-T671 VanDerWaalsContact O-N 3.09Å; S669-V672 PolarHBondContact O-N 2.95Å; S669-V672 PolarHBondContact OG-N 2.89Å; S669-V673 PolarHBondContact O-N 2.93Å
670	K	82.2	Confident	90.8	Very high	98 Å²	98	40.9 Å²	40.9	43%	0.426	19%	0.192	S	C	.	.	H	α-helix	trans	-61.3	-23	179.1	-166.8	59.6	172.8	-174.9	0	113	W576 V673 N674 D766	W576-K670 HydrophobicContact CH2-CG 4.31Å; K670-V673 HydrophobicContact CD-CB 4.26Å; K670-V673 HydrophobicContact CD-CG1 4.34Å; K670-N674 VanDerWaalsContact O-CG 3.28Å; K670-N674 PolarHBondContact O-N 2.78Å; K670-N674 PolarHBondContact O-OD1 2.84Å; K670-D766 IonicContact NZ-OD2 2.69Å
671	T	89	Confident	91.1	Very high	15 Å²	15	41.5 Å²	41.5	9%	0.092	20%	0.195	C	C	.	.	H	α-helix	trans	-74.5	-43.2	174.4	-49	0	0	0	0	111.2	F623 Y657 S669 V673 N674 V675	F623-T671 HydrophobicContact CD1-CG2 3.55Å; F623-T671 HydrophobicContact CE1-CG2 3.47Å; F623-T671 VanDerWaalsContact CE1-CG2 3.47Å; Y657-T671 HydrophobicContact CE1-CG2 3.84Å; Y657-T671 HydrophobicContact CE2-CG2 4.33Å; Y657-T671 WeakPolarHBondContact OH-CB 3.5Å; Y657-T671 VanDerWaalsContact OH-CG2 3.24Å; Y657-T671 WeakPolarHBondContact OH-CG2 3.28Å; S669-T671 PolarHBondContact O-N 2.85Å; S669-T671 VanDerWaalsContact O-N 3.09Å; T671-V673 PolarHBondContact O-N 2.84Å; T671-N674 PolarHBondContact O-N 2.83Å; T671-V675 WeakPolarHBondContact O-CG2 3.49Å; T671-V675 PolarHBondContact O-N 2.9Å
672	V	92.6	Very high	91.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59	-46.3	170.9	173.9	0	0	0	0	110.5	Y657 L658 A661 S669 N674 V675 V676 L758 V767	Y657-V672 HydrophobicContact CE1-CG2 4.26Å; L658-V672 HydrophobicContact CD2-CG1 4.17Å; A661-V672 HydrophobicContact CB-CG2 3.89Å; S669-V672 PolarHBondContact O-N 2.95Å; S669-V672 PolarHBondContact OG-N 2.89Å; V672-N674 VanDerWaalsContact C-N 3.34Å; V672-N674 PolarHBondContact O-N 2.83Å; V672-V675 PolarHBondContact O-N 3.27Å; V672-V676 HydrophobicContact CG1-CG2 3.98Å; V672-V676 VanDerWaalsContact O-CG2 3.27Å; V672-V676 WeakPolarHBondContact O-CG2 3.37Å; V672-V676 PolarHBondContact O-N 3.4Å; V672-L758 HydrophobicContact CG1-CD2 3.91Å; V672-V767 HydrophobicContact CG1-CG1 4.38Å; V672-V767 HydrophobicContact CG1-CG2 4.31Å
673	V	89.3	Confident	91.7	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.024	18%	0.18	C	C	.	.	H	α-helix	trans	-51	-51.7	172.9	172.3	0	0	0	0	111.7	S669 K670 T671 V675 C677 N764 D766 V767	S669-V673 PolarHBondContact O-N 2.93Å; K670-V673 HydrophobicContact CD-CB 4.26Å; K670-V673 HydrophobicContact CD-CG1 4.34Å; T671-V673 PolarHBondContact O-N 2.84Å; V673-V675 PolarHBondContact O-N 2.94Å; V673-C677 VanDerWaalsContact O-CB 3.24Å; V673-C677 WeakPolarHBondContact O-CB 3.02Å; V673-C677 PolarHBondContact O-N 2.84Å; V673-C677 PolarHBondContact O-SG 2.71Å; V673-N764 VanDerWaalsContact CG2-ND2 3.27Å; V673-N764 WeakPolarHBondContact CG2-ND2 3.46Å; V673-D766 HydrophobicContact CG1-CB 3.75Å; V673-D766 HydrophobicContact CG2-CB 4.13Å; V673-V767 HydrophobicContact CB-CG2 4.4Å; V673-V767 HydrophobicContact CG2-CG2 3.52Å
674	N	95.1	Very high	91.8	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-45.9	-178.6	-76.1	-4.3	0	0	0	111.7	W576 R624 G628 K670 T671 V672 L678	W576-N674 WeakPolarHBondContact CH2-ND2 3.47Å; W576-N674 VanDerWaalsContact CZ2-ND2 3.28Å; W576-N674 WeakPolarHBondContact CZ2-ND2 3.32Å; R624-N674 PolarHBondContact O-ND2 3.3Å; G628-N674 WeakPolarHBondContact CA-ND2 3.41Å; G628-N674 PolarHBondContact N-ND2 3.5Å; K670-N674 VanDerWaalsContact O-CG 3.28Å; K670-N674 PolarHBondContact O-N 2.78Å; K670-N674 PolarHBondContact O-OD1 2.84Å; T671-N674 PolarHBondContact O-N 2.83Å; V672-N674 VanDerWaalsContact C-N 3.34Å; V672-N674 PolarHBondContact O-N 2.83Å; N674-L678 WeakPolarHBondContact O-CB 3.5Å; N674-L678 PolarHBondContact O-N 2.98Å
675	V	97.6	Very high	92	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.4	-47	-177.5	171	0	0	0	0	112	T627 L654 Y657 L658 T671 V672 V673 L678 L679	T627-V675 HydrophobicContact CG2-CG2 3.99Å; L654-V675 HydrophobicContact CB-CG1 4.09Å; L654-V675 HydrophobicContact CD2-CB 4.47Å; L654-V675 HydrophobicContact CD2-CG1 4.01Å; L654-V675 HydrophobicContact CD2-CG2 4.04Å; L654-V675 WeakPolarHBondContact O-CG1 3.47Å; Y657-V675 HydrophobicContact CD1-CB 4.29Å; Y657-V675 HydrophobicContact CD1-CG1 4.24Å; Y657-V675 HydrophobicContact CD1-CG2 3.82Å; Y657-V675 HydrophobicContact CE1-CG2 4.19Å; L658-V675 HydrophobicContact CD1-CG1 4.29Å; L658-V675 HydrophobicContact CD2-CB 4.24Å; L658-V675 HydrophobicContact CD2-CG1 3.75Å; L658-V675 HydrophobicContact CG-CG1 3.74Å; T671-V675 WeakPolarHBondContact O-CG2 3.49Å; T671-V675 PolarHBondContact O-N 2.9Å; V672-V675 PolarHBondContact O-N 3.27Å; V673-V675 PolarHBondContact O-N 2.94Å; V675-L678 PolarHBondContact O-N 2.78Å; V675-L679 HydrophobicContact CG1-CD1 3.97Å; V675-L679 WeakPolarHBondContact O-CG 3.34Å; V675-L679 PolarHBondContact O-N 3.02Å
676	V	97.9	Very high	91.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.3	-41.4	178.4	-176.5	0	0	0	0	110.8	L658 V672 L678 L679 R680 Y755 L758 A770 S771	L658-V676 HydrophobicContact CD1-CG2 3.89Å; L658-V676 HydrophobicContact CD2-CG2 3.77Å; V672-V676 HydrophobicContact CG1-CG2 3.98Å; V672-V676 VanDerWaalsContact O-CG2 3.27Å; V672-V676 WeakPolarHBondContact O-CG2 3.37Å; V672-V676 PolarHBondContact O-N 3.4Å; V676-L678 VanDerWaalsContact C-N 3.33Å; V676-L678 PolarHBondContact O-N 3.39Å; V676-L679 PolarHBondContact O-N 3.21Å; V676-R680 WeakPolarHBondContact O-CB 3.36Å; V676-R680 PolarHBondContact O-N 2.87Å; V676-Y755 HydrophobicContact CG1-CE1 4.49Å; V676-L758 HydrophobicContact CG2-CD1 3.61Å; V676-A770 HydrophobicContact CB-CB 4.15Å; V676-A770 HydrophobicContact CG1-CB 3.57Å; V676-S771 WeakPolarHBondContact CG1-OG 3.32Å
677	C	96.9	Very high	91.8	Very high	12 Å²	12	24.7 Å²	24.7	8%	0.081	11%	0.113	C	C	.	.	H	α-helix	trans	-62.3	-38.9	175	-73.5	0	0	0	0	112.4	L631 V673 N681 A770	L631-C677 HydrophobicContact CD1-CB 3.52Å; L631-C677 HydrophobicContact CD2-CB 3.7Å; L631-C677 HydrophobicContact CG-CB 4.28Å; V673-C677 VanDerWaalsContact O-CB 3.24Å; V673-C677 WeakPolarHBondContact O-CB 3.02Å; V673-C677 PolarHBondContact O-N 2.84Å; V673-C677 PolarHBondContact O-SG 2.71Å; C677-N681 PolarHBondContact O-N 2.99Å; C677-N681 VanDerWaalsContact O-N 3.08Å; C677-N681 PolarHBondContact O-OD1 2.91Å; C677-N681 VanDerWaalsContact O-OD1 3.1Å; C677-A770 HydrophobicContact CB-CB 4.49Å; C677-A770 VanDerWaalsContact SG-CB 3.56Å
678	L	98.1	Very high	91.3	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-67.5	-44.7	176.6	175.6	54.4	0	0	0	111	V630 L631 L654 N674 V675 V676 R680 N681 L682	V630-L678 HydrophobicContact CB-CD2 4.12Å; V630-L678 HydrophobicContact CG1-CD1 3.97Å; V630-L678 HydrophobicContact CG1-CD2 3.67Å; L631-L678 HydrophobicContact CB-CB 4.34Å; L654-L678 HydrophobicContact CD1-CD2 3.62Å; L654-L678 HydrophobicContact CD1-CG 3.84Å; L654-L678 HydrophobicContact CD2-CD2 3.98Å; L654-L678 HydrophobicContact CG-CD2 4.47Å; N674-L678 WeakPolarHBondContact O-CB 3.5Å; N674-L678 PolarHBondContact O-N 2.98Å; V675-L678 PolarHBondContact O-N 2.78Å; V676-L678 VanDerWaalsContact C-N 3.33Å; V676-L678 PolarHBondContact O-N 3.39Å; L678-R680 PolarHBondContact O-N 2.95Å; L678-N681 PolarHBondContact O-N 2.9Å; L678-N681 VanDerWaalsContact O-N 3.12Å; L678-L682 HydrophobicContact CD1-CD1 4.15Å; L678-L682 HydrophobicContact CD1-CD2 4.5Å; L678-L682 HydrophobicContact CD1-CG 4.02Å; L678-L682 HydrophobicContact CG-CD1 4.14Å; L678-L682 HydrophobicContact CG-CG 4.45Å; L678-L682 WeakPolarHBondContact O-CG 3.46Å; L678-L682 PolarHBondContact O-N 3.22Å
679	L	98.1	Very high	91.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.8	-40.7	175.3	-73.5	167.1	0	0	0	112.8	L654 V655 L658 V675 V676 N681 L682 S683 L746	L654-L679 HydrophobicContact CB-CD1 4.19Å; L654-L679 HydrophobicContact CB-CD2 3.77Å; L654-L679 HydrophobicContact CB-CG 4Å; L654-L679 HydrophobicContact CD1-CD2 4.2Å; L654-L679 HydrophobicContact CD1-CG 4.42Å; V655-L679 HydrophobicContact CG2-CD1 4.41Å; V655-L679 HydrophobicContact CG2-CD2 4.06Å; L658-L679 HydrophobicContact CD1-CD1 3.45Å; L658-L679 VanDerWaalsContact CD1-CD1 3.45Å; L658-L679 HydrophobicContact CG-CD1 4.22Å; V675-L679 HydrophobicContact CG1-CD1 3.97Å; V675-L679 WeakPolarHBondContact O-CG 3.34Å; V675-L679 PolarHBondContact O-N 3.02Å; V676-L679 PolarHBondContact O-N 3.21Å; L679-N681 VanDerWaalsContact C-N 3.35Å; L679-N681 PolarHBondContact O-N 3.08Å; L679-L682 PolarHBondContact O-N 2.76Å; L679-S683 WeakPolarHBondContact O-CB 3.35Å; L679-S683 PolarHBondContact O-N 2.86Å; L679-S683 PolarHBondContact O-OG 3.49Å; L679-L746 HydrophobicContact CD2-CD2 3.42Å; L679-L746 VanDerWaalsContact CD2-CD2 3.42Å
680	R	97.5	Very high	90.9	Very high	52 Å²	52	24.4 Å²	24.4	20%	0.196	11%	0.108	C	C	.	.	H	α-helix	trans	-56.6	-47.6	170.5	174.7	-167.3	68.4	-162.8	-5.4	111.6	V676 L678 S683 Y684 A774 N777	V676-R680 WeakPolarHBondContact O-CB 3.36Å; V676-R680 PolarHBondContact O-N 2.87Å; L678-R680 PolarHBondContact O-N 2.95Å; R680-S683 WeakPolarHBondContact O-CB 3.46Å; R680-S683 PolarHBondContact O-N 3.04Å; R680-Y684 PolarHBondContact O-N 2.73Å; R680-A774 HydrophobicContact CB-CB 4.12Å; R680-N777 PolarHBondContact O-ND2 2.82Å
681	N	97	Very high	90.9	Very high	19 Å²	19	20.4 Å²	20.4	10%	0.102	9%	0.091	C	C	.	.	H	α-helix	trans	-67.4	-43.3	-178.2	-68.7	7	0	0	0	111.1	L631 S634 T635 R641 C677 L678 L679 S683 Y684	L631-N681 WeakPolarHBondContact CD1-ND2 3.5Å; S634-N681 WeakPolarHBondContact OG-CB 3.3Å; S634-N681 PolarHBondContact OG-ND2 2.91Å; T635-N681 WeakPolarHBondContact CG2-ND2 3.32Å; R641-N681 WeakPolarHBondContact CD-O 3.49Å; C677-N681 PolarHBondContact O-N 2.99Å; C677-N681 VanDerWaalsContact O-N 3.08Å; C677-N681 PolarHBondContact O-OD1 2.91Å; C677-N681 VanDerWaalsContact O-OD1 3.1Å; L678-N681 PolarHBondContact O-N 2.9Å; L678-N681 VanDerWaalsContact O-N 3.12Å; L679-N681 VanDerWaalsContact C-N 3.35Å; L679-N681 PolarHBondContact O-N 3.08Å; N681-S683 PolarHBondContact O-N 3.42Å; N681-Y684 WeakPolarHBondContact O-CB 3.4Å; N681-Y684 PolarHBondContact O-N 2.89Å; N681-Y684 VanDerWaalsContact O-N 3.09Å
682	L	96.6	Very high	90.2	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-61.2	-28	172.4	-67.5	174.4	0	0	0	112.2	L644 R645 L654 L678 L679 L746	L644-L682 HydrophobicContact CB-CD2 3.77Å; L644-L682 HydrophobicContact CD1-CD2 4.48Å; R645-L682 HydrophobicContact CG-CD2 4.15Å; R645-L682 VanDerWaalsContact CZ-O 3.25Å; R645-L682 PolarHBondContact NE-O 2.91Å; R645-L682 PolarHBondContact NH2-O 3.48Å; L654-L682 HydrophobicContact CD1-CD1 3.91Å; L678-L682 HydrophobicContact CD1-CD1 4.15Å; L678-L682 HydrophobicContact CD1-CD2 4.5Å; L678-L682 HydrophobicContact CD1-CG 4.02Å; L678-L682 HydrophobicContact CG-CD1 4.14Å; L678-L682 HydrophobicContact CG-CG 4.45Å; L678-L682 WeakPolarHBondContact O-CG 3.46Å; L678-L682 PolarHBondContact O-N 3.22Å; L679-L682 PolarHBondContact O-N 2.76Å; L682-L746 HydrophobicContact CB-CD1 3.98Å; L682-L746 HydrophobicContact CB-CD2 4.39Å
683	S	95.3	Very high	89.3	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-76.7	-17.2	175.4	-57.1	0	0	0	0	114.3	L679 R680 N681 R685 L686	L679-S683 WeakPolarHBondContact O-CB 3.35Å; L679-S683 PolarHBondContact O-N 2.86Å; L679-S683 PolarHBondContact O-OG 3.49Å; R680-S683 WeakPolarHBondContact O-CB 3.46Å; R680-S683 PolarHBondContact O-N 3.04Å; N681-S683 PolarHBondContact O-N 3.42Å; S683-R685 PolarHBondContact O-N 3.21Å; S683-L686 PolarHBondContact O-N 2.84Å
684	Y	94	Very high	88.6	Confident	109 Å²	109	33.9 Å²	33.9	43%	0.427	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	118.3	-171.7	178.6	-104	0	0	0	113.5	R645 R680 N681 L686	R645-Y684 PolarHBondContact NH2-O 3.32Å; R680-Y684 PolarHBondContact O-N 2.73Å; N681-Y684 WeakPolarHBondContact O-CB 3.4Å; N681-Y684 PolarHBondContact O-N 2.89Å; N681-Y684 VanDerWaalsContact O-N 3.09Å; Y684-L686 PolarHBondContact O-N 3.07Å
685	R	88.1	Confident	87.4	Confident	84 Å²	84	37.8 Å²	37.8	32%	0.317	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	21.2	-176.9	-58	-179.9	68.1	-152.9	6.7	115.2	D638 S683 Q687 E688 L689	D638-R685 IonicContact OD2-CZ 2.68Å; D638-R685 IonicContact OD2-NH1 3.7Å; D638-R685 PolarHBondContact OD2-NH1 3.31Å; S683-R685 PolarHBondContact O-N 3.21Å; R685-Q687 PolarHBondContact O-N 2.95Å; R685-Q687 VanDerWaalsContact O-N 3.15Å; R685-E688 IonicContact CZ-OE2 3.7Å; R685-E688 VanDerWaalsContact CZ-OE2 3.24Å; R685-E688 IonicContact NE-OE2 3.51Å; R685-E688 PolarHBondContact NE-OE2 3.23Å; R685-E688 IonicContact NH2-OE2 3.35Å; R685-E688 PolarHBondContact NH2-OE2 2.93Å; R685-E688 PolarHBondContact O-N 2.89Å; R685-L689 HydrophobicContact CB-CD1 4.1Å
686	L	86.7	Confident	85.8	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-56.7	-37	-173.4	82.9	79.7	0	0	0	112.2	S683 Y684 E688 L689 E690 I743 L746 L778 W783	S683-L686 PolarHBondContact O-N 2.84Å; Y684-L686 PolarHBondContact O-N 3.07Å; L686-E688 VanDerWaalsContact C-N 3.31Å; L686-E688 PolarHBondContact O-N 3.37Å; L686-L689 PolarHBondContact O-N 3.16Å; L686-E690 WeakPolarHBondContact O-CB 3.11Å; L686-E690 WeakPolarHBondContact O-CG 3.06Å; L686-E690 PolarHBondContact O-N 2.93Å; L686-I743 HydrophobicContact CD1-CD1 3.67Å; L686-L746 HydrophobicContact CD2-CD1 4.41Å; L686-L778 HydrophobicContact CD2-CD2 3.73Å; L686-W783 HydrophobicContact CD1-CE3 4.45Å; L686-W783 HydrophobicContact CD1-CH2 3.2Å; L686-W783 HydrophobicContact CD1-CZ2 4.01Å; L686-W783 HydrophobicContact CD1-CZ3 3.45Å; L686-W783 VanDerWaalsContact CD1-CZ3 3.45Å; L686-W783 HydrophobicContact CG-CH2 4.46Å; L686-W783 HydrophobicContact CG-CZ3 4.32Å
687	Q	82.3	Confident	83.8	Confident	5 Å²	5	48.6 Å²	48.6	2%	0.023	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-31.6	178.6	70	-75.1	-10.2	0	0	114.2	R685 Y694 W783	R685-Q687 PolarHBondContact O-N 2.95Å; R685-Q687 VanDerWaalsContact O-N 3.15Å; Q687-Y694 HydrophobicContact CB-CD2 4.17Å; Q687-Y694 HydrophobicContact CB-CE2 4.33Å; Q687-Y694 HydrophobicContact CB-CG 4.42Å; Q687-Y694 HydrophobicContact CG-CD2 4.31Å; Q687-Y694 HydrophobicContact CG-CE1 4.23Å; Q687-Y694 HydrophobicContact CG-CE2 4.01Å; Q687-Y694 WeakPolarHBondContact O-CB 3.47Å; Q687-W783 HydrophobicContact CB-CD2 3.78Å; Q687-W783 HydrophobicContact CB-CE3 3.97Å; Q687-W783 HydrophobicContact CB-CG 4.06Å
688	E	78.9	Confident	81.8	Confident	37 Å²	37	50.1 Å²	50.1	17%	0.173	24%	0.236	C	C	.	.	H	α-helix	trans	-85.6	-16.5	-174.7	-80.3	154.3	-122.7	0	0	113	R685 L686 Y694 R696	R685-E688 IonicContact CZ-OE2 3.7Å; R685-E688 VanDerWaalsContact CZ-OE2 3.24Å; R685-E688 IonicContact NE-OE2 3.51Å; R685-E688 PolarHBondContact NE-OE2 3.23Å; R685-E688 IonicContact NH2-OE2 3.35Å; R685-E688 PolarHBondContact NH2-OE2 2.93Å; R685-E688 PolarHBondContact O-N 2.89Å; L686-E688 VanDerWaalsContact C-N 3.31Å; L686-E688 PolarHBondContact O-N 3.37Å; E688-Y694 HydrophobicContact CG-CD1 4.07Å; E688-Y694 HydrophobicContact CG-CE1 3.64Å; E688-R696 PolarHBondContact O-NH2 3.3Å
689	L	78.4	Confident	79.3	Confident	52 Å²	52	54 Å²	54	27%	0.272	26%	0.257	S	S	.	.	H	α-helix	trans	-116.4	-31.5	-168	-62.5	173.1	0	0	0	112.7	D638 K642 R685 L686	D638-L689 HydrophobicContact CB-CD1 4.44Å; K642-L689 PolarHBondContact NZ-O 2.74Å; R685-L689 HydrophobicContact CB-CD1 4.1Å; L686-L689 PolarHBondContact O-N 3.16Å
690	E	77.9	Confident	76.3	Confident	19 Å²	19	58.8 Å²	58.8	9%	0.089	28%	0.282	C	S	.	.	H	α-helix	trans	-110.8	-16.9	-173.9	-44.7	-43.9	153.1	0	0	115.1	K642 R645 L686 P692 L740 I743	K642-E690 IonicContact NZ-OE2 3.1Å; K642-E690 PolarHBondContact NZ-OE2 3.11Å; R645-E690 WeakPolarHBondContact CD-OE1 3.35Å; R645-E690 IonicContact CZ-OE1 3.8Å; R645-E690 IonicContact NE-OE1 3.22Å; R645-E690 IonicContact NH1-OE1 2.72Å; R645-E690 PolarHBondContact NH1-OE1 2.84Å; L686-E690 WeakPolarHBondContact O-CB 3.11Å; L686-E690 WeakPolarHBondContact O-CG 3.06Å; L686-E690 PolarHBondContact O-N 2.93Å; E690-P692 WeakPolarHBondContact O-CD 3.35Å; E690-L740 HydrophobicContact CB-CD2 4.42Å; E690-L740 VanDerWaalsContact O-CD2 3.28Å; E690-L740 WeakPolarHBondContact O-CD2 3.35Å; E690-I743 HydrophobicContact CB-CD1 3.8Å; E690-I743 HydrophobicContact CG-CD1 4.03Å
691	D	80.7	Confident	73.4	Confident	13 Å²	13	63.4 Å²	63.4	7%	0.07	31%	0.31	C	S	.	.			trans	-106.8	104.7	178.3	-174.8	5.7	0	0	0	112	R693 Y694 R737 L740 W783	D691-R693 PolarHBondContact O-N 2.95Å; D691-R693 WeakPolarHBondContact OD1-CA 3.42Å; D691-R693 WeakPolarHBondContact OD1-CB 3.33Å; D691-R693 PolarHBondContact OD1-N 3.44Å; D691-Y694 WeakPolarHBondContact O-CB 3.45Å; D691-Y694 PolarHBondContact O-N 2.63Å; D691-R737 IonicContact OD1-CZ 3.99Å; D691-R737 IonicContact OD1-NH1 3.35Å; D691-R737 PolarHBondContact OD1-NH1 2.67Å; D691-R737 IonicContact OD1-NH2 3.75Å; D691-R737 IonicContact OD2-CZ 3.5Å; D691-R737 IonicContact OD2-NH1 3.97Å; D691-R737 PolarHBondContact OD2-NH1 3.03Å; D691-R737 VanDerWaalsContact OD2-NH1 3.13Å; D691-R737 IonicContact OD2-NH2 3.44Å; D691-R737 PolarHBondContact OD2-NH2 2.73Å; D691-L740 HydrophobicContact CB-CD2 4.3Å; D691-W783 HydrophobicContact CB-CZ2 4.39Å; D691-W783 PolarHBondContact OD2-NE1 2.82Å
692	P	74.5	Confident	70.5	Confident	118 Å²	118	69.6 Å²	69.6	77%	0.766	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.1	176.1	-21.5	33.7	0	0	0	113.8	E690	E690-P692 WeakPolarHBondContact O-CD 3.35Å
693	R	74.9	Confident	67.4	Low	166 Å²	166	76.7 Å²	76.7	63%	0.626	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	1.3	178.7	-51.5	-169.2	-117	179.1	-9.3	113.3	D691 D695 R737 E739	D691-R693 PolarHBondContact O-N 2.95Å; D691-R693 WeakPolarHBondContact OD1-CA 3.42Å; D691-R693 WeakPolarHBondContact OD1-CB 3.33Å; D691-R693 PolarHBondContact OD1-N 3.44Å; R693-D695 PolarHBondContact O-N 2.89Å; R693-D695 VanDerWaalsContact O-N 3.13Å; R693-R737 VanDerWaalsContact NH2-CD 3.27Å; R693-E739 IonicContact CZ-OE1 2.89Å; R693-E739 VanDerWaalsContact CZ-OE1 3.28Å; R693-E739 IonicContact NE-OE1 3.26Å; R693-E739 PolarHBondContact NE-OE1 2.93Å; R693-E739 VanDerWaalsContact NE-OE1 3.07Å; R693-E739 IonicContact NH2-OE1 2.78Å; R693-E739 PolarHBondContact NH2-OE1 2.83Å; R693-E739 IonicContact NH2-OE2 2.67Å
694	Y	73.9	Confident	64.4	Low	18 Å²	18	87.7 Å²	87.7	7%	0.071	41%	0.406	C	S	.	.			trans	-73.7	102.7	178.1	-179.7	-106.5	0	0	0	111.4	Q687 E688 D691 R696 L699 C781 W783	Q687-Y694 HydrophobicContact CB-CD2 4.17Å; Q687-Y694 HydrophobicContact CB-CE2 4.33Å; Q687-Y694 HydrophobicContact CB-CG 4.42Å; Q687-Y694 HydrophobicContact CG-CD2 4.31Å; Q687-Y694 HydrophobicContact CG-CE1 4.23Å; Q687-Y694 HydrophobicContact CG-CE2 4.01Å; Q687-Y694 WeakPolarHBondContact O-CB 3.47Å; E688-Y694 HydrophobicContact CG-CD1 4.07Å; E688-Y694 HydrophobicContact CG-CE1 3.64Å; D691-Y694 WeakPolarHBondContact O-CB 3.45Å; D691-Y694 PolarHBondContact O-N 2.63Å; Y694-R696 HydrophobicContact CD1-CG 4.02Å; Y694-R696 HydrophobicContact CE1-CG 4.19Å; Y694-R696 PolarHBondContact O-N 3.19Å; Y694-L699 HydrophobicContact CE1-CD1 4.21Å; Y694-C781 HydrophobicContact CE2-CB 4.32Å; Y694-C781 WeakPolarHBondContact OH-CB 3.34Å; Y694-W783 HydrophobicContact CD2-CB 4.26Å; Y694-W783 AromaticContact CD2-CD1 3.85Å; Y694-W783 HydrophobicContact CD2-CG 4.25Å; Y694-W783 HydrophobicContact CE2-CB 4.19Å
695	D	69.4	Low	61.6	Low	87 Å²	87	86.7 Å²	86.7	47%	0.465	42%	0.416	S	S	.	.			trans	-69	100.7	175.4	177.6	24.9	0	0	0	111.6	R693 S697 T698	R693-D695 PolarHBondContact O-N 2.89Å; R693-D695 VanDerWaalsContact O-N 3.13Å; D695-S697 VanDerWaalsContact CG-OG 3.29Å; D695-S697 PolarHBondContact O-N 2.72Å; D695-S697 VanDerWaalsContact O-N 3.14Å; D695-S697 WeakPolarHBondContact OD1-CB 3.39Å; D695-S697 PolarHBondContact OD1-N 3.49Å; D695-S697 PolarHBondContact OD1-OG 3.26Å; D695-S697 WeakPolarHBondContact OD2-CB 3.32Å; D695-S697 PolarHBondContact OD2-OG 3.33Å; D695-T698 HydrophobicContact CB-CG2 4.26Å; D695-T698 WeakPolarHBondContact O-CB 3.28Å; D695-T698 WeakPolarHBondContact O-CG2 3.43Å; D695-T698 PolarHBondContact O-N 3.17Å; D695-T698 VanDerWaalsContact O-N 3.14Å; D695-T698 PolarHBondContact O-OG1 3.16Å
696	R	65.8	Low	59	Low	157 Å²	157	91.7 Å²	91.7	59%	0.592	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-60	-18.4	174.3	-63.3	179.7	178.9	175.9	-1	113	E688 Y694 T698 L699	E688-R696 PolarHBondContact O-NH2 3.3Å; Y694-R696 HydrophobicContact CD1-CG 4.02Å; Y694-R696 HydrophobicContact CE1-CG 4.19Å; Y694-R696 PolarHBondContact O-N 3.19Å; R696-T698 PolarHBondContact O-N 3.11Å; R696-L699 WeakPolarHBondContact O-CB 3.49Å; R696-L699 PolarHBondContact O-N 3.42Å
697	S	55.6	Low	56.5	Low	69 Å²	69	96.9 Å²	96.9	48%	0.483	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-63.6	-26.3	175.3	99.2	0	0	0	0	112.8	D695 L699 N700	D695-S697 VanDerWaalsContact CG-OG 3.29Å; D695-S697 PolarHBondContact O-N 2.72Å; D695-S697 VanDerWaalsContact O-N 3.14Å; D695-S697 WeakPolarHBondContact OD1-CB 3.39Å; D695-S697 PolarHBondContact OD1-N 3.49Å; D695-S697 PolarHBondContact OD1-OG 3.26Å; D695-S697 WeakPolarHBondContact OD2-CB 3.32Å; D695-S697 PolarHBondContact OD2-OG 3.33Å; S697-L699 PolarHBondContact O-N 3.07Å; S697-N700 WeakPolarHBondContact O-CB 3.47Å; S697-N700 PolarHBondContact O-N 2.71Å
698	T	54.3	Low	54	Low	45 Å²	45	100.7 Å²	100.7	28%	0.276	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-63.7	-21.6	178.6	62.1	0	0	0	0	114	D695 R696 N700	D695-T698 HydrophobicContact CB-CG2 4.26Å; D695-T698 WeakPolarHBondContact O-CB 3.28Å; D695-T698 WeakPolarHBondContact O-CG2 3.43Å; D695-T698 PolarHBondContact O-N 3.17Å; D695-T698 VanDerWaalsContact O-N 3.14Å; D695-T698 PolarHBondContact O-OG1 3.16Å; R696-T698 PolarHBondContact O-N 3.11Å; T698-N700 VanDerWaalsContact C-N 3.33Å
699	L	45.8	Very low	51.8	Low	82 Å²	82	105.1 Å²	105.1	43%	0.429	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-67.7	-31.7	172.8	-75	152.3	0	0	0	112.3	Y694 R696 S697 L701 R702	Y694-L699 HydrophobicContact CE1-CD1 4.21Å; R696-L699 WeakPolarHBondContact O-CB 3.49Å; R696-L699 PolarHBondContact O-N 3.42Å; S697-L699 PolarHBondContact O-N 3.07Å; L699-L701 PolarHBondContact O-N 3.06Å; L699-R702 PolarHBondContact O-N 3.15Å
700	N	35.1	Very low	49.5	Very low	99 Å²	99	108.9 Å²	108.9	53%	0.529	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-75.4	0.2	-168.2	-66.4	-19.5	0	0	0	114.7	S697 T698 R702	S697-N700 WeakPolarHBondContact O-CB 3.47Å; S697-N700 PolarHBondContact O-N 2.71Å; T698-N700 VanDerWaalsContact C-N 3.33Å; N700-R702 VanDerWaalsContact C-N 3.26Å; N700-R702 PolarHBondContact O-N 2.84Å
701	L	36.5	Very low	47.3	Very low	149 Å²	149	111.6 Å²	111.6	78%	0.78	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-72.3	-15.4	170.9	-81.3	166.5	0	0	0	113.6	L699	L699-L701 PolarHBondContact O-N 3.06Å
702	R	36	Very low	44.9	Very low	150 Å²	150	116.6 Å²	116.6	57%	0.566	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	-13.8	-172.1	-150.2	171.7	-173.5	167.4	2.7	115.6	L699 N700 S705	L699-R702 PolarHBondContact O-N 3.15Å; N700-R702 VanDerWaalsContact C-N 3.26Å; N700-R702 PolarHBondContact O-N 2.84Å; R702-S705 PolarHBondContact O-OG 3.24Å
703	E	32.3	Very low	43.1	Very low	150 Å²	150	116.1 Å²	116.1	70%	0.701	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-29.8	179.2	-62	-161.3	137.6	0	0	113.5	S705 K706	E703-S705 PolarHBondContact O-N 3.09Å; E703-K706 PolarHBondContact O-N 3.25Å
704	R	31.1	Very low	41.1	Very low	231 Å²	231	118.2 Å²	118.2	87%	0.872	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-3.6	177.9	-84.1	-173.6	164.4	-162.9	-4.6	115.2
705	S	35.3	Very low	39	Very low	89 Å²	89	122.4 Å²	122.4	62%	0.622	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	4.8	-180	39.6	0	0	0	0	114.6	R702 E703	R702-S705 PolarHBondContact O-OG 3.24Å; E703-S705 PolarHBondContact O-N 3.09Å
706	K	34	Very low	37	Very low	188 Å²	188	122.6 Å²	122.6	82%	0.817	70%	0.702	S	S	*	*			trans	-95.8	4.2	-178.6	-74.7	-168.9	172.8	-175.8	0	116.3	E703	E703-K706 PolarHBondContact O-N 3.25Å
707	S	34.2	Very low	35.3	Very low	111 Å²	111	127.4 Å²	127.4	78%	0.776	72%	0.721	S	S	*	*			trans	-104.4	69.4	178.5	62.4	0	0	0	0	112.5
708	A	29.9	Very low	33.9	Very low	85 Å²	85	133.2 Å²	133.2	70%	0.702	74%	0.737	S	S	*	*			trans	-136.3	111.8	171.8	0	0	0	0	0	109.4
709	P	32.1	Very low	32.7	Very low	129 Å²	129	140.1 Å²	140.1	84%	0.838	77%	0.769	S	S	*	*			trans	-73.2	149.3	179.7	30.3	-34.2	0	0	0	111.4	G711	P709-G711 PolarHBondContact O-N 3.36Å; P709-G711 VanDerWaalsContact O-N 3.09Å
710	S	30.5	Very low	31.9	Very low	132 Å²	132	139.7 Å²	139.7	92%	0.923	78%	0.784	S	S	*	*	S	Bend	trans	-70.2	101.3	177.9	53.1	0	0	0	0	111.6
711	G	32.3	Very low	31.6	Very low	76 Å²	76	143.8 Å²	143.8	78%	0.784	81%	0.805	S	S	*	*			trans	-163.5	117.3	175.8	0	0	0	0	0	112.5	P709	P709-G711 PolarHBondContact O-N 3.36Å; P709-G711 VanDerWaalsContact O-N 3.09Å
712	S	30.8	Very low	31.3	Very low	118 Å²	118	148.1 Å²	148.1	83%	0.825	81%	0.811	S	S	*	*			trans	-95	170.2	172.2	64.2	0	0	0	0	110.3
713	P	36.5	Very low	30.9	Very low	107 Å²	107	150.6 Å²	150.6	70%	0.695	83%	0.826	S	S	*	*			cis	-134.2	177	1.5	41.5	-25	0	0	0	115.7
714	K	31.1	Very low	30.7	Very low	211 Å²	211	152.2 Å²	152.2	92%	0.917	83%	0.831	S	S	*	*			trans	29.1	99.7	149.5	-64.1	177.3	-179.1	177.1	0	119.1
715	A	30.5	Very low	30.5	Very low	105 Å²	105	151.7 Å²	151.7	87%	0.868	83%	0.829	S	S	*	*			trans	-149.2	159.6	143.8	0	0	0	0	0	110.6
716	A	27.9	Very low	30.1	Very low	91 Å²	91	153.4 Å²	153.4	75%	0.752	83%	0.831	S	S	*	*			trans	-73	154.6	-177.3	0	0	0	0	0	113
717	W	28.9	Very low	30.1	Very low	259 Å²	259	153.3 Å²	153.3	98%	0.981	83%	0.831	S	S	*	*			trans	-149.5	121.4	134.5	-106.5	21.7	0	0	0	110.1
718	K	27.7	Very low	30	Very low	191 Å²	191	155.8 Å²	155.8	83%	0.83	83%	0.83	S	S	*	*			trans	-81.9	175.7	157.6	-74.5	-179.2	175.7	177.9	0	108.3
719	M	28.5	Very low	30.3	Very low	189 Å²	189	157 Å²	157	93%	0.931	82%	0.821	S	S	*	*			trans	79.2	116.3	-179.6	-48.1	-66.9	-91.6	0	0	113.3
720	G	29.3	Very low	30.5	Very low	74 Å²	74	156.8 Å²	156.8	76%	0.763	81%	0.812	S	S	*	*			trans	155.7	9.3	-178.8	0	0	0	0	0	117.7	R722	G720-R722 PolarHBondContact O-N 3.46Å
721	L	28.3	Very low	31	Very low	185 Å²	185	156.1 Å²	156.1	97%	0.969	79%	0.794	S	S	*	*			trans	-70.4	70.3	179.5	-80.4	167.4	0	0	0	113
722	R	29.6	Very low	31.3	Very low	239 Å²	239	158.3 Å²	158.3	90%	0.902	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-76.8	123.5	158.1	-86.9	-174.6	165	-178.6	-4.3	108.4	G720 K724	G720-R722 PolarHBondContact O-N 3.46Å; R722-K724 PolarHBondContact O-N 3.23Å
723	K	27.6	Very low	32.3	Very low	203 Å²	203	157.8 Å²	157.8	88%	0.883	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-47.1	125.5	-175.1	-64.7	-179.1	176.5	-176.7	0	111.4	R725	K723-R725 PolarHBondContact O-N 3.48Å
724	K	28.5	Very low	33.3	Very low	183 Å²	183	155.3 Å²	155.3	80%	0.796	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-55.6	134.9	152.5	-77	-177.9	175.1	-179.5	0	107.1	R722 D726	R722-K724 PolarHBondContact O-N 3.23Å; K724-D726 PolarHBondContact O-N 3.17Å
725	R	27.8	Very low	34.8	Very low	220 Å²	220	151.9 Å²	151.9	83%	0.83	75%	0.747	S	S	*	*			trans	-78.8	104	159.1	-84.7	-178.1	168.8	169.5	-4.6	106.1	K723 F727	K723-R725 PolarHBondContact O-N 3.48Å; R725-F727 VanDerWaalsContact C-N 3.33Å; R725-F727 HydrophobicContact CB-CD2 4.4Å; R725-F727 HydrophobicContact CB-CE2 4.37Å; R725-F727 PolarHBondContact O-N 3.38Å
726	D	27	Very low	36.6	Very low	126 Å²	126	152.6 Å²	152.6	67%	0.674	73%	0.732	S	S	*	*			trans	-67.9	98.9	166.7	-60.7	-44.4	0	0	0	107.3	K724 H728	K724-D726 PolarHBondContact O-N 3.17Å; D726-H728 VanDerWaalsContact C-N 3.27Å; D726-H728 PolarHBondContact O-N 3.08Å
727	F	33.6	Very low	39	Very low	185 Å²	185	149.8 Å²	149.8	81%	0.811	70%	0.702	S	S	*	*			trans	-67.1	93	166.4	-85.9	-93.5	0	0	0	107.2	R725 E729	R725-F727 VanDerWaalsContact C-N 3.33Å; R725-F727 HydrophobicContact CB-CD2 4.4Å; R725-F727 HydrophobicContact CB-CE2 4.37Å; R725-F727 PolarHBondContact O-N 3.38Å; F727-E729 PolarHBondContact O-N 3.12Å
728	H	31	Very low	41.4	Very low	163 Å²	163	142.5 Å²	142.5	76%	0.755	69%	0.688	S	S	*	*			trans	-57.3	121.5	164.4	-88.6	27.7	0	0	0	108.3	D726 I730	D726-H728 VanDerWaalsContact C-N 3.27Å; D726-H728 PolarHBondContact O-N 3.08Å; H728-I730 PolarHBondContact O-N 3.24Å
729	E	36.7	Very low	44	Very low	111 Å²	111	137.3 Å²	137.3	52%	0.519	67%	0.667	S	S	.	*			trans	-77	74.2	-171.5	-171.2	168.3	-126.3	0	0	110	F727 Q731 Q829	F727-E729 PolarHBondContact O-N 3.12Å; E729-Q731 PolarHBondContact O-N 3.22Å; E729-Q829 PolarHBondContact OE2-NE2 3.45Å; E729-Q829 VanDerWaalsContact OE2-NE2 3.11Å
730	I	36.6	Very low	46.8	Very low	124 Å²	124	128.4 Å²	128.4	64%	0.636	62%	0.623	S	S	*	*			trans	-65.2	103.8	172.6	-54.5	178.3	0	0	0	107.3	H728 M732	H728-I730 PolarHBondContact O-N 3.24Å; I730-M732 HydrophobicContact CG2-CE 3.72Å; I730-M732 HydrophobicContact CG2-CG 4.1Å; I730-M732 PolarHBondContact O-N 3.48Å
731	Q	41	Very low	49.7	Very low	119 Å²	119	132.6 Å²	132.6	56%	0.556	62%	0.616	S	S	*	*			trans	-69	75.7	170.6	-74.3	-170.6	-6.7	0	0	110.1	E729	E729-Q731 PolarHBondContact O-N 3.22Å
732	M	39.3	Very low	52.7	Low	122 Å²	122	125.3 Å²	125.3	60%	0.601	58%	0.578	S	S	*	*			trans	-62.2	126.6	162.5	-78.1	-71.9	151.2	0	0	108.3	I730	I730-M732 HydrophobicContact CG2-CE 3.72Å; I730-M732 HydrophobicContact CG2-CG 4.1Å; I730-M732 PolarHBondContact O-N 3.48Å
733	P	51.4	Low	55.7	Low	106 Å²	106	114.3 Å²	114.3	69%	0.688	54%	0.537	S	S	*	.			trans	-60.3	149.3	173.4	26.8	-33.9	0	0	0	109.7	I735	P733-I735 PolarHBondContact O-N 2.67Å
734	Y	57.6	Low	58.8	Low	55 Å²	55	104.9 Å²	104.9	22%	0.216	50%	0.497	C	S	.	.			trans	-66.7	104.6	173.5	-178.9	-108.5	0	0	0	109.5	E736 R737 F747 P785	Y734-E736 HydrophobicContact CD1-CG 4.17Å; Y734-E736 HydrophobicContact CE1-CB 4.41Å; Y734-E736 HydrophobicContact CE1-CG 4.04Å; Y734-E736 PolarHBondContact O-N 2.82Å; Y734-R737 HydrophobicContact CE2-CG 4.48Å; Y734-F747 AromaticContact CE1-CE2 3.85Å; Y734-F747 HydrophobicContact CE1-CE2 3.85Å; Y734-F747 HydrophobicContact CE2-CE2 4.25Å; Y734-F747 AromaticContact CZ-CE2 3.66Å; Y734-P785 HydrophobicContact CD2-CG 4.1Å; Y734-P785 HydrophobicContact CE2-CG 3.72Å
735	I	62	Low	61.9	Low	140 Å²	140	96.6 Å²	96.6	72%	0.718	46%	0.461	S	S	*	.			trans	-66.1	117.3	165.6	-58.1	174.8	0	0	0	106.2	P733 R737	P733-I735 PolarHBondContact O-N 2.67Å; I735-R737 WeakPolarHBondContact O-CG 3.48Å; I735-R737 PolarHBondContact O-N 2.89Å
736	E	67.4	Low	65.1	Low	120 Å²	120	86.1 Å²	86.1	56%	0.561	42%	0.422	S	S	*	.			trans	-59.6	129.6	176.3	-75.3	-161.4	146.6	0	0	110.1	Y734 K748	Y734-E736 HydrophobicContact CD1-CG 4.17Å; Y734-E736 HydrophobicContact CE1-CB 4.41Å; Y734-E736 HydrophobicContact CE1-CG 4.04Å; Y734-E736 PolarHBondContact O-N 2.82Å; E736-K748 WeakPolarHBondContact OE1-CE 3.35Å; E736-K748 IonicContact OE1-NZ 3.12Å; E736-K748 PolarHBondContact OE1-NZ 3.01Å
737	R	78.4	Confident	68.3	Low	31 Å²	31	80.9 Å²	80.9	12%	0.117	39%	0.393	C	S	.	.			trans	-104.2	118.1	-172.1	-68.2	-157.5	-78.1	157.6	-17.5	109.5	D691 R693 Y734 I735 E739 L740 R741	D691-R737 IonicContact OD1-CZ 3.99Å; D691-R737 IonicContact OD1-NH1 3.35Å; D691-R737 PolarHBondContact OD1-NH1 2.67Å; D691-R737 IonicContact OD1-NH2 3.75Å; D691-R737 IonicContact OD2-CZ 3.5Å; D691-R737 IonicContact OD2-NH1 3.97Å; D691-R737 PolarHBondContact OD2-NH1 3.03Å; D691-R737 VanDerWaalsContact OD2-NH1 3.13Å; D691-R737 IonicContact OD2-NH2 3.44Å; D691-R737 PolarHBondContact OD2-NH2 2.73Å; R693-R737 VanDerWaalsContact NH2-CD 3.27Å; Y734-R737 HydrophobicContact CE2-CG 4.48Å; I735-R737 WeakPolarHBondContact O-CG 3.48Å; I735-R737 PolarHBondContact O-N 2.89Å; R737-E739 WeakPolarHBondContact CB-OE2 3.44Å; R737-E739 IonicContact NH1-OE1 3.71Å; R737-E739 PolarHBondContact NH1-OE1 3.16Å; R737-E739 PolarHBondContact O-N 2.88Å; R737-E739 VanDerWaalsContact O-N 3.15Å; R737-L740 HydrophobicContact CB-CB 4.36Å; R737-L740 HydrophobicContact CB-CD1 4.45Å; R737-L740 HydrophobicContact CB-CG 4.18Å; R737-L740 VanDerWaalsContact CZ-CD1 3.47Å; R737-L740 PolarHBondContact O-N 2.92Å; R737-R741 PolarHBondContact O-N 2.81Å
738	P	81.1	Confident	71.1	Confident	107 Å²	107	75.7 Å²	75.7	70%	0.695	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-54.2	-34.9	-179.1	-27.9	35.7	0	0	0	113	L740 R741	P738-L740 PolarHBondContact O-N 2.67Å; P738-R741 PolarHBondContact O-N 2.9Å
739	E	81.9	Confident	74.1	Confident	82 Å²	82	71.7 Å²	71.7	38%	0.383	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-68.7	-15.6	178.2	73.7	-87.8	-157.3	0	0	114.3	R693 R737	R693-E739 IonicContact CZ-OE1 2.89Å; R693-E739 VanDerWaalsContact CZ-OE1 3.28Å; R693-E739 IonicContact NE-OE1 3.26Å; R693-E739 PolarHBondContact NE-OE1 2.93Å; R693-E739 VanDerWaalsContact NE-OE1 3.07Å; R693-E739 IonicContact NH2-OE1 2.78Å; R693-E739 PolarHBondContact NH2-OE1 2.83Å; R693-E739 IonicContact NH2-OE2 2.67Å; R737-E739 WeakPolarHBondContact CB-OE2 3.44Å; R737-E739 IonicContact NH1-OE1 3.71Å; R737-E739 PolarHBondContact NH1-OE1 3.16Å; R737-E739 PolarHBondContact O-N 2.88Å; R737-E739 VanDerWaalsContact O-N 3.15Å
740	L	86.6	Confident	76.8	Confident	2 Å²	2	71 Å²	71	1%	0.01	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-112.1	7.5	178.9	-54	-171.1	0	0	0	113.5	E690 D691 R737 P738 N742 I743 A744 F747 W783	E690-L740 HydrophobicContact CB-CD2 4.42Å; E690-L740 VanDerWaalsContact O-CD2 3.28Å; E690-L740 WeakPolarHBondContact O-CD2 3.35Å; D691-L740 HydrophobicContact CB-CD2 4.3Å; R737-L740 HydrophobicContact CB-CB 4.36Å; R737-L740 HydrophobicContact CB-CD1 4.45Å; R737-L740 HydrophobicContact CB-CG 4.18Å; R737-L740 VanDerWaalsContact CZ-CD1 3.47Å; R737-L740 PolarHBondContact O-N 2.92Å; P738-L740 PolarHBondContact O-N 2.67Å; L740-N742 VanDerWaalsContact C-N 3.32Å; L740-N742 PolarHBondContact O-N 3.21Å; L740-I743 HydrophobicContact CB-CD1 4.41Å; L740-I743 HydrophobicContact CB-CG1 4.06Å; L740-I743 HydrophobicContact CD2-CD1 4.16Å; L740-I743 VanDerWaalsContact O-CG1 3.23Å; L740-I743 WeakPolarHBondContact O-CG1 3.35Å; L740-I743 PolarHBondContact O-N 2.89Å; L740-A744 PolarHBondContact O-N 3.44Å; L740-F747 HydrophobicContact CB-CZ 4.39Å; L740-F747 HydrophobicContact CD1-CZ 4.22Å; L740-W783 HydrophobicContact CD1-CH2 4.38Å; L740-W783 HydrophobicContact CD1-CZ2 3.74Å
741	R	89.6	Confident	79.6	Confident	161 Å²	161	65.3 Å²	65.3	61%	0.608	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-44.1	-168.2	78.7	-169.6	-164.5	-174.9	10.7	113.3	D648 R737 P738 I743 A744	D648-R741 IonicContact OD2-CZ 2.7Å; D648-R741 IonicContact OD2-NE 3.48Å; D648-R741 IonicContact OD2-NH2 2.75Å; D648-R741 PolarHBondContact OD2-NH2 3.07Å; R737-R741 PolarHBondContact O-N 2.81Å; P738-R741 PolarHBondContact O-N 2.9Å; R741-I743 VanDerWaalsContact C-N 3.3Å; R741-I743 PolarHBondContact O-N 2.81Å; R741-A744 PolarHBondContact O-N 3.44Å
742	N	91.3	Very high	82.2	Confident	32 Å²	32	59.7 Å²	59.7	17%	0.171	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-29.8	-176.5	-62.4	19.5	0	0	0	112.3	R645 D646 A651 L740	R645-N742 WeakPolarHBondContact O-CB 3.24Å; R645-N742 PolarHBondContact O-ND2 2.79Å; D646-N742 PolarHBondContact O-ND2 3.08Å; A651-N742 VanDerWaalsContact CB-O 3.32Å; A651-N742 WeakPolarHBondContact CB-O 3.1Å; L740-N742 VanDerWaalsContact C-N 3.32Å; L740-N742 PolarHBondContact O-N 3.21Å
743	I	92.7	Very high	84.9	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.041	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-9.1	-178.9	63.9	163.2	0	0	0	113.7	R645 L686 E690 L740 R741 P745 L746 F747	R645-I743 HydrophobicContact CB-CG2 3.55Å; R645-I743 HydrophobicContact CG-CG2 3.72Å; L686-I743 HydrophobicContact CD1-CD1 3.67Å; E690-I743 HydrophobicContact CB-CD1 3.8Å; E690-I743 HydrophobicContact CG-CD1 4.03Å; L740-I743 HydrophobicContact CB-CD1 4.41Å; L740-I743 HydrophobicContact CB-CG1 4.06Å; L740-I743 HydrophobicContact CD2-CD1 4.16Å; L740-I743 VanDerWaalsContact O-CG1 3.23Å; L740-I743 WeakPolarHBondContact O-CG1 3.35Å; L740-I743 PolarHBondContact O-N 2.89Å; R741-I743 VanDerWaalsContact C-N 3.3Å; R741-I743 PolarHBondContact O-N 2.81Å; I743-P745 VanDerWaalsContact C-N 3.27Å; I743-L746 HydrophobicContact CB-CD1 4.17Å; I743-L746 HydrophobicContact CG2-CD1 4.41Å; I743-L746 VanDerWaalsContact O-CB 3.29Å; I743-L746 WeakPolarHBondContact O-CB 3.02Å; I743-L746 WeakPolarHBondContact O-CG 3.45Å; I743-L746 PolarHBondContact O-N 2.9Å; I743-F747 HydrophobicContact CD1-CE1 4.08Å; I743-F747 HydrophobicContact CG1-CE1 4.01Å; I743-F747 WeakPolarHBondContact O-CE1 3.3Å
744	A	92.7	Very high	87.1	Confident	6 Å²	6	55.8 Å²	55.8	5%	0.05	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-51.1	-38.6	178.1	0	0	0	0	0	113.8	L740 R741 L746 F747 K748	L740-A744 PolarHBondContact O-N 3.44Å; R741-A744 PolarHBondContact O-N 3.44Å; A744-L746 PolarHBondContact O-N 2.82Å; A744-L746 VanDerWaalsContact O-N 3.12Å; A744-F747 HydrophobicContact CB-CE2 4.32Å; A744-F747 HydrophobicContact CB-CZ 4.21Å; A744-F747 PolarHBondContact O-N 2.88Å; A744-F747 VanDerWaalsContact O-N 3.13Å; A744-K748 PolarHBondContact O-N 2.75Å
745	P	94.8	Very high	89	Confident	8 Å²	8	53.2 Å²	53.2	5%	0.052	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-57.2	-24.5	174.5	-26	35.9	0	0	0	114.7	A651 Q652 V655 I743 F747 T751	A651-P745 HydrophobicContact CB-CB 4.33Å; A651-P745 HydrophobicContact CB-CG 4.46Å; Q652-P745 HydrophobicContact CB-CB 4.44Å; Q652-P745 HydrophobicContact CB-CG 3.86Å; V655-P745 HydrophobicContact CG2-CB 4.23Å; I743-P745 VanDerWaalsContact C-N 3.27Å; P745-F747 PolarHBondContact O-N 2.71Å; P745-T751 WeakPolarHBondContact O-CB 3.29Å; P745-T751 WeakPolarHBondContact O-CG2 3.46Å; P745-T751 PolarHBondContact O-OG1 3.48Å
746	L	95	Very high	90.6	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-69.1	-21.7	179.6	-57.2	-179.5	0	0	0	113	A651 L679 L682 L686 I743 A744 L778	A651-L746 HydrophobicContact CB-CD2 3.91Å; A651-L746 HydrophobicContact CB-CG 4.15Å; L679-L746 HydrophobicContact CD2-CD2 3.42Å; L679-L746 VanDerWaalsContact CD2-CD2 3.42Å; L682-L746 HydrophobicContact CB-CD1 3.98Å; L682-L746 HydrophobicContact CB-CD2 4.39Å; L686-L746 HydrophobicContact CD2-CD1 4.41Å; I743-L746 HydrophobicContact CB-CD1 4.17Å; I743-L746 HydrophobicContact CG2-CD1 4.41Å; I743-L746 VanDerWaalsContact O-CB 3.29Å; I743-L746 WeakPolarHBondContact O-CB 3.02Å; I743-L746 WeakPolarHBondContact O-CG 3.45Å; I743-L746 PolarHBondContact O-N 2.9Å; A744-L746 PolarHBondContact O-N 2.82Å; A744-L746 VanDerWaalsContact O-N 3.12Å; L746-L778 WeakPolarHBondContact O-CD1 3.49Å
747	F	93.5	Very high	92	Very high	15 Å²	15	41.3 Å²	41.3	7%	0.066	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-130.6	18.6	-172.9	55.4	-106.5	0	0	0	114.7	Y734 L740 I743 A744 P745 L778 W783 P785 V789	Y734-F747 AromaticContact CE1-CE2 3.85Å; Y734-F747 HydrophobicContact CE1-CE2 3.85Å; Y734-F747 HydrophobicContact CE2-CE2 4.25Å; Y734-F747 AromaticContact CZ-CE2 3.66Å; L740-F747 HydrophobicContact CB-CZ 4.39Å; L740-F747 HydrophobicContact CD1-CZ 4.22Å; I743-F747 HydrophobicContact CD1-CE1 4.08Å; I743-F747 HydrophobicContact CG1-CE1 4.01Å; I743-F747 WeakPolarHBondContact O-CE1 3.3Å; A744-F747 HydrophobicContact CB-CE2 4.32Å; A744-F747 HydrophobicContact CB-CZ 4.21Å; A744-F747 PolarHBondContact O-N 2.88Å; A744-F747 VanDerWaalsContact O-N 3.13Å; P745-F747 PolarHBondContact O-N 2.71Å; F747-L778 HydrophobicContact CB-CD2 4.22Å; F747-W783 AromaticContact CD1-CH2 3.98Å; F747-W783 HydrophobicContact CD1-CH2 3.98Å; F747-W783 HydrophobicContact CD1-CZ3 4.23Å; F747-W783 AromaticContact CE1-CH2 3.67Å; F747-W783 HydrophobicContact CE1-CH2 3.67Å; F747-W783 HydrophobicContact CE1-CZ3 4.37Å; F747-W783 HydrophobicContact CZ-CH2 4.13Å; F747-P785 HydrophobicContact CB-CB 4.13Å; F747-P785 HydrophobicContact CD1-CB 4.38Å; F747-P785 HydrophobicContact CD2-CB 3.57Å; F747-P785 HydrophobicContact CD2-CG 3.95Å; F747-P785 HydrophobicContact CE2-CB 3.96Å; F747-P785 HydrophobicContact CE2-CG 3.78Å; F747-P785 HydrophobicContact CG-CB 3.79Å; F747-P785 HydrophobicContact CG-CG 4.45Å; F747-P785 HydrophobicContact CZ-CB 4.5Å; F747-P785 HydrophobicContact CZ-CG 4.15Å; F747-V789 HydrophobicContact CB-CG2 4.04Å
748	K	93.4	Very high	92.9	Very high	76 Å²	76	40.3 Å²	40.3	33%	0.33	20%	0.197	S	C	.	.	S	Bend	trans	-73.8	153.1	167.9	-75.5	-175.8	178.9	-166.7	0	111.1	E736 A744 D750 T751 V752	E736-K748 WeakPolarHBondContact OE1-CE 3.35Å; E736-K748 IonicContact OE1-NZ 3.12Å; E736-K748 PolarHBondContact OE1-NZ 3.01Å; A744-K748 PolarHBondContact O-N 2.75Å; K748-D750 VanDerWaalsContact C-N 3.27Å; K748-D750 PolarHBondContact O-N 2.86Å; K748-T751 WeakPolarHBondContact O-CB 3.43Å; K748-T751 PolarHBondContact O-N 3.32Å; K748-V752 PolarHBondContact O-N 3.07Å
749	T	92.9	Very high	93.6	Very high	80 Å²	80	35.6 Å²	35.6	49%	0.491	17%	0.166	S	C	.	.	H	α-helix	trans	-57.8	-40.2	-178.5	-51.2	0	0	0	0	111.8	T751 V752 R753 A792	T749-T751 VanDerWaalsContact C-N 3.29Å; T749-T751 PolarHBondContact O-N 3.04Å; T749-V752 WeakPolarHBondContact O-CA 3.42Å; T749-V752 WeakPolarHBondContact O-CB 3.46Å; T749-V752 PolarHBondContact O-N 2.94Å; T749-R753 PolarHBondContact O-N 3.07Å; T749-A792 HydrophobicContact CG2-CB 4.17Å
750	D	93	Very high	94.2	Very high	97 Å²	97	36.8 Å²	36.8	52%	0.519	17%	0.172	S	C	.	.	H	α-helix	trans	-64	-36.5	-178.9	-45.2	-68.6	0	0	0	111.5	K748 V752 R753 L754	K748-D750 VanDerWaalsContact C-N 3.27Å; K748-D750 PolarHBondContact O-N 2.86Å; D750-V752 VanDerWaalsContact C-N 3.34Å; D750-V752 PolarHBondContact O-N 3.2Å; D750-R753 CarbonylContact O-C 3.4Å; D750-R753 WeakPolarHBondContact O-CB 3.46Å; D750-R753 PolarHBondContact O-N 3.1Å; D750-L754 WeakPolarHBondContact O-CG 3.42Å; D750-L754 PolarHBondContact O-N 3.36Å
751	T	95.9	Very high	94.5	Very high	4 Å²	4	40.5 Å²	40.5	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-66.4	-34.8	173.3	-43.5	0	0	0	0	112	V655 P745 K748 T749 L754 Y755	V655-T751 HydrophobicContact CG1-CG2 4.27Å; V655-T751 HydrophobicContact CG2-CG2 3.74Å; P745-T751 WeakPolarHBondContact O-CB 3.29Å; P745-T751 WeakPolarHBondContact O-CG2 3.46Å; P745-T751 PolarHBondContact O-OG1 3.48Å; K748-T751 WeakPolarHBondContact O-CB 3.43Å; K748-T751 PolarHBondContact O-N 3.32Å; T749-T751 VanDerWaalsContact C-N 3.29Å; T749-T751 PolarHBondContact O-N 3.04Å; T751-L754 PolarHBondContact O-N 3.47Å; T751-Y755 HydrophobicContact CG2-CD2 4.47Å; T751-Y755 HydrophobicContact CG2-CE2 3.77Å; T751-Y755 WeakPolarHBondContact O-CD2 3.22Å; T751-Y755 PolarHBondContact O-N 2.77Å
752	V	96.2	Very high	94.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-68.1	-36.9	172.3	-179.8	0	0	0	0	111.3	K748 T749 D750 T756 V789 A792 V793	K748-V752 PolarHBondContact O-N 3.07Å; T749-V752 WeakPolarHBondContact O-CA 3.42Å; T749-V752 WeakPolarHBondContact O-CB 3.46Å; T749-V752 PolarHBondContact O-N 2.94Å; D750-V752 VanDerWaalsContact C-N 3.34Å; D750-V752 PolarHBondContact O-N 3.2Å; V752-T756 WeakPolarHBondContact O-CB 3.34Å; V752-T756 PolarHBondContact O-N 2.77Å; V752-T756 PolarHBondContact O-OG1 3.29Å; V752-V789 HydrophobicContact CG2-CB 4.37Å; V752-V789 HydrophobicContact CG2-CG1 3.86Å; V752-V789 HydrophobicContact CG2-CG2 4.01Å; V752-A792 HydrophobicContact CB-CB 4.11Å; V752-A792 HydrophobicContact CG1-CB 3.89Å; V752-A792 HydrophobicContact CG2-CB 4.2Å; V752-V793 HydrophobicContact CG1-CB 4.46Å; V752-V793 HydrophobicContact CG1-CG2 3.49Å; V752-V793 VanDerWaalsContact CG1-CG2 3.49Å
753	R	96.4	Very high	94.6	Very high	139 Å²	139	37.4 Å²	37.4	53%	0.525	19%	0.193	S	C	.	.	H	α-helix	trans	-65.2	-39.7	172.6	-178.9	175.3	172.2	-150.7	-3.1	111.7	T749 D750 T756 A757 E796	T749-R753 PolarHBondContact O-N 3.07Å; D750-R753 CarbonylContact O-C 3.4Å; D750-R753 WeakPolarHBondContact O-CB 3.46Å; D750-R753 PolarHBondContact O-N 3.1Å; R753-T756 WeakPolarHBondContact O-CB 3.46Å; R753-T756 PolarHBondContact O-N 3.16Å; R753-A757 WeakPolarHBondContact O-CB 3.35Å; R753-A757 PolarHBondContact O-N 2.87Å; R753-E796 HydrophobicContact CB-CG 4.26Å; R753-E796 WeakPolarHBondContact CD-OE2 3.34Å; R753-E796 WeakPolarHBondContact CG-OE2 3.3Å
754	L	97.4	Very high	94.2	Very high	7 Å²	7	38.8 Å²	38.8	4%	0.037	20%	0.2	C	C	.	.	H	α-helix	trans	-63.8	-46	173.7	-72.1	170.1	0	0	0	112.6	V655 L658 Q659 F662 D750 T751 T756 A757 L758	V655-L754 HydrophobicContact CG1-CD1 4.1Å; L658-L754 HydrophobicContact CB-CD1 4.18Å; Q659-L754 HydrophobicContact CB-CD1 4.24Å; F662-L754 HydrophobicContact CB-CD2 3.69Å; F662-L754 HydrophobicContact CD1-CD2 4.44Å; F662-L754 HydrophobicContact CG-CD2 3.98Å; D750-L754 WeakPolarHBondContact O-CG 3.42Å; D750-L754 PolarHBondContact O-N 3.36Å; T751-L754 PolarHBondContact O-N 3.47Å; L754-T756 VanDerWaalsContact C-N 3.28Å; L754-T756 PolarHBondContact O-N 3.01Å; L754-A757 PolarHBondContact O-N 3.47Å; L754-L758 WeakPolarHBondContact O-CG 3.2Å; L754-L758 PolarHBondContact O-N 2.87Å
755	Y	97.9	Very high	93.9	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	21%	0.212	C	C	.	.	H	α-helix	trans	-60.7	-38.7	172.1	-61.9	-48	0	0	0	111.8	V676 T751 L758 L759 A774 V775 L778	V676-Y755 HydrophobicContact CG1-CE1 4.49Å; T751-Y755 HydrophobicContact CG2-CD2 4.47Å; T751-Y755 HydrophobicContact CG2-CE2 3.77Å; T751-Y755 WeakPolarHBondContact O-CD2 3.22Å; T751-Y755 PolarHBondContact O-N 2.77Å; Y755-L758 PolarHBondContact O-N 3.48Å; Y755-L759 WeakPolarHBondContact O-CB 3.29Å; Y755-L759 WeakPolarHBondContact O-CD1 3.42Å; Y755-L759 WeakPolarHBondContact O-CG 3.2Å; Y755-L759 PolarHBondContact O-N 3.4Å; Y755-A774 HydrophobicContact CD1-CB 4.19Å; Y755-A774 HydrophobicContact CD2-CB 4.4Å; Y755-A774 HydrophobicContact CE1-CB 3.7Å; Y755-A774 HydrophobicContact CE2-CB 3.94Å; Y755-V775 HydrophobicContact CD2-CG2 4Å; Y755-V775 HydrophobicContact CG-CG2 4.27Å; Y755-L778 HydrophobicContact CE2-CD1 3.88Å
756	T	95.8	Very high	93.7	Very high	4 Å²	4	42.6 Å²	42.6	3%	0.025	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-43.9	177	-59.2	0	0	0	0	111.5	V752 R753 L754 L759 Q760 E796 A798	V752-T756 WeakPolarHBondContact O-CB 3.34Å; V752-T756 PolarHBondContact O-N 2.77Å; V752-T756 PolarHBondContact O-OG1 3.29Å; R753-T756 WeakPolarHBondContact O-CB 3.46Å; R753-T756 PolarHBondContact O-N 3.16Å; L754-T756 VanDerWaalsContact C-N 3.28Å; L754-T756 PolarHBondContact O-N 3.01Å; T756-L759 PolarHBondContact O-N 2.88Å; T756-Q760 VanDerWaalsContact O-CG 3.27Å; T756-Q760 WeakPolarHBondContact O-CG 3.14Å; T756-Q760 PolarHBondContact O-N 2.78Å; T756-Q760 VanDerWaalsContact O-N 3.11Å; T756-E796 HydrophobicContact CG2-CB 4.25Å; T756-A798 HydrophobicContact CG2-CB 3.61Å
757	A	95.9	Very high	93.7	Very high	7 Å²	7	42.6 Å²	42.6	6%	0.058	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-43.5	176.9	0	0	0	0	0	112.3	F662 R753 L754 L759 Q760 N761	F662-A757 HydrophobicContact CD2-CB 3.52Å; F662-A757 HydrophobicContact CE2-CB 3.45Å; F662-A757 VanDerWaalsContact CE2-CB 3.45Å; R753-A757 WeakPolarHBondContact O-CB 3.35Å; R753-A757 PolarHBondContact O-N 2.87Å; L754-A757 PolarHBondContact O-N 3.47Å; A757-L759 PolarHBondContact O-N 3.31Å; A757-Q760 PolarHBondContact O-N 2.81Å; A757-Q760 VanDerWaalsContact O-N 3.1Å; A757-N761 PolarHBondContact O-N 2.69Å; A757-N761 PolarHBondContact O-ND2 3.01Å
758	L	97	Very high	93.8	Very high	10 Å²	10	42.6 Å²	42.6	5%	0.052	22%	0.222	C	C	.	.	H	α-helix	trans	-60.7	-44.8	174.7	-70	164.6	0	0	0	111.1	L658 F667 V672 V676 L754 Y755 Q760 N761 S762 V767	L658-L758 HydrophobicContact CD1-CD1 4.22Å; F667-L758 HydrophobicContact CB-CD2 4.34Å; F667-L758 HydrophobicContact CD1-CD2 4.18Å; V672-L758 HydrophobicContact CG1-CD2 3.91Å; V676-L758 HydrophobicContact CG2-CD1 3.61Å; L754-L758 WeakPolarHBondContact O-CG 3.2Å; L754-L758 PolarHBondContact O-N 2.87Å; Y755-L758 PolarHBondContact O-N 3.48Å; L758-Q760 PolarHBondContact O-N 2.84Å; L758-Q760 VanDerWaalsContact O-N 3.16Å; L758-N761 PolarHBondContact O-N 2.83Å; L758-S762 WeakPolarHBondContact O-CB 3.28Å; L758-S762 PolarHBondContact O-N 3.24Å; L758-V767 HydrophobicContact CB-CG1 4.1Å; L758-V767 HydrophobicContact CD2-CG1 3.9Å; L758-V767 HydrophobicContact CG-CG1 4.41Å
759	L	96.6	Very high	93.9	Very high	8 Å²	8	41.4 Å²	41.4	4%	0.042	22%	0.218	C	C	.	.	H	α-helix	trans	-64.4	-15.5	175.8	-67.6	163.4	0	0	0	114.1	Y755 T756 A757 L768 A772 V801 F802 L805	Y755-L759 WeakPolarHBondContact O-CB 3.29Å; Y755-L759 WeakPolarHBondContact O-CD1 3.42Å; Y755-L759 WeakPolarHBondContact O-CG 3.2Å; Y755-L759 PolarHBondContact O-N 3.4Å; T756-L759 PolarHBondContact O-N 2.88Å; A757-L759 PolarHBondContact O-N 3.31Å; L759-L768 HydrophobicContact CD2-CD2 4.44Å; L759-A772 HydrophobicContact CD2-CB 4Å; L759-V801 HydrophobicContact CB-CG1 3.87Å; L759-V801 WeakPolarHBondContact O-CG1 3.29Å; L759-F802 HydrophobicContact CD1-CE1 4.05Å; L759-F802 HydrophobicContact CD1-CE2 3.84Å; L759-F802 HydrophobicContact CD1-CZ 3.46Å; L759-F802 VanDerWaalsContact CD1-CZ 3.46Å; L759-L805 HydrophobicContact CB-CD1 4.27Å; L759-L805 HydrophobicContact CD2-CD1 3.4Å; L759-L805 VanDerWaalsContact CD2-CD1 3.4Å; L759-L805 HydrophobicContact CG-CD1 4.36Å
760	Q	94.5	Very high	94.1	Very high	106 Å²	106	37.6 Å²	37.6	50%	0.495	19%	0.194	S	C	.	.	H	α-helix	trans	-100.3	-29.1	179	-76	171.4	-19.9	0	0	114.3	T756 A757 L758 V801	T756-Q760 VanDerWaalsContact O-CG 3.27Å; T756-Q760 WeakPolarHBondContact O-CG 3.14Å; T756-Q760 PolarHBondContact O-N 2.78Å; T756-Q760 VanDerWaalsContact O-N 3.11Å; A757-Q760 PolarHBondContact O-N 2.81Å; A757-Q760 VanDerWaalsContact O-N 3.1Å; L758-Q760 PolarHBondContact O-N 2.84Å; L758-Q760 VanDerWaalsContact O-N 3.16Å; Q760-V801 HydrophobicContact CG-CB 4.46Å; Q760-V801 HydrophobicContact CG-CG1 3.92Å; Q760-V801 HydrophobicContact CG-CG2 3.65Å
761	N	92.9	Very high	94.3	Very high	81 Å²	81	33 Å²	33	43%	0.433	17%	0.17	S	C	.	.	H	α-helix	trans	-121.2	-15.1	-168.3	-59.6	-93.5	0	0	0	114.1	F667 A757 L758	F667-N761 HydrophobicContact CD1-CB 4.27Å; F667-N761 HydrophobicContact CD2-CB 3.52Å; F667-N761 HydrophobicContact CE1-CB 4.26Å; F667-N761 HydrophobicContact CE2-CB 3.52Å; F667-N761 HydrophobicContact CG-CB 3.91Å; F667-N761 HydrophobicContact CZ-CB 3.89Å; A757-N761 PolarHBondContact O-N 2.69Å; A757-N761 PolarHBondContact O-ND2 3.01Å; L758-N761 PolarHBondContact O-N 2.83Å
762	S	93	Very high	94.4	Very high	11 Å²	11	32.8 Å²	32.8	8%	0.077	17%	0.168	C	C	.	.			trans	-78.4	134.9	178.2	175.4	0	0	0	0	111.5	D668 L758 N764 V767	D668-S762 VanDerWaalsContact OD1-CA 3.29Å; D668-S762 WeakPolarHBondContact OD1-CA 3.49Å; D668-S762 VanDerWaalsContact OD1-CB 3.31Å; D668-S762 WeakPolarHBondContact OD1-CB 3.23Å; D668-S762 PolarHBondContact OD1-OG 2.84Å; L758-S762 WeakPolarHBondContact O-CB 3.28Å; L758-S762 PolarHBondContact O-N 3.24Å; S762-N764 PolarHBondContact OG-N 2.87Å; S762-V767 VanDerWaalsContact OG-CB 3.31Å; S762-V767 WeakPolarHBondContact OG-CB 3.45Å; S762-V767 WeakPolarHBondContact OG-CG1 3.46Å
763	T	89.2	Confident	94.4	Very high	117 Å²	117	33 Å²	33	72%	0.718	17%	0.171	S	C	*	.			trans	-92.1	-17.9	168.2	67.4	0	0	0	0	112.4	D668 P765	D668-T763 PolarHBondContact OD1-N 2.85Å; D668-T763 WeakPolarHBondContact OD2-CB 3.32Å; D668-T763 PolarHBondContact OD2-N 3.37Å; D668-T763 PolarHBondContact OD2-OG1 3.05Å; T763-P765 WeakPolarHBondContact O-CD 3.26Å
764	N	83.8	Confident	94.5	Very high	36 Å²	36	26.4 Å²	26.4	19%	0.193	15%	0.146	C	C	.	.			trans	-76.9	116.1	-173.3	-173	-27.5	0	0	0	112.7	D668 V673 S762 D766 V767 L768	D668-N764 HydrophobicContact CB-CB 4.03Å; D668-N764 PolarHBondContact O-ND2 2.92Å; D668-N764 WeakPolarHBondContact OD1-CB 3.4Å; D668-N764 PolarHBondContact OD1-N 3.49Å; V673-N764 VanDerWaalsContact CG2-ND2 3.27Å; V673-N764 WeakPolarHBondContact CG2-ND2 3.46Å; S762-N764 PolarHBondContact OG-N 2.87Å; N764-D766 PolarHBondContact O-N 2.79Å; N764-D766 VanDerWaalsContact O-N 3.12Å; N764-D766 WeakPolarHBondContact OD1-CB 3.42Å; N764-D766 PolarHBondContact OD1-N 2.89Å; N764-V767 HydrophobicContact CB-CB 4.31Å; N764-V767 HydrophobicContact CB-CG2 3.92Å; N764-V767 PolarHBondContact O-N 3.36Å; N764-L768 PolarHBondContact O-N 3.49Å; N764-L768 VanDerWaalsContact O-N 3.15Å
765	P	87.9	Confident	94.5	Very high	46 Å²	46	26.1 Å²	26.1	30%	0.299	14%	0.144	S	C	.	.	H	α-helix	trans	-64.4	-19.7	-177.3	-22.9	34.7	0	0	0	115.3	T763 E769 T810 K812 V813	T763-P765 WeakPolarHBondContact O-CD 3.26Å; P765-E769 WeakPolarHBondContact O-CB 3.08Å; P765-E769 PolarHBondContact O-N 3.21Å; P765-E769 VanDerWaalsContact O-N 3.16Å; P765-T810 HydrophobicContact CB-CG2 3.98Å; P765-K812 VanDerWaalsContact O-CE 3.24Å; P765-K812 WeakPolarHBondContact O-CE 3.48Å; P765-V813 HydrophobicContact CB-CG2 4.11Å; P765-V813 WeakPolarHBondContact O-CG2 3.29Å
766	D	89.2	Confident	94.3	Very high	49 Å²	49	28.1 Å²	28.1	26%	0.262	15%	0.154	S	C	.	.	H	α-helix	trans	-69.3	-42.7	171.2	-75	-15.4	0	0	0	111.2	K670 V673 N764 A770 K812	K670-D766 IonicContact NZ-OD2 2.69Å; V673-D766 HydrophobicContact CG1-CB 3.75Å; V673-D766 HydrophobicContact CG2-CB 4.13Å; N764-D766 PolarHBondContact O-N 2.79Å; N764-D766 VanDerWaalsContact O-N 3.12Å; N764-D766 WeakPolarHBondContact OD1-CB 3.42Å; N764-D766 PolarHBondContact OD1-N 2.89Å; D766-A770 WeakPolarHBondContact O-CB 3.3Å; D766-A770 PolarHBondContact O-N 3.34Å; D766-K812 IonicContact OD1-NZ 2.83Å; D766-K812 PolarHBondContact OD1-NZ 3.3Å
767	V	94.6	Very high	94.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-69.1	-41.7	-179.3	177.5	0	0	0	0	110.8	V672 V673 L758 S762 N764 A770 S771	V672-V767 HydrophobicContact CG1-CG1 4.38Å; V672-V767 HydrophobicContact CG1-CG2 4.31Å; V673-V767 HydrophobicContact CB-CG2 4.4Å; V673-V767 HydrophobicContact CG2-CG2 3.52Å; L758-V767 HydrophobicContact CB-CG1 4.1Å; L758-V767 HydrophobicContact CD2-CG1 3.9Å; L758-V767 HydrophobicContact CG-CG1 4.41Å; S762-V767 VanDerWaalsContact OG-CB 3.31Å; S762-V767 WeakPolarHBondContact OG-CB 3.45Å; S762-V767 WeakPolarHBondContact OG-CG1 3.46Å; N764-V767 HydrophobicContact CB-CB 4.31Å; N764-V767 HydrophobicContact CB-CG2 3.92Å; N764-V767 PolarHBondContact O-N 3.36Å; V767-A770 PolarHBondContact O-N 3.1Å; V767-S771 VanDerWaalsContact O-CB 3.28Å; V767-S771 WeakPolarHBondContact O-CB 3.35Å; V767-S771 PolarHBondContact O-N 3.47Å; V767-S771 PolarHBondContact O-OG 2.91Å
768	L	96.7	Very high	94.2	Very high	16 Å²	16	28.6 Å²	28.6	8%	0.084	16%	0.155	C	C	.	.	H	α-helix	trans	-63.4	-47.6	176	-63.6	177.5	0	0	0	111.7	L759 N764 A770 A772 L805 V813	L759-L768 HydrophobicContact CD2-CD2 4.44Å; N764-L768 PolarHBondContact O-N 3.49Å; N764-L768 VanDerWaalsContact O-N 3.15Å; L768-A770 VanDerWaalsContact C-N 3.35Å; L768-A770 PolarHBondContact O-N 3.48Å; L768-A772 VanDerWaalsContact O-CB 3.31Å; L768-A772 WeakPolarHBondContact O-CB 3.38Å; L768-A772 PolarHBondContact O-N 2.65Å; L768-L805 HydrophobicContact CD1-CD2 4.09Å; L768-L805 HydrophobicContact CD2-CD2 4.18Å; L768-V813 HydrophobicContact CB-CG1 4.03Å; L768-V813 HydrophobicContact CB-CG2 4.05Å
769	E	95.3	Very high	94	Very high	50 Å²	50	28.1 Å²	28.1	23%	0.234	15%	0.153	C	C	.	.	H	α-helix	trans	-60.1	-44.8	173.8	-175.8	-171.2	-178.1	0	0	111.4	P765 G773 K812 V813 A816	P765-E769 WeakPolarHBondContact O-CB 3.08Å; P765-E769 PolarHBondContact O-N 3.21Å; P765-E769 VanDerWaalsContact O-N 3.16Å; E769-G773 PolarHBondContact O-N 3.02Å; E769-K812 HydrophobicContact CB-CG 4.11Å; E769-K812 HydrophobicContact CG-CB 4.34Å; E769-K812 HydrophobicContact CG-CG 4.11Å; E769-K812 WeakPolarHBondContact OE2-CD 3.39Å; E769-K812 WeakPolarHBondContact OE2-CE 3.37Å; E769-K812 VanDerWaalsContact OE2-CG 3.22Å; E769-K812 WeakPolarHBondContact OE2-CG 3.24Å; E769-K812 IonicContact OE2-NZ 3.66Å; E769-V813 HydrophobicContact CB-CG2 4.33Å; E769-A816 HydrophobicContact CG-CB 4.13Å
770	A	97	Very high	93.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.9	-43.6	-175.7	0	0	0	0	0	112.4	V676 C677 D766 V767 L768 G773 A774	V676-A770 HydrophobicContact CB-CB 4.15Å; V676-A770 HydrophobicContact CG1-CB 3.57Å; C677-A770 HydrophobicContact CB-CB 4.49Å; C677-A770 VanDerWaalsContact SG-CB 3.56Å; D766-A770 WeakPolarHBondContact O-CB 3.3Å; D766-A770 PolarHBondContact O-N 3.34Å; V767-A770 PolarHBondContact O-N 3.1Å; L768-A770 VanDerWaalsContact C-N 3.35Å; L768-A770 PolarHBondContact O-N 3.48Å; A770-G773 PolarHBondContact O-N 2.99Å; A770-A774 WeakPolarHBondContact O-CB 3.42Å; A770-A774 PolarHBondContact O-N 3.08Å
771	S	98.2	Very high	93	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.3	-44.6	177.6	-58.3	0	0	0	0	111.4	V676 V767 G773 A774 V775	V676-S771 WeakPolarHBondContact CG1-OG 3.32Å; V767-S771 VanDerWaalsContact O-CB 3.28Å; V767-S771 WeakPolarHBondContact O-CB 3.35Å; V767-S771 PolarHBondContact O-N 3.47Å; V767-S771 PolarHBondContact O-OG 2.91Å; S771-G773 PolarHBondContact O-N 3.49Å; S771-A774 PolarHBondContact O-N 2.92Å; S771-V775 PolarHBondContact O-N 3.45Å; S771-V775 VanDerWaalsContact O-N 3.16Å
772	A	97.3	Very high	92.5	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.5	-41.2	175.5	0	0	0	0	0	111.5	L759 L768 A774 V775 Q776 F802 A816	L759-A772 HydrophobicContact CD2-CB 4Å; L768-A772 VanDerWaalsContact O-CB 3.31Å; L768-A772 WeakPolarHBondContact O-CB 3.38Å; L768-A772 PolarHBondContact O-N 2.65Å; A772-A774 VanDerWaalsContact C-N 3.34Å; A772-A774 PolarHBondContact O-N 3.49Å; A772-V775 PolarHBondContact O-N 2.75Å; A772-Q776 VanDerWaalsContact O-CB 3.31Å; A772-Q776 WeakPolarHBondContact O-CB 3.36Å; A772-Q776 PolarHBondContact O-N 3.03Å; A772-F802 HydrophobicContact CB-CE1 3.87Å; A772-A816 HydrophobicContact CB-CB 3.76Å
773	G	96	Very high	92.1	Very high	5 Å²	5	27.1 Å²	27.1	5%	0.052	15%	0.146	C	C	.	.	H	α-helix	trans	-64.6	-32.6	174.8	0	0	0	0	0	113.9	E769 A770 S771 Q776 N777	E769-G773 PolarHBondContact O-N 3.02Å; A770-G773 PolarHBondContact O-N 2.99Å; S771-G773 PolarHBondContact O-N 3.49Å; G773-Q776 WeakPolarHBondContact O-CB 3.42Å; G773-N777 WeakPolarHBondContact O-CB 3.38Å; G773-N777 PolarHBondContact O-N 3.49Å; G773-N777 PolarHBondContact O-ND2 3.27Å
774	A	97.6	Very high	91.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.4	-51.4	174.3	0	0	0	0	0	110.4	R680 Y755 A770 S771 A772 Q776 N777 L778	R680-A774 HydrophobicContact CB-CB 4.12Å; Y755-A774 HydrophobicContact CD1-CB 4.19Å; Y755-A774 HydrophobicContact CD2-CB 4.4Å; Y755-A774 HydrophobicContact CE1-CB 3.7Å; Y755-A774 HydrophobicContact CE2-CB 3.94Å; A770-A774 WeakPolarHBondContact O-CB 3.42Å; A770-A774 PolarHBondContact O-N 3.08Å; S771-A774 PolarHBondContact O-N 2.92Å; A772-A774 VanDerWaalsContact C-N 3.34Å; A772-A774 PolarHBondContact O-N 3.49Å; A774-Q776 VanDerWaalsContact C-N 3.32Å; A774-Q776 PolarHBondContact O-N 2.87Å; A774-N777 PolarHBondContact O-N 3.04Å; A774-N777 VanDerWaalsContact O-N 3.15Å; A774-L778 VanDerWaalsContact O-CG 3.28Å; A774-L778 WeakPolarHBondContact O-CG 3.22Å; A774-L778 PolarHBondContact O-N 2.89Å
775	V	97.3	Very high	92.2	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-60.8	-39.9	176	176.3	0	0	0	0	111.7	Y755 S771 A772 N777 L778 C779 V793 F802 L824	Y755-V775 HydrophobicContact CD2-CG2 4Å; Y755-V775 HydrophobicContact CG-CG2 4.27Å; S771-V775 PolarHBondContact O-N 3.45Å; S771-V775 VanDerWaalsContact O-N 3.16Å; A772-V775 PolarHBondContact O-N 2.75Å; V775-N777 PolarHBondContact O-N 3.07Å; V775-L778 PolarHBondContact O-N 2.93Å; V775-C779 VanDerWaalsContact O-CB 3.26Å; V775-C779 WeakPolarHBondContact O-CB 3.35Å; V775-C779 PolarHBondContact O-N 3.28Å; V775-C779 PolarHBondContact O-SG 2.89Å; V775-V793 HydrophobicContact CG1-CG2 3.86Å; V775-F802 HydrophobicContact CB-CZ 3.76Å; V775-F802 HydrophobicContact CG1-CE2 4.14Å; V775-F802 HydrophobicContact CG1-CZ 3.7Å; V775-F802 HydrophobicContact CG2-CZ 4Å; V775-L824 HydrophobicContact CG1-CD1 4.48Å; V775-L824 HydrophobicContact CG1-CD2 4.32Å
776	Q	94.7	Very high	92.3	Very high	44 Å²	44	21 Å²	21	21%	0.206	11%	0.105	C	C	.	.	H	α-helix	trans	-53.8	-50.6	172.3	177.5	-159.9	-71.1	0	0	111.9	A772 G773 A774 C779 A780 T819 A820 N823	A772-Q776 VanDerWaalsContact O-CB 3.31Å; A772-Q776 WeakPolarHBondContact O-CB 3.36Å; A772-Q776 PolarHBondContact O-N 3.03Å; G773-Q776 WeakPolarHBondContact O-CB 3.42Å; A774-Q776 VanDerWaalsContact C-N 3.32Å; A774-Q776 PolarHBondContact O-N 2.87Å; Q776-C779 PolarHBondContact O-N 2.99Å; Q776-A780 PolarHBondContact O-N 2.98Å; Q776-T819 HydrophobicContact CG-CG2 3.75Å; Q776-T819 VanDerWaalsContact OE1-CB 3.24Å; Q776-A820 HydrophobicContact CB-CB 4.04Å; Q776-N823 PolarHBondContact O-ND2 2.68Å
777	N	94.6	Very high	92.4	Very high	18 Å²	18	21.4 Å²	21.4	10%	0.096	11%	0.106	C	C	.	.	H	α-helix	trans	-64.8	-46.4	-178.8	-73.3	-15.4	0	0	0	111.1	R680 G773 A774 V775 C779 A780	R680-N777 PolarHBondContact O-ND2 2.82Å; G773-N777 WeakPolarHBondContact O-CB 3.38Å; G773-N777 PolarHBondContact O-N 3.49Å; G773-N777 PolarHBondContact O-ND2 3.27Å; A774-N777 PolarHBondContact O-N 3.04Å; A774-N777 VanDerWaalsContact O-N 3.15Å; V775-N777 PolarHBondContact O-N 3.07Å; N777-C779 VanDerWaalsContact C-N 3.3Å; N777-C779 PolarHBondContact O-N 3.15Å; N777-A780 WeakPolarHBondContact O-CB 3.36Å; N777-A780 PolarHBondContact O-N 3.18Å
778	L	94.7	Very high	92.3	Very high	3 Å²	3	23.9 Å²	23.9	2%	0.016	12%	0.119	C	C	.	.	H	α-helix	trans	-64.4	-31	179.1	-65	170.7	0	0	0	113.1	L686 L746 F747 Y755 A774 V775 S786 V789	L686-L778 HydrophobicContact CD2-CD2 3.73Å; L746-L778 WeakPolarHBondContact O-CD1 3.49Å; F747-L778 HydrophobicContact CB-CD2 4.22Å; Y755-L778 HydrophobicContact CE2-CD1 3.88Å; A774-L778 VanDerWaalsContact O-CG 3.28Å; A774-L778 WeakPolarHBondContact O-CG 3.22Å; A774-L778 PolarHBondContact O-N 2.89Å; V775-L778 PolarHBondContact O-N 2.93Å; L778-S786 WeakPolarHBondContact O-CA 3.34Å; L778-S786 WeakPolarHBondContact O-CB 3.17Å; L778-S786 PolarHBondContact O-OG 3.19Å; L778-V789 HydrophobicContact CB-CG1 4.06Å; L778-V789 HydrophobicContact CB-CG2 4.48Å
779	C	92.9	Very high	92.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	2.9	-179.1	-66.6	0	0	0	0	114.9	V775 Q776 N777 C781 R790 N823 L824	V775-C779 VanDerWaalsContact O-CB 3.26Å; V775-C779 WeakPolarHBondContact O-CB 3.35Å; V775-C779 PolarHBondContact O-N 3.28Å; V775-C779 PolarHBondContact O-SG 2.89Å; Q776-C779 PolarHBondContact O-N 2.99Å; N777-C779 VanDerWaalsContact C-N 3.3Å; N777-C779 PolarHBondContact O-N 3.15Å; C779-C781 VanDerWaalsContact C-N 3.33Å; C779-C781 PolarHBondContact O-N 2.74Å; C779-C781 VanDerWaalsContact O-N 3.13Å; C779-R790 HydrophobicContact CB-CG 4.07Å; C779-R790 PolarHBondContact O-NH1 3.4Å; C779-N823 HydrophobicContact CB-CB 3.9Å; C779-L824 VanDerWaalsContact SG-CD2 3.59Å
780	A	87.1	Confident	92.2	Very high	39 Å²	39	21 Å²	21	32%	0.322	11%	0.105	S	C	.	.	S	Bend	trans	-64.5	-21.6	-160	0	0	0	0	0	117.1	Q776 N777	Q776-A780 PolarHBondContact O-N 2.98Å; N777-A780 WeakPolarHBondContact O-CB 3.36Å; N777-A780 PolarHBondContact O-N 3.18Å
781	C	83.1	Confident	92.1	Very high	8 Å²	8	21.8 Å²	21.8	5%	0.054	11%	0.11	C	C	.	.	S	Bend	trans	-148.1	-172.7	-168.2	68.8	0	0	0	0	114.9	Y694 C779 W783 S786 R790	Y694-C781 HydrophobicContact CE2-CB 4.32Å; Y694-C781 WeakPolarHBondContact OH-CB 3.34Å; C779-C781 VanDerWaalsContact C-N 3.33Å; C779-C781 PolarHBondContact O-N 2.74Å; C779-C781 VanDerWaalsContact O-N 3.13Å; C781-W783 PolarHBondContact O-N 3.07Å; C781-W783 WeakPolarHBondContact SG-CB 3.43Å; C781-S786 WeakPolarHBondContact O-CB 3.36Å; C781-R790 PolarHBondContact O-NH1 2.89Å; C781-R790 PolarHBondContact O-NH2 2.94Å
782	Y	82.2	Confident	92	Very high	125 Å²	125	22 Å²	22	49%	0.49	11%	0.112	S	C	.	.	S	Bend	trans	-90.8	79.3	170.6	-67.4	-75.5	0	0	0	110.7
783	W	85.3	Confident	91.9	Very high	12 Å²	12	22 Å²	22	5%	0.045	11%	0.112	C	C	.	.			trans	-130.9	146.2	177.4	-176.7	57.5	0	0	0	108.7	L686 Q687 D691 Y694 L740 F747 C781 P785 S786 M787	L686-W783 HydrophobicContact CD1-CE3 4.45Å; L686-W783 HydrophobicContact CD1-CH2 3.2Å; L686-W783 HydrophobicContact CD1-CZ2 4.01Å; L686-W783 HydrophobicContact CD1-CZ3 3.45Å; L686-W783 VanDerWaalsContact CD1-CZ3 3.45Å; L686-W783 HydrophobicContact CG-CH2 4.46Å; L686-W783 HydrophobicContact CG-CZ3 4.32Å; Q687-W783 HydrophobicContact CB-CD2 3.78Å; Q687-W783 HydrophobicContact CB-CE3 3.97Å; Q687-W783 HydrophobicContact CB-CG 4.06Å; D691-W783 HydrophobicContact CB-CZ2 4.39Å; D691-W783 PolarHBondContact OD2-NE1 2.82Å; Y694-W783 HydrophobicContact CD2-CB 4.26Å; Y694-W783 AromaticContact CD2-CD1 3.85Å; Y694-W783 HydrophobicContact CD2-CG 4.25Å; Y694-W783 HydrophobicContact CE2-CB 4.19Å; L740-W783 HydrophobicContact CD1-CH2 4.38Å; L740-W783 HydrophobicContact CD1-CZ2 3.74Å; F747-W783 AromaticContact CD1-CH2 3.98Å; F747-W783 HydrophobicContact CD1-CH2 3.98Å; F747-W783 HydrophobicContact CD1-CZ3 4.23Å; F747-W783 AromaticContact CE1-CH2 3.67Å; F747-W783 HydrophobicContact CE1-CH2 3.67Å; F747-W783 HydrophobicContact CE1-CZ3 4.37Å; F747-W783 HydrophobicContact CZ-CH2 4.13Å; C781-W783 PolarHBondContact O-N 3.07Å; C781-W783 WeakPolarHBondContact SG-CB 3.43Å; W783-P785 HydrophobicContact CD2-CB 4.37Å; W783-P785 HydrophobicContact CD2-CG 4.12Å; W783-P785 HydrophobicContact CE3-CB 3.79Å; W783-P785 HydrophobicContact CE3-CG 4Å; W783-P785 HydrophobicContact CH2-CB 3.86Å; W783-P785 HydrophobicContact CH2-CG 3.6Å; W783-P785 HydrophobicContact CZ2-CB 4.48Å; W783-P785 HydrophobicContact CZ2-CG 3.79Å; W783-P785 HydrophobicContact CZ3-CB 3.5Å; W783-P785 HydrophobicContact CZ3-CG 3.74Å; W783-S786 CarbonylContact O-C 3.55Å; W783-S786 WeakPolarHBondContact O-CA 3.39Å; W783-S786 WeakPolarHBondContact O-CB 3.43Å; W783-S786 PolarHBondContact O-N 2.88Å; W783-M787 PolarHBondContact O-N 2.83Å
784	Q	85.3	Confident	91.9	Very high	70 Å²	70	23.5 Å²	23.5	33%	0.327	12%	0.116	S	C	.	.	H	α-helix	trans	-61.2	-48.1	-168.9	-173.6	67.3	55.5	0	0	112.8	S786 M787 N788	Q784-S786 VanDerWaalsContact C-N 3.32Å; Q784-S786 PolarHBondContact O-N 2.84Å; Q784-M787 HydrophobicContact CB-CE 4.38Å; Q784-M787 PolarHBondContact O-N 3.35Å; Q784-M787 VanDerWaalsContact OE1-CE 3.31Å; Q784-N788 PolarHBondContact NE2-OD1 3.31Å; Q784-N788 PolarHBondContact O-N 2.88Å; Q784-N788 PolarHBondContact O-OD1 2.87Å
785	P	89.2	Confident	91.7	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.013	15%	0.145	C	C	.	.	H	α-helix	trans	-60.4	-35.1	170.3	-25.6	35.4	0	0	0	114.1	Y734 F747 W783 M787 N788 V789	Y734-P785 HydrophobicContact CD2-CG 4.1Å; Y734-P785 HydrophobicContact CE2-CG 3.72Å; F747-P785 HydrophobicContact CB-CB 4.13Å; F747-P785 HydrophobicContact CD1-CB 4.38Å; F747-P785 HydrophobicContact CD2-CB 3.57Å; F747-P785 HydrophobicContact CD2-CG 3.95Å; F747-P785 HydrophobicContact CE2-CB 3.96Å; F747-P785 HydrophobicContact CE2-CG 3.78Å; F747-P785 HydrophobicContact CG-CB 3.79Å; F747-P785 HydrophobicContact CG-CG 4.45Å; F747-P785 HydrophobicContact CZ-CB 4.5Å; F747-P785 HydrophobicContact CZ-CG 4.15Å; W783-P785 HydrophobicContact CD2-CB 4.37Å; W783-P785 HydrophobicContact CD2-CG 4.12Å; W783-P785 HydrophobicContact CE3-CB 3.79Å; W783-P785 HydrophobicContact CE3-CG 4Å; W783-P785 HydrophobicContact CH2-CB 3.86Å; W783-P785 HydrophobicContact CH2-CG 3.6Å; W783-P785 HydrophobicContact CZ2-CB 4.48Å; W783-P785 HydrophobicContact CZ2-CG 3.79Å; W783-P785 HydrophobicContact CZ3-CB 3.5Å; W783-P785 HydrophobicContact CZ3-CG 3.74Å; P785-M787 VanDerWaalsContact C-N 3.34Å; P785-M787 PolarHBondContact O-N 2.77Å; P785-N788 PolarHBondContact O-N 2.91Å; P785-V789 WeakPolarHBondContact O-CB 3.25Å; P785-V789 VanDerWaalsContact O-CG2 3.31Å; P785-V789 WeakPolarHBondContact O-CG2 3.33Å; P785-V789 PolarHBondContact O-N 3.49Å
786	S	90.8	Very high	91.5	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.7	-37.6	173.5	-61.5	0	0	0	0	112.9	L778 C781 W783 Q784 R790	L778-S786 WeakPolarHBondContact O-CA 3.34Å; L778-S786 WeakPolarHBondContact O-CB 3.17Å; L778-S786 PolarHBondContact O-OG 3.19Å; C781-S786 WeakPolarHBondContact O-CB 3.36Å; W783-S786 CarbonylContact O-C 3.55Å; W783-S786 WeakPolarHBondContact O-CA 3.39Å; W783-S786 WeakPolarHBondContact O-CB 3.43Å; W783-S786 PolarHBondContact O-N 2.88Å; Q784-S786 VanDerWaalsContact C-N 3.32Å; Q784-S786 PolarHBondContact O-N 2.84Å; S786-R790 WeakPolarHBondContact O-CB 3.27Å; S786-R790 WeakPolarHBondContact O-CG 3.21Å; S786-R790 PolarHBondContact O-N 2.86Å
787	M	90.6	Very high	91.4	Very high	57 Å²	57	38.9 Å²	38.9	28%	0.281	18%	0.183	S	C	.	.	H	α-helix	trans	-67.4	-39.7	173.6	-66.6	-173.8	-63.7	0	0	111.3	W783 Q784 P785 R790 T791	W783-M787 PolarHBondContact O-N 2.83Å; Q784-M787 HydrophobicContact CB-CE 4.38Å; Q784-M787 PolarHBondContact O-N 3.35Å; Q784-M787 VanDerWaalsContact OE1-CE 3.31Å; P785-M787 VanDerWaalsContact C-N 3.34Å; P785-M787 PolarHBondContact O-N 2.77Å; M787-R790 VanDerWaalsContact CG-NH2 3.33Å; M787-R790 PolarHBondContact O-N 2.94Å; M787-T791 PolarHBondContact O-N 3.29Å; M787-T791 PolarHBondContact O-OG1 3.25Å
788	N	92.1	Very high	91.4	Very high	52 Å²	52	38 Å²	38	28%	0.278	18%	0.178	S	C	.	.	H	α-helix	trans	-66.6	-43.1	176.9	-61.9	-2.5	0	0	0	111.6	Q784 P785 T791 A792	Q784-N788 PolarHBondContact NE2-OD1 3.31Å; Q784-N788 PolarHBondContact O-N 2.88Å; Q784-N788 PolarHBondContact O-OD1 2.87Å; P785-N788 PolarHBondContact O-N 2.91Å; N788-T791 CarbonylContact O-C 3.48Å; N788-T791 WeakPolarHBondContact O-CB 3.45Å; N788-T791 PolarHBondContact O-N 2.82Å; N788-A792 WeakPolarHBondContact O-CB 3.44Å; N788-A792 PolarHBondContact O-N 3.38Å
789	V	94.7	Very high	91.3	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.012	18%	0.179	C	C	.	.	H	α-helix	trans	-64.5	-43.5	175.2	171.8	0	0	0	0	110.8	F747 V752 L778 P785 T791 A792 V793	F747-V789 HydrophobicContact CB-CG2 4.04Å; V752-V789 HydrophobicContact CG2-CB 4.37Å; V752-V789 HydrophobicContact CG2-CG1 3.86Å; V752-V789 HydrophobicContact CG2-CG2 4.01Å; L778-V789 HydrophobicContact CB-CG1 4.06Å; L778-V789 HydrophobicContact CB-CG2 4.48Å; P785-V789 WeakPolarHBondContact O-CB 3.25Å; P785-V789 VanDerWaalsContact O-CG2 3.31Å; P785-V789 WeakPolarHBondContact O-CG2 3.33Å; P785-V789 PolarHBondContact O-N 3.49Å; V789-T791 PolarHBondContact O-N 2.86Å; V789-A792 PolarHBondContact O-N 3.1Å; V789-A792 VanDerWaalsContact O-N 3.09Å; V789-V793 HydrophobicContact CG1-CG2 4.33Å; V789-V793 WeakPolarHBondContact O-CG2 3.38Å; V789-V793 PolarHBondContact O-N 3.26Å
790	R	95.3	Very high	91.3	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.015	20%	0.198	C	C	.	.	H	α-helix	trans	-57	-35.8	172.4	-78.4	-165.9	-69.4	-90.5	4	112.8	C779 C781 S786 M787 N823 L824 D827 N830	C779-R790 HydrophobicContact CB-CG 4.07Å; C779-R790 PolarHBondContact O-NH1 3.4Å; C781-R790 PolarHBondContact O-NH1 2.89Å; C781-R790 PolarHBondContact O-NH2 2.94Å; S786-R790 WeakPolarHBondContact O-CB 3.27Å; S786-R790 WeakPolarHBondContact O-CG 3.21Å; S786-R790 PolarHBondContact O-N 2.86Å; M787-R790 VanDerWaalsContact CG-NH2 3.33Å; M787-R790 PolarHBondContact O-N 2.94Å; R790-N823 WeakPolarHBondContact CD-O 3.22Å; R790-L824 WeakPolarHBondContact CD-O 3.4Å; R790-L824 HydrophobicContact CG-CD2 4.26Å; R790-D827 HydrophobicContact CB-CB 4.2Å; R790-N830 PolarHBondContact O-ND2 2.83Å
791	T	94.8	Very high	91.6	Very high	15 Å²	15	40.4 Å²	40.4	9%	0.092	19%	0.19	C	C	.	.	H	α-helix	trans	-74.8	-37.8	174.9	-59	0	0	0	0	112.2	M787 N788 V789 R794 K795	M787-T791 PolarHBondContact O-N 3.29Å; M787-T791 PolarHBondContact O-OG1 3.25Å; N788-T791 CarbonylContact O-C 3.48Å; N788-T791 WeakPolarHBondContact O-CB 3.45Å; N788-T791 PolarHBondContact O-N 2.82Å; V789-T791 PolarHBondContact O-N 2.86Å; T791-R794 WeakPolarHBondContact O-CB 3.15Å; T791-R794 PolarHBondContact O-N 3.16Å; T791-K795 HydrophobicContact CG2-CD 4.29Å; T791-K795 WeakPolarHBondContact O-CG 3.17Å; T791-K795 PolarHBondContact O-N 3.42Å
792	A	95.4	Very high	92.1	Very high	5 Å²	5	40 Å²	40	4%	0.041	19%	0.187	C	C	.	.	H	α-helix	trans	-64.2	-48.5	176.9	0	0	0	0	0	111.3	T749 V752 N788 V789 R794 K795 E796	T749-A792 HydrophobicContact CG2-CB 4.17Å; V752-A792 HydrophobicContact CB-CB 4.11Å; V752-A792 HydrophobicContact CG1-CB 3.89Å; V752-A792 HydrophobicContact CG2-CB 4.2Å; N788-A792 WeakPolarHBondContact O-CB 3.44Å; N788-A792 PolarHBondContact O-N 3.38Å; V789-A792 PolarHBondContact O-N 3.1Å; V789-A792 VanDerWaalsContact O-N 3.09Å; A792-R794 PolarHBondContact O-N 2.72Å; A792-R794 VanDerWaalsContact O-N 3.13Å; A792-K795 WeakPolarHBondContact O-CA 3.41Å; A792-K795 PolarHBondContact O-N 3.32Å; A792-E796 WeakPolarHBondContact O-CG 3.21Å; A792-E796 PolarHBondContact O-N 3.15Å
793	V	96.5	Very high	92.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.5	-31.5	175.8	176.7	0	0	0	0	112	V752 V775 V789 A798 L799 F802 L824	V752-V793 HydrophobicContact CG1-CB 4.46Å; V752-V793 HydrophobicContact CG1-CG2 3.49Å; V752-V793 VanDerWaalsContact CG1-CG2 3.49Å; V775-V793 HydrophobicContact CG1-CG2 3.86Å; V789-V793 HydrophobicContact CG1-CG2 4.33Å; V789-V793 WeakPolarHBondContact O-CG2 3.38Å; V789-V793 PolarHBondContact O-N 3.26Å; V793-A798 HydrophobicContact CG1-CB 3.77Å; V793-A798 WeakPolarHBondContact O-CB 3.49Å; V793-A798 PolarHBondContact O-N 3.12Å; V793-L799 HydrophobicContact CG1-CD2 3.92Å; V793-F802 HydrophobicContact CG1-CD2 4.25Å; V793-F802 HydrophobicContact CG1-CE2 4.01Å; V793-L824 HydrophobicContact CB-CD2 3.78Å; V793-L824 HydrophobicContact CG1-CD1 3.93Å; V793-L824 HydrophobicContact CG1-CD2 3.63Å; V793-L824 HydrophobicContact CG1-CG 4.46Å; V793-L824 HydrophobicContact CG2-CD2 3.98Å
794	R	94.8	Very high	92.7	Very high	37 Å²	37	38.3 Å²	38.3	14%	0.14	18%	0.184	C	C	.	.	H	α-helix	trans	-70.4	-45	171.3	-175.3	162.6	66.8	-97.5	13.2	112.7	T791 A792 K797 L799 D827 N830 L833	T791-R794 WeakPolarHBondContact O-CB 3.15Å; T791-R794 PolarHBondContact O-N 3.16Å; A792-R794 PolarHBondContact O-N 2.72Å; A792-R794 VanDerWaalsContact O-N 3.13Å; R794-K797 PolarHBondContact O-N 2.85Å; R794-L799 HydrophobicContact CB-CD1 4.42Å; R794-L799 HydrophobicContact CG-CD1 4.38Å; R794-D827 IonicContact CZ-OD1 2.69Å; R794-D827 IonicContact CZ-OD2 2.71Å; R794-D827 VanDerWaalsContact NH1-CG 3.34Å; R794-D827 IonicContact NH1-OD1 2.67Å; R794-D827 PolarHBondContact NH1-OD1 3.06Å; R794-D827 IonicContact NH1-OD2 2.63Å; R794-D827 PolarHBondContact NH1-OD2 3.15Å; R794-D827 IonicContact NH2-OD2 3.16Å; R794-D827 PolarHBondContact NH2-OD2 3.26Å; R794-N830 WeakPolarHBondContact CB-OD1 3.18Å; R794-N830 WeakPolarHBondContact CD-OD1 3.28Å; R794-N830 PolarHBondContact NH1-OD1 3.48Å; R794-L833 HydrophobicContact CG-CD1 3.84Å
795	K	94.1	Very high	92.9	Very high	140 Å²	140	35.4 Å²	35.4	61%	0.609	17%	0.171	S	C	*	.	H	α-helix	trans	-68.4	-40.8	-178.9	-73.1	179.4	177	-177.5	0	112.7	T791 A792 K797	T791-K795 HydrophobicContact CG2-CD 4.29Å; T791-K795 WeakPolarHBondContact O-CG 3.17Å; T791-K795 PolarHBondContact O-N 3.42Å; A792-K795 WeakPolarHBondContact O-CA 3.41Å; A792-K795 PolarHBondContact O-N 3.32Å; K795-K797 PolarHBondContact O-N 3.29Å; K795-K797 VanDerWaalsContact O-N 3.08Å
796	E	93.4	Very high	92.8	Very high	59 Å²	59	36 Å²	36	28%	0.276	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	5.5	174.1	-58.6	-49.9	116.9	0	0	113.4	R753 T756 A792 A798	R753-E796 HydrophobicContact CB-CG 4.26Å; R753-E796 WeakPolarHBondContact CD-OE2 3.34Å; R753-E796 WeakPolarHBondContact CG-OE2 3.3Å; T756-E796 HydrophobicContact CG2-CB 4.25Å; A792-E796 WeakPolarHBondContact O-CG 3.21Å; A792-E796 PolarHBondContact O-N 3.15Å; E796-A798 PolarHBondContact O-N 3.4Å
797	K	92.7	Very high	92.4	Very high	168 Å²	168	40.7 Å²	40.7	73%	0.73	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.1	32.4	-178.3	-54.5	176.5	-177.3	172.8	0	113.5	R794 K795 P800	R794-K797 PolarHBondContact O-N 2.85Å; K795-K797 PolarHBondContact O-N 3.29Å; K795-K797 VanDerWaalsContact O-N 3.08Å; K797-P800 VanDerWaalsContact O-CD 3.27Å; K797-P800 WeakPolarHBondContact O-CD 3.47Å
798	A	93.9	Very high	92.1	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.191	C	C	.	.			trans	-81.7	-16.6	-175.1	0	0	0	0	0	113.8	T756 V793 E796 V801 F802	T756-A798 HydrophobicContact CG2-CB 3.61Å; V793-A798 HydrophobicContact CG1-CB 3.77Å; V793-A798 WeakPolarHBondContact O-CB 3.49Å; V793-A798 PolarHBondContact O-N 3.12Å; E796-A798 PolarHBondContact O-N 3.4Å; A798-V801 VanDerWaalsContact O-CB 3.3Å; A798-V801 WeakPolarHBondContact O-CB 3.42Å; A798-V801 PolarHBondContact O-N 3.37Å; A798-F802 HydrophobicContact CB-CD2 4.41Å; A798-F802 HydrophobicContact CB-CE2 4.38Å; A798-F802 WeakPolarHBondContact O-CD2 3.49Å; A798-F802 PolarHBondContact O-N 3.05Å; A798-F802 VanDerWaalsContact O-N 3.09Å
799	L	94.1	Very high	91.6	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-55.5	-41.9	-177.8	-60.1	176.9	0	0	0	114.1	V793 R794 F802 V803 L824 N830 L833 I834	V793-L799 HydrophobicContact CG1-CD2 3.92Å; R794-L799 HydrophobicContact CB-CD1 4.42Å; R794-L799 HydrophobicContact CG-CD1 4.38Å; L799-F802 PolarHBondContact O-N 3.13Å; L799-V803 PolarHBondContact O-N 2.92Å; L799-L824 HydrophobicContact CD2-CB 4.46Å; L799-L824 HydrophobicContact CD2-CD1 4.08Å; L799-N830 HydrophobicContact CD1-CB 4.38Å; L799-L833 HydrophobicContact CD1-CB 3.9Å; L799-L833 HydrophobicContact CD1-CD1 4.03Å; L799-I834 HydrophobicContact CB-CG1 4.46Å; L799-I834 HydrophobicContact CD1-CG1 4.42Å; L799-I834 HydrophobicContact CD2-CD1 4.21Å; L799-I834 HydrophobicContact CD2-CG1 4.2Å
800	P	91.6	Very high	91.1	Very high	63 Å²	63	47 Å²	47	41%	0.409	23%	0.23	S	C	.	.	H	α-helix	trans	-65.8	-35	172.8	-19.9	33.9	0	0	0	113.6	K797 F802 V803 E804 T837	K797-P800 VanDerWaalsContact O-CD 3.27Å; K797-P800 WeakPolarHBondContact O-CD 3.47Å; P800-F802 VanDerWaalsContact C-N 3.32Å; P800-F802 PolarHBondContact O-N 3.07Å; P800-V803 CarbonylContact O-C 3.54Å; P800-V803 WeakPolarHBondContact O-CB 3.29Å; P800-V803 PolarHBondContact O-N 2.83Å; P800-V803 VanDerWaalsContact O-N 3.07Å; P800-E804 PolarHBondContact O-N 3.15Å; P800-T837 HydrophobicContact CB-CG2 3.76Å; P800-T837 HydrophobicContact CG-CG2 3.99Å
801	V	93.7	Very high	90.6	Very high	23 Å²	23	52 Å²	52	14%	0.139	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-44.3	176.7	-169.2	0	0	0	0	110.1	L759 Q760 A798 V803 E804 L805	L759-V801 HydrophobicContact CB-CG1 3.87Å; L759-V801 WeakPolarHBondContact O-CG1 3.29Å; Q760-V801 HydrophobicContact CG-CB 4.46Å; Q760-V801 HydrophobicContact CG-CG1 3.92Å; Q760-V801 HydrophobicContact CG-CG2 3.65Å; A798-V801 VanDerWaalsContact O-CB 3.3Å; A798-V801 WeakPolarHBondContact O-CB 3.42Å; A798-V801 PolarHBondContact O-N 3.37Å; V801-V803 VanDerWaalsContact C-N 3.29Å; V801-V803 PolarHBondContact O-N 3.23Å; V801-E804 WeakPolarHBondContact O-CB 3.41Å; V801-E804 PolarHBondContact O-N 3.45Å; V801-E804 VanDerWaalsContact O-N 3.17Å; V801-L805 WeakPolarHBondContact O-CG 3.43Å; V801-L805 PolarHBondContact O-N 3.41Å
802	F	93.8	Very high	90.2	Very high	1 Å²	1	53.7 Å²	53.7	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-63.1	-31.2	174.2	-83.8	-76.8	0	0	0	113.8	L759 A772 V775 V793 A798 L799 P800 A817 A820 L821 L824	L759-F802 HydrophobicContact CD1-CE1 4.05Å; L759-F802 HydrophobicContact CD1-CE2 3.84Å; L759-F802 HydrophobicContact CD1-CZ 3.46Å; L759-F802 VanDerWaalsContact CD1-CZ 3.46Å; A772-F802 HydrophobicContact CB-CE1 3.87Å; V775-F802 HydrophobicContact CB-CZ 3.76Å; V775-F802 HydrophobicContact CG1-CE2 4.14Å; V775-F802 HydrophobicContact CG1-CZ 3.7Å; V775-F802 HydrophobicContact CG2-CZ 4Å; V793-F802 HydrophobicContact CG1-CD2 4.25Å; V793-F802 HydrophobicContact CG1-CE2 4.01Å; A798-F802 HydrophobicContact CB-CD2 4.41Å; A798-F802 HydrophobicContact CB-CE2 4.38Å; A798-F802 WeakPolarHBondContact O-CD2 3.49Å; A798-F802 PolarHBondContact O-N 3.05Å; A798-F802 VanDerWaalsContact O-N 3.09Å; L799-F802 PolarHBondContact O-N 3.13Å; P800-F802 VanDerWaalsContact C-N 3.32Å; P800-F802 PolarHBondContact O-N 3.07Å; F802-A817 HydrophobicContact CD1-CB 4.49Å; F802-A820 HydrophobicContact CD1-CB 3.81Å; F802-A820 HydrophobicContact CE1-CB 3.46Å; F802-A820 VanDerWaalsContact CE1-CB 3.46Å; F802-A820 HydrophobicContact CZ-CB 4.31Å; F802-L821 HydrophobicContact CB-CD1 4.26Å; F802-L821 HydrophobicContact CB-CD2 3.62Å; F802-L821 HydrophobicContact CB-CG 3.82Å; F802-L824 HydrophobicContact CD2-CD1 4.03Å; F802-L824 HydrophobicContact CE2-CD1 4.21Å; F802-L824 HydrophobicContact CG-CD1 4.29Å
803	V	90.4	Very high	90	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.012	26%	0.262	C	S	.	.	H	α-helix	trans	-73.7	-37.4	173.3	172.8	0	0	0	0	110.9	L799 P800 V801 L805 L806 L821 T837 V838	L799-V803 PolarHBondContact O-N 2.92Å; P800-V803 CarbonylContact O-C 3.54Å; P800-V803 WeakPolarHBondContact O-CB 3.29Å; P800-V803 PolarHBondContact O-N 2.83Å; P800-V803 VanDerWaalsContact O-N 3.07Å; V801-V803 VanDerWaalsContact C-N 3.29Å; V801-V803 PolarHBondContact O-N 3.23Å; V803-L805 VanDerWaalsContact C-N 3.34Å; V803-L805 PolarHBondContact O-N 3.04Å; V803-L806 VanDerWaalsContact O-CB 3.29Å; V803-L806 WeakPolarHBondContact O-CB 3Å; V803-L806 WeakPolarHBondContact O-CG 3.47Å; V803-L806 PolarHBondContact O-N 2.92Å; V803-L821 HydrophobicContact CG2-CD1 4.18Å; V803-L821 HydrophobicContact CG2-CD2 4.33Å; V803-T837 HydrophobicContact CB-CG2 4.29Å; V803-T837 HydrophobicContact CG1-CG2 4.48Å; V803-T837 HydrophobicContact CG2-CG2 4.2Å; V803-V838 HydrophobicContact CG1-CG2 4.01Å; V803-V838 HydrophobicContact CG2-CG2 4.05Å
804	E	89.2	Confident	89.7	Confident	99 Å²	99	56.1 Å²	56.1	46%	0.463	27%	0.273	S	S	.	.	H	α-helix	trans	-62.9	-40.6	177.6	-159.6	54.8	-107.6	0	0	112.1	P800 V801 L806 R807	P800-E804 PolarHBondContact O-N 3.15Å; V801-E804 WeakPolarHBondContact O-CB 3.41Å; V801-E804 PolarHBondContact O-N 3.45Å; V801-E804 VanDerWaalsContact O-N 3.17Å; E804-L806 PolarHBondContact O-N 2.75Å; E804-R807 WeakPolarHBondContact O-CB 3.37Å; E804-R807 PolarHBondContact O-N 2.77Å; E804-R807 WeakPolarHBondContact OE1-CD 3.11Å; E804-R807 IonicContact OE1-CZ 3.92Å; E804-R807 IonicContact OE1-NE 2.68Å; E804-R807 IonicContact OE1-NH1 3.23Å; E804-R807 PolarHBondContact OE1-NH1 3.18Å; E804-R807 IonicContact OE2-CZ 2.77Å; E804-R807 IonicContact OE2-NH1 2.75Å; E804-R807 PolarHBondContact OE2-NH1 3.22Å
805	L	90	Very high	89.3	Confident	9 Å²	9	60.6 Å²	60.6	5%	0.047	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.7	178.2	-68.6	169.5	0	0	0	114.2	L759 L768 V801 V803 R807 T808 V813 A817	L759-L805 HydrophobicContact CB-CD1 4.27Å; L759-L805 HydrophobicContact CD2-CD1 3.4Å; L759-L805 VanDerWaalsContact CD2-CD1 3.4Å; L759-L805 HydrophobicContact CG-CD1 4.36Å; L768-L805 HydrophobicContact CD1-CD2 4.09Å; L768-L805 HydrophobicContact CD2-CD2 4.18Å; V801-L805 WeakPolarHBondContact O-CG 3.43Å; V801-L805 PolarHBondContact O-N 3.41Å; V803-L805 VanDerWaalsContact C-N 3.34Å; V803-L805 PolarHBondContact O-N 3.04Å; L805-R807 VanDerWaalsContact C-N 3.26Å; L805-R807 PolarHBondContact O-N 2.83Å; L805-T808 HydrophobicContact CD2-CG2 4.03Å; L805-T808 PolarHBondContact O-OG1 2.96Å; L805-V813 HydrophobicContact CB-CG1 4.12Å; L805-V813 HydrophobicContact CD2-CG1 3.91Å; L805-V813 HydrophobicContact CG-CG1 4.47Å; L805-A817 HydrophobicContact CB-CB 3.78Å
806	L	86.9	Confident	89.2	Confident	14 Å²	14	54.2 Å²	54.2	7%	0.073	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-23.5	171.9	-53.6	171.8	0	0	0	112.6	V803 E804 K814 A817 A818 L821 F854	V803-L806 VanDerWaalsContact O-CB 3.29Å; V803-L806 WeakPolarHBondContact O-CB 3Å; V803-L806 WeakPolarHBondContact O-CG 3.47Å; V803-L806 PolarHBondContact O-N 2.92Å; E804-L806 PolarHBondContact O-N 2.75Å; L806-K814 WeakPolarHBondContact O-CE 3.39Å; L806-A817 HydrophobicContact CD2-CB 3.92Å; L806-A818 HydrophobicContact CD2-CB 3.88Å; L806-L821 HydrophobicContact CD1-CD1 3.7Å; L806-L821 HydrophobicContact CD2-CD1 4.26Å; L806-L821 HydrophobicContact CG-CD1 4.23Å; L806-F854 HydrophobicContact CB-CD2 4.36Å; L806-F854 HydrophobicContact CD1-CD2 3.84Å; L806-F854 HydrophobicContact CD1-CE2 3.76Å; L806-F854 HydrophobicContact CG-CD2 4.47Å
807	R	83.5	Confident	89.2	Confident	98 Å²	98	51.4 Å²	51.4	37%	0.37	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-21.6	177.9	-57.5	-165.5	-169.2	81.8	-14.3	113.5	E804 L805 P839	E804-R807 WeakPolarHBondContact O-CB 3.37Å; E804-R807 PolarHBondContact O-N 2.77Å; E804-R807 WeakPolarHBondContact OE1-CD 3.11Å; E804-R807 IonicContact OE1-CZ 3.92Å; E804-R807 IonicContact OE1-NE 2.68Å; E804-R807 IonicContact OE1-NH1 3.23Å; E804-R807 PolarHBondContact OE1-NH1 3.18Å; E804-R807 IonicContact OE2-CZ 2.77Å; E804-R807 IonicContact OE2-NH1 2.75Å; E804-R807 PolarHBondContact OE2-NH1 3.22Å; L805-R807 VanDerWaalsContact C-N 3.26Å; L805-R807 PolarHBondContact O-N 2.83Å; R807-P839 VanDerWaalsContact NH2-CG 3.3Å
808	T	83.6	Confident	89.1	Confident	43 Å²	43	43.6 Å²	43.6	26%	0.264	22%	0.217	S	C	.	.	S	Bend	trans	-59.1	137	178.9	63.7	0	0	0	0	112.1	L805 T810 K814	L805-T808 HydrophobicContact CD2-CG2 4.03Å; L805-T808 PolarHBondContact O-OG1 2.96Å; T808-T810 PolarHBondContact O-N 3.34Å; T808-K814 WeakPolarHBondContact O-CE 3.23Å; T808-K814 WeakPolarHBondContact O-CG 3.48Å
809	D	81.8	Confident	88.8	Confident	153 Å²	153	45.2 Å²	45.2	82%	0.818	23%	0.227	S	C	*	.	S	Bend	trans	-67.9	-1.6	-176	-69.1	-58	0	0	0	115.6	D811	D809-D811 PolarHBondContact O-N 2.81Å
810	T	83.6	Confident	88.8	Confident	49 Å²	49	45 Å²	45	30%	0.301	23%	0.225	S	C	.	.			trans	-92.2	103.5	-177.8	-45.7	0	0	0	0	112	P765 T808 K812 V813 K814	P765-T810 HydrophobicContact CB-CG2 3.98Å; T808-T810 PolarHBondContact O-N 3.34Å; T810-K812 HydrophobicContact CG2-CD 3.98Å; T810-K812 HydrophobicContact CG2-CG 3.73Å; T810-K812 PolarHBondContact O-N 2.88Å; T810-V813 HydrophobicContact CG2-CG2 4.21Å; T810-V813 WeakPolarHBondContact O-CA 3.29Å; T810-V813 WeakPolarHBondContact O-CB 3.41Å; T810-V813 PolarHBondContact O-N 3.3Å; T810-K814 PolarHBondContact O-N 2.91Å; T810-K814 VanDerWaalsContact O-N 3.08Å
811	D	85.1	Confident	88.9	Confident	108 Å²	108	42 Å²	42	58%	0.578	21%	0.206	S	C	*	.	H	α-helix	trans	-51.8	-25.5	-178.5	-87.1	-11.5	0	0	0	116	D809 R815	D809-D811 PolarHBondContact O-N 2.81Å; D811-R815 WeakPolarHBondContact O-CB 3.45Å; D811-R815 VanDerWaalsContact O-CG 3.28Å; D811-R815 WeakPolarHBondContact O-CG 3.49Å; D811-R815 PolarHBondContact O-N 2.8Å; D811-R815 VanDerWaalsContact O-N 3.17Å; D811-R815 PolarHBondContact O-NE 2.8Å
812	K	87.2	Confident	88.7	Confident	51 Å²	51	46.1 Å²	46.1	22%	0.222	22%	0.219	C	C	.	.	H	α-helix	trans	-74	-39.6	175.1	79.4	-162.9	-161.2	177.5	0	112.1	P765 D766 E769 T810 R815 A816	P765-K812 VanDerWaalsContact O-CE 3.24Å; P765-K812 WeakPolarHBondContact O-CE 3.48Å; D766-K812 IonicContact OD1-NZ 2.83Å; D766-K812 PolarHBondContact OD1-NZ 3.3Å; E769-K812 HydrophobicContact CB-CG 4.11Å; E769-K812 HydrophobicContact CG-CB 4.34Å; E769-K812 HydrophobicContact CG-CG 4.11Å; E769-K812 WeakPolarHBondContact OE2-CD 3.39Å; E769-K812 WeakPolarHBondContact OE2-CE 3.37Å; E769-K812 VanDerWaalsContact OE2-CG 3.22Å; E769-K812 WeakPolarHBondContact OE2-CG 3.24Å; E769-K812 IonicContact OE2-NZ 3.66Å; T810-K812 HydrophobicContact CG2-CD 3.98Å; T810-K812 HydrophobicContact CG2-CG 3.73Å; T810-K812 PolarHBondContact O-N 2.88Å; K812-R815 PolarHBondContact O-N 2.81Å; K812-A816 PolarHBondContact O-N 3.06Å
813	V	90.9	Very high	88.7	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-67.3	-47	174.5	-178.6	0	0	0	0	109.7	P765 L768 E769 L805 T810 R815 A816 A817	P765-V813 HydrophobicContact CB-CG2 4.11Å; P765-V813 WeakPolarHBondContact O-CG2 3.29Å; L768-V813 HydrophobicContact CB-CG1 4.03Å; L768-V813 HydrophobicContact CB-CG2 4.05Å; E769-V813 HydrophobicContact CB-CG2 4.33Å; L805-V813 HydrophobicContact CB-CG1 4.12Å; L805-V813 HydrophobicContact CD2-CG1 3.91Å; L805-V813 HydrophobicContact CG-CG1 4.47Å; T810-V813 HydrophobicContact CG2-CG2 4.21Å; T810-V813 WeakPolarHBondContact O-CA 3.29Å; T810-V813 WeakPolarHBondContact O-CB 3.41Å; T810-V813 PolarHBondContact O-N 3.3Å; V813-R815 VanDerWaalsContact C-N 3.32Å; V813-R815 PolarHBondContact O-N 2.97Å; V813-A816 PolarHBondContact O-N 2.86Å; V813-A817 WeakPolarHBondContact O-CB 3.41Å; V813-A817 PolarHBondContact O-N 3.17Å
814	K	90.1	Very high	88.8	Confident	54 Å²	54	46.3 Å²	46.3	24%	0.235	22%	0.22	C	C	.	.	H	α-helix	trans	-52.2	-47.9	173.3	-64.6	-168.1	-176.2	-176.1	0	112.2	L806 T808 T810 A817 A818	L806-K814 WeakPolarHBondContact O-CE 3.39Å; T808-K814 WeakPolarHBondContact O-CE 3.23Å; T808-K814 WeakPolarHBondContact O-CG 3.48Å; T810-K814 PolarHBondContact O-N 2.91Å; T810-K814 VanDerWaalsContact O-N 3.08Å; K814-A817 PolarHBondContact O-N 2.78Å; K814-A818 VanDerWaalsContact O-CB 3.29Å; K814-A818 WeakPolarHBondContact O-CB 3.4Å; K814-A818 PolarHBondContact O-N 3.23Å
815	R	85.9	Confident	89	Confident	131 Å²	131	42.4 Å²	42.4	49%	0.494	21%	0.205	S	C	.	.	H	α-helix	trans	-63.5	-44.4	179.3	-79.8	178.6	-66.5	134.8	-4.2	113	D811 K812 V813 T819 P853	D811-R815 WeakPolarHBondContact O-CB 3.45Å; D811-R815 VanDerWaalsContact O-CG 3.28Å; D811-R815 WeakPolarHBondContact O-CG 3.49Å; D811-R815 PolarHBondContact O-N 2.8Å; D811-R815 VanDerWaalsContact O-N 3.17Å; D811-R815 PolarHBondContact O-NE 2.8Å; K812-R815 PolarHBondContact O-N 2.81Å; V813-R815 VanDerWaalsContact C-N 3.32Å; V813-R815 PolarHBondContact O-N 2.97Å; R815-T819 WeakPolarHBondContact O-CB 2.93Å; R815-T819 PolarHBondContact O-N 2.83Å; R815-T819 VanDerWaalsContact O-N 3.1Å; R815-T819 PolarHBondContact O-OG1 3.19Å; R815-P853 HydrophobicContact CG-CB 3.96Å; R815-P853 HydrophobicContact CG-CG 3.45Å; R815-P853 VanDerWaalsContact CG-CG 3.45Å
816	A	91.5	Very high	88.9	Confident	7 Å²	7	43.1 Å²	43.1	6%	0.058	21%	0.208	C	C	.	.	H	α-helix	trans	-64.9	-46.3	177.6	0	0	0	0	0	111.3	E769 A772 K812 V813 T819 A820	E769-A816 HydrophobicContact CG-CB 4.13Å; A772-A816 HydrophobicContact CB-CB 3.76Å; K812-A816 PolarHBondContact O-N 3.06Å; V813-A816 PolarHBondContact O-N 2.86Å; A816-T819 PolarHBondContact O-N 2.9Å; A816-A820 VanDerWaalsContact O-CB 3.28Å; A816-A820 WeakPolarHBondContact O-CB 3.34Å; A816-A820 PolarHBondContact O-N 2.8Å
817	A	93.3	Very high	89	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.9	-47.8	178.7	0	0	0	0	0	112.7	F802 L805 L806 V813 K814 T819 A820 L821	F802-A817 HydrophobicContact CD1-CB 4.49Å; L805-A817 HydrophobicContact CB-CB 3.78Å; L806-A817 HydrophobicContact CD2-CB 3.92Å; V813-A817 WeakPolarHBondContact O-CB 3.41Å; V813-A817 PolarHBondContact O-N 3.17Å; K814-A817 PolarHBondContact O-N 2.78Å; A817-T819 VanDerWaalsContact C-N 3.34Å; A817-T819 PolarHBondContact O-N 2.87Å; A817-A820 PolarHBondContact O-N 3.02Å; A817-L821 WeakPolarHBondContact O-CG 3.29Å; A817-L821 PolarHBondContact O-N 3.15Å
818	A	90.2	Very high	89.2	Confident	3 Å²	3	42.3 Å²	42.3	3%	0.025	22%	0.215	C	C	.	.	H	α-helix	trans	-61	-41.6	177.2	0	0	0	0	0	112.1	L806 K814 L821 R822 P853 F857	L806-A818 HydrophobicContact CD2-CB 3.88Å; K814-A818 VanDerWaalsContact O-CB 3.29Å; K814-A818 WeakPolarHBondContact O-CB 3.4Å; K814-A818 PolarHBondContact O-N 3.23Å; A818-L821 PolarHBondContact O-N 3.13Å; A818-R822 WeakPolarHBondContact O-CB 3.46Å; A818-R822 PolarHBondContact O-N 2.87Å; A818-P853 HydrophobicContact CB-CB 4.5Å; A818-F857 HydrophobicContact CB-CB 4.21Å
819	T	89.1	Confident	89.6	Confident	35 Å²	35	44.5 Å²	44.5	22%	0.215	22%	0.222	C	C	.	.	H	α-helix	trans	-73.2	-33.1	179.4	-49.8	0	0	0	0	111.8	Q776 R815 A816 A817 N823	Q776-T819 HydrophobicContact CG-CG2 3.75Å; Q776-T819 VanDerWaalsContact OE1-CB 3.24Å; R815-T819 WeakPolarHBondContact O-CB 2.93Å; R815-T819 PolarHBondContact O-N 2.83Å; R815-T819 VanDerWaalsContact O-N 3.1Å; R815-T819 PolarHBondContact O-OG1 3.19Å; A816-T819 PolarHBondContact O-N 2.9Å; A817-T819 VanDerWaalsContact C-N 3.34Å; A817-T819 PolarHBondContact O-N 2.87Å; T819-N823 VanDerWaalsContact O-CG 3.27Å; T819-N823 PolarHBondContact O-N 2.9Å; T819-N823 PolarHBondContact O-OD1 2.86Å
820	A	94.2	Very high	90.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.2	-50.6	170	0	0	0	0	0	111.2	Q776 F802 A816 A817 R822 N823 L824	Q776-A820 HydrophobicContact CB-CB 4.04Å; F802-A820 HydrophobicContact CD1-CB 3.81Å; F802-A820 HydrophobicContact CE1-CB 3.46Å; F802-A820 VanDerWaalsContact CE1-CB 3.46Å; F802-A820 HydrophobicContact CZ-CB 4.31Å; A816-A820 VanDerWaalsContact O-CB 3.28Å; A816-A820 WeakPolarHBondContact O-CB 3.34Å; A816-A820 PolarHBondContact O-N 2.8Å; A817-A820 PolarHBondContact O-N 3.02Å; A820-R822 VanDerWaalsContact C-N 3.34Å; A820-R822 PolarHBondContact O-N 3.38Å; A820-N823 CarbonylContact O-C 3.58Å; A820-N823 PolarHBondContact O-N 3.19Å; A820-L824 WeakPolarHBondContact O-CB 3.34Å; A820-L824 VanDerWaalsContact O-CG 3.29Å; A820-L824 WeakPolarHBondContact O-CG 3.47Å; A820-L824 PolarHBondContact O-N 3.32Å
821	L	93.8	Very high	90.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-57.2	-43.8	176.3	-75.1	168.2	0	0	0	112.5	F802 V803 L806 A817 A818 N823 L824 A825 I834 F857	F802-L821 HydrophobicContact CB-CD1 4.26Å; F802-L821 HydrophobicContact CB-CD2 3.62Å; F802-L821 HydrophobicContact CB-CG 3.82Å; V803-L821 HydrophobicContact CG2-CD1 4.18Å; V803-L821 HydrophobicContact CG2-CD2 4.33Å; L806-L821 HydrophobicContact CD1-CD1 3.7Å; L806-L821 HydrophobicContact CD2-CD1 4.26Å; L806-L821 HydrophobicContact CG-CD1 4.23Å; A817-L821 WeakPolarHBondContact O-CG 3.29Å; A817-L821 PolarHBondContact O-N 3.15Å; A818-L821 PolarHBondContact O-N 3.13Å; L821-N823 PolarHBondContact O-N 2.9Å; L821-L824 HydrophobicContact CD2-CD1 4.45Å; L821-L824 PolarHBondContact O-N 2.86Å; L821-A825 VanDerWaalsContact O-CB 3.29Å; L821-A825 WeakPolarHBondContact O-CB 3.29Å; L821-A825 PolarHBondContact O-N 3.23Å; L821-I834 HydrophobicContact CD2-CD1 3.81Å; L821-I834 HydrophobicContact CD2-CG1 3.91Å; L821-I834 HydrophobicContact CD2-CG2 4.19Å; L821-F857 HydrophobicContact CB-CD2 4.13Å; L821-F857 HydrophobicContact CB-CE2 3.47Å; L821-F857 VanDerWaalsContact CB-CE2 3.47Å; L821-F857 HydrophobicContact CB-CZ 3.71Å; L821-F857 HydrophobicContact CD1-CE1 4.29Å; L821-F857 HydrophobicContact CD1-CZ 4.14Å; L821-F857 HydrophobicContact CG-CZ 4.48Å
822	R	89.6	Confident	90.6	Very high	110 Å²	110	40.2 Å²	40.2	42%	0.415	19%	0.185	S	C	.	.	H	α-helix	trans	-58.1	-35.1	174.9	-168.1	-159.8	66.9	-170.4	-3.9	112.7	A818 A820 F857	A818-R822 WeakPolarHBondContact O-CB 3.46Å; A818-R822 PolarHBondContact O-N 2.87Å; A820-R822 VanDerWaalsContact C-N 3.34Å; A820-R822 PolarHBondContact O-N 3.38Å; R822-F857 HydrophobicContact CB-CD2 4.06Å
823	N	92.1	Very high	90.7	Very high	8 Å²	8	41 Å²	41	4%	0.043	19%	0.191	C	C	.	.	H	α-helix	trans	-82.2	-35.4	177.3	-67.9	3.4	0	0	0	111.5	Q776 C779 R790 T819 A820 L821 L826	Q776-N823 PolarHBondContact O-ND2 2.68Å; C779-N823 HydrophobicContact CB-CB 3.9Å; R790-N823 WeakPolarHBondContact CD-O 3.22Å; T819-N823 VanDerWaalsContact O-CG 3.27Å; T819-N823 PolarHBondContact O-N 2.9Å; T819-N823 PolarHBondContact O-OD1 2.86Å; A820-N823 CarbonylContact O-C 3.58Å; A820-N823 PolarHBondContact O-N 3.19Å; L821-N823 PolarHBondContact O-N 2.9Å; N823-L826 WeakPolarHBondContact O-CB 3.31Å; N823-L826 VanDerWaalsContact O-CG 3.29Å; N823-L826 WeakPolarHBondContact O-CG 3.38Å; N823-L826 PolarHBondContact O-N 3.43Å
824	L	94.3	Very high	90.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-39.3	174.1	-72.6	163.6	0	0	0	112.1	V775 C779 R790 V793 L799 F802 A820 L821 L826 D827 N830 I834	V775-L824 HydrophobicContact CG1-CD1 4.48Å; V775-L824 HydrophobicContact CG1-CD2 4.32Å; C779-L824 VanDerWaalsContact SG-CD2 3.59Å; R790-L824 WeakPolarHBondContact CD-O 3.4Å; R790-L824 HydrophobicContact CG-CD2 4.26Å; V793-L824 HydrophobicContact CB-CD2 3.78Å; V793-L824 HydrophobicContact CG1-CD1 3.93Å; V793-L824 HydrophobicContact CG1-CD2 3.63Å; V793-L824 HydrophobicContact CG1-CG 4.46Å; V793-L824 HydrophobicContact CG2-CD2 3.98Å; L799-L824 HydrophobicContact CD2-CB 4.46Å; L799-L824 HydrophobicContact CD2-CD1 4.08Å; F802-L824 HydrophobicContact CD2-CD1 4.03Å; F802-L824 HydrophobicContact CE2-CD1 4.21Å; F802-L824 HydrophobicContact CG-CD1 4.29Å; A820-L824 WeakPolarHBondContact O-CB 3.34Å; A820-L824 VanDerWaalsContact O-CG 3.29Å; A820-L824 WeakPolarHBondContact O-CG 3.47Å; A820-L824 PolarHBondContact O-N 3.32Å; L821-L824 HydrophobicContact CD2-CD1 4.45Å; L821-L824 PolarHBondContact O-N 2.86Å; L824-L826 PolarHBondContact O-N 3.03Å; L824-L826 VanDerWaalsContact O-N 3.12Å; L824-D827 PolarHBondContact O-N 2.85Å; L824-N830 VanDerWaalsContact O-CB 3.3Å; L824-N830 WeakPolarHBondContact O-CB 3.44Å; L824-N830 PolarHBondContact O-ND2 3.2Å; L824-N830 VanDerWaalsContact O-ND2 3.1Å; L824-I834 HydrophobicContact CB-CD1 4.35Å
825	A	91.8	Very high	90.1	Very high	17 Å²	17	43.9 Å²	43.9	14%	0.14	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	4.3	177.8	0	0	0	0	0	114.7	L821 D827 R831 I834	L821-A825 VanDerWaalsContact O-CB 3.29Å; L821-A825 WeakPolarHBondContact O-CB 3.29Å; L821-A825 PolarHBondContact O-N 3.23Å; A825-D827 VanDerWaalsContact C-N 3.26Å; A825-D827 CarbonylContact C-O 3.56Å; A825-R831 HydrophobicContact CB-CB 4.23Å; A825-R831 HydrophobicContact CB-CG 4.26Å; A825-R831 VanDerWaalsContact O-CZ 3.28Å; A825-R831 PolarHBondContact O-NE 3.29Å; A825-R831 PolarHBondContact O-NH2 3.19Å; A825-I834 HydrophobicContact CB-CD1 4.16Å
826	L	88.7	Confident	89.9	Confident	23 Å²	23	46.4 Å²	46.4	12%	0.12	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-33.4	163.4	-67.9	175.8	0	0	0	111.3	N823 L824	N823-L826 WeakPolarHBondContact O-CB 3.31Å; N823-L826 VanDerWaalsContact O-CG 3.29Å; N823-L826 WeakPolarHBondContact O-CG 3.38Å; N823-L826 PolarHBondContact O-N 3.43Å; L824-L826 PolarHBondContact O-N 3.03Å; L824-L826 VanDerWaalsContact O-N 3.12Å
827	D	88.4	Confident	89.2	Confident	11 Å²	11	48.2 Å²	48.2	6%	0.059	23%	0.233	C	C	.	.	S	Bend	trans	-74.7	133.7	167.1	173.9	-40	0	0	0	109.5	R790 R794 L824 A825 Q829 N830 R831	R790-D827 HydrophobicContact CB-CB 4.2Å; R794-D827 IonicContact CZ-OD1 2.69Å; R794-D827 IonicContact CZ-OD2 2.71Å; R794-D827 VanDerWaalsContact NH1-CG 3.34Å; R794-D827 IonicContact NH1-OD1 2.67Å; R794-D827 PolarHBondContact NH1-OD1 3.06Å; R794-D827 IonicContact NH1-OD2 2.63Å; R794-D827 PolarHBondContact NH1-OD2 3.15Å; R794-D827 IonicContact NH2-OD2 3.16Å; R794-D827 PolarHBondContact NH2-OD2 3.26Å; L824-D827 PolarHBondContact O-N 2.85Å; A825-D827 VanDerWaalsContact C-N 3.26Å; A825-D827 CarbonylContact C-O 3.56Å; D827-Q829 WeakPolarHBondContact OD1-CA 3.48Å; D827-Q829 WeakPolarHBondContact OD1-CB 3.21Å; D827-Q829 PolarHBondContact OD1-N 2.82Å; D827-N830 HydrophobicContact CB-CB 3.95Å; D827-N830 PolarHBondContact OD1-N 2.82Å; D827-R831 PolarHBondContact O-N 3.01Å; D827-R831 VanDerWaalsContact O-N 3.07Å
828	V	88.8	Confident	88.1	Confident	85 Å²	85	49.5 Å²	49.5	52%	0.515	24%	0.24	S	C	.	.	H	α-helix	trans	-71.2	-40.8	-175.4	-178.2	0	0	0	0	111.6	N830 R831 E832	V828-N830 VanDerWaalsContact C-N 3.32Å; V828-N830 PolarHBondContact O-N 2.79Å; V828-R831 WeakPolarHBondContact O-CB 3.33Å; V828-R831 PolarHBondContact O-N 3.25Å; V828-E832 PolarHBondContact O-N 3.11Å
829	Q	91.3	Very high	86.6	Confident	88 Å²	88	51.2 Å²	51.2	41%	0.411	25%	0.251	S	S	.	.	H	α-helix	trans	-66.4	-38.3	178.4	-54.2	176.5	32.2	0	0	110.2	E729 D827 L833	E729-Q829 PolarHBondContact OE2-NE2 3.45Å; E729-Q829 VanDerWaalsContact OE2-NE2 3.11Å; D827-Q829 WeakPolarHBondContact OD1-CA 3.48Å; D827-Q829 WeakPolarHBondContact OD1-CB 3.21Å; D827-Q829 PolarHBondContact OD1-N 2.82Å; Q829-L833 WeakPolarHBondContact O-CG 3.48Å; Q829-L833 PolarHBondContact O-N 3.14Å; Q829-L833 VanDerWaalsContact O-N 3.16Å
830	N	93	Very high	84.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.9	-46.7	171.6	-75.6	-3.8	0	0	0	111.6	R790 R794 L799 L824 D827 V828 E832 L833 I834	R790-N830 PolarHBondContact O-ND2 2.83Å; R794-N830 WeakPolarHBondContact CB-OD1 3.18Å; R794-N830 WeakPolarHBondContact CD-OD1 3.28Å; R794-N830 PolarHBondContact NH1-OD1 3.48Å; L799-N830 HydrophobicContact CD1-CB 4.38Å; L824-N830 VanDerWaalsContact O-CB 3.3Å; L824-N830 WeakPolarHBondContact O-CB 3.44Å; L824-N830 PolarHBondContact O-ND2 3.2Å; L824-N830 VanDerWaalsContact O-ND2 3.1Å; D827-N830 HydrophobicContact CB-CB 3.95Å; D827-N830 PolarHBondContact OD1-N 2.82Å; V828-N830 VanDerWaalsContact C-N 3.32Å; V828-N830 PolarHBondContact O-N 2.79Å; N830-E832 VanDerWaalsContact C-N 3.34Å; N830-E832 PolarHBondContact O-N 3.11Å; N830-L833 PolarHBondContact O-N 2.99Å; N830-I834 HydrophobicContact CB-CD1 4.36Å; N830-I834 WeakPolarHBondContact O-CB 3.39Å; N830-I834 WeakPolarHBondContact O-CD1 3.42Å; N830-I834 WeakPolarHBondContact O-CG1 3.24Å; N830-I834 PolarHBondContact O-N 3.09Å
831	R	89.9	Confident	82.9	Confident	120 Å²	120	63.8 Å²	63.8	45%	0.453	31%	0.311	S	S	.	.	H	α-helix	trans	-58.9	-44.8	-179.6	-166.4	-177.6	-52.3	149.8	13	111.9	A825 D827 V828 L833 I834 V835	A825-R831 HydrophobicContact CB-CB 4.23Å; A825-R831 HydrophobicContact CB-CG 4.26Å; A825-R831 VanDerWaalsContact O-CZ 3.28Å; A825-R831 PolarHBondContact O-NE 3.29Å; A825-R831 PolarHBondContact O-NH2 3.19Å; D827-R831 PolarHBondContact O-N 3.01Å; D827-R831 VanDerWaalsContact O-N 3.07Å; V828-R831 WeakPolarHBondContact O-CB 3.33Å; V828-R831 PolarHBondContact O-N 3.25Å; R831-L833 PolarHBondContact O-N 2.8Å; R831-I834 PolarHBondContact O-N 2.63Å; R831-V835 VanDerWaalsContact O-CG2 3.3Å; R831-V835 WeakPolarHBondContact O-CG2 3.46Å; R831-V835 PolarHBondContact O-N 3.15Å
832	E	88	Confident	80.9	Confident	101 Å²	101	65.4 Å²	65.4	47%	0.472	32%	0.32	S	S	.	.	H	α-helix	trans	-62.9	-39.5	176.8	-72.9	-175.1	-150.9	0	0	113.1	V828 N830 R836	V828-E832 PolarHBondContact O-N 3.11Å; N830-E832 VanDerWaalsContact C-N 3.34Å; N830-E832 PolarHBondContact O-N 3.11Å; E832-R836 VanDerWaalsContact O-CG 3.3Å; E832-R836 WeakPolarHBondContact O-CG 3.38Å; E832-R836 PolarHBondContact O-N 2.81Å; E832-R836 IonicContact OE2-NH2 2.82Å; E832-R836 PolarHBondContact OE2-NH2 3.34Å; E832-R836 VanDerWaalsContact OE2-NH2 3.16Å
833	L	89.2	Confident	79.1	Confident	67 Å²	67	64.5 Å²	64.5	35%	0.351	32%	0.32	S	S	.	.	H	α-helix	trans	-71.4	-41.6	177.3	-69.7	173.8	0	0	0	112.2	R794 L799 Q829 N830 R831 V835 R836 T837	R794-L833 HydrophobicContact CG-CD1 3.84Å; L799-L833 HydrophobicContact CD1-CB 3.9Å; L799-L833 HydrophobicContact CD1-CD1 4.03Å; Q829-L833 WeakPolarHBondContact O-CG 3.48Å; Q829-L833 PolarHBondContact O-N 3.14Å; Q829-L833 VanDerWaalsContact O-N 3.16Å; N830-L833 PolarHBondContact O-N 2.99Å; R831-L833 PolarHBondContact O-N 2.8Å; L833-V835 PolarHBondContact O-N 2.67Å; L833-R836 PolarHBondContact O-N 2.48Å; L833-R836 VanDerWaalsContact O-N 3.15Å; L833-T837 WeakPolarHBondContact O-CB 3.4Å; L833-T837 PolarHBondContact O-N 2.58Å; L833-T837 PolarHBondContact O-OG1 2.98Å
834	I	86.7	Confident	76.9	Confident	5 Å²	5	70.4 Å²	70.4	3%	0.026	35%	0.351	C	S	.	.	H	α-helix	trans	-61.2	-45.6	178.3	-67.4	161.5	0	0	0	110.2	L799 L821 L824 A825 N830 R831 R836 T837 V838 F857	L799-I834 HydrophobicContact CB-CG1 4.46Å; L799-I834 HydrophobicContact CD1-CG1 4.42Å; L799-I834 HydrophobicContact CD2-CD1 4.21Å; L799-I834 HydrophobicContact CD2-CG1 4.2Å; L821-I834 HydrophobicContact CD2-CD1 3.81Å; L821-I834 HydrophobicContact CD2-CG1 3.91Å; L821-I834 HydrophobicContact CD2-CG2 4.19Å; L824-I834 HydrophobicContact CB-CD1 4.35Å; A825-I834 HydrophobicContact CB-CD1 4.16Å; N830-I834 HydrophobicContact CB-CD1 4.36Å; N830-I834 WeakPolarHBondContact O-CB 3.39Å; N830-I834 WeakPolarHBondContact O-CD1 3.42Å; N830-I834 WeakPolarHBondContact O-CG1 3.24Å; N830-I834 PolarHBondContact O-N 3.09Å; R831-I834 PolarHBondContact O-N 2.63Å; I834-R836 PolarHBondContact O-N 3.11Å; I834-T837 PolarHBondContact O-N 2.68Å; I834-V838 HydrophobicContact CG2-CG2 4.45Å; I834-V838 PolarHBondContact O-N 2.85Å; I834-V838 VanDerWaalsContact O-N 3.16Å; I834-F857 HydrophobicContact CG2-CZ 3.89Å
835	V	82	Confident	74.8	Confident	110 Å²	110	78.3 Å²	78.3	67%	0.667	39%	0.388	S	S	*	.	H	α-helix	trans	-61.4	-29.4	177.1	169.7	0	0	0	0	112.8	R831 L833 T837	R831-V835 VanDerWaalsContact O-CG2 3.3Å; R831-V835 WeakPolarHBondContact O-CG2 3.46Å; R831-V835 PolarHBondContact O-N 3.15Å; L833-V835 PolarHBondContact O-N 2.67Å; V835-T837 VanDerWaalsContact C-N 3.34Å
836	R	82	Confident	72.8	Confident	185 Å²	185	79 Å²	79	70%	0.698	39%	0.389	S	S	*	.	H	α-helix	trans	-81.3	-10.6	173.8	-66.7	172.9	-158.9	177.9	10.9	113.9	E832 L833 I834	E832-R836 VanDerWaalsContact O-CG 3.3Å; E832-R836 WeakPolarHBondContact O-CG 3.38Å; E832-R836 PolarHBondContact O-N 2.81Å; E832-R836 IonicContact OE2-NH2 2.82Å; E832-R836 PolarHBondContact OE2-NH2 3.34Å; E832-R836 VanDerWaalsContact OE2-NH2 3.16Å; L833-R836 PolarHBondContact O-N 2.48Å; L833-R836 VanDerWaalsContact O-N 3.15Å; I834-R836 PolarHBondContact O-N 3.11Å
837	T	77.1	Confident	70.9	Confident	45 Å²	45	81 Å²	81	28%	0.276	41%	0.409	S	S	.	.	H	α-helix	trans	-105.8	-24.5	-171.8	-51	0	0	0	0	112.9	P800 V803 L833 I834 V835 P839	P800-T837 HydrophobicContact CB-CG2 3.76Å; P800-T837 HydrophobicContact CG-CG2 3.99Å; V803-T837 HydrophobicContact CB-CG2 4.29Å; V803-T837 HydrophobicContact CG1-CG2 4.48Å; V803-T837 HydrophobicContact CG2-CG2 4.2Å; L833-T837 WeakPolarHBondContact O-CB 3.4Å; L833-T837 PolarHBondContact O-N 2.58Å; L833-T837 PolarHBondContact O-OG1 2.98Å; I834-T837 PolarHBondContact O-N 2.68Å; V835-T837 VanDerWaalsContact C-N 3.34Å; T837-P839 WeakPolarHBondContact O-CD 3.45Å
838	V	69	Low	69.2	Low	26 Å²	26	90.7 Å²	90.7	16%	0.158	44%	0.444	C	S	.	.	S	Bend	trans	-76.2	119.7	173.3	177.4	0	0	0	0	109.5	V803 I834 I842 F854	V803-V838 HydrophobicContact CG1-CG2 4.01Å; V803-V838 HydrophobicContact CG2-CG2 4.05Å; I834-V838 HydrophobicContact CG2-CG2 4.45Å; I834-V838 PolarHBondContact O-N 2.85Å; I834-V838 VanDerWaalsContact O-N 3.16Å; V838-I842 HydrophobicContact CG1-CD1 4.44Å; V838-F854 HydrophobicContact CG1-CZ 4.29Å
839	P	59.5	Low	67.6	Low	40 Å²	40	92.9 Å²	92.9	26%	0.26	45%	0.447	S	S	.	.			trans	-72.3	152	174.9	-11.7	27.1	0	0	0	111.9	R807 T837 E841 I842	R807-P839 VanDerWaalsContact NH2-CG 3.3Å; T837-P839 WeakPolarHBondContact O-CD 3.45Å; P839-E841 PolarHBondContact O-N 3.08Å; P839-E841 VanDerWaalsContact O-N 3.14Å; P839-I842 PolarHBondContact O-N 2.99Å
840	L	54.4	Low	65.8	Low	144 Å²	144	94 Å²	94	75%	0.754	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.5	178.5	-72.5	163.1	0	0	0	113.8	I842 H843	L840-I842 VanDerWaalsContact C-N 3.34Å; L840-I842 PolarHBondContact O-N 2.7Å; L840-H843 WeakPolarHBondContact O-CB 3.24Å; L840-H843 PolarHBondContact O-N 2.9Å
841	E	51.7	Low	64	Low	154 Å²	154	99.4 Å²	99.4	72%	0.72	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-35.8	-173.7	-66.9	161.4	160.6	0	0	112.8	P839 H843 L844	P839-E841 PolarHBondContact O-N 3.08Å; P839-E841 VanDerWaalsContact O-N 3.14Å; E841-H843 PolarHBondContact O-N 3.3Å; E841-H843 VanDerWaalsContact O-N 3.1Å; E841-L844 PolarHBondContact O-N 2.84Å
842	I	52.5	Low	62.4	Low	35 Å²	35	94.3 Å²	94.3	18%	0.179	48%	0.483	C	S	.	.	H	α-helix	trans	-68.5	-12.6	-178.7	-31.4	-177	0	0	0	111.8	V838 P839 L840 L844 F854	V838-I842 HydrophobicContact CG1-CD1 4.44Å; P839-I842 PolarHBondContact O-N 2.99Å; L840-I842 VanDerWaalsContact C-N 3.34Å; L840-I842 PolarHBondContact O-N 2.7Å; I842-L844 VanDerWaalsContact C-N 3.3Å; I842-L844 PolarHBondContact O-N 3.41Å; I842-F854 HydrophobicContact CB-CE1 3.82Å; I842-F854 HydrophobicContact CB-CZ 3.64Å; I842-F854 HydrophobicContact CD1-CZ 4.34Å; I842-F854 HydrophobicContact CG2-CD1 4.03Å; I842-F854 HydrophobicContact CG2-CE1 3.37Å; I842-F854 HydrophobicContact CG2-CE2 4.1Å; I842-F854 HydrophobicContact CG2-CZ 3.43Å; I842-F854 VanDerWaalsContact CG2-CZ 3.43Å; I842-F854 WeakPolarHBondContact O-CE1 3.32Å
843	H	49.8	Very low	60.8	Low	91 Å²	91	92 Å²	92	42%	0.421	48%	0.476	S	S	.	.	H	α-helix	trans	-70	-18.7	173.7	-71.6	-51.3	0	0	0	114.5	L840 E841 A847 L858	L840-H843 WeakPolarHBondContact O-CB 3.24Å; L840-H843 PolarHBondContact O-N 2.9Å; E841-H843 PolarHBondContact O-N 3.3Å; E841-H843 VanDerWaalsContact O-N 3.1Å; H843-A847 WeakPolarHBondContact O-CB 3.2Å; H843-L858 WeakPolarHBondContact ND1-CD1 3.23Å
844	L	46.2	Very low	59.1	Low	131 Å²	131	89.4 Å²	89.4	69%	0.686	46%	0.462	S	S	*	.	H	α-helix	trans	-98.6	-33	-166.3	-70.4	174	0	0	0	115.3	E841 I842	E841-L844 PolarHBondContact O-N 2.84Å; I842-L844 VanDerWaalsContact C-N 3.3Å; I842-L844 PolarHBondContact O-N 3.41Å
845	E	50.9	Low	57.5	Low	167 Å²	167	89.9 Å²	89.9	78%	0.78	47%	0.465	S	S	*	.	H	α-helix	trans	-87.7	-52.4	-178.9	-61.6	-160.7	123.7	0	0	111.8	A847 R848	E845-A847 VanDerWaalsContact C-N 3.31Å; E845-A847 PolarHBondContact O-N 2.17Å; E845-R848 WeakPolarHBondContact O-CB 2.81Å; E845-R848 WeakPolarHBondContact O-CG 3.43Å; E845-R848 PolarHBondContact O-N 2.18Å
846	D	49.9	Very low	56.4	Low	31 Å²	31	88.8 Å²	88.8	17%	0.166	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-77.7	-17.9	-171	-140.2	32.9	0	0	0	112.9	R848 K849 S852 F854 V855	D846-R848 PolarHBondContact O-N 2.17Å; D846-R848 VanDerWaalsContact O-N 3.09Å; D846-K849 PolarHBondContact O-N 2.16Å; D846-S852 VanDerWaalsContact OD2-CB 3.26Å; D846-S852 WeakPolarHBondContact OD2-CB 3.29Å; D846-S852 PolarHBondContact OD2-OG 3.38Å; D846-F854 HydrophobicContact CB-CD1 4.14Å; D846-F854 WeakPolarHBondContact OD2-CB 3.42Å; D846-V855 VanDerWaalsContact O-CG2 3.3Å; D846-V855 WeakPolarHBondContact O-CG2 3.44Å
847	A	48.4	Very low	55.3	Low	64 Å²	64	81.5 Å²	81.5	53%	0.529	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-60.8	-14.8	169.2	0	0	0	0	0	113.7	H843 E845 K849	H843-A847 WeakPolarHBondContact O-CB 3.2Å; E845-A847 VanDerWaalsContact C-N 3.31Å; E845-A847 PolarHBondContact O-N 2.17Å; A847-K849 VanDerWaalsContact C-N 3.26Å
848	R	52.1	Low	54.3	Low	215 Å²	215	82.8 Å²	82.8	81%	0.811	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-76.9	-11.3	170.8	-57.3	-177.4	-174.6	-164.6	1.5	113	E845 D846 P850	E845-R848 WeakPolarHBondContact O-CB 2.81Å; E845-R848 WeakPolarHBondContact O-CG 3.43Å; E845-R848 PolarHBondContact O-N 2.18Å; D846-R848 PolarHBondContact O-N 2.17Å; D846-R848 VanDerWaalsContact O-N 3.09Å; R848-P850 WeakPolarHBondContact O-CD 3.35Å
849	K	56.5	Low	53.4	Low	131 Å²	131	93.6 Å²	93.6	57%	0.57	48%	0.48	S	S	*	.			trans	-115.6	85.1	177.3	-67	176	-177.4	169.6	0	109.5	D846 A847 S851 S852	D846-K849 PolarHBondContact O-N 2.16Å; A847-K849 VanDerWaalsContact C-N 3.26Å; K849-S851 PolarHBondContact O-N 2.9Å; K849-S852 VanDerWaalsContact O-CB 3.27Å; K849-S852 WeakPolarHBondContact O-CB 3.47Å; K849-S852 PolarHBondContact O-N 2.86Å
850	P	52.4	Low	53	Low	113 Å²	113	96.3 Å²	96.3	73%	0.734	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-10.9	-178.3	26	-35.2	0	0	0	114.4	R848	R848-P850 WeakPolarHBondContact O-CD 3.35Å
851	S	56.8	Low	53	Low	113 Å²	113	93.7 Å²	93.7	79%	0.79	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-1.5	170.3	51.3	0	0	0	0	114.3	K849	K849-S851 PolarHBondContact O-N 2.9Å
852	S	55.6	Low	53	Low	13 Å²	13	90.4 Å²	90.4	9%	0.091	46%	0.464	C	S	.	.			trans	-64.6	134.1	-178.7	175.1	0	0	0	0	111.7	D846 K849 F854 V855 S856	D846-S852 VanDerWaalsContact OD2-CB 3.26Å; D846-S852 WeakPolarHBondContact OD2-CB 3.29Å; D846-S852 PolarHBondContact OD2-OG 3.38Å; K849-S852 VanDerWaalsContact O-CB 3.27Å; K849-S852 WeakPolarHBondContact O-CB 3.47Å; K849-S852 PolarHBondContact O-N 2.86Å; S852-F854 PolarHBondContact O-N 3.08Å; S852-F854 PolarHBondContact OG-N 2.99Å; S852-F854 VanDerWaalsContact OG-N 3.12Å; S852-V855 PolarHBondContact O-N 2.64Å; S852-V855 VanDerWaalsContact O-N 3.16Å; S852-S856 PolarHBondContact O-N 3.42Å
853	P	54.6	Low	53.1	Low	51 Å²	51	93.6 Å²	93.6	33%	0.331	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-29.1	170.2	-22.8	32.6	0	0	0	113.4	R815 A818 S856 F857	R815-P853 HydrophobicContact CG-CB 3.96Å; R815-P853 HydrophobicContact CG-CG 3.45Å; R815-P853 VanDerWaalsContact CG-CG 3.45Å; A818-P853 HydrophobicContact CB-CB 4.5Å; P853-S856 CarbonylContact O-C 3.36Å; P853-F857 WeakPolarHBondContact O-CB 3.43Å; P853-F857 PolarHBondContact O-N 3.25Å; P853-F857 VanDerWaalsContact O-N 3.14Å
854	F	53.1	Low	53.3	Low	13 Å²	13	93.8 Å²	93.8	6%	0.057	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-44.8	176.7	178.7	-102.8	0	0	0	111.5	L806 V838 I842 D846 S852 S856 F857 L858	L806-F854 HydrophobicContact CB-CD2 4.36Å; L806-F854 HydrophobicContact CD1-CD2 3.84Å; L806-F854 HydrophobicContact CD1-CE2 3.76Å; L806-F854 HydrophobicContact CG-CD2 4.47Å; V838-F854 HydrophobicContact CG1-CZ 4.29Å; I842-F854 HydrophobicContact CB-CE1 3.82Å; I842-F854 HydrophobicContact CB-CZ 3.64Å; I842-F854 HydrophobicContact CD1-CZ 4.34Å; I842-F854 HydrophobicContact CG2-CD1 4.03Å; I842-F854 HydrophobicContact CG2-CE1 3.37Å; I842-F854 HydrophobicContact CG2-CE2 4.1Å; I842-F854 HydrophobicContact CG2-CZ 3.43Å; I842-F854 VanDerWaalsContact CG2-CZ 3.43Å; I842-F854 WeakPolarHBondContact O-CE1 3.32Å; D846-F854 HydrophobicContact CB-CD1 4.14Å; D846-F854 WeakPolarHBondContact OD2-CB 3.42Å; S852-F854 PolarHBondContact O-N 3.08Å; S852-F854 PolarHBondContact OG-N 2.99Å; S852-F854 VanDerWaalsContact OG-N 3.12Å; F854-S856 VanDerWaalsContact C-N 3.29Å; F854-S856 PolarHBondContact O-N 3.39Å; F854-F857 HydrophobicContact CD2-CD1 4.46Å; F854-F857 WeakPolarHBondContact O-CA 3.48Å; F854-F857 WeakPolarHBondContact O-CB 3.33Å; F854-F857 PolarHBondContact O-N 2.88Å; F854-L858 HydrophobicContact CD1-CD1 4.02Å; F854-L858 HydrophobicContact CD1-CG 4.46Å; F854-L858 HydrophobicContact CE1-CD1 3.38Å; F854-L858 HydrophobicContact CE1-CG 4.02Å; F854-L858 HydrophobicContact CZ-CD1 3.76Å; F854-L858 HydrophobicContact CZ-CD2 4.12Å; F854-L858 HydrophobicContact CZ-CG 4.03Å; F854-L858 PolarHBondContact O-N 3.25Å
855	V	53.7	Low	53.8	Low	16 Å²	16	91.3 Å²	91.3	10%	0.097	47%	0.471	C	S	.	.	H	α-helix	trans	-60.4	-41.5	172.4	174	0	0	0	0	110.5	D846 S852 F857 L858 Y859	D846-V855 VanDerWaalsContact O-CG2 3.3Å; D846-V855 WeakPolarHBondContact O-CG2 3.44Å; S852-V855 PolarHBondContact O-N 2.64Å; S852-V855 VanDerWaalsContact O-N 3.16Å; V855-F857 PolarHBondContact O-N 3.11Å; V855-L858 PolarHBondContact O-N 3.42Å; V855-Y859 HydrophobicContact CG1-CD2 3.79Å; V855-Y859 HydrophobicContact CG1-CE2 3.69Å; V855-Y859 WeakPolarHBondContact O-CD2 3.27Å; V855-Y859 PolarHBondContact O-N 3.27Å
856	S	58.2	Low	54	Low	86 Å²	86	85.9 Å²	85.9	60%	0.601	45%	0.449	S	S	*	.	H	α-helix	trans	-69.6	-5.2	174.1	-158.2	0	0	0	0	115	S852 P853 F854	S852-S856 PolarHBondContact O-N 3.42Å; P853-S856 CarbonylContact O-C 3.36Å; F854-S856 VanDerWaalsContact C-N 3.29Å; F854-S856 PolarHBondContact O-N 3.39Å
857	F	59.4	Low	54.3	Low	33 Å²	33	90.2 Å²	90.2	15%	0.145	47%	0.471	C	S	.	.	H	α-helix	trans	-102.6	-28.3	172.7	160.8	-101.9	0	0	0	112.4	A818 L821 R822 I834 P853 F854 V855	A818-F857 HydrophobicContact CB-CB 4.21Å; L821-F857 HydrophobicContact CB-CD2 4.13Å; L821-F857 HydrophobicContact CB-CE2 3.47Å; L821-F857 VanDerWaalsContact CB-CE2 3.47Å; L821-F857 HydrophobicContact CB-CZ 3.71Å; L821-F857 HydrophobicContact CD1-CE1 4.29Å; L821-F857 HydrophobicContact CD1-CZ 4.14Å; L821-F857 HydrophobicContact CG-CZ 4.48Å; R822-F857 HydrophobicContact CB-CD2 4.06Å; I834-F857 HydrophobicContact CG2-CZ 3.89Å; P853-F857 WeakPolarHBondContact O-CB 3.43Å; P853-F857 PolarHBondContact O-N 3.25Å; P853-F857 VanDerWaalsContact O-N 3.14Å; F854-F857 HydrophobicContact CD2-CD1 4.46Å; F854-F857 WeakPolarHBondContact O-CA 3.48Å; F854-F857 WeakPolarHBondContact O-CB 3.33Å; F854-F857 PolarHBondContact O-N 2.88Å; V855-F857 PolarHBondContact O-N 3.11Å
858	L	54.8	Low	54.8	Low	72 Å²	72	92.3 Å²	92.3	38%	0.377	47%	0.466	S	S	.	.	H	α-helix	trans	-75.8	-22.9	173.9	-69.2	-179.3	0	0	0	113.8	H843 F854 V855	H843-L858 WeakPolarHBondContact ND1-CD1 3.23Å; F854-L858 HydrophobicContact CD1-CD1 4.02Å; F854-L858 HydrophobicContact CD1-CG 4.46Å; F854-L858 HydrophobicContact CE1-CD1 3.38Å; F854-L858 HydrophobicContact CE1-CG 4.02Å; F854-L858 HydrophobicContact CZ-CD1 3.76Å; F854-L858 HydrophobicContact CZ-CD2 4.12Å; F854-L858 HydrophobicContact CZ-CG 4.03Å; F854-L858 PolarHBondContact O-N 3.25Å; V855-L858 PolarHBondContact O-N 3.42Å
859	Y	50.1	Low	55	Low	252 Å²	252	81.2 Å²	81.2	99%	0.988	44%	0.435	S	S	*	.			trans	-89	0	174.4	-81.4	-65.9	0	0	0	113.3	V855	V855-Y859 HydrophobicContact CG1-CD2 3.79Å; V855-Y859 HydrophobicContact CG1-CE2 3.69Å; V855-Y859 WeakPolarHBondContact O-CD2 3.27Å; V855-Y859 PolarHBondContact O-N 3.27Å

Retrieved 859 of 859 residues in 1195.9 ms (Link to these results)

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