A0A087X3D3_POEFO Loading...

Pyrroline-5-carboxylate reductase

Oxidoreductase that catalyzes the last step in proline biosynthesis, which corresponds to the reduction of pyrroline-5-carboxylate (P5C) to L-proline using NAD(P)H. Proline is synthesized from either glutamate or ornithine; both are converted to P5C, and then to proline via pyrroline-5-carboxylate reductases (PYCRs). PYCR3 is exclusively linked to the biosynthesis of proline from ornithine.

AlphaFold DB , UniProt , Accession A0A087X3D3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 271 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.9	Very low	74.4	Confident	222 Å²	222	69.8 Å²	69.8	100%	1.094	35%	0.352	S	S	*	.				0	127.9	0	-79.8	179.4	-107.4	0	0	106.5	P3	M1-P3 VanDerWaalsContact O-CD 3.31Å; M1-P3 WeakPolarHBondContact O-CD 3.5Å
2	N	50.2	Low	76.4	Confident	75 Å²	75	64.1 Å²	64.1	40%	0.401	32%	0.323	S	S	.	.			trans	-67	116	-179.6	-164.2	11.1	0	0	0	108.2	D4 A5	N2-D4 PolarHBondContact ND2-OD2 2.95Å; N2-D4 PolarHBondContact O-N 2.89Å; N2-D4 VanDerWaalsContact O-N 3.07Å; N2-D4 PolarHBondContact OD1-OD2 3.2Å; N2-A5 WeakPolarHBondContact O-CB 3.27Å; N2-A5 PolarHBondContact O-N 3.24Å
3	P	52.8	Low	78	Confident	89 Å²	89	59.8 Å²	59.8	58%	0.578	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-56.5	-25	-175.7	19.6	-31.4	0	0	0	113	M1 A5 Q6	M1-P3 VanDerWaalsContact O-CD 3.31Å; M1-P3 WeakPolarHBondContact O-CD 3.5Å; P3-A5 VanDerWaalsContact C-N 3.25Å; P3-A5 PolarHBondContact O-N 2.77Å; P3-Q6 PolarHBondContact O-N 3.16Å
4	D	55.7	Low	79.3	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.08	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-62.7	-28.1	177.1	-51.7	-30.2	0	0	0	113.9	N2 Q6 Q7 S151 L152	N2-D4 PolarHBondContact ND2-OD2 2.95Å; N2-D4 PolarHBondContact O-N 2.89Å; N2-D4 VanDerWaalsContact O-N 3.07Å; N2-D4 PolarHBondContact OD1-OD2 3.2Å; D4-Q6 PolarHBondContact O-N 2.96Å; D4-Q6 VanDerWaalsContact O-N 3.12Å; D4-Q7 PolarHBondContact O-N 3.48Å; D4-S151 WeakPolarHBondContact OD2-CB 3.5Å; D4-S151 PolarHBondContact OD2-OG 2.9Å; D4-L152 HydrophobicContact CB-CD2 4.49Å
5	A	58.6	Low	80.4	Confident	35 Å²	35	53.9 Å²	53.9	29%	0.289	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-70.6	-7.3	-176.7	0	0	0	0	0	113.5	N2 P3 N34	N2-A5 WeakPolarHBondContact O-CB 3.27Å; N2-A5 PolarHBondContact O-N 3.24Å; P3-A5 VanDerWaalsContact C-N 3.25Å; P3-A5 PolarHBondContact O-N 2.77Å; A5-N34 PolarHBondContact O-ND2 3.46Å
6	Q	75.3	Confident	81.2	Confident	143 Å²	143	55.7 Å²	55.7	67%	0.668	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-109.4	-11	179.3	-69.8	-176.2	-6.3	0	0	114	P3 D4	P3-Q6 PolarHBondContact O-N 3.16Å; D4-Q6 PolarHBondContact O-N 2.96Å; D4-Q6 VanDerWaalsContact O-N 3.12Å
7	Q	89.1	Confident	82	Confident	51 Å²	51	55.1 Å²	55.1	24%	0.238	29%	0.291	C	S	.	.			trans	-70.1	133.3	-177.4	-66	-65.7	-20.9	0	0	111.1	D4 N34 D67 L148	D4-Q7 PolarHBondContact O-N 3.48Å; Q7-N34 WeakPolarHBondContact O-CB 3.34Å; Q7-D67 PolarHBondContact OE1-OD2 2.97Å; Q7-L148 HydrophobicContact CG-CD1 4.12Å
8	R	96.6	Very high	82.8	Confident	138 Å²	138	52.1 Å²	52.1	52%	0.521	28%	0.275	S	S	.	.			trans	-90.5	124	175.3	-60.7	-177.4	-176.1	-172.4	2.7	109.7	N34 V65 S66 D67 V68	R8-N34 CarbonylContact C-O 3.38Å; R8-N34 WeakPolarHBondContact CA-O 3.39Å; R8-V65 WeakPolarHBondContact CB-O 3.31Å; R8-V65 WeakPolarHBondContact CD-O 3.34Å; R8-S66 CarbonylContact O-C 3.57Å; R8-S66 WeakPolarHBondContact O-CA 3.41Å; R8-D67 WeakPolarHBondContact CB-OD2 3.47Å; R8-D67 PolarHBondContact N-OD2 3.37Å; R8-D67 PolarHBondContact O-N 3.49Å; R8-V68 PolarHBondContact O-N 3.16Å
9	I	98.1	Very high	83.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128	-172.7	-62.9	146.1	0	0	0	109.5	F11 M25 V30 N34 I35 K36 V68 F70 L152	I9-F11 HydrophobicContact CG2-CD2 4.27Å; I9-F11 HydrophobicContact CG2-CE2 3.62Å; I9-F11 HydrophobicContact CG2-CZ 4.09Å; I9-M25 HydrophobicContact CD1-SD 4.01Å; I9-M25 HydrophobicContact CG2-CE 4.34Å; I9-M25 HydrophobicContact CG2-SD 3.97Å; I9-V30 HydrophobicContact CD1-CB 4.39Å; I9-V30 HydrophobicContact CD1-CG1 3.54Å; I9-V30 HydrophobicContact CD1-CG2 3.93Å; I9-N34 PolarHBondContact N-O 2.97Å; I9-I35 HydrophobicContact CB-CG1 4.42Å; I9-I35 CarbonylContact O-C 3.41Å; I9-I35 VanDerWaalsContact O-CA 3.28Å; I9-I35 WeakPolarHBondContact O-CA 3.41Å; I9-K36 PolarHBondContact O-N 3.23Å; I9-V68 CarbonylContact C-O 3.55Å; I9-V68 WeakPolarHBondContact CA-O 3.45Å; I9-F70 HydrophobicContact CG2-CD2 3.86Å; I9-F70 HydrophobicContact CG2-CE2 3.83Å; I9-L152 HydrophobicContact CD1-CD2 3.86Å
10	G	98.3	Very high	84.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	140.5	178.5	0	0	0	0	0	111.8	K36 S66 V68 V69 F70	G10-K36 CarbonylContact C-O 3.59Å; G10-K36 WeakPolarHBondContact CA-O 3.33Å; G10-S66 VanDerWaalsContact CA-OG 3.23Å; G10-S66 WeakPolarHBondContact CA-OG 3.32Å; G10-S66 PolarHBondContact N-OG 2.97Å; G10-V68 PolarHBondContact N-O 2.93Å; G10-V69 CarbonylContact O-C 3.53Å; G10-V69 WeakPolarHBondContact O-CA 3.34Å; G10-F70 PolarHBondContact O-N 3.43Å
11	F	98.6	Very high	84.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.6	166.3	-66.7	-93	0	0	0	109.9	I9 A18 I21 A22 M25 I35 K36 V37 S38 F70	I9-F11 HydrophobicContact CG2-CD2 4.27Å; I9-F11 HydrophobicContact CG2-CE2 3.62Å; I9-F11 HydrophobicContact CG2-CZ 4.09Å; F11-A18 HydrophobicContact CB-CB 4.27Å; F11-A18 HydrophobicContact CD1-CB 3.65Å; F11-A18 HydrophobicContact CE1-CB 4.35Å; F11-A18 HydrophobicContact CG-CB 4.18Å; F11-I21 HydrophobicContact CE1-CB 4.08Å; F11-I21 HydrophobicContact CE1-CG2 3.85Å; F11-I21 HydrophobicContact CZ-CB 4.31Å; F11-I21 HydrophobicContact CZ-CG2 3.81Å; F11-A22 HydrophobicContact CE2-CB 3.97Å; F11-A22 HydrophobicContact CZ-CB 4.09Å; F11-M25 HydrophobicContact CE2-SD 4.35Å; F11-M25 HydrophobicContact CZ-CE 4.41Å; F11-M25 HydrophobicContact CZ-SD 3.92Å; F11-I35 HydrophobicContact CD2-CG2 3.74Å; F11-I35 HydrophobicContact CE2-CG2 3.69Å; F11-K36 PolarHBondContact N-O 3.09Å; F11-V37 HydrophobicContact CB-CB 4.41Å; F11-V37 HydrophobicContact CB-CG1 4.18Å; F11-V37 HydrophobicContact CB-CG2 4.06Å; F11-V37 HydrophobicContact CD2-CG2 4.07Å; F11-V37 HydrophobicContact CG-CG2 4.41Å; F11-V37 CarbonylContact O-C 3.55Å; F11-V37 WeakPolarHBondContact O-CA 3.49Å; F11-S38 PolarHBondContact O-N 2.73Å; F11-F70 CarbonylContact C-O 3.57Å; F11-F70 WeakPolarHBondContact CA-O 3.47Å; F11-F70 HydrophobicContact CD1-CB 3.44Å; F11-F70 VanDerWaalsContact CD1-CB 3.44Å; F11-F70 HydrophobicContact CD1-CD2 4.32Å; F11-F70 AromaticContact CD1-CG 3.98Å; F11-F70 HydrophobicContact CD1-CG 3.98Å; F11-F70 HydrophobicContact CE1-CB 3.64Å; F11-F70 HydrophobicContact CE1-CD1 4.22Å; F11-F70 AromaticContact CE1-CD2 3.83Å; F11-F70 HydrophobicContact CE1-CD2 3.83Å; F11-F70 AromaticContact CE1-CG 3.62Å; F11-F70 HydrophobicContact CE1-CG 3.62Å; F11-F70 HydrophobicContact CG-CB 4.2Å; F11-F70 AromaticContact CZ-CD2 3.95Å; F11-F70 HydrophobicContact CZ-CD2 3.95Å; F11-F70 HydrophobicContact CZ-CE2 4.44Å; F11-F70 HydrophobicContact CZ-CG 4.22Å
12	I	98.4	Very high	87.4	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	105.9	166	-60	173.3	0	0	0	108.1	S38 N59 V62 V63 V69 F70 A72 V73 V81 V85	I12-S38 WeakPolarHBondContact CA-OG 3.49Å; I12-N59 HydrophobicContact CD1-CB 4.33Å; I12-N59 HydrophobicContact CG1-CB 4.41Å; I12-N59 HydrophobicContact CG2-CB 4.3Å; I12-N59 WeakPolarHBondContact CG2-OD1 3.43Å; I12-V62 HydrophobicContact CG1-CG1 4.34Å; I12-V63 HydrophobicContact CD1-CG2 3.81Å; I12-V69 HydrophobicContact CD1-CG1 3.81Å; I12-V69 HydrophobicContact CG1-CG1 4.03Å; I12-F70 PolarHBondContact N-O 2.86Å; I12-A72 CarbonylContact O-C 3.56Å; I12-A72 WeakPolarHBondContact O-CA 3.43Å; I12-A72 PolarHBondContact O-N 3.19Å; I12-V73 HydrophobicContact CG2-CG1 4.13Å; I12-V81 HydrophobicContact CD1-CG1 4.32Å; I12-V81 HydrophobicContact CG2-CG1 3.54Å; I12-V85 HydrophobicContact CD1-CG1 4.2Å; I12-V85 HydrophobicContact CD1-CG2 4.42Å
13	G	97.4	Very high	89.6	Confident	9 Å²	9	36.1 Å²	36.1	9%	0.093	19%	0.189	C	C	.	.	S	Bend	trans	104.3	125.5	-173.4	0	0	0	0	0	112.4	G15 A18 S38	G13-G15 PolarHBondContact O-N 3.16Å; G13-A18 WeakPolarHBondContact O-CB 3.31Å; G13-S38 CarbonylContact C-O 3.51Å; G13-S38 VanDerWaalsContact CA-O 3.22Å; G13-S38 WeakPolarHBondContact CA-O 3.41Å; G13-S38 PolarHBondContact N-O 2.88Å
14	A	96.9	Very high	91.6	Very high	4 Å²	4	31.9 Å²	31.9	3%	0.033	16%	0.161	C	C	.	.			trans	-97.9	33.3	-178.8	0	0	0	0	0	113.3	V37 S38 A39 H44 L45 R47 F48	A14-V37 HydrophobicContact CB-CG1 3.76Å; A14-S38 PolarHBondContact N-O 3.41Å; A14-A39 HydrophobicContact CB-CB 3.67Å; A14-H44 HydrophobicContact CB-CB 4.05Å; A14-H44 VanDerWaalsContact O-CB 3.24Å; A14-H44 WeakPolarHBondContact O-CB 3.41Å; A14-L45 HydrophobicContact CB-CD2 3.78Å; A14-R47 PolarHBondContact O-NH2 3.33Å; A14-F48 HydrophobicContact CB-CD2 4.23Å; A14-F48 HydrophobicContact CB-CE2 3.66Å; A14-F48 HydrophobicContact CB-CZ 4.37Å
15	G	94.9	Very high	93.5	Very high	27 Å²	27	31.3 Å²	31.3	28%	0.278	16%	0.158	S	C	.	.	S	Bend	trans	-74.8	178.1	-178.5	0	0	0	0	0	114.1	G13 M17 A18 F19 R47	G13-G15 PolarHBondContact O-N 3.16Å; G15-M17 VanDerWaalsContact C-N 3.27Å; G15-M17 PolarHBondContact O-N 3.25Å; G15-A18 PolarHBondContact O-N 2.98Å; G15-F19 PolarHBondContact O-N 3.28Å; G15-R47 PolarHBondContact O-NH2 3.31Å
16	N	94.2	Very high	95.2	Very high	82 Å²	82	31.6 Å²	31.6	44%	0.439	16%	0.155	S	C	.	.	H	α-helix	trans	-58.4	-36.5	-179.1	-75	-13.2	0	0	0	113.2	F19 G20 R47 L127	N16-F19 PolarHBondContact O-N 2.94Å; N16-G20 PolarHBondContact O-N 3.37Å; N16-R47 PolarHBondContact OD1-NH1 3.1Å; N16-L127 HydrophobicContact CB-CD1 4.49Å; N16-L127 HydrophobicContact CB-CD2 4.39Å; N16-L127 WeakPolarHBondContact O-CD2 3.12Å
17	M	94.5	Very high	96	Very high	46 Å²	46	28.3 Å²	28.3	23%	0.227	15%	0.147	C	C	.	.	H	α-helix	trans	-66.9	-47	178.8	-65.8	-59.9	93.2	0	0	111.4	G15 F19 G20 I21 P122 L124	G15-M17 VanDerWaalsContact C-N 3.27Å; G15-M17 PolarHBondContact O-N 3.25Å; M17-F19 VanDerWaalsContact C-N 3.26Å; M17-F19 PolarHBondContact O-N 3.42Å; M17-G20 PolarHBondContact O-N 2.97Å; M17-I21 WeakPolarHBondContact O-CB 3.31Å; M17-I21 VanDerWaalsContact O-CG1 3.29Å; M17-I21 WeakPolarHBondContact O-CG1 3.34Å; M17-I21 PolarHBondContact O-N 3.05Å; M17-P122 HydrophobicContact CB-CG 4.39Å; M17-P122 HydrophobicContact CG-CG 4.21Å; M17-P122 HydrophobicContact SD-CB 4.14Å; M17-P122 HydrophobicContact SD-CG 3.69Å; M17-L124 HydrophobicContact CE-CD1 3.95Å
18	A	96.9	Very high	96	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-56.5	-42.4	173.8	0	0	0	0	0	111.8	F11 G13 G15 A22 F48 A72	F11-A18 HydrophobicContact CB-CB 4.27Å; F11-A18 HydrophobicContact CD1-CB 3.65Å; F11-A18 HydrophobicContact CE1-CB 4.35Å; F11-A18 HydrophobicContact CG-CB 4.18Å; G13-A18 WeakPolarHBondContact O-CB 3.31Å; G15-A18 PolarHBondContact O-N 2.98Å; A18-A22 WeakPolarHBondContact O-CB 3.46Å; A18-A22 PolarHBondContact O-N 3.46Å; A18-F48 HydrophobicContact CB-CZ 4.09Å; A18-A72 HydrophobicContact CB-CB 3.86Å
19	F	97	Very high	95.5	Very high	36 Å²	36	25 Å²	25	16%	0.158	15%	0.146	C	C	.	.	H	α-helix	trans	-67	-44.7	179.8	-174.1	-104.9	0	0	0	113	G15 N16 M17 K23 R47 F48 L51 L127	G15-F19 PolarHBondContact O-N 3.28Å; N16-F19 PolarHBondContact O-N 2.94Å; M17-F19 VanDerWaalsContact C-N 3.26Å; M17-F19 PolarHBondContact O-N 3.42Å; F19-K23 WeakPolarHBondContact O-CB 3.39Å; F19-K23 PolarHBondContact O-N 2.99Å; F19-R47 VanDerWaalsContact CB-CZ 3.46Å; F19-R47 HydrophobicContact CD2-CB 4.29Å; F19-R47 VanDerWaalsContact CD2-CD 3.43Å; F19-R47 HydrophobicContact CD2-CG 3.68Å; F19-R47 HydrophobicContact CE2-CB 3.73Å; F19-R47 HydrophobicContact CE2-CG 3.65Å; F19-R47 WeakPolarHBondContact CE2-O 3.43Å; F19-R47 HydrophobicContact CG-CG 4.45Å; F19-R47 HydrophobicContact CZ-CB 4.21Å; F19-R47 HydrophobicContact CZ-CG 4.4Å; F19-F48 HydrophobicContact CB-CE1 4.17Å; F19-F48 HydrophobicContact CB-CE2 4.22Å; F19-F48 HydrophobicContact CB-CZ 3.65Å; F19-F48 HydrophobicContact CD2-CD1 4.2Å; F19-F48 HydrophobicContact CD2-CD2 4.33Å; F19-F48 AromaticContact CD2-CE1 3.99Å; F19-F48 HydrophobicContact CD2-CE1 3.99Å; F19-F48 HydrophobicContact CD2-CE2 4.09Å; F19-F48 HydrophobicContact CD2-CG 4.4Å; F19-F48 AromaticContact CD2-CZ 3.94Å; F19-F48 HydrophobicContact CD2-CZ 3.94Å; F19-F48 HydrophobicContact CG-CZ 4.31Å; F19-L51 HydrophobicContact CD2-CD1 4.31Å; F19-L51 HydrophobicContact CE2-CD1 3.54Å; F19-L51 HydrophobicContact CE2-CG 4.39Å; F19-L51 HydrophobicContact CZ-CD1 4.06Å; F19-L127 HydrophobicContact CD1-CD2 3.95Å
20	G	96.6	Very high	95.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.7	-47	177.5	0	0	0	0	0	112.2	N16 M17 K23 G24 Q129	N16-G20 PolarHBondContact O-N 3.37Å; M17-G20 PolarHBondContact O-N 2.97Å; G20-K23 PolarHBondContact O-N 3.25Å; G20-G24 PolarHBondContact O-N 3.47Å; G20-Q129 PolarHBondContact O-NE2 3.09Å
21	I	97.4	Very high	95.2	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-62.8	-49.1	178.1	-66.3	168.5	0	0	0	110.7	F11 M17 K23 G24 M25 F70 V98 L120 P122 L153	F11-I21 HydrophobicContact CE1-CB 4.08Å; F11-I21 HydrophobicContact CE1-CG2 3.85Å; F11-I21 HydrophobicContact CZ-CB 4.31Å; F11-I21 HydrophobicContact CZ-CG2 3.81Å; M17-I21 WeakPolarHBondContact O-CB 3.31Å; M17-I21 VanDerWaalsContact O-CG1 3.29Å; M17-I21 WeakPolarHBondContact O-CG1 3.34Å; M17-I21 PolarHBondContact O-N 3.05Å; I21-K23 VanDerWaalsContact C-N 3.3Å; I21-K23 PolarHBondContact O-N 3.5Å; I21-G24 PolarHBondContact O-N 2.63Å; I21-G24 VanDerWaalsContact O-N 3.07Å; I21-M25 HydrophobicContact CG2-CE 3.67Å; I21-M25 HydrophobicContact CG2-CG 4.47Å; I21-M25 HydrophobicContact CG2-SD 4.07Å; I21-M25 WeakPolarHBondContact O-CG 3.27Å; I21-M25 PolarHBondContact O-N 3.33Å; I21-F70 HydrophobicContact CD1-CD1 4.48Å; I21-F70 HydrophobicContact CG2-CE1 4.29Å; I21-V98 HydrophobicContact CD1-CG1 4.03Å; I21-L120 HydrophobicContact CD1-CD2 4.27Å; I21-P122 HydrophobicContact CD1-CG 4.35Å; I21-L153 HydrophobicContact CG2-CD2 3.53Å
22	A	97.3	Very high	95.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-43.3	178.3	0	0	0	0	0	111.4	F11 A18 G24 M25 L26 F48 I53	F11-A22 HydrophobicContact CE2-CB 3.97Å; F11-A22 HydrophobicContact CZ-CB 4.09Å; A18-A22 WeakPolarHBondContact O-CB 3.46Å; A18-A22 PolarHBondContact O-N 3.46Å; A22-G24 VanDerWaalsContact C-N 3.29Å; A22-G24 PolarHBondContact O-N 3.42Å; A22-M25 PolarHBondContact O-N 3.48Å; A22-L26 VanDerWaalsContact O-CG 3.28Å; A22-L26 WeakPolarHBondContact O-CG 3.05Å; A22-L26 PolarHBondContact O-N 2.99Å; A22-F48 HydrophobicContact CB-CD1 4.5Å; A22-F48 HydrophobicContact CB-CE1 4.08Å; A22-I53 HydrophobicContact CB-CD1 4.09Å
23	K	96.3	Very high	95	Very high	82 Å²	82	36.3 Å²	36.3	36%	0.357	22%	0.22	S	C	.	.	H	α-helix	trans	-62.6	-35.8	176.6	-172.2	-177.3	176	-172.4	0	112.4	F19 G20 I21 S27	F19-K23 WeakPolarHBondContact O-CB 3.39Å; F19-K23 PolarHBondContact O-N 2.99Å; G20-K23 PolarHBondContact O-N 3.25Å; I21-K23 VanDerWaalsContact C-N 3.3Å; I21-K23 PolarHBondContact O-N 3.5Å; K23-S27 PolarHBondContact O-N 2.9Å; K23-S27 VanDerWaalsContact O-N 3.09Å; K23-S27 PolarHBondContact O-OG 3.5Å
24	G	95.4	Very high	95	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-48.6	174.8	0	0	0	0	0	111.6	G20 I21 A22 L26 S27 G28 Q129 C155	G20-G24 PolarHBondContact O-N 3.47Å; I21-G24 PolarHBondContact O-N 2.63Å; I21-G24 VanDerWaalsContact O-N 3.07Å; A22-G24 VanDerWaalsContact C-N 3.29Å; A22-G24 PolarHBondContact O-N 3.42Å; G24-L26 VanDerWaalsContact C-N 3.3Å; G24-L26 PolarHBondContact O-N 3.09Å; G24-S27 WeakPolarHBondContact O-CB 3.46Å; G24-S27 PolarHBondContact O-N 3.35Å; G24-G28 PolarHBondContact O-N 2.88Å; G24-G28 VanDerWaalsContact O-N 3.14Å; G24-Q129 VanDerWaalsContact CA-CD 3.41Å; G24-C155 WeakPolarHBondContact O-CB 3.36Å
25	M	95.8	Very high	95.1	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-55.8	-43.2	175.4	-71.2	174.5	171	0	0	112.6	I9 F11 I21 A22 S27 G28 N29 V30 I35 F70 L152 L153	I9-M25 HydrophobicContact CD1-SD 4.01Å; I9-M25 HydrophobicContact CG2-CE 4.34Å; I9-M25 HydrophobicContact CG2-SD 3.97Å; F11-M25 HydrophobicContact CE2-SD 4.35Å; F11-M25 HydrophobicContact CZ-CE 4.41Å; F11-M25 HydrophobicContact CZ-SD 3.92Å; I21-M25 HydrophobicContact CG2-CE 3.67Å; I21-M25 HydrophobicContact CG2-CG 4.47Å; I21-M25 HydrophobicContact CG2-SD 4.07Å; I21-M25 WeakPolarHBondContact O-CG 3.27Å; I21-M25 PolarHBondContact O-N 3.33Å; A22-M25 PolarHBondContact O-N 3.48Å; M25-S27 VanDerWaalsContact C-N 3.32Å; M25-S27 PolarHBondContact O-N 3.25Å; M25-G28 PolarHBondContact O-N 3.49Å; M25-N29 PolarHBondContact O-N 3.25Å; M25-V30 HydrophobicContact CB-CB 4.03Å; M25-V30 HydrophobicContact CB-CG2 3.93Å; M25-V30 WeakPolarHBondContact O-CB 3.5Å; M25-V30 PolarHBondContact O-N 3.13Å; M25-V30 VanDerWaalsContact O-N 3.15Å; M25-I35 HydrophobicContact CB-CD1 4.49Å; M25-F70 HydrophobicContact CE-CD2 4.36Å; M25-F70 HydrophobicContact CE-CE1 4.26Å; M25-F70 HydrophobicContact CE-CE2 3.35Å; M25-F70 HydrophobicContact CE-CZ 3.29Å; M25-L152 HydrophobicContact CE-CB 3.96Å; M25-L152 WeakPolarHBondContact CG-O 3.12Å; M25-L153 HydrophobicContact CE-CD2 3.61Å
26	L	94.9	Very high	95.2	Very high	41 Å²	41	38.1 Å²	38.1	22%	0.215	22%	0.219	C	C	.	.	H	α-helix	trans	-65.3	-33.1	176.1	-69.5	-176.2	0	0	0	113.2	A22 G24 G28 V30 P32 I35 L51 I53	A22-L26 VanDerWaalsContact O-CG 3.28Å; A22-L26 WeakPolarHBondContact O-CG 3.05Å; A22-L26 PolarHBondContact O-N 2.99Å; G24-L26 VanDerWaalsContact C-N 3.3Å; G24-L26 PolarHBondContact O-N 3.09Å; L26-G28 VanDerWaalsContact C-N 3.27Å; L26-V30 VanDerWaalsContact CD2-O 3.23Å; L26-V30 WeakPolarHBondContact CD2-O 3.46Å; L26-P32 HydrophobicContact CD2-CB 4.13Å; L26-P32 HydrophobicContact CD2-CG 3.65Å; L26-I35 HydrophobicContact CD2-CD1 3.76Å; L26-I35 HydrophobicContact CG-CD1 4.12Å; L26-L51 HydrophobicContact CD1-CB 3.88Å; L26-L51 HydrophobicContact CD1-CD1 4.07Å; L26-L51 HydrophobicContact CD1-CG 4.41Å; L26-I53 HydrophobicContact CD1-CD1 4.02Å; L26-I53 HydrophobicContact CD1-CG1 4.44Å
27	S	92.4	Very high	95.5	Very high	74 Å²	74	34.2 Å²	34.2	52%	0.517	20%	0.198	S	C	.	.	H	α-helix	trans	-74.8	-20.5	178.5	-56.3	0	0	0	0	112.6	K23 G24 M25	K23-S27 PolarHBondContact O-N 2.9Å; K23-S27 VanDerWaalsContact O-N 3.09Å; K23-S27 PolarHBondContact O-OG 3.5Å; G24-S27 WeakPolarHBondContact O-CB 3.46Å; G24-S27 PolarHBondContact O-N 3.35Å; M25-S27 VanDerWaalsContact C-N 3.32Å; M25-S27 PolarHBondContact O-N 3.25Å
28	G	87.7	Confident	95.6	Very high	16 Å²	16	32 Å²	32	17%	0.165	19%	0.187	C	C	.	.	H	α-helix	trans	-77.2	-103.2	167.7	0	0	0	0	0	110.3	G24 M25 L26 C155	G24-G28 PolarHBondContact O-N 2.88Å; G24-G28 VanDerWaalsContact O-N 3.14Å; M25-G28 PolarHBondContact O-N 3.49Å; L26-G28 VanDerWaalsContact C-N 3.27Å; G28-C155 WeakPolarHBondContact CA-SG 3.25Å
29	N	86.8	Confident	95.6	Very high	104 Å²	104	32.3 Å²	32.3	56%	0.556	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-145.5	11.5	-176.4	-68.9	-65.8	0	0	0	113.9	M25	M25-N29 PolarHBondContact O-N 3.25Å
30	V	94.7	Very high	95.5	Very high	8 Å²	8	36.7 Å²	36.7	5%	0.048	22%	0.222	C	C	.	.			trans	-78.8	127.9	176.9	179.4	0	0	0	0	108.8	I9 M25 L26 N34 I35 L152	I9-V30 HydrophobicContact CD1-CB 4.39Å; I9-V30 HydrophobicContact CD1-CG1 3.54Å; I9-V30 HydrophobicContact CD1-CG2 3.93Å; M25-V30 HydrophobicContact CB-CB 4.03Å; M25-V30 HydrophobicContact CB-CG2 3.93Å; M25-V30 WeakPolarHBondContact O-CB 3.5Å; M25-V30 PolarHBondContact O-N 3.13Å; M25-V30 VanDerWaalsContact O-N 3.15Å; L26-V30 VanDerWaalsContact CD2-O 3.23Å; L26-V30 WeakPolarHBondContact CD2-O 3.46Å; V30-N34 HydrophobicContact CG1-CB 4.37Å; V30-I35 HydrophobicContact CG1-CD1 3.84Å; V30-I35 HydrophobicContact CG1-CG1 3.74Å; V30-L152 HydrophobicContact CG2-CD2 3.94Å
31	L	95.7	Very high	95.3	Very high	101 Å²	101	39.3 Å²	39.3	53%	0.529	24%	0.24	S	C	.	.			trans	-76.2	141.4	176.4	-62.4	176.5	0	0	0	110.5	A33 N34	L31-A33 PolarHBondContact O-N 3.37Å; L31-A33 VanDerWaalsContact O-N 3.12Å; L31-N34 WeakPolarHBondContact O-CB 3.49Å; L31-N34 PolarHBondContact O-N 3.44Å
32	P	96.6	Very high	95	Very high	42 Å²	42	43 Å²	43	27%	0.273	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-53.9	-34.2	174.8	-25.1	31.7	0	0	0	113.9	L26 N34 I35 L51 G52 I53	L26-P32 HydrophobicContact CD2-CB 4.13Å; L26-P32 HydrophobicContact CD2-CG 3.65Å; P32-N34 PolarHBondContact O-N 3.49Å; P32-I35 PolarHBondContact O-N 3.23Å; P32-L51 VanDerWaalsContact CB-O 3.3Å; P32-L51 WeakPolarHBondContact CB-O 3.28Å; P32-L51 WeakPolarHBondContact CG-O 3.31Å; P32-G52 WeakPolarHBondContact CB-O 3.49Å; P32-I53 HydrophobicContact CB-CG1 4.16Å
33	A	96.4	Very high	94.7	Very high	88 Å²	88	48.2 Å²	48.2	73%	0.727	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-63.6	-19.8	177.5	0	0	0	0	0	113.9	L31	L31-A33 PolarHBondContact O-N 3.37Å; L31-A33 VanDerWaalsContact O-N 3.12Å
34	N	96.9	Very high	94.5	Very high	34 Å²	34	48.9 Å²	48.9	18%	0.182	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-89.9	-6.2	176.7	-66.5	-8.9	0	0	0	112.6	A5 Q7 R8 I9 V30 L31 P32	A5-N34 PolarHBondContact O-ND2 3.46Å; Q7-N34 WeakPolarHBondContact O-CB 3.34Å; R8-N34 CarbonylContact C-O 3.38Å; R8-N34 WeakPolarHBondContact CA-O 3.39Å; I9-N34 PolarHBondContact N-O 2.97Å; V30-N34 HydrophobicContact CG1-CB 4.37Å; L31-N34 WeakPolarHBondContact O-CB 3.49Å; L31-N34 PolarHBondContact O-N 3.44Å; P32-N34 PolarHBondContact O-N 3.49Å
35	I	98.2	Very high	94.5	Very high	1 Å²	1	49 Å²	49	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135.4	-179.8	-54.2	178.1	0	0	0	109.5	I9 F11 M25 L26 V30 P32 V37 I53 S54	I9-I35 HydrophobicContact CB-CG1 4.42Å; I9-I35 CarbonylContact O-C 3.41Å; I9-I35 VanDerWaalsContact O-CA 3.28Å; I9-I35 WeakPolarHBondContact O-CA 3.41Å; F11-I35 HydrophobicContact CD2-CG2 3.74Å; F11-I35 HydrophobicContact CE2-CG2 3.69Å; M25-I35 HydrophobicContact CB-CD1 4.49Å; L26-I35 HydrophobicContact CD2-CD1 3.76Å; L26-I35 HydrophobicContact CG-CD1 4.12Å; V30-I35 HydrophobicContact CG1-CD1 3.84Å; V30-I35 HydrophobicContact CG1-CG1 3.74Å; P32-I35 PolarHBondContact O-N 3.23Å; I35-V37 HydrophobicContact CG2-CG2 4.21Å; I35-I53 HydrophobicContact CB-CD1 4.33Å; I35-I53 HydrophobicContact CB-CG1 4.15Å; I35-I53 HydrophobicContact CB-CG2 3.96Å; I35-I53 HydrophobicContact CD1-CD1 4.16Å; I35-I53 HydrophobicContact CG2-CD1 4.13Å; I35-I53 HydrophobicContact CG2-CG1 4.37Å; I35-I53 HydrophobicContact CG2-CG2 3.72Å; I35-I53 WeakPolarHBondContact O-CG2 3.36Å; I35-S54 PolarHBondContact O-N 3.06Å
36	K	98.5	Very high	94.5	Very high	42 Å²	42	50.2 Å²	50.2	18%	0.183	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.4	171.4	-164.5	173.7	-176.6	176.7	0	111.5	I9 G10 F11 S54 T56 D61 V62 V65	I9-K36 PolarHBondContact O-N 3.23Å; G10-K36 CarbonylContact C-O 3.59Å; G10-K36 WeakPolarHBondContact CA-O 3.33Å; F11-K36 PolarHBondContact N-O 3.09Å; K36-S54 CarbonylContact C-O 3.59Å; K36-S54 VanDerWaalsContact CA-O 3.31Å; K36-S54 WeakPolarHBondContact CA-O 3.47Å; K36-T56 HydrophobicContact CG-CG2 4.44Å; K36-D61 PolarHBondContact NZ-O 3.2Å; K36-V62 HydrophobicContact CD-CG2 4.48Å; K36-V62 HydrophobicContact CG-CG2 4.2Å; K36-V65 HydrophobicContact CD-CG2 3.8Å
37	V	98.6	Very high	94.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	132.6	-174.9	-177.8	0	0	0	0	110.6	F11 A14 I35 L45 F48 I53 S54 V55 T56	F11-V37 HydrophobicContact CB-CB 4.41Å; F11-V37 HydrophobicContact CB-CG1 4.18Å; F11-V37 HydrophobicContact CB-CG2 4.06Å; F11-V37 HydrophobicContact CD2-CG2 4.07Å; F11-V37 HydrophobicContact CG-CG2 4.41Å; F11-V37 CarbonylContact O-C 3.55Å; F11-V37 WeakPolarHBondContact O-CA 3.49Å; A14-V37 HydrophobicContact CB-CG1 3.76Å; I35-V37 HydrophobicContact CG2-CG2 4.21Å; V37-L45 HydrophobicContact CG1-CD2 4.31Å; V37-F48 HydrophobicContact CB-CD1 4.41Å; V37-F48 HydrophobicContact CB-CG 4.49Å; V37-F48 HydrophobicContact CG1-CD1 4.41Å; V37-F48 HydrophobicContact CG1-CD2 4.34Å; V37-F48 HydrophobicContact CG1-CE1 4.3Å; V37-F48 HydrophobicContact CG1-CE2 4.27Å; V37-F48 HydrophobicContact CG1-CG 4.41Å; V37-F48 HydrophobicContact CG1-CZ 4.22Å; V37-F48 HydrophobicContact CG2-CD1 3.59Å; V37-F48 HydrophobicContact CG2-CE1 3.82Å; V37-F48 HydrophobicContact CG2-CG 4.1Å; V37-I53 HydrophobicContact CG2-CG2 3.68Å; V37-S54 PolarHBondContact N-O 3.01Å; V37-V55 HydrophobicContact CB-CG1 4.49Å; V37-V55 CarbonylContact O-C 3.57Å; V37-V55 VanDerWaalsContact O-CA 3.27Å; V37-V55 WeakPolarHBondContact O-CA 3.39Å; V37-T56 PolarHBondContact O-N 3.24Å
38	S	98.4	Very high	94.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	146.4	170.4	67.5	0	0	0	0	113	F11 I12 G13 A14 T56 N59	F11-S38 PolarHBondContact O-N 2.73Å; I12-S38 WeakPolarHBondContact CA-OG 3.49Å; G13-S38 CarbonylContact C-O 3.51Å; G13-S38 VanDerWaalsContact CA-O 3.22Å; G13-S38 WeakPolarHBondContact CA-O 3.41Å; G13-S38 PolarHBondContact N-O 2.88Å; A14-S38 PolarHBondContact N-O 3.41Å; S38-T56 VanDerWaalsContact CA-O 3.25Å; S38-T56 WeakPolarHBondContact CA-O 3.48Å; S38-N59 WeakPolarHBondContact CB-OD1 3.3Å; S38-N59 PolarHBondContact OG-OD1 3.21Å
39	A	97	Very high	95.3	Very high	7 Å²	7	51.8 Å²	51.8	6%	0.058	31%	0.307	C	S	.	.			trans	-152.3	150.8	165	0	0	0	0	0	111.1	A14 S41 L45 T56 H57	A14-A39 HydrophobicContact CB-CB 3.67Å; A39-S41 PolarHBondContact O-N 3.44Å; A39-L45 HydrophobicContact CB-CD2 3.77Å; A39-L45 HydrophobicContact CB-CG 4.17Å; A39-T56 PolarHBondContact N-O 3.37Å; A39-H57 PolarHBondContact O-ND1 3.3Å
40	P	93.4	Very high	95.7	Very high	127 Å²	127	54.7 Å²	54.7	83%	0.825	32%	0.317	S	S	*	.	S	Bend	trans	-69.2	-20.6	178.4	28.5	-35.9	0	0	0	113.4
41	S	92.9	Very high	95.8	Very high	55 Å²	55	57 Å²	57	39%	0.385	33%	0.329	S	S	.	.	S	Bend	trans	-130.2	155.6	176.1	77.1	0	0	0	0	111.5	A39 T43	A39-S41 PolarHBondContact O-N 3.44Å; S41-T43 PolarHBondContact O-N 3.12Å; S41-T43 PolarHBondContact OG-OG1 3.39Å; S41-T43 VanDerWaalsContact OG-OG1 3.05Å
42	S	92	Very high	95.9	Very high	78 Å²	78	54.6 Å²	54.6	55%	0.545	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-77.5	-5.4	-179.8	-44.1	0	0	0	0	114	H44 L45 H57	S42-H44 PolarHBondContact O-N 3.32Å; S42-H44 VanDerWaalsContact O-N 3.11Å; S42-L45 PolarHBondContact O-N 2.95Å; S42-L45 VanDerWaalsContact O-N 3.09Å; S42-H57 PolarHBondContact OG-CE1 3.45Å; S42-H57 PolarHBondContact OG-NE2 2.98Å
43	T	91.1	Very high	96	Very high	110 Å²	110	52.9 Å²	52.9	68%	0.675	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-51.3	-39.9	-173	-48.9	0	0	0	0	113.5	S41	S41-T43 PolarHBondContact O-N 3.12Å; S41-T43 PolarHBondContact OG-OG1 3.39Å; S41-T43 VanDerWaalsContact OG-OG1 3.05Å
44	H	91.8	Very high	96	Very high	96 Å²	96	51.7 Å²	51.7	44%	0.444	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-110.5	1.5	-178.2	-56.1	123.6	0	0	0	113.5	A14 S42 R47 F48	A14-H44 HydrophobicContact CB-CB 4.05Å; A14-H44 VanDerWaalsContact O-CB 3.24Å; A14-H44 WeakPolarHBondContact O-CB 3.41Å; S42-H44 PolarHBondContact O-N 3.32Å; S42-H44 VanDerWaalsContact O-N 3.11Å; H44-R47 VanDerWaalsContact O-CG 3.28Å; H44-R47 WeakPolarHBondContact O-CG 3.42Å; H44-F48 VanDerWaalsContact O-CD2 3.25Å; H44-F48 WeakPolarHBondContact O-CD2 3.37Å
45	L	95.1	Very high	96.1	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.021	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-31.8	-177.9	-67.3	-177	0	0	0	112.2	A14 V37 A39 S42 R47 F48 Q49 V55	A14-L45 HydrophobicContact CB-CD2 3.78Å; V37-L45 HydrophobicContact CG1-CD2 4.31Å; A39-L45 HydrophobicContact CB-CD2 3.77Å; A39-L45 HydrophobicContact CB-CG 4.17Å; S42-L45 PolarHBondContact O-N 2.95Å; S42-L45 VanDerWaalsContact O-N 3.09Å; L45-R47 VanDerWaalsContact C-N 3.34Å; L45-R47 PolarHBondContact O-N 3.32Å; L45-F48 WeakPolarHBondContact O-CB 3.47Å; L45-F48 PolarHBondContact O-N 3.36Å; L45-Q49 PolarHBondContact O-N 2.71Å; L45-Q49 VanDerWaalsContact O-N 3.12Å; L45-V55 HydrophobicContact CB-CB 4.31Å; L45-V55 HydrophobicContact CB-CG1 4.22Å; L45-V55 HydrophobicContact CB-CG2 4.35Å; L45-V55 HydrophobicContact CD1-CB 4.18Å; L45-V55 HydrophobicContact CD1-CG2 4.31Å; L45-V55 HydrophobicContact CD2-CB 3.99Å; L45-V55 HydrophobicContact CD2-CG1 4.02Å; L45-V55 HydrophobicContact CG-CB 4.38Å
46	G	96.3	Very high	96.1	Very high	27 Å²	27	52.7 Å²	52.7	28%	0.278	31%	0.311	S	S	.	.	H	α-helix	trans	-53.5	-45.9	-177.8	0	0	0	0	0	113.6	F48 Q49 E50	G46-F48 PolarHBondContact O-N 3.06Å; G46-Q49 WeakPolarHBondContact O-CB 3.39Å; G46-Q49 PolarHBondContact O-N 2.83Å; G46-Q49 VanDerWaalsContact O-N 3.07Å; G46-E50 WeakPolarHBondContact O-CG 3.44Å; G46-E50 PolarHBondContact O-N 3.31Å
47	R	95.7	Very high	96.1	Very high	50 Å²	50	55.9 Å²	55.9	19%	0.189	33%	0.327	C	S	.	.	H	α-helix	trans	-62.4	-25.3	177.6	65.1	175.5	-178.5	-177.3	-4.9	114.4	A14 G15 N16 F19 H44 L45 L51	A14-R47 PolarHBondContact O-NH2 3.33Å; G15-R47 PolarHBondContact O-NH2 3.31Å; N16-R47 PolarHBondContact OD1-NH1 3.1Å; F19-R47 VanDerWaalsContact CB-CZ 3.46Å; F19-R47 HydrophobicContact CD2-CB 4.29Å; F19-R47 VanDerWaalsContact CD2-CD 3.43Å; F19-R47 HydrophobicContact CD2-CG 3.68Å; F19-R47 HydrophobicContact CE2-CB 3.73Å; F19-R47 HydrophobicContact CE2-CG 3.65Å; F19-R47 WeakPolarHBondContact CE2-O 3.43Å; F19-R47 HydrophobicContact CG-CG 4.45Å; F19-R47 HydrophobicContact CZ-CB 4.21Å; F19-R47 HydrophobicContact CZ-CG 4.4Å; H44-R47 VanDerWaalsContact O-CG 3.28Å; H44-R47 WeakPolarHBondContact O-CG 3.42Å; L45-R47 VanDerWaalsContact C-N 3.34Å; L45-R47 PolarHBondContact O-N 3.32Å; R47-L51 WeakPolarHBondContact O-CG 3.47Å
48	F	97.8	Very high	96	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-80.3	-39.5	174.2	-69	-90.7	0	0	0	110.5	A14 A18 F19 A22 V37 H44 L45 G46 E50 L51 G52 I53 V55	A14-F48 HydrophobicContact CB-CD2 4.23Å; A14-F48 HydrophobicContact CB-CE2 3.66Å; A14-F48 HydrophobicContact CB-CZ 4.37Å; A18-F48 HydrophobicContact CB-CZ 4.09Å; F19-F48 HydrophobicContact CB-CE1 4.17Å; F19-F48 HydrophobicContact CB-CE2 4.22Å; F19-F48 HydrophobicContact CB-CZ 3.65Å; F19-F48 HydrophobicContact CD2-CD1 4.2Å; F19-F48 HydrophobicContact CD2-CD2 4.33Å; F19-F48 AromaticContact CD2-CE1 3.99Å; F19-F48 HydrophobicContact CD2-CE1 3.99Å; F19-F48 HydrophobicContact CD2-CE2 4.09Å; F19-F48 HydrophobicContact CD2-CG 4.4Å; F19-F48 AromaticContact CD2-CZ 3.94Å; F19-F48 HydrophobicContact CD2-CZ 3.94Å; F19-F48 HydrophobicContact CG-CZ 4.31Å; A22-F48 HydrophobicContact CB-CD1 4.5Å; A22-F48 HydrophobicContact CB-CE1 4.08Å; V37-F48 HydrophobicContact CB-CD1 4.41Å; V37-F48 HydrophobicContact CB-CG 4.49Å; V37-F48 HydrophobicContact CG1-CD1 4.41Å; V37-F48 HydrophobicContact CG1-CD2 4.34Å; V37-F48 HydrophobicContact CG1-CE1 4.3Å; V37-F48 HydrophobicContact CG1-CE2 4.27Å; V37-F48 HydrophobicContact CG1-CG 4.41Å; V37-F48 HydrophobicContact CG1-CZ 4.22Å; V37-F48 HydrophobicContact CG2-CD1 3.59Å; V37-F48 HydrophobicContact CG2-CE1 3.82Å; V37-F48 HydrophobicContact CG2-CG 4.1Å; H44-F48 VanDerWaalsContact O-CD2 3.25Å; H44-F48 WeakPolarHBondContact O-CD2 3.37Å; L45-F48 WeakPolarHBondContact O-CB 3.47Å; L45-F48 PolarHBondContact O-N 3.36Å; G46-F48 PolarHBondContact O-N 3.06Å; F48-E50 VanDerWaalsContact C-N 3.28Å; F48-E50 PolarHBondContact O-N 3.36Å; F48-L51 WeakPolarHBondContact O-CA 3.39Å; F48-L51 WeakPolarHBondContact O-CB 3.46Å; F48-L51 PolarHBondContact O-N 3.31Å; F48-G52 PolarHBondContact O-N 3.12Å; F48-I53 HydrophobicContact CB-CB 4.17Å; F48-I53 HydrophobicContact CB-CG2 4.27Å; F48-I53 HydrophobicContact CD1-CD1 3.98Å; F48-I53 WeakPolarHBondContact O-CB 3.42Å; F48-I53 PolarHBondContact O-N 3.28Å; F48-V55 HydrophobicContact CB-CG1 3.96Å
49	Q	97	Very high	96	Very high	114 Å²	114	58.5 Å²	58.5	53%	0.533	34%	0.343	S	S	.	.	H	α-helix	trans	-61.6	-37.5	174.8	-64.7	177.5	-58.9	0	0	111.9	L45 G46 L51 G52 V55	L45-Q49 PolarHBondContact O-N 2.71Å; L45-Q49 VanDerWaalsContact O-N 3.12Å; G46-Q49 WeakPolarHBondContact O-CB 3.39Å; G46-Q49 PolarHBondContact O-N 2.83Å; G46-Q49 VanDerWaalsContact O-N 3.07Å; Q49-L51 PolarHBondContact O-N 3.41Å; Q49-G52 WeakPolarHBondContact O-CA 3.42Å; Q49-G52 PolarHBondContact O-N 3.02Å; Q49-V55 HydrophobicContact CG-CB 4.42Å; Q49-V55 HydrophobicContact CG-CG1 3.85Å; Q49-V55 HydrophobicContact CG-CG2 3.64Å
50	E	96.8	Very high	96	Very high	164 Å²	164	59.6 Å²	59.6	77%	0.766	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-27.3	172.9	-73.4	167.2	-165.7	0	0	112.9	G46 F48 G52	G46-E50 WeakPolarHBondContact O-CG 3.44Å; G46-E50 PolarHBondContact O-N 3.31Å; F48-E50 VanDerWaalsContact C-N 3.28Å; F48-E50 PolarHBondContact O-N 3.36Å; E50-G52 VanDerWaalsContact C-N 3.3Å
51	L	96.1	Very high	96.2	Very high	57 Å²	57	56.9 Å²	56.9	30%	0.298	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	3.3	173.9	-60.4	176.7	0	0	0	113	F19 L26 P32 R47 F48 Q49 I53	F19-L51 HydrophobicContact CD2-CD1 4.31Å; F19-L51 HydrophobicContact CE2-CD1 3.54Å; F19-L51 HydrophobicContact CE2-CG 4.39Å; F19-L51 HydrophobicContact CZ-CD1 4.06Å; L26-L51 HydrophobicContact CD1-CB 3.88Å; L26-L51 HydrophobicContact CD1-CD1 4.07Å; L26-L51 HydrophobicContact CD1-CG 4.41Å; P32-L51 VanDerWaalsContact CB-O 3.3Å; P32-L51 WeakPolarHBondContact CB-O 3.28Å; P32-L51 WeakPolarHBondContact CG-O 3.31Å; R47-L51 WeakPolarHBondContact O-CG 3.47Å; F48-L51 WeakPolarHBondContact O-CA 3.39Å; F48-L51 WeakPolarHBondContact O-CB 3.46Å; F48-L51 PolarHBondContact O-N 3.31Å; Q49-L51 PolarHBondContact O-N 3.41Å; L51-I53 VanDerWaalsContact C-N 3.3Å; L51-I53 HydrophobicContact CB-CD1 4.16Å; L51-I53 HydrophobicContact CB-CG1 4.23Å; L51-I53 HydrophobicContact CD1-CD1 4.37Å
52	G	97.3	Very high	96.4	Very high	51 Å²	51	54.2 Å²	54.2	53%	0.526	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	13.6	-176.1	0	0	0	0	0	114.4	P32 F48 Q49 E50	P32-G52 WeakPolarHBondContact CB-O 3.49Å; F48-G52 PolarHBondContact O-N 3.12Å; Q49-G52 WeakPolarHBondContact O-CA 3.42Å; Q49-G52 PolarHBondContact O-N 3.02Å; E50-G52 VanDerWaalsContact C-N 3.3Å
53	I	98.2	Very high	96.7	Very high	6 Å²	6	50.5 Å²	50.5	3%	0.031	28%	0.283	C	S	.	.			trans	-82.1	138.3	-179.4	-66	172.9	0	0	0	110.2	A22 L26 P32 I35 V37 F48 L51	A22-I53 HydrophobicContact CB-CD1 4.09Å; L26-I53 HydrophobicContact CD1-CD1 4.02Å; L26-I53 HydrophobicContact CD1-CG1 4.44Å; P32-I53 HydrophobicContact CB-CG1 4.16Å; I35-I53 HydrophobicContact CB-CD1 4.33Å; I35-I53 HydrophobicContact CB-CG1 4.15Å; I35-I53 HydrophobicContact CB-CG2 3.96Å; I35-I53 HydrophobicContact CD1-CD1 4.16Å; I35-I53 HydrophobicContact CG2-CD1 4.13Å; I35-I53 HydrophobicContact CG2-CG1 4.37Å; I35-I53 HydrophobicContact CG2-CG2 3.72Å; I35-I53 WeakPolarHBondContact O-CG2 3.36Å; V37-I53 HydrophobicContact CG2-CG2 3.68Å; F48-I53 HydrophobicContact CB-CB 4.17Å; F48-I53 HydrophobicContact CB-CG2 4.27Å; F48-I53 HydrophobicContact CD1-CD1 3.98Å; F48-I53 WeakPolarHBondContact O-CB 3.42Å; F48-I53 PolarHBondContact O-N 3.28Å; L51-I53 VanDerWaalsContact C-N 3.3Å; L51-I53 HydrophobicContact CB-CD1 4.16Å; L51-I53 HydrophobicContact CB-CG1 4.23Å; L51-I53 HydrophobicContact CD1-CD1 4.37Å
54	S	97.7	Very high	96.9	Very high	63 Å²	63	48.8 Å²	48.8	44%	0.441	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.3	174.8	-172	0	0	0	0	111.1	I35 K36 V37	I35-S54 PolarHBondContact O-N 3.06Å; K36-S54 CarbonylContact C-O 3.59Å; K36-S54 VanDerWaalsContact CA-O 3.31Å; K36-S54 WeakPolarHBondContact CA-O 3.47Å; V37-S54 PolarHBondContact N-O 3.01Å
55	V	98.4	Very high	97.1	Very high	34 Å²	34	46.7 Å²	46.7	21%	0.206	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	152.9	-179.6	-59.5	0	0	0	0	111.7	V37 L45 F48 Q49	V37-V55 HydrophobicContact CB-CG1 4.49Å; V37-V55 CarbonylContact O-C 3.57Å; V37-V55 VanDerWaalsContact O-CA 3.27Å; V37-V55 WeakPolarHBondContact O-CA 3.39Å; L45-V55 HydrophobicContact CB-CB 4.31Å; L45-V55 HydrophobicContact CB-CG1 4.22Å; L45-V55 HydrophobicContact CB-CG2 4.35Å; L45-V55 HydrophobicContact CD1-CB 4.18Å; L45-V55 HydrophobicContact CD1-CG2 4.31Å; L45-V55 HydrophobicContact CD2-CB 3.99Å; L45-V55 HydrophobicContact CD2-CG1 4.02Å; L45-V55 HydrophobicContact CG-CB 4.38Å; F48-V55 HydrophobicContact CB-CG1 3.96Å; Q49-V55 HydrophobicContact CG-CB 4.42Å; Q49-V55 HydrophobicContact CG-CG1 3.85Å; Q49-V55 HydrophobicContact CG-CG2 3.64Å
56	T	98.3	Very high	97.2	Very high	21 Å²	21	46.7 Å²	46.7	13%	0.129	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	168.2	176.8	-177.5	0	0	0	0	111	K36 V37 S38 A39 S58 D61 V62	K36-T56 HydrophobicContact CG-CG2 4.44Å; V37-T56 PolarHBondContact O-N 3.24Å; S38-T56 VanDerWaalsContact CA-O 3.25Å; S38-T56 WeakPolarHBondContact CA-O 3.48Å; A39-T56 PolarHBondContact N-O 3.37Å; T56-S58 VanDerWaalsContact CG2-O 3.26Å; T56-S58 WeakPolarHBondContact CG2-O 3.5Å; T56-S58 PolarHBondContact OG1-N 3.17Å; T56-S58 VanDerWaalsContact OG1-N 3.13Å; T56-D61 HydrophobicContact CG2-CB 4.12Å; T56-D61 PolarHBondContact OG1-OD2 2.91Å; T56-V62 HydrophobicContact CG2-CG2 3.67Å
57	H	97.8	Very high	97.2	Very high	110 Å²	110	48.3 Å²	48.3	51%	0.509	27%	0.271	S	S	.	.	S	Bend	trans	-101.1	-2.3	168.8	-65.7	-63	0	0	0	112.9	A39 S42	A39-H57 PolarHBondContact O-ND1 3.3Å; S42-H57 PolarHBondContact OG-CE1 3.45Å; S42-H57 PolarHBondContact OG-NE2 2.98Å
58	S	97.8	Very high	97.3	Very high	35 Å²	35	46 Å²	46	25%	0.245	26%	0.263	C	S	.	.			trans	-103.3	120.8	-178.4	168.6	0	0	0	0	111	T56 T60 D61	T56-S58 VanDerWaalsContact CG2-O 3.26Å; T56-S58 WeakPolarHBondContact CG2-O 3.5Å; T56-S58 PolarHBondContact OG1-N 3.17Å; T56-S58 VanDerWaalsContact OG1-N 3.13Å; S58-T60 VanDerWaalsContact C-N 3.34Å; S58-D61 WeakPolarHBondContact CB-OD1 3.49Å; S58-D61 PolarHBondContact O-N 3.42Å; S58-D61 PolarHBondContact OG-N 2.99Å; S58-D61 VanDerWaalsContact OG-N 3.07Å; S58-D61 PolarHBondContact OG-OD1 2.8Å
59	N	98	Very high	97.3	Very high	19 Å²	19	46.1 Å²	46.1	10%	0.102	26%	0.263	C	S	.	.	H	α-helix	trans	-67.8	-38.3	174	-64.1	-27.4	0	0	0	110.9	I12 S38 D61 V62 V63 E84 V85	I12-N59 HydrophobicContact CD1-CB 4.33Å; I12-N59 HydrophobicContact CG1-CB 4.41Å; I12-N59 HydrophobicContact CG2-CB 4.3Å; I12-N59 WeakPolarHBondContact CG2-OD1 3.43Å; S38-N59 WeakPolarHBondContact CB-OD1 3.3Å; S38-N59 PolarHBondContact OG-OD1 3.21Å; N59-D61 VanDerWaalsContact C-N 3.29Å; N59-D61 PolarHBondContact O-N 3.38Å; N59-V62 WeakPolarHBondContact O-CB 3.5Å; N59-V62 PolarHBondContact O-N 2.94Å; N59-V63 PolarHBondContact O-N 3.28Å; N59-V63 VanDerWaalsContact O-N 3.1Å; N59-E84 PolarHBondContact ND2-OE1 3.46Å; N59-E84 PolarHBondContact ND2-OE2 3.12Å; N59-V85 HydrophobicContact CB-CG1 3.64Å
60	T	97.1	Very high	97.4	Very high	31 Å²	31	40.7 Å²	40.7	19%	0.19	24%	0.238	C	C	.	.	H	α-helix	trans	-57	-42.1	175.3	-61.1	0	0	0	0	112.2	S58 V62 V63 C64 H88	S58-T60 VanDerWaalsContact C-N 3.34Å; T60-V62 PolarHBondContact O-N 3.1Å; T60-V63 PolarHBondContact O-N 2.98Å; T60-C64 WeakPolarHBondContact O-CB 3.49Å; T60-C64 PolarHBondContact O-N 3.38Å; T60-C64 PolarHBondContact O-SG 2.94Å; T60-C64 VanDerWaalsContact O-SG 3.32Å; T60-H88 VanDerWaalsContact CG2-CD2 3.4Å; T60-H88 WeakPolarHBondContact CG2-CD2 3.33Å; T60-H88 VanDerWaalsContact CG2-NE2 3.33Å; T60-H88 WeakPolarHBondContact CG2-NE2 3.46Å
61	D	96.8	Very high	97.5	Very high	69 Å²	69	32.9 Å²	32.9	37%	0.369	20%	0.202	S	C	.	.	H	α-helix	trans	-62.8	-27.1	178.5	-72.6	14.7	0	0	0	112.9	K36 T56 S58 N59 V65	K36-D61 PolarHBondContact NZ-O 3.2Å; T56-D61 HydrophobicContact CG2-CB 4.12Å; T56-D61 PolarHBondContact OG1-OD2 2.91Å; S58-D61 WeakPolarHBondContact CB-OD1 3.49Å; S58-D61 PolarHBondContact O-N 3.42Å; S58-D61 PolarHBondContact OG-N 2.99Å; S58-D61 VanDerWaalsContact OG-N 3.07Å; S58-D61 PolarHBondContact OG-OD1 2.8Å; N59-D61 VanDerWaalsContact C-N 3.29Å; N59-D61 PolarHBondContact O-N 3.38Å; D61-V65 VanDerWaalsContact O-CG2 3.27Å; D61-V65 WeakPolarHBondContact O-CG2 3.45Å
62	V	97.9	Very high	97.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-76.8	-50	175.4	175	0	0	0	0	109.4	I12 K36 T56 N59 T60 C64 V65 S66	I12-V62 HydrophobicContact CG1-CG1 4.34Å; K36-V62 HydrophobicContact CD-CG2 4.48Å; K36-V62 HydrophobicContact CG-CG2 4.2Å; T56-V62 HydrophobicContact CG2-CG2 3.67Å; N59-V62 WeakPolarHBondContact O-CB 3.5Å; N59-V62 PolarHBondContact O-N 2.94Å; T60-V62 PolarHBondContact O-N 3.1Å; V62-C64 PolarHBondContact O-N 3.35Å; V62-V65 PolarHBondContact O-N 3.02Å; V62-S66 VanDerWaalsContact O-CB 3.31Å; V62-S66 WeakPolarHBondContact O-CB 3.41Å; V62-S66 PolarHBondContact O-N 2.94Å; V62-S66 PolarHBondContact O-OG 2.88Å
63	V	97.2	Very high	97.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.1	-43.7	-177.9	176.9	0	0	0	0	112.2	I12 N59 T60 V65 S66 V69 V85 H88 I89	I12-V63 HydrophobicContact CD1-CG2 3.81Å; N59-V63 PolarHBondContact O-N 3.28Å; N59-V63 VanDerWaalsContact O-N 3.1Å; T60-V63 PolarHBondContact O-N 2.98Å; V63-V65 PolarHBondContact O-N 3.45Å; V63-S66 PolarHBondContact O-N 3.02Å; V63-V69 HydrophobicContact CG2-CG1 4.19Å; V63-V69 HydrophobicContact CG2-CG2 4.4Å; V63-V85 HydrophobicContact CG2-CB 3.85Å; V63-V85 HydrophobicContact CG2-CG1 3.95Å; V63-V85 HydrophobicContact CG2-CG2 4.13Å; V63-H88 HydrophobicContact CG1-CB 4.11Å; V63-I89 HydrophobicContact CG1-CG1 3.82Å
64	C	95.8	Very high	97.1	Very high	73 Å²	73	36.5 Å²	36.5	49%	0.493	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-21.7	-176	-72.2	0	0	0	0	114.2	T60 V62	T60-C64 WeakPolarHBondContact O-CB 3.49Å; T60-C64 PolarHBondContact O-N 3.38Å; T60-C64 PolarHBondContact O-SG 2.94Å; T60-C64 VanDerWaalsContact O-SG 3.32Å; V62-C64 PolarHBondContact O-N 3.35Å
65	V	95.6	Very high	96.8	Very high	53 Å²	53	36.2 Å²	36.2	32%	0.321	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-2.9	-176.1	-53.3	0	0	0	0	113.7	R8 K36 D61 V62 V63	R8-V65 WeakPolarHBondContact CB-O 3.31Å; R8-V65 WeakPolarHBondContact CD-O 3.34Å; K36-V65 HydrophobicContact CD-CG2 3.8Å; D61-V65 VanDerWaalsContact O-CG2 3.27Å; D61-V65 WeakPolarHBondContact O-CG2 3.45Å; V62-V65 PolarHBondContact O-N 3.02Å; V63-V65 PolarHBondContact O-N 3.45Å
66	S	97.4	Very high	96.5	Very high	4 Å²	4	41 Å²	41	3%	0.028	22%	0.222	C	C	.	.			trans	-110.6	144.8	-172.2	-53.1	0	0	0	0	111.7	R8 G10 V62 V63 Q93	R8-S66 CarbonylContact O-C 3.57Å; R8-S66 WeakPolarHBondContact O-CA 3.41Å; G10-S66 VanDerWaalsContact CA-OG 3.23Å; G10-S66 WeakPolarHBondContact CA-OG 3.32Å; G10-S66 PolarHBondContact N-OG 2.97Å; V62-S66 VanDerWaalsContact O-CB 3.31Å; V62-S66 WeakPolarHBondContact O-CB 3.41Å; V62-S66 PolarHBondContact O-N 2.94Å; V62-S66 PolarHBondContact O-OG 2.88Å; V63-S66 PolarHBondContact O-N 3.02Å; S66-Q93 VanDerWaalsContact O-CG 3.27Å; S66-Q93 WeakPolarHBondContact O-CG 3.43Å
67	D	96.6	Very high	96.3	Very high	60 Å²	60	43.1 Å²	43.1	32%	0.321	23%	0.231	S	C	.	.	S	Bend	trans	-88	-36.1	171	-52.8	-57.9	0	0	0	110.3	Q7 R8 Q93 I94	Q7-D67 PolarHBondContact OE1-OD2 2.97Å; R8-D67 WeakPolarHBondContact CB-OD2 3.47Å; R8-D67 PolarHBondContact N-OD2 3.37Å; R8-D67 PolarHBondContact O-N 3.49Å; D67-Q93 CarbonylContact O-C 3.49Å; D67-Q93 VanDerWaalsContact O-CA 3.31Å; D67-Q93 WeakPolarHBondContact O-CA 3.46Å; D67-I94 PolarHBondContact O-N 3.26Å
68	V	98.1	Very high	96.2	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.018	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.6	174.9	-173.3	0	0	0	0	109.5	R8 I9 G10 F70 I94 V96 L148 L152	R8-V68 PolarHBondContact O-N 3.16Å; I9-V68 CarbonylContact C-O 3.55Å; I9-V68 WeakPolarHBondContact CA-O 3.45Å; G10-V68 PolarHBondContact N-O 2.93Å; V68-F70 HydrophobicContact CG1-CD2 4.21Å; V68-F70 HydrophobicContact CG1-CE2 3.62Å; V68-F70 HydrophobicContact CG1-CZ 4.18Å; V68-I94 WeakPolarHBondContact CA-O 3.49Å; V68-I94 HydrophobicContact CG1-CB 4.4Å; V68-I94 HydrophobicContact CG2-CB 4.38Å; V68-I94 HydrophobicContact CG2-CD1 4.28Å; V68-V96 HydrophobicContact CG1-CG2 3.77Å; V68-L148 HydrophobicContact CG2-CD2 4.11Å; V68-L152 HydrophobicContact CG2-CD1 4.07Å
69	V	98.5	Very high	96	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	110.9	-178.1	-178.4	0	0	0	0	110.4	G10 I12 V63 V71 I94 I95 V96	G10-V69 CarbonylContact O-C 3.53Å; G10-V69 WeakPolarHBondContact O-CA 3.34Å; I12-V69 HydrophobicContact CD1-CG1 3.81Å; I12-V69 HydrophobicContact CG1-CG1 4.03Å; V63-V69 HydrophobicContact CG2-CG1 4.19Å; V63-V69 HydrophobicContact CG2-CG2 4.4Å; V69-V71 HydrophobicContact CG1-CG2 4.49Å; V69-I94 PolarHBondContact N-O 2.78Å; V69-I95 HydrophobicContact CB-CD1 3.95Å; V69-I95 HydrophobicContact CG2-CD1 4.3Å; V69-V96 PolarHBondContact O-N 3.47Å
70	F	98.6	Very high	95.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	117.8	171.7	-69.6	-95.9	0	0	0	110.7	I9 G10 F11 I12 I21 M25 V68 A72 V96 V98 L120 L149 L153	I9-F70 HydrophobicContact CG2-CD2 3.86Å; I9-F70 HydrophobicContact CG2-CE2 3.83Å; G10-F70 PolarHBondContact O-N 3.43Å; F11-F70 CarbonylContact C-O 3.57Å; F11-F70 WeakPolarHBondContact CA-O 3.47Å; F11-F70 HydrophobicContact CD1-CB 3.44Å; F11-F70 VanDerWaalsContact CD1-CB 3.44Å; F11-F70 HydrophobicContact CD1-CD2 4.32Å; F11-F70 AromaticContact CD1-CG 3.98Å; F11-F70 HydrophobicContact CD1-CG 3.98Å; F11-F70 HydrophobicContact CE1-CB 3.64Å; F11-F70 HydrophobicContact CE1-CD1 4.22Å; F11-F70 AromaticContact CE1-CD2 3.83Å; F11-F70 HydrophobicContact CE1-CD2 3.83Å; F11-F70 AromaticContact CE1-CG 3.62Å; F11-F70 HydrophobicContact CE1-CG 3.62Å; F11-F70 HydrophobicContact CG-CB 4.2Å; F11-F70 AromaticContact CZ-CD2 3.95Å; F11-F70 HydrophobicContact CZ-CD2 3.95Å; F11-F70 HydrophobicContact CZ-CE2 4.44Å; F11-F70 HydrophobicContact CZ-CG 4.22Å; I12-F70 PolarHBondContact N-O 2.86Å; I21-F70 HydrophobicContact CD1-CD1 4.48Å; I21-F70 HydrophobicContact CG2-CE1 4.29Å; M25-F70 HydrophobicContact CE-CD2 4.36Å; M25-F70 HydrophobicContact CE-CE1 4.26Å; M25-F70 HydrophobicContact CE-CE2 3.35Å; M25-F70 HydrophobicContact CE-CZ 3.29Å; V68-F70 HydrophobicContact CG1-CD2 4.21Å; V68-F70 HydrophobicContact CG1-CE2 3.62Å; V68-F70 HydrophobicContact CG1-CZ 4.18Å; F70-A72 PolarHBondContact O-N 3.05Å; F70-V96 CarbonylContact C-O 3.59Å; F70-V96 VanDerWaalsContact CA-O 3.26Å; F70-V96 WeakPolarHBondContact CA-O 3.41Å; F70-V96 HydrophobicContact CD1-CB 3.86Å; F70-V96 HydrophobicContact CD1-CG1 3.77Å; F70-V96 HydrophobicContact CE1-CB 3.98Å; F70-V96 HydrophobicContact CE1-CG1 3.67Å; F70-V96 HydrophobicContact CE1-CG2 4.34Å; F70-V96 HydrophobicContact CG-CB 4.3Å; F70-V96 HydrophobicContact CZ-CB 4.49Å; F70-V96 HydrophobicContact CZ-CG1 4.48Å; F70-V96 HydrophobicContact CZ-CG2 4.4Å; F70-V98 HydrophobicContact CD1-CG1 4.28Å; F70-L120 HydrophobicContact CD1-CD2 4.23Å; F70-L120 HydrophobicContact CE1-CD2 3.74Å; F70-L149 HydrophobicContact CE1-CD1 4.09Å; F70-L149 HydrophobicContact CZ-CD1 3.7Å; F70-L153 HydrophobicContact CE1-CD2 4.33Å; F70-L153 HydrophobicContact CZ-CD2 4.24Å
71	V	98.2	Very high	95.9	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	93.5	174.8	-168	0	0	0	0	108.6	V69 V73 I78 V81 L82 I95 V96 V98	V69-V71 HydrophobicContact CG1-CG2 4.49Å; V71-V73 HydrophobicContact CG1-CG2 4.14Å; V71-I78 HydrophobicContact CB-CD1 4.27Å; V71-I78 HydrophobicContact CG1-CD1 3.41Å; V71-I78 VanDerWaalsContact CG1-CD1 3.41Å; V71-V81 HydrophobicContact CG1-CG1 4.17Å; V71-L82 HydrophobicContact CG1-CD2 4.34Å; V71-L82 HydrophobicContact CG2-CD2 4.05Å; V71-I95 HydrophobicContact CG2-CG2 3.8Å; V71-V96 PolarHBondContact N-O 2.83Å; V71-V98 WeakPolarHBondContact O-CG2 3.35Å; V71-V98 PolarHBondContact O-N 3.46Å; V71-V98 VanDerWaalsContact O-N 3.17Å
72	A	96.6	Very high	95.8	Very high	14 Å²	14	41.8 Å²	41.8	12%	0.116	21%	0.213	C	C	.	.			trans	-109.8	43	-171.3	0	0	0	0	0	113.7	I12 A18 F70 V98	I12-A72 CarbonylContact O-C 3.56Å; I12-A72 WeakPolarHBondContact O-CA 3.43Å; I12-A72 PolarHBondContact O-N 3.19Å; A18-A72 HydrophobicContact CB-CB 3.86Å; F70-A72 PolarHBondContact O-N 3.05Å; A72-V98 HydrophobicContact CB-CG2 3.49Å; A72-V98 VanDerWaalsContact CB-CG2 3.49Å
73	V	95.6	Very high	95.7	Very high	31 Å²	31	46.1 Å²	46.1	19%	0.188	24%	0.239	C	C	.	.	S	Bend	trans	-99.3	169.5	174	-59.4	0	0	0	0	111.5	I12 V71 M77 I78 V81	I12-V73 HydrophobicContact CG2-CG1 4.13Å; V71-V73 HydrophobicContact CG1-CG2 4.14Å; V73-M77 HydrophobicContact CB-CB 4.12Å; V73-M77 HydrophobicContact CG2-CB 3.87Å; V73-I78 HydrophobicContact CG2-CD1 3.49Å; V73-I78 VanDerWaalsContact CG2-CD1 3.49Å; V73-I78 HydrophobicContact CG2-CG1 4.01Å; V73-V81 HydrophobicContact CG1-CG2 4.33Å; V73-V81 HydrophobicContact CG2-CG2 4.21Å
74	K	92.3	Very high	95.6	Very high	144 Å²	144	50 Å²	50	63%	0.626	26%	0.257	S	S	*	.			trans	-62.6	146.7	174.3	-64.8	-174.5	179.9	178.7	0	110.2	H76 M77	K74-H76 VanDerWaalsContact C-N 3.32Å; K74-H76 PolarHBondContact O-N 3.43Å; K74-H76 VanDerWaalsContact O-N 3.17Å; K74-M77 HydrophobicContact CB-CG 4.35Å; K74-M77 WeakPolarHBondContact O-CB 3.44Å; K74-M77 PolarHBondContact O-N 3.08Å
75	P	91.2	Very high	95.6	Very high	57 Å²	57	46.6 Å²	46.6	37%	0.37	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-51.7	-44.3	-174.9	-30.2	35.7	0	0	0	114.9	M77 I78 A99 A100 V102	P75-M77 PolarHBondContact O-N 2.87Å; P75-M77 VanDerWaalsContact O-N 3.09Å; P75-I78 WeakPolarHBondContact O-CB 3.31Å; P75-I78 WeakPolarHBondContact O-CG1 3.46Å; P75-I78 PolarHBondContact O-N 3.32Å; P75-I78 VanDerWaalsContact O-N 3.07Å; P75-A99 HydrophobicContact CB-CB 4.43Å; P75-A99 HydrophobicContact CG-CB 4.24Å; P75-A100 WeakPolarHBondContact CB-O 3.45Å; P75-A100 WeakPolarHBondContact CG-O 3.37Å; P75-V102 HydrophobicContact CB-CG2 4.19Å
76	H	91.4	Very high	95.5	Very high	136 Å²	136	45.8 Å²	45.8	63%	0.63	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-64.9	-14.7	178.9	62.6	-95.6	0	0	0	114.6	K74	K74-H76 VanDerWaalsContact C-N 3.32Å; K74-H76 PolarHBondContact O-N 3.43Å; K74-H76 VanDerWaalsContact O-N 3.17Å
77	M	94.4	Very high	95.3	Very high	64 Å²	64	53 Å²	53	32%	0.315	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-89.8	-15.6	177.3	-62.8	-64.1	-67.1	0	0	112.6	V73 K74 P75 R80 V81	V73-M77 HydrophobicContact CB-CB 4.12Å; V73-M77 HydrophobicContact CG2-CB 3.87Å; K74-M77 HydrophobicContact CB-CG 4.35Å; K74-M77 WeakPolarHBondContact O-CB 3.44Å; K74-M77 PolarHBondContact O-N 3.08Å; P75-M77 PolarHBondContact O-N 2.87Å; P75-M77 VanDerWaalsContact O-N 3.09Å; M77-R80 PolarHBondContact O-N 2.99Å; M77-V81 WeakPolarHBondContact O-CG2 3.49Å; M77-V81 PolarHBondContact O-N 2.98Å
78	I	95.1	Very high	95.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57	-49.5	-173.5	-67.5	-74.4	0	0	0	112.3	V71 V73 P75 R80 V81 L82 A99 V102 L107 L110	V71-I78 HydrophobicContact CB-CD1 4.27Å; V71-I78 HydrophobicContact CG1-CD1 3.41Å; V71-I78 VanDerWaalsContact CG1-CD1 3.41Å; V73-I78 HydrophobicContact CG2-CD1 3.49Å; V73-I78 VanDerWaalsContact CG2-CD1 3.49Å; V73-I78 HydrophobicContact CG2-CG1 4.01Å; P75-I78 WeakPolarHBondContact O-CB 3.31Å; P75-I78 WeakPolarHBondContact O-CG1 3.46Å; P75-I78 PolarHBondContact O-N 3.32Å; P75-I78 VanDerWaalsContact O-N 3.07Å; I78-R80 VanDerWaalsContact C-N 3.32Å; I78-R80 PolarHBondContact O-N 3.32Å; I78-V81 PolarHBondContact O-N 3.44Å; I78-L82 HydrophobicContact CG2-CD1 3.58Å; I78-L82 HydrophobicContact CG2-CG 3.94Å; I78-L82 WeakPolarHBondContact O-CG 3.45Å; I78-L82 PolarHBondContact O-N 2.96Å; I78-A99 HydrophobicContact CD1-CB 3.81Å; I78-A99 HydrophobicContact CG1-CB 3.67Å; I78-V102 HydrophobicContact CB-CG2 4.44Å; I78-V102 HydrophobicContact CG1-CG2 4.14Å; I78-V102 HydrophobicContact CG2-CG1 4.14Å; I78-L107 HydrophobicContact CG2-CD2 4.11Å; I78-L110 HydrophobicContact CG2-CD1 4.49Å
79	P	94.6	Very high	95	Very high	46 Å²	46	53.2 Å²	53.2	30%	0.299	26%	0.263	S	S	.	.	H	α-helix	trans	-55.2	-47.2	179.4	-26.5	35	0	0	0	112.9	V81 V83 M106 L110	P79-V81 PolarHBondContact O-N 3.44Å; P79-V83 WeakPolarHBondContact O-CB 3.45Å; P79-V83 WeakPolarHBondContact O-CG2 3.02Å; P79-V83 PolarHBondContact O-N 3.37Å; P79-M106 HydrophobicContact CG-CE 3.6Å; P79-L110 HydrophobicContact CB-CD1 4.3Å; P79-L110 HydrophobicContact CB-CD2 4.37Å; P79-L110 HydrophobicContact CG-CD1 4.33Å
80	R	95.4	Very high	94.6	Very high	184 Å²	184	56.3 Å²	56.3	69%	0.694	28%	0.282	S	S	*	.	H	α-helix	trans	-62.3	-45.3	179.9	177.7	-179.6	169.9	-180	-1	111.9	M77 I78 E84	M77-R80 PolarHBondContact O-N 2.99Å; I78-R80 VanDerWaalsContact C-N 3.32Å; I78-R80 PolarHBondContact O-N 3.32Å; R80-E84 WeakPolarHBondContact O-CB 3.38Å; R80-E84 PolarHBondContact O-N 3.31Å
81	V	96.5	Very high	94.1	Very high	7 Å²	7	62.9 Å²	62.9	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-69	-42.6	-177	167.9	0	0	0	0	111.3	I12 V71 V73 M77 I78 P79 E84 V85	I12-V81 HydrophobicContact CD1-CG1 4.32Å; I12-V81 HydrophobicContact CG2-CG1 3.54Å; V71-V81 HydrophobicContact CG1-CG1 4.17Å; V73-V81 HydrophobicContact CG1-CG2 4.33Å; V73-V81 HydrophobicContact CG2-CG2 4.21Å; M77-V81 WeakPolarHBondContact O-CG2 3.49Å; M77-V81 PolarHBondContact O-N 2.98Å; I78-V81 PolarHBondContact O-N 3.44Å; P79-V81 PolarHBondContact O-N 3.44Å; V81-E84 WeakPolarHBondContact O-CB 3.5Å; V81-E84 PolarHBondContact O-N 3.09Å; V81-V85 WeakPolarHBondContact O-CG2 3.34Å; V81-V85 PolarHBondContact O-N 3.46Å
82	L	95.3	Very high	93.6	Very high	0 Å²	0	71 Å²	71	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-67.1	-41.1	178.5	-65.8	-174.6	0	0	0	111.6	V71 I78 E84 V85 S86 L107 L110 L111	V71-L82 HydrophobicContact CG1-CD2 4.34Å; V71-L82 HydrophobicContact CG2-CD2 4.05Å; I78-L82 HydrophobicContact CG2-CD1 3.58Å; I78-L82 HydrophobicContact CG2-CG 3.94Å; I78-L82 WeakPolarHBondContact O-CG 3.45Å; I78-L82 PolarHBondContact O-N 2.96Å; L82-E84 VanDerWaalsContact C-N 3.34Å; L82-E84 PolarHBondContact O-N 3.17Å; L82-V85 PolarHBondContact O-N 3.42Å; L82-S86 WeakPolarHBondContact O-CA 3.38Å; L82-S86 VanDerWaalsContact O-CB 3.3Å; L82-S86 WeakPolarHBondContact O-CB 3.48Å; L82-S86 PolarHBondContact O-N 2.85Å; L82-L107 HydrophobicContact CD1-CD2 3.66Å; L82-L110 HydrophobicContact CB-CB 4.23Å; L82-L110 HydrophobicContact CD1-CB 3.96Å; L82-L110 HydrophobicContact CD1-CD1 4.02Å; L82-L111 HydrophobicContact CB-CD2 4.33Å; L82-L111 HydrophobicContact CD1-CG 4.35Å; L82-L111 HydrophobicContact CD2-CD2 4.17Å
83	V	94.7	Very high	93.5	Very high	90 Å²	90	71.2 Å²	71.2	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-44.6	174	169.1	0	0	0	0	111.2	P79 V85 S86	P79-V83 WeakPolarHBondContact O-CB 3.45Å; P79-V83 WeakPolarHBondContact O-CG2 3.02Å; P79-V83 PolarHBondContact O-N 3.37Å; V83-V85 VanDerWaalsContact C-N 3.33Å; V83-V85 PolarHBondContact O-N 3.32Å; V83-S86 PolarHBondContact O-N 2.99Å; V83-S86 PolarHBondContact O-OG 3.4Å
84	E	95.4	Very high	93.6	Very high	81 Å²	81	70.3 Å²	70.3	38%	0.379	34%	0.339	S	S	.	.	H	α-helix	trans	-55.5	-44.4	177.9	-180	-167.3	161.9	0	0	112.5	N59 R80 V81 L82	N59-E84 PolarHBondContact ND2-OE1 3.46Å; N59-E84 PolarHBondContact ND2-OE2 3.12Å; R80-E84 WeakPolarHBondContact O-CB 3.38Å; R80-E84 PolarHBondContact O-N 3.31Å; V81-E84 WeakPolarHBondContact O-CB 3.5Å; V81-E84 PolarHBondContact O-N 3.09Å; L82-E84 VanDerWaalsContact C-N 3.34Å; L82-E84 PolarHBondContact O-N 3.17Å
85	V	95.8	Very high	93.9	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.012	31%	0.309	C	S	.	.	H	α-helix	trans	-95.9	-8.1	-174.7	-56.8	0	0	0	0	114.3	I12 N59 V63 V81 L82 V83 Q87 H88 I89	I12-V85 HydrophobicContact CD1-CG1 4.2Å; I12-V85 HydrophobicContact CD1-CG2 4.42Å; N59-V85 HydrophobicContact CB-CG1 3.64Å; V63-V85 HydrophobicContact CG2-CB 3.85Å; V63-V85 HydrophobicContact CG2-CG1 3.95Å; V63-V85 HydrophobicContact CG2-CG2 4.13Å; V81-V85 WeakPolarHBondContact O-CG2 3.34Å; V81-V85 PolarHBondContact O-N 3.46Å; L82-V85 PolarHBondContact O-N 3.42Å; V83-V85 VanDerWaalsContact C-N 3.33Å; V83-V85 PolarHBondContact O-N 3.32Å; V85-Q87 VanDerWaalsContact C-N 3.3Å; V85-Q87 PolarHBondContact O-N 3.04Å; V85-Q87 VanDerWaalsContact O-N 3.17Å; V85-H88 WeakPolarHBondContact O-CB 3.46Å; V85-H88 PolarHBondContact O-N 3.41Å; V85-I89 HydrophobicContact CG2-CD1 3.76Å; V85-I89 HydrophobicContact CG2-CG1 4.44Å; V85-I89 PolarHBondContact O-N 3.02Å
86	S	93.8	Very high	94.2	Very high	36 Å²	36	60.8 Å²	60.8	25%	0.252	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-49.2	-45.5	-172.2	59.7	0	0	0	0	113.8	L82 V83 H88 I89 P112	L82-S86 WeakPolarHBondContact O-CA 3.38Å; L82-S86 VanDerWaalsContact O-CB 3.3Å; L82-S86 WeakPolarHBondContact O-CB 3.48Å; L82-S86 PolarHBondContact O-N 2.85Å; V83-S86 PolarHBondContact O-N 2.99Å; V83-S86 PolarHBondContact O-OG 3.4Å; S86-H88 PolarHBondContact O-N 3.01Å; S86-H88 VanDerWaalsContact O-N 3.12Å; S86-I89 PolarHBondContact O-N 3.5Å; S86-I89 VanDerWaalsContact O-N 3.12Å; S86-P112 VanDerWaalsContact O-CG 3.31Å; S86-P112 WeakPolarHBondContact O-CG 3.34Å
87	Q	93.9	Very high	94.5	Very high	156 Å²	156	54.3 Å²	54.3	73%	0.729	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-65.6	-14.8	-178.8	69.2	-177.2	-7.1	0	0	114.4	V85	V85-Q87 VanDerWaalsContact C-N 3.3Å; V85-Q87 PolarHBondContact O-N 3.04Å; V85-Q87 VanDerWaalsContact O-N 3.17Å
88	H	94.5	Very high	94.6	Very high	56 Å²	56	52 Å²	52	26%	0.259	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-102.1	-8.2	179.6	-58	-68.8	0	0	0	112.6	T60 V63 V85 S86	T60-H88 VanDerWaalsContact CG2-CD2 3.4Å; T60-H88 WeakPolarHBondContact CG2-CD2 3.33Å; T60-H88 VanDerWaalsContact CG2-NE2 3.33Å; T60-H88 WeakPolarHBondContact CG2-NE2 3.46Å; V63-H88 HydrophobicContact CG1-CB 4.11Å; V85-H88 WeakPolarHBondContact O-CB 3.46Å; V85-H88 PolarHBondContact O-N 3.41Å; S86-H88 PolarHBondContact O-N 3.01Å; S86-H88 VanDerWaalsContact O-N 3.12Å
89	I	93.9	Very high	94.4	Very high	11 Å²	11	52.1 Å²	52.1	6%	0.056	25%	0.252	C	S	.	.			trans	-83.3	128.7	178	-66.4	174	0	0	0	108.8	V63 V85 S86 I95 L111 P112	V63-I89 HydrophobicContact CG1-CG1 3.82Å; V85-I89 HydrophobicContact CG2-CD1 3.76Å; V85-I89 HydrophobicContact CG2-CG1 4.44Å; V85-I89 PolarHBondContact O-N 3.02Å; S86-I89 PolarHBondContact O-N 3.5Å; S86-I89 VanDerWaalsContact O-N 3.12Å; I89-I95 HydrophobicContact CD1-CD1 3.82Å; I89-I95 HydrophobicContact CD1-CG1 4.13Å; I89-I95 HydrophobicContact CG1-CD1 4.11Å; I89-I95 HydrophobicContact CG2-CD1 4.3Å; I89-I95 HydrophobicContact CG2-CG1 4.25Å; I89-L111 HydrophobicContact CD1-CD2 3.29Å; I89-P112 HydrophobicContact CB-CG 4.44Å
90	T	90.5	Very high	94	Very high	67 Å²	67	51.7 Å²	51.7	41%	0.411	25%	0.252	S	S	.	.			trans	-123.4	179.1	177.3	73.9	0	0	0	0	109.3	K92 Q93	T90-K92 PolarHBondContact O-N 3.46Å; T90-K92 PolarHBondContact OG1-N 3.24Å; T90-Q93 PolarHBondContact O-N 2.81Å; T90-Q93 PolarHBondContact O-OE1 3.09Å; T90-Q93 PolarHBondContact OG1-OE1 3.06Å
91	K	86.9	Confident	93.6	Very high	137 Å²	137	43.3 Å²	43.3	60%	0.596	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	2.5	175.4	-55.4	-168.9	-175.8	-159.2	0	114.4	N114	K91-N114 HydrophobicContact CD-CB 4.2Å; K91-N114 PolarHBondContact NZ-ND2 2.91Å
92	K	87	Confident	93.4	Very high	173 Å²	173	43.1 Å²	43.1	75%	0.752	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-29.9	179.9	-65.9	-177.3	176	-177.1	0	113	T90	T90-K92 PolarHBondContact O-N 3.46Å; T90-K92 PolarHBondContact OG1-N 3.24Å
93	Q	95	Very high	93.4	Very high	17 Å²	17	44.9 Å²	44.9	8%	0.079	23%	0.233	C	C	.	.			trans	-90.1	136.5	-174.3	-65.9	92.1	-10.3	0	0	111.6	S66 D67 T90 I95	S66-Q93 VanDerWaalsContact O-CG 3.27Å; S66-Q93 WeakPolarHBondContact O-CG 3.43Å; D67-Q93 CarbonylContact O-C 3.49Å; D67-Q93 VanDerWaalsContact O-CA 3.31Å; D67-Q93 WeakPolarHBondContact O-CA 3.46Å; T90-Q93 PolarHBondContact O-N 2.81Å; T90-Q93 PolarHBondContact O-OE1 3.09Å; T90-Q93 PolarHBondContact OG1-OE1 3.06Å; Q93-I95 HydrophobicContact CB-CD1 4.02Å
94	I	97.9	Very high	93.5	Very high	12 Å²	12	41.1 Å²	41.1	6%	0.062	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	114.5	167.2	-54.4	175.5	0	0	0	107.7	D67 V68 V69 V96 I116 I118 D145 L148	D67-I94 PolarHBondContact O-N 3.26Å; V68-I94 WeakPolarHBondContact CA-O 3.49Å; V68-I94 HydrophobicContact CG1-CB 4.4Å; V68-I94 HydrophobicContact CG2-CB 4.38Å; V68-I94 HydrophobicContact CG2-CD1 4.28Å; V69-I94 PolarHBondContact N-O 2.78Å; I94-V96 HydrophobicContact CG2-CG2 3.98Å; I94-I116 HydrophobicContact CB-CG2 4.36Å; I94-I116 HydrophobicContact CG1-CG2 4.04Å; I94-I116 HydrophobicContact CG2-CG2 4.14Å; I94-I118 HydrophobicContact CG2-CD1 3.71Å; I94-I118 HydrophobicContact CG2-CG1 4.08Å; I94-D145 HydrophobicContact CD1-CB 3.9Å; I94-D145 WeakPolarHBondContact CD1-OD1 3.16Å; I94-L148 HydrophobicContact CD1-CD2 3.87Å
95	I	98.4	Very high	93.5	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	113	178.3	-50.7	-56.1	0	0	0	109.2	V69 V71 I89 Q93 L111 I116 V117 I118	V69-I95 HydrophobicContact CB-CD1 3.95Å; V69-I95 HydrophobicContact CG2-CD1 4.3Å; V71-I95 HydrophobicContact CG2-CG2 3.8Å; I89-I95 HydrophobicContact CD1-CD1 3.82Å; I89-I95 HydrophobicContact CD1-CG1 4.13Å; I89-I95 HydrophobicContact CG1-CD1 4.11Å; I89-I95 HydrophobicContact CG2-CD1 4.3Å; I89-I95 HydrophobicContact CG2-CG1 4.25Å; Q93-I95 HydrophobicContact CB-CD1 4.02Å; I95-L111 HydrophobicContact CB-CD1 4.2Å; I95-L111 HydrophobicContact CG1-CD1 4.19Å; I95-L111 HydrophobicContact CG2-CD1 4.08Å; I95-I116 PolarHBondContact N-O 3.45Å; I95-V117 CarbonylContact O-C 3.59Å; I95-V117 WeakPolarHBondContact O-CA 3.46Å; I95-I118 PolarHBondContact O-N 3.3Å
96	V	98.6	Very high	93.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	107.2	-178.5	-171.9	0	0	0	0	109.6	V68 V69 F70 V71 I94 I118 L120 L149	V68-V96 HydrophobicContact CG1-CG2 3.77Å; V69-V96 PolarHBondContact O-N 3.47Å; F70-V96 CarbonylContact C-O 3.59Å; F70-V96 VanDerWaalsContact CA-O 3.26Å; F70-V96 WeakPolarHBondContact CA-O 3.41Å; F70-V96 HydrophobicContact CD1-CB 3.86Å; F70-V96 HydrophobicContact CD1-CG1 3.77Å; F70-V96 HydrophobicContact CE1-CB 3.98Å; F70-V96 HydrophobicContact CE1-CG1 3.67Å; F70-V96 HydrophobicContact CE1-CG2 4.34Å; F70-V96 HydrophobicContact CG-CB 4.3Å; F70-V96 HydrophobicContact CZ-CB 4.49Å; F70-V96 HydrophobicContact CZ-CG1 4.48Å; F70-V96 HydrophobicContact CZ-CG2 4.4Å; V71-V96 PolarHBondContact N-O 2.83Å; I94-V96 HydrophobicContact CG2-CG2 3.98Å; V96-I118 CarbonylContact C-O 3.51Å; V96-I118 VanDerWaalsContact CA-O 3.32Å; V96-I118 WeakPolarHBondContact CA-O 3.36Å; V96-I118 HydrophobicContact CG1-CB 4.48Å; V96-I118 HydrophobicContact CG2-CB 4.33Å; V96-L120 HydrophobicContact CG1-CB 3.59Å; V96-L120 HydrophobicContact CG1-CD2 3.89Å; V96-L120 HydrophobicContact CG1-CG 4.39Å; V96-L149 HydrophobicContact CG1-CD1 4.48Å; V96-L149 HydrophobicContact CG1-CD2 4.35Å; V96-L149 HydrophobicContact CG2-CD1 4.15Å
97	S	97.8	Very high	93.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	132.2	174.5	-179.7	0	0	0	0	110.7	A99 L107 I118 L120	S97-A99 PolarHBondContact OG-N 3.24Å; S97-L107 VanDerWaalsContact CB-CD1 3.46Å; S97-I118 PolarHBondContact N-O 3.02Å; S97-L120 PolarHBondContact O-N 3.33Å
98	V	95.4	Very high	93.6	Very high	14 Å²	14	35.4 Å²	35.4	9%	0.085	19%	0.19	C	C	.	.			trans	-106.1	12.1	170.5	-59.2	0	0	0	0	113.5	I21 F70 V71 A72 L120 P122	I21-V98 HydrophobicContact CD1-CG1 4.03Å; F70-V98 HydrophobicContact CD1-CG1 4.28Å; V71-V98 WeakPolarHBondContact O-CG2 3.35Å; V71-V98 PolarHBondContact O-N 3.46Å; V71-V98 VanDerWaalsContact O-N 3.17Å; A72-V98 HydrophobicContact CB-CG2 3.49Å; A72-V98 VanDerWaalsContact CB-CG2 3.49Å; V98-L120 VanDerWaalsContact CA-O 3.3Å; V98-L120 WeakPolarHBondContact CA-O 3.39Å; V98-L120 HydrophobicContact CG1-CB 4.18Å; V98-L120 HydrophobicContact CG1-CD2 3.78Å; V98-L120 HydrophobicContact CG1-CG 4.11Å; V98-P122 HydrophobicContact CB-CG 4.32Å; V98-P122 HydrophobicContact CG1-CG 4.42Å
99	A	90.8	Very high	93.7	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.033	22%	0.216	C	C	.	.			trans	-80.9	123	-175.4	0	0	0	0	0	111.8	P75 I78 S97 V102	P75-A99 HydrophobicContact CB-CB 4.43Å; P75-A99 HydrophobicContact CG-CB 4.24Å; I78-A99 HydrophobicContact CD1-CB 3.81Å; I78-A99 HydrophobicContact CG1-CB 3.67Å; S97-A99 PolarHBondContact OG-N 3.24Å; A99-V102 HydrophobicContact CB-CB 4.1Å; A99-V102 HydrophobicContact CB-CG2 3.65Å; A99-V102 PolarHBondContact O-N 3.24Å
100	A	87.3	Confident	93.7	Very high	36 Å²	36	42.4 Å²	42.4	30%	0.298	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	137.2	172.8	0	0	0	0	0	111.4	P75 V102 M121	P75-A100 WeakPolarHBondContact CB-O 3.45Å; P75-A100 WeakPolarHBondContact CG-O 3.37Å; A100-V102 VanDerWaalsContact C-N 3.25Å; A100-V102 PolarHBondContact O-N 3.38Å; A100-M121 HydrophobicContact CB-CE 4.3Å; A100-M121 HydrophobicContact CB-SD 4.28Å
101	G	86.4	Confident	94	Very high	8 Å²	8	39.8 Å²	39.8	8%	0.082	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	9.8	179.8	0	0	0	0	0	115.1	G269	G101-G269 WeakPolarHBondContact O-CA 3.41Å
102	V	92.1	Very high	94.4	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.024	19%	0.194	C	C	.	.			trans	-101.2	115.8	173.3	179.5	0	0	0	0	109.1	P75 I78 A99 A100 M106 L107 R119	P75-V102 HydrophobicContact CB-CG2 4.19Å; I78-V102 HydrophobicContact CB-CG2 4.44Å; I78-V102 HydrophobicContact CG1-CG2 4.14Å; I78-V102 HydrophobicContact CG2-CG1 4.14Å; A99-V102 HydrophobicContact CB-CB 4.1Å; A99-V102 HydrophobicContact CB-CG2 3.65Å; A99-V102 PolarHBondContact O-N 3.24Å; A100-V102 VanDerWaalsContact C-N 3.25Å; A100-V102 PolarHBondContact O-N 3.38Å; V102-M106 HydrophobicContact CG1-CG 4.47Å; V102-M106 HydrophobicContact CG1-SD 3.94Å; V102-L107 HydrophobicContact CG1-CD1 4.35Å; V102-L107 HydrophobicContact CG1-CD2 3.58Å; V102-L107 HydrophobicContact CG1-CG 3.74Å; V102-R119 WeakPolarHBondContact O-CD 3.32Å; V102-R119 PolarHBondContact O-NE 3.12Å
103	T	95.3	Very high	94.6	Very high	36 Å²	36	35.4 Å²	35.4	22%	0.221	20%	0.196	C	C	.	.			trans	-80.4	158.6	-176.5	63.6	0	0	0	0	112.2	A105 M106 L107 E164	T103-A105 VanDerWaalsContact C-N 3.28Å; T103-A105 PolarHBondContact O-N 3.49Å; T103-M106 PolarHBondContact O-N 2.83Å; T103-M106 WeakPolarHBondContact OG1-CB 3.45Å; T103-M106 PolarHBondContact OG1-N 2.86Å; T103-L107 WeakPolarHBondContact O-CG 3.29Å; T103-L107 PolarHBondContact O-N 2.94Å; T103-L107 VanDerWaalsContact O-N 3.09Å; T103-E164 VanDerWaalsContact CA-OE1 3.23Å; T103-E164 WeakPolarHBondContact CA-OE1 3.24Å
104	L	96.8	Very high	94.5	Very high	12 Å²	12	37.6 Å²	37.6	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-56.3	-44.7	171.2	-74.6	169.4	0	0	0	111.2	M106 L107 E108 V117 R119 A136 L137 E164	L104-M106 VanDerWaalsContact C-N 3.33Å; L104-M106 PolarHBondContact O-N 3.47Å; L104-L107 WeakPolarHBondContact O-CB 3.35Å; L104-L107 PolarHBondContact O-N 2.92Å; L104-L107 VanDerWaalsContact O-N 3.13Å; L104-E108 WeakPolarHBondContact O-CB 3.43Å; L104-E108 WeakPolarHBondContact O-CG 3.43Å; L104-E108 PolarHBondContact O-N 2.98Å; L104-V117 HydrophobicContact CD2-CG1 4.03Å; L104-R119 HydrophobicContact CD2-CB 3.67Å; L104-R119 HydrophobicContact CG-CB 3.85Å; L104-A136 HydrophobicContact CD1-CB 4Å; L104-L137 WeakPolarHBondContact CD1-O 3.44Å; L104-E164 HydrophobicContact CD1-CB 4.1Å; L104-E164 HydrophobicContact CD1-CG 4.07Å; L104-E164 HydrophobicContact CG-CG 4.39Å; L104-E164 PolarHBondContact N-OE1 3.5Å
105	A	95.6	Very high	94.4	Very high	64 Å²	64	37.2 Å²	37.2	53%	0.529	21%	0.207	S	C	.	.	H	α-helix	trans	-56.6	-44.5	177.9	0	0	0	0	0	112.6	T103 E108 E109	T103-A105 VanDerWaalsContact C-N 3.28Å; T103-A105 PolarHBondContact O-N 3.49Å; A105-E108 PolarHBondContact O-N 3.4Å; A105-E109 WeakPolarHBondContact O-CB 3.46Å; A105-E109 PolarHBondContact O-N 2.81Å
106	M	94.4	Very high	94.4	Very high	43 Å²	43	38.3 Å²	38.3	21%	0.212	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-40.6	177.1	-179.8	-175.6	173.3	0	0	112	P79 V102 T103 L104 E109 L110	P79-M106 HydrophobicContact CG-CE 3.6Å; V102-M106 HydrophobicContact CG1-CG 4.47Å; V102-M106 HydrophobicContact CG1-SD 3.94Å; T103-M106 PolarHBondContact O-N 2.83Å; T103-M106 WeakPolarHBondContact OG1-CB 3.45Å; T103-M106 PolarHBondContact OG1-N 2.86Å; L104-M106 VanDerWaalsContact C-N 3.33Å; L104-M106 PolarHBondContact O-N 3.47Å; M106-E109 PolarHBondContact O-N 3.33Å; M106-L110 HydrophobicContact CE-CD1 3.92Å; M106-L110 HydrophobicContact CG-CD1 3.96Å; M106-L110 WeakPolarHBondContact O-CB 3.46Å; M106-L110 WeakPolarHBondContact O-CD1 3.46Å; M106-L110 VanDerWaalsContact O-CG 3.22Å; M106-L110 WeakPolarHBondContact O-CG 3.47Å; M106-L110 PolarHBondContact O-N 3.08Å; M106-L110 VanDerWaalsContact O-N 3.17Å
107	L	95.9	Very high	94.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-43.5	177.2	-66	167.1	0	0	0	111.3	I78 L82 S97 V102 T103 L104 L110 L111 V117	I78-L107 HydrophobicContact CG2-CD2 4.11Å; L82-L107 HydrophobicContact CD1-CD2 3.66Å; S97-L107 VanDerWaalsContact CB-CD1 3.46Å; V102-L107 HydrophobicContact CG1-CD1 4.35Å; V102-L107 HydrophobicContact CG1-CD2 3.58Å; V102-L107 HydrophobicContact CG1-CG 3.74Å; T103-L107 WeakPolarHBondContact O-CG 3.29Å; T103-L107 PolarHBondContact O-N 2.94Å; T103-L107 VanDerWaalsContact O-N 3.09Å; L104-L107 WeakPolarHBondContact O-CB 3.35Å; L104-L107 PolarHBondContact O-N 2.92Å; L104-L107 VanDerWaalsContact O-N 3.13Å; L107-L110 PolarHBondContact O-N 3.41Å; L107-L111 WeakPolarHBondContact O-CB 3.49Å; L107-L111 WeakPolarHBondContact O-CD1 3.49Å; L107-L111 VanDerWaalsContact O-CG 3.24Å; L107-L111 WeakPolarHBondContact O-CG 3.32Å; L107-L111 PolarHBondContact O-N 3.41Å; L107-V117 HydrophobicContact CB-CG1 3.61Å; L107-V117 HydrophobicContact CD1-CG1 3.59Å; L107-V117 HydrophobicContact CG-CG1 4.2Å
108	E	96.1	Very high	94.4	Very high	48 Å²	48	38.3 Å²	38.3	22%	0.224	21%	0.212	C	C	.	.	H	α-helix	trans	-66.5	-35.3	179.1	-71.5	178.1	168.6	0	0	112.4	L104 A105 V117 G138 T139	L104-E108 WeakPolarHBondContact O-CB 3.43Å; L104-E108 WeakPolarHBondContact O-CG 3.43Å; L104-E108 PolarHBondContact O-N 2.98Å; A105-E108 PolarHBondContact O-N 3.4Å; E108-V117 HydrophobicContact CG-CB 4.45Å; E108-V117 HydrophobicContact CG-CG2 4.23Å; E108-G138 WeakPolarHBondContact OE1-CA 3.32Å; E108-T139 WeakPolarHBondContact OE1-CB 3.44Å; E108-T139 PolarHBondContact OE1-N 3.44Å; E108-T139 PolarHBondContact OE1-OG1 3.35Å; E108-T139 PolarHBondContact OE2-OG1 2.92Å
109	E	95.1	Very high	94.5	Very high	170 Å²	170	38 Å²	38	79%	0.794	21%	0.209	S	C	*	.	H	α-helix	trans	-67.7	-35.4	174.6	-174.6	179.6	178.4	0	0	112.5	A105 M106 L111	A105-E109 WeakPolarHBondContact O-CB 3.46Å; A105-E109 PolarHBondContact O-N 2.81Å; M106-E109 PolarHBondContact O-N 3.33Å; E109-L111 VanDerWaalsContact C-N 3.34Å
110	L	94.8	Very high	94.9	Very high	43 Å²	43	37.8 Å²	37.8	23%	0.225	21%	0.208	C	C	.	.	H	α-helix	trans	-82.5	-10.9	-178	-70.2	170.2	0	0	0	113.9	I78 P79 L82 M106 L107	I78-L110 HydrophobicContact CG2-CD1 4.49Å; P79-L110 HydrophobicContact CB-CD1 4.3Å; P79-L110 HydrophobicContact CB-CD2 4.37Å; P79-L110 HydrophobicContact CG-CD1 4.33Å; L82-L110 HydrophobicContact CB-CB 4.23Å; L82-L110 HydrophobicContact CD1-CB 3.96Å; L82-L110 HydrophobicContact CD1-CD1 4.02Å; M106-L110 HydrophobicContact CE-CD1 3.92Å; M106-L110 HydrophobicContact CG-CD1 3.96Å; M106-L110 WeakPolarHBondContact O-CB 3.46Å; M106-L110 WeakPolarHBondContact O-CD1 3.46Å; M106-L110 VanDerWaalsContact O-CG 3.22Å; M106-L110 WeakPolarHBondContact O-CG 3.47Å; M106-L110 PolarHBondContact O-N 3.08Å; M106-L110 VanDerWaalsContact O-N 3.17Å; L107-L110 PolarHBondContact O-N 3.41Å
111	L	95.8	Very high	95.3	Very high	12 Å²	12	37 Å²	37	6%	0.063	20%	0.199	C	C	.	.	S	Bend	trans	-112.3	159.5	-174.4	-72.9	174.6	0	0	0	111.4	L82 I89 I95 L107 E109 V117	L82-L111 HydrophobicContact CB-CD2 4.33Å; L82-L111 HydrophobicContact CD1-CG 4.35Å; L82-L111 HydrophobicContact CD2-CD2 4.17Å; I89-L111 HydrophobicContact CD1-CD2 3.29Å; I95-L111 HydrophobicContact CB-CD1 4.2Å; I95-L111 HydrophobicContact CG1-CD1 4.19Å; I95-L111 HydrophobicContact CG2-CD1 4.08Å; L107-L111 WeakPolarHBondContact O-CB 3.49Å; L107-L111 WeakPolarHBondContact O-CD1 3.49Å; L107-L111 VanDerWaalsContact O-CG 3.24Å; L107-L111 WeakPolarHBondContact O-CG 3.32Å; L107-L111 PolarHBondContact O-N 3.41Å; E109-L111 VanDerWaalsContact C-N 3.34Å; L111-V117 HydrophobicContact CD1-CG2 3.67Å
112	P	95.4	Very high	95.7	Very high	49 Å²	49	36.9 Å²	36.9	32%	0.318	20%	0.196	S	C	.	.			trans	-54.2	146.3	174	-25.2	34.2	0	0	0	112.2	S86 I89 N114 S115	S86-P112 VanDerWaalsContact O-CG 3.31Å; S86-P112 WeakPolarHBondContact O-CG 3.34Å; I89-P112 HydrophobicContact CB-CG 4.44Å; P112-N114 PolarHBondContact O-N 2.75Å; P112-S115 VanDerWaalsContact O-CB 3.3Å; P112-S115 WeakPolarHBondContact O-CB 3.36Å; P112-S115 PolarHBondContact O-N 3.16Å; P112-S115 VanDerWaalsContact O-N 3.07Å; P112-S115 PolarHBondContact O-OG 3.2Å
113	E	92.9	Very high	95.9	Very high	170 Å²	170	37.4 Å²	37.4	79%	0.794	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	138	177.2	-165.7	-175.6	-173.5	0	0	111.3	S115	E113-S115 VanDerWaalsContact C-N 3.32Å
114	N	92.1	Very high	95.8	Very high	63 Å²	63	38.8 Å²	38.8	34%	0.337	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	17.5	-174.4	-42.9	-88.2	0	0	0	115.7	K91 P112 N140	K91-N114 HydrophobicContact CD-CB 4.2Å; K91-N114 PolarHBondContact NZ-ND2 2.91Å; P112-N114 PolarHBondContact O-N 2.75Å; N114-N140 WeakPolarHBondContact CA-ND2 3.44Å
115	S	96.3	Very high	95.8	Very high	4 Å²	4	39.9 Å²	39.9	3%	0.028	21%	0.212	C	C	.	.			trans	-62.6	140.9	170	-65.7	0	0	0	0	111	P112 E113 N140	P112-S115 VanDerWaalsContact O-CB 3.3Å; P112-S115 WeakPolarHBondContact O-CB 3.36Å; P112-S115 PolarHBondContact O-N 3.16Å; P112-S115 VanDerWaalsContact O-N 3.07Å; P112-S115 PolarHBondContact O-OG 3.2Å; E113-S115 VanDerWaalsContact C-N 3.32Å; S115-N140 PolarHBondContact O-ND2 3.41Å
116	I	97.9	Very high	95.7	Very high	25 Å²	25	36.8 Å²	36.8	13%	0.128	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	116.5	174.5	-58.4	173.8	0	0	0	107.7	I94 I95 A141 D145	I94-I116 HydrophobicContact CB-CG2 4.36Å; I94-I116 HydrophobicContact CG1-CG2 4.04Å; I94-I116 HydrophobicContact CG2-CG2 4.14Å; I95-I116 PolarHBondContact N-O 3.45Å; I116-A141 HydrophobicContact CG2-CB 3.85Å; I116-D145 HydrophobicContact CG2-CB 4.43Å
117	V	98	Very high	95.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.7	-173.4	-176.5	0	0	0	0	110.3	I95 L104 L107 E108 L111 G138	I95-V117 CarbonylContact O-C 3.59Å; I95-V117 WeakPolarHBondContact O-CA 3.46Å; L104-V117 HydrophobicContact CD2-CG1 4.03Å; L107-V117 HydrophobicContact CB-CG1 3.61Å; L107-V117 HydrophobicContact CD1-CG1 3.59Å; L107-V117 HydrophobicContact CG-CG1 4.2Å; E108-V117 HydrophobicContact CG-CB 4.45Å; E108-V117 HydrophobicContact CG-CG2 4.23Å; L111-V117 HydrophobicContact CD1-CG2 3.67Å; V117-G138 WeakPolarHBondContact O-CA 3.1Å; V117-G138 PolarHBondContact O-N 3.1Å
118	I	98.6	Very high	95.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	133.9	170.6	-58.5	179	0	0	0	108.5	I94 I95 V96 S97 F135 A136 L137 A141 D145 L149	I94-I118 HydrophobicContact CG2-CD1 3.71Å; I94-I118 HydrophobicContact CG2-CG1 4.08Å; I95-I118 PolarHBondContact O-N 3.3Å; V96-I118 CarbonylContact C-O 3.51Å; V96-I118 VanDerWaalsContact CA-O 3.32Å; V96-I118 WeakPolarHBondContact CA-O 3.36Å; V96-I118 HydrophobicContact CG1-CB 4.48Å; V96-I118 HydrophobicContact CG2-CB 4.33Å; S97-I118 PolarHBondContact N-O 3.02Å; I118-F135 HydrophobicContact CG2-CB 3.85Å; I118-F135 HydrophobicContact CG2-CD2 3.77Å; I118-F135 HydrophobicContact CG2-CG 4.19Å; I118-A136 WeakPolarHBondContact CA-O 3.49Å; I118-A136 WeakPolarHBondContact CG2-O 3.49Å; I118-L137 HydrophobicContact CD1-CD2 3.72Å; I118-L137 HydrophobicContact CG1-CD2 3.79Å; I118-A141 HydrophobicContact CG1-CB 4.38Å; I118-D145 HydrophobicContact CD1-CB 4.33Å; I118-L149 HydrophobicContact CB-CD2 4.39Å; I118-L149 HydrophobicContact CD1-CB 4.38Å; I118-L149 HydrophobicContact CD1-CD2 3.92Å; I118-L149 HydrophobicContact CG2-CD2 3.61Å
119	R	98	Very high	95.6	Very high	6 Å²	6	41.2 Å²	41.2	2%	0.023	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	116.9	169.6	-177.4	-179.2	176.9	-163.3	-10.7	107.8	V102 L104 F135 A136 E164 I167 D168	V102-R119 WeakPolarHBondContact O-CD 3.32Å; V102-R119 PolarHBondContact O-NE 3.12Å; L104-R119 HydrophobicContact CD2-CB 3.67Å; L104-R119 HydrophobicContact CG-CB 3.85Å; R119-F135 CarbonylContact O-C 3.38Å; R119-F135 WeakPolarHBondContact O-CA 3.35Å; R119-F135 WeakPolarHBondContact O-CB 3.49Å; R119-A136 PolarHBondContact N-O 2.89Å; R119-A136 PolarHBondContact O-N 3.36Å; R119-E164 VanDerWaalsContact CD-OE1 3.28Å; R119-E164 WeakPolarHBondContact CD-OE1 3.36Å; R119-E164 IonicContact CZ-OE1 2.83Å; R119-E164 IonicContact NE-OE1 3.47Å; R119-E164 IonicContact NH1-OE1 3.91Å; R119-E164 PolarHBondContact NH1-OE1 3.19Å; R119-I167 HydrophobicContact CB-CD1 4.07Å; R119-I167 HydrophobicContact CG-CD1 3.79Å; R119-I167 WeakPolarHBondContact O-CD1 3.43Å; R119-D168 IonicContact CZ-OD1 3.81Å; R119-D168 IonicContact NH1-OD1 2.61Å; R119-D168 IonicContact NH2-OD1 2.79Å; R119-D168 PolarHBondContact NH2-OD1 2.61Å
120	L	97.9	Very high	95.7	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	136.3	178.4	174	67.2	0	0	0	109	I21 F70 V96 S97 V98 L133 L134 F135 L153	I21-L120 HydrophobicContact CD1-CD2 4.27Å; F70-L120 HydrophobicContact CD1-CD2 4.23Å; F70-L120 HydrophobicContact CE1-CD2 3.74Å; V96-L120 HydrophobicContact CG1-CB 3.59Å; V96-L120 HydrophobicContact CG1-CD2 3.89Å; V96-L120 HydrophobicContact CG1-CG 4.39Å; S97-L120 PolarHBondContact O-N 3.33Å; V98-L120 VanDerWaalsContact CA-O 3.3Å; V98-L120 WeakPolarHBondContact CA-O 3.39Å; V98-L120 HydrophobicContact CG1-CB 4.18Å; V98-L120 HydrophobicContact CG1-CD2 3.78Å; V98-L120 HydrophobicContact CG1-CG 4.11Å; L120-L133 HydrophobicContact CD1-CB 4.12Å; L120-L133 HydrophobicContact CD1-CD2 4.37Å; L120-L134 CarbonylContact C-O 3.49Å; L120-F135 HydrophobicContact CB-CB 4.28Å; L120-F135 HydrophobicContact CD1-CB 3.83Å; L120-L153 HydrophobicContact CD1-CD1 3.9Å; L120-L153 HydrophobicContact CD2-CD1 3.69Å
121	M	95.9	Very high	95.8	Very high	20 Å²	20	35.5 Å²	35.5	10%	0.099	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	100.3	173.2	-175.1	65.9	-169.2	0	0	109.2	A100 L133 L134 I167 H170 T171	A100-M121 HydrophobicContact CB-CE 4.3Å; A100-M121 HydrophobicContact CB-SD 4.28Å; M121-L133 WeakPolarHBondContact O-CA 3.33Å; M121-L134 PolarHBondContact N-O 3.33Å; M121-L134 PolarHBondContact O-N 2.92Å; M121-L134 VanDerWaalsContact O-N 3.12Å; M121-I167 HydrophobicContact CB-CG2 3.62Å; M121-I167 HydrophobicContact CG-CG2 4.19Å; M121-H170 PolarHBondContact O-CD2 2.88Å; M121-H170 PolarHBondContact O-NE2 3.44Å; M121-H170 VanDerWaalsContact O-NE2 3.09Å; M121-T171 HydrophobicContact CE-CG2 3.83Å
122	P	95.6	Very high	95.9	Very high	5 Å²	5	36 Å²	36	3%	0.032	19%	0.194	C	C	.	.			trans	-85.6	172.5	170.8	35.6	-34.2	0	0	0	111.4	M17 I21 V98 L133	M17-P122 HydrophobicContact CB-CG 4.39Å; M17-P122 HydrophobicContact CG-CG 4.21Å; M17-P122 HydrophobicContact SD-CB 4.14Å; M17-P122 HydrophobicContact SD-CG 3.69Å; I21-P122 HydrophobicContact CD1-CG 4.35Å; V98-P122 HydrophobicContact CB-CG 4.32Å; V98-P122 HydrophobicContact CG1-CG 4.42Å; P122-L133 HydrophobicContact CB-CD2 3.89Å; P122-L133 HydrophobicContact CB-CG 4.04Å
123	N	95.4	Very high	96	Very high	14 Å²	14	33.6 Å²	33.6	8%	0.075	18%	0.179	C	C	.	.			trans	-124.6	170.7	166.1	70.4	-3.8	0	0	0	112.5	C126 G131 A132 S174	N123-C126 WeakPolarHBondContact O-CB 3.4Å; N123-C126 PolarHBondContact O-N 3.03Å; N123-C126 PolarHBondContact O-SG 2.84Å; N123-G131 WeakPolarHBondContact OD1-CA 3.34Å; N123-A132 PolarHBondContact N-O 3.23Å; N123-A132 PolarHBondContact OD1-N 3.32Å; N123-A132 PolarHBondContact OD1-O 3.46Å; N123-S174 WeakPolarHBondContact CB-O 3.38Å; N123-S174 PolarHBondContact ND2-O 2.73Å; N123-S174 VanDerWaalsContact ND2-O 3.16Å
124	L	93.5	Very high	96.2	Very high	65 Å²	65	26.7 Å²	26.7	34%	0.34	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-57.3	-37.6	-172.9	-172.8	65.3	0	0	0	115.1	M17 C126 L127 V178	M17-L124 HydrophobicContact CE-CD1 3.95Å; L124-C126 PolarHBondContact O-N 3.26Å; L124-L127 HydrophobicContact CD1-CD1 3.48Å; L124-L127 VanDerWaalsContact CD1-CD1 3.48Å; L124-L127 HydrophobicContact CD1-CG 4.28Å; L124-L127 HydrophobicContact CG-CD1 4.24Å; L124-L127 WeakPolarHBondContact O-CG 3.43Å; L124-L127 PolarHBondContact O-N 3.4Å; L124-V178 HydrophobicContact CB-CG1 4.49Å; L124-V178 HydrophobicContact CB-CG2 4.49Å; L124-V178 HydrophobicContact CD2-CG1 4.42Å
125	P	95.9	Very high	96.5	Very high	35 Å²	35	23.7 Å²	23.7	23%	0.227	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-54	-13.4	174.8	-32.6	37.4	0	0	0	116.7	L127 V128 Q129 E130 V178	P125-L127 PolarHBondContact O-N 3.48Å; P125-L127 VanDerWaalsContact O-N 3.1Å; P125-V128 CarbonylContact O-C 3.6Å; P125-V128 VanDerWaalsContact O-CG2 3.23Å; P125-V128 WeakPolarHBondContact O-CG2 3.49Å; P125-V128 PolarHBondContact O-N 3.46Å; P125-Q129 PolarHBondContact O-N 3.34Å; P125-E130 HydrophobicContact CB-CB 4.39Å; P125-E130 WeakPolarHBondContact CB-O 3.3Å; P125-E130 PolarHBondContact O-N 3.45Å; P125-E130 VanDerWaalsContact O-N 3.1Å; P125-V178 HydrophobicContact CG-CG2 3.94Å
126	C	94.3	Very high	96.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-53.8	-27.8	168.1	-63.1	0	0	0	0	112.8	N123 L124 V128 Q129	N123-C126 WeakPolarHBondContact O-CB 3.4Å; N123-C126 PolarHBondContact O-N 3.03Å; N123-C126 PolarHBondContact O-SG 2.84Å; L124-C126 PolarHBondContact O-N 3.26Å; C126-V128 PolarHBondContact O-N 2.88Å; C126-Q129 PolarHBondContact O-N 3.28Å; C126-Q129 VanDerWaalsContact O-N 3.17Å; C126-Q129 PolarHBondContact O-NE2 3.47Å
127	L	93.6	Very high	96.6	Very high	45 Å²	45	24.2 Å²	24.2	24%	0.236	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-60.7	-25.5	176.6	-70	176.2	0	0	0	113.6	N16 F19 L124 P125	N16-L127 HydrophobicContact CB-CD1 4.49Å; N16-L127 HydrophobicContact CB-CD2 4.39Å; N16-L127 WeakPolarHBondContact O-CD2 3.12Å; F19-L127 HydrophobicContact CD1-CD2 3.95Å; L124-L127 HydrophobicContact CD1-CD1 3.48Å; L124-L127 VanDerWaalsContact CD1-CD1 3.48Å; L124-L127 HydrophobicContact CD1-CG 4.28Å; L124-L127 HydrophobicContact CG-CD1 4.24Å; L124-L127 WeakPolarHBondContact O-CG 3.43Å; L124-L127 PolarHBondContact O-N 3.4Å; P125-L127 PolarHBondContact O-N 3.48Å; P125-L127 VanDerWaalsContact O-N 3.1Å
128	V	95.1	Very high	96.6	Very high	102 Å²	102	24.5 Å²	24.5	62%	0.618	14%	0.137	S	C	*	.	G	3₁₀ helix	trans	-116.3	17	179.6	-61.8	0	0	0	0	112.2	P125 C126 E130	P125-V128 CarbonylContact O-C 3.6Å; P125-V128 VanDerWaalsContact O-CG2 3.23Å; P125-V128 WeakPolarHBondContact O-CG2 3.49Å; P125-V128 PolarHBondContact O-N 3.46Å; C126-V128 PolarHBondContact O-N 2.88Å; V128-E130 HydrophobicContact CG2-CB 4.2Å; V128-E130 HydrophobicContact CG2-CG 4.5Å; V128-E130 PolarHBondContact O-N 3.47Å
129	Q	95.9	Very high	96.6	Very high	37 Å²	37	29.9 Å²	29.9	17%	0.173	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	30.6	179	-48.9	-46.5	-31.6	0	0	114.3	G20 G24 P125 C126 C155 C156	G20-Q129 PolarHBondContact O-NE2 3.09Å; G24-Q129 VanDerWaalsContact CA-CD 3.41Å; P125-Q129 PolarHBondContact O-N 3.34Å; C126-Q129 PolarHBondContact O-N 3.28Å; C126-Q129 VanDerWaalsContact O-N 3.17Å; C126-Q129 PolarHBondContact O-NE2 3.47Å; Q129-C155 WeakPolarHBondContact CB-O 3.35Å; Q129-C155 PolarHBondContact OE1-O 2.87Å; Q129-C156 CarbonylContact C-O 3.59Å; Q129-C156 VanDerWaalsContact OE1-CA 3.31Å
130	E	96.9	Very high	96.5	Very high	88 Å²	88	32.4 Å²	32.4	41%	0.411	18%	0.184	S	C	.	.			trans	-124.3	32.8	176.4	-68.1	-71.3	-166.9	0	0	110.6	P125 V128 R218	P125-E130 HydrophobicContact CB-CB 4.39Å; P125-E130 WeakPolarHBondContact CB-O 3.3Å; P125-E130 PolarHBondContact O-N 3.45Å; P125-E130 VanDerWaalsContact O-N 3.1Å; V128-E130 HydrophobicContact CG2-CB 4.2Å; V128-E130 HydrophobicContact CG2-CG 4.5Å; V128-E130 PolarHBondContact O-N 3.47Å; E130-R218 IonicContact OE1-CZ 3.9Å; E130-R218 IonicContact OE1-NH1 2.81Å; E130-R218 PolarHBondContact OE1-NH1 3.07Å; E130-R218 IonicContact OE2-CZ 2.83Å; E130-R218 IonicContact OE2-NH1 3.92Å; E130-R218 PolarHBondContact OE2-NH1 3.02Å
131	G	96.8	Very high	96.5	Very high	5 Å²	5	33 Å²	33	5%	0.052	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	158.2	-179.2	0	0	0	0	0	113.4	N123 C156 G157 L158	N123-G131 WeakPolarHBondContact OD1-CA 3.34Å; G131-C156 WeakPolarHBondContact CA-O 3.28Å; G131-C156 PolarHBondContact N-O 3.28Å; G131-G157 CarbonylContact O-C 3.58Å; G131-G157 WeakPolarHBondContact O-CA 3.49Å; G131-L158 PolarHBondContact O-N 3.14Å
132	A	97.5	Very high	96.5	Very high	21 Å²	21	38 Å²	38	17%	0.174	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.4	157	0	0	0	0	0	107	N123 L158 H170	N123-A132 PolarHBondContact N-O 3.23Å; N123-A132 PolarHBondContact OD1-N 3.32Å; N123-A132 PolarHBondContact OD1-O 3.46Å; A132-L158 CarbonylContact C-O 3.58Å; A132-L158 WeakPolarHBondContact CA-O 3.16Å; A132-H170 PolarHBondContact O-CE1 3.18Å; A132-H170 PolarHBondContact O-NE2 2.8Å
133	L	97.4	Very high	96.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	121.5	-173.1	-59.6	92.2	0	0	0	108.7	L120 M121 P122 L153 C156 L158 V159 E160	L120-L133 HydrophobicContact CD1-CB 4.12Å; L120-L133 HydrophobicContact CD1-CD2 4.37Å; M121-L133 WeakPolarHBondContact O-CA 3.33Å; P122-L133 HydrophobicContact CB-CD2 3.89Å; P122-L133 HydrophobicContact CB-CG 4.04Å; L133-L153 HydrophobicContact CD2-CD1 4.3Å; L133-C156 HydrophobicContact CD1-CB 3.75Å; L133-C156 HydrophobicContact CD2-CB 4.08Å; L133-L158 PolarHBondContact N-O 3.45Å; L133-V159 HydrophobicContact CB-CG1 4.29Å; L133-V159 HydrophobicContact CB-CG2 4.28Å; L133-V159 HydrophobicContact CD1-CG2 4.13Å; L133-V159 VanDerWaalsContact O-CA 3.3Å; L133-V159 WeakPolarHBondContact O-CA 3.48Å; L133-E160 PolarHBondContact O-N 2.9Å
134	L	97.6	Very high	96.5	Very high	24 Å²	24	45.7 Å²	45.7	13%	0.126	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139.4	172.2	-93.6	62.3	0	0	0	109.3	L120 M121 E160 V162 H170	L120-L134 CarbonylContact C-O 3.49Å; M121-L134 PolarHBondContact N-O 3.33Å; M121-L134 PolarHBondContact O-N 2.92Å; M121-L134 VanDerWaalsContact O-N 3.12Å; L134-E160 WeakPolarHBondContact CA-O 3.42Å; L134-E160 HydrophobicContact CD1-CB 4.29Å; L134-E160 HydrophobicContact CG-CB 4.43Å; L134-V162 HydrophobicContact CB-CG2 3.87Å; L134-V162 HydrophobicContact CD2-CB 4.33Å; L134-V162 HydrophobicContact CD2-CG1 3.73Å; L134-V162 HydrophobicContact CD2-CG2 3.81Å; L134-V162 HydrophobicContact CG-CG1 3.87Å; L134-V162 HydrophobicContact CG-CG2 3.89Å; L134-H170 HydrophobicContact CB-CB 4.38Å; L134-H170 VanDerWaalsContact CD1-CE1 3.43Å; L134-H170 WeakPolarHBondContact CD1-CE1 3.13Å; L134-H170 VanDerWaalsContact CD1-ND1 3.31Å; L134-H170 WeakPolarHBondContact CD1-ND1 3.49Å; L134-H170 HydrophobicContact CD2-CB 3.76Å
135	F	98.4	Very high	96.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	155	173.2	71.8	-87.2	0	0	0	113.1	I118 R119 L120 L137 L149 L150 V159 E160 E161 V162	I118-F135 HydrophobicContact CG2-CB 3.85Å; I118-F135 HydrophobicContact CG2-CD2 3.77Å; I118-F135 HydrophobicContact CG2-CG 4.19Å; R119-F135 CarbonylContact O-C 3.38Å; R119-F135 WeakPolarHBondContact O-CA 3.35Å; R119-F135 WeakPolarHBondContact O-CB 3.49Å; L120-F135 HydrophobicContact CB-CB 4.28Å; L120-F135 HydrophobicContact CD1-CB 3.83Å; F135-L137 HydrophobicContact CD2-CD2 4.11Å; F135-L137 HydrophobicContact CE2-CD2 3.9Å; F135-L149 HydrophobicContact CB-CD2 4.11Å; F135-L149 HydrophobicContact CD1-CD2 4.17Å; F135-L149 HydrophobicContact CD2-CD2 3.92Å; F135-L149 HydrophobicContact CE2-CD2 4.39Å; F135-L149 HydrophobicContact CG-CD2 3.79Å; F135-L150 HydrophobicContact CE1-CD2 3.68Å; F135-L150 HydrophobicContact CE1-CG 3.73Å; F135-L150 HydrophobicContact CZ-CD1 4.17Å; F135-L150 HydrophobicContact CZ-CD2 4.15Å; F135-L150 HydrophobicContact CZ-CG 3.73Å; F135-V159 HydrophobicContact CD1-CG1 4.01Å; F135-V159 HydrophobicContact CE1-CG1 3.98Å; F135-E160 WeakPolarHBondContact CD1-O 3.14Å; F135-E160 PolarHBondContact N-O 2.79Å; F135-E161 HydrophobicContact CD2-CB 4.49Å; F135-E161 HydrophobicContact CD2-CG 4.26Å; F135-E161 HydrophobicContact CE1-CB 4.05Å; F135-E161 HydrophobicContact CE2-CB 3.77Å; F135-E161 HydrophobicContact CE2-CG 3.65Å; F135-E161 HydrophobicContact CZ-CB 3.52Å; F135-E161 HydrophobicContact CZ-CG 3.96Å; F135-E161 WeakPolarHBondContact O-CA 3.41Å; F135-V162 PolarHBondContact O-N 3.07Å
136	A	98.5	Very high	96.7	Very high	2 Å²	2	41.9 Å²	41.9	2%	0.017	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	138.2	176.1	0	0	0	0	0	110	L104 I118 R119 V162 E164 I167	L104-A136 HydrophobicContact CD1-CB 4Å; I118-A136 WeakPolarHBondContact CA-O 3.49Å; I118-A136 WeakPolarHBondContact CG2-O 3.49Å; R119-A136 PolarHBondContact N-O 2.89Å; R119-A136 PolarHBondContact O-N 3.36Å; A136-V162 WeakPolarHBondContact CB-O 3.33Å; A136-E164 HydrophobicContact CB-CB 3.87Å; A136-E164 HydrophobicContact CB-CG 4.33Å; A136-I167 HydrophobicContact CB-CD1 3.63Å
137	L	98.5	Very high	96.8	Very high	38 Å²	38	44.5 Å²	44.5	20%	0.199	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	134.7	179.5	-59.3	-175.1	0	0	0	110.7	L104 I118 F135 A141 E161	L104-L137 WeakPolarHBondContact CD1-O 3.44Å; I118-L137 HydrophobicContact CD1-CD2 3.72Å; I118-L137 HydrophobicContact CG1-CD2 3.79Å; F135-L137 HydrophobicContact CD2-CD2 4.11Å; F135-L137 HydrophobicContact CE2-CD2 3.9Å; L137-A141 HydrophobicContact CB-CB 3.98Å; L137-A141 HydrophobicContact CD2-CB 4.18Å; L137-E161 WeakPolarHBondContact CD1-OE1 3.35Å
138	G	97.9	Very high	96.9	Very high	7 Å²	7	43.9 Å²	43.9	7%	0.072	26%	0.257	C	S	.	.			trans	-71.6	173.8	168.6	0	0	0	0	0	112.6	E108 V117 N140 A141	E108-G138 WeakPolarHBondContact OE1-CA 3.32Å; V117-G138 WeakPolarHBondContact O-CA 3.1Å; V117-G138 PolarHBondContact O-N 3.1Å; G138-N140 PolarHBondContact O-N 2.99Å; G138-N140 VanDerWaalsContact O-N 3.17Å; G138-A141 PolarHBondContact O-N 3.3Å
139	T	97.4	Very high	96.9	Very high	113 Å²	113	39.2 Å²	39.2	69%	0.693	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-38.2	-175.3	-54.3	0	0	0	0	113.1	E108	E108-T139 WeakPolarHBondContact OE1-CB 3.44Å; E108-T139 PolarHBondContact OE1-N 3.44Å; E108-T139 PolarHBondContact OE1-OG1 3.35Å; E108-T139 PolarHBondContact OE2-OG1 2.92Å
140	N	96.8	Very high	97	Very high	58 Å²	58	40.3 Å²	40.3	31%	0.31	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-5.3	-177.6	-54.9	-64.9	0	0	0	113.9	N114 S115 G138	N114-N140 WeakPolarHBondContact CA-ND2 3.44Å; S115-N140 PolarHBondContact O-ND2 3.41Å; G138-N140 PolarHBondContact O-N 2.99Å; G138-N140 VanDerWaalsContact O-N 3.17Å
141	A	97.3	Very high	96.9	Very high	15 Å²	15	38 Å²	38	12%	0.124	23%	0.229	C	C	.	.			trans	-80.9	137.5	178.3	0	0	0	0	0	110.4	I116 I118 L137 G138	I116-A141 HydrophobicContact CG2-CB 3.85Å; I118-A141 HydrophobicContact CG1-CB 4.38Å; L137-A141 HydrophobicContact CB-CB 3.98Å; L137-A141 HydrophobicContact CD2-CB 4.18Å; G138-A141 PolarHBondContact O-N 3.3Å
142	K	95.3	Very high	96.8	Very high	124 Å²	124	38 Å²	38	54%	0.539	23%	0.227	S	C	.	.			trans	-106.2	166.9	-177	-65.7	171.2	-178.2	174	0	110.6	E144 D145 G146	K142-E144 HydrophobicContact CB-CG 3.89Å; K142-E144 HydrophobicContact CD-CG 4.35Å; K142-E144 WeakPolarHBondContact CD-OE1 3.23Å; K142-E144 IonicContact NZ-OE1 3.8Å; K142-E144 PolarHBondContact NZ-OE1 2.89Å; K142-E144 PolarHBondContact O-N 3.02Å; K142-E144 VanDerWaalsContact O-N 3.14Å; K142-D145 PolarHBondContact N-OD2 3.03Å; K142-D145 WeakPolarHBondContact O-CB 3.42Å; K142-D145 PolarHBondContact O-N 3.47Å; K142-G146 PolarHBondContact O-N 3.37Å
143	G	95.8	Very high	96.8	Very high	55 Å²	55	37 Å²	37	57%	0.567	22%	0.219	S	C	*	.	H	α-helix	trans	-58.2	-27.1	175.4	0	0	0	0	0	113.8	G146 A147	G143-G146 PolarHBondContact O-N 3.24Å; G143-A147 WeakPolarHBondContact O-CB 3.34Å; G143-A147 PolarHBondContact O-N 3.27Å
144	E	95.9	Very high	96.7	Very high	126 Å²	126	41.9 Å²	41.9	59%	0.589	24%	0.242	S	C	*	.	H	α-helix	trans	-66.8	-35.7	173.5	60.7	-170.4	165.8	0	0	112.8	K142 L148	K142-E144 HydrophobicContact CB-CG 3.89Å; K142-E144 HydrophobicContact CD-CG 4.35Å; K142-E144 WeakPolarHBondContact CD-OE1 3.23Å; K142-E144 IonicContact NZ-OE1 3.8Å; K142-E144 PolarHBondContact NZ-OE1 2.89Å; K142-E144 PolarHBondContact O-N 3.02Å; K142-E144 VanDerWaalsContact O-N 3.14Å; E144-L148 WeakPolarHBondContact O-CB 3.28Å; E144-L148 PolarHBondContact O-N 2.9Å
145	D	96.1	Very high	96.6	Very high	19 Å²	19	42.4 Å²	42.4	10%	0.102	25%	0.247	C	C	.	.	H	α-helix	trans	-69.1	-41.1	175.8	-56	-50.4	0	0	0	110.8	I94 I116 I118 K142 L148 L149	I94-D145 HydrophobicContact CD1-CB 3.9Å; I94-D145 WeakPolarHBondContact CD1-OD1 3.16Å; I116-D145 HydrophobicContact CG2-CB 4.43Å; I118-D145 HydrophobicContact CD1-CB 4.33Å; K142-D145 PolarHBondContact N-OD2 3.03Å; K142-D145 WeakPolarHBondContact O-CB 3.42Å; K142-D145 PolarHBondContact O-N 3.47Å; D145-L148 PolarHBondContact O-N 3.4Å; D145-L149 PolarHBondContact O-N 3.41Å
146	G	96.9	Very high	96.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-44.4	174.1	0	0	0	0	0	112.7	K142 G143 L148 L149 L150	K142-G146 PolarHBondContact O-N 3.37Å; G143-G146 PolarHBondContact O-N 3.24Å; G146-L148 VanDerWaalsContact C-N 3.34Å; G146-L148 PolarHBondContact O-N 2.99Å; G146-L149 PolarHBondContact O-N 3.45Å; G146-L150 WeakPolarHBondContact O-CG 3.35Å; G146-L150 PolarHBondContact O-N 2.97Å
147	A	96.8	Very high	96.3	Very high	56 Å²	56	43.4 Å²	43.4	46%	0.463	26%	0.258	S	S	.	.	H	α-helix	trans	-62.1	-40.5	175.9	0	0	0	0	0	112.1	G143 L150 S151	G143-A147 WeakPolarHBondContact O-CB 3.34Å; G143-A147 PolarHBondContact O-N 3.27Å; A147-L150 PolarHBondContact O-N 3.09Å; A147-S151 PolarHBondContact O-N 3.45Å
148	L	95.8	Very high	96.2	Very high	32 Å²	32	46.4 Å²	46.4	17%	0.168	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-46.2	173	174.4	59.7	0	0	0	111.1	Q7 V68 I94 E144 D145 G146 L150 S151 L152	Q7-L148 HydrophobicContact CG-CD1 4.12Å; V68-L148 HydrophobicContact CG2-CD2 4.11Å; I94-L148 HydrophobicContact CD1-CD2 3.87Å; E144-L148 WeakPolarHBondContact O-CB 3.28Å; E144-L148 PolarHBondContact O-N 2.9Å; D145-L148 PolarHBondContact O-N 3.4Å; G146-L148 VanDerWaalsContact C-N 3.34Å; G146-L148 PolarHBondContact O-N 2.99Å; L148-L150 PolarHBondContact O-N 3.48Å; L148-S151 PolarHBondContact O-N 3.06Å; L148-L152 HydrophobicContact CD1-CD1 4.14Å; L148-L152 HydrophobicContact CD1-CG 4.08Å; L148-L152 HydrophobicContact CG-CD1 4.11Å; L148-L152 HydrophobicContact CG-CG 4.46Å; L148-L152 WeakPolarHBondContact O-CG 3.47Å; L148-L152 PolarHBondContact O-N 3.14Å
149	L	96.5	Very high	96.2	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-63.5	-41.3	-180	-169.8	64.2	0	0	0	112.2	F70 V96 I118 F135 D145 G146 S151 L152 L153	F70-L149 HydrophobicContact CE1-CD1 4.09Å; F70-L149 HydrophobicContact CZ-CD1 3.7Å; V96-L149 HydrophobicContact CG1-CD1 4.48Å; V96-L149 HydrophobicContact CG1-CD2 4.35Å; V96-L149 HydrophobicContact CG2-CD1 4.15Å; I118-L149 HydrophobicContact CB-CD2 4.39Å; I118-L149 HydrophobicContact CD1-CB 4.38Å; I118-L149 HydrophobicContact CD1-CD2 3.92Å; I118-L149 HydrophobicContact CG2-CD2 3.61Å; F135-L149 HydrophobicContact CB-CD2 4.11Å; F135-L149 HydrophobicContact CD1-CD2 4.17Å; F135-L149 HydrophobicContact CD2-CD2 3.92Å; F135-L149 HydrophobicContact CE2-CD2 4.39Å; F135-L149 HydrophobicContact CG-CD2 3.79Å; D145-L149 PolarHBondContact O-N 3.41Å; G146-L149 PolarHBondContact O-N 3.45Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-S151 PolarHBondContact O-N 3.48Å; L149-L152 PolarHBondContact O-N 2.94Å; L149-L153 HydrophobicContact CD1-CD1 3.68Å; L149-L153 HydrophobicContact CD1-CG 4.03Å; L149-L153 HydrophobicContact CD2-CD1 4.29Å; L149-L153 HydrophobicContact CG-CD1 3.69Å; L149-L153 HydrophobicContact CG-CG 4.28Å; L149-L153 WeakPolarHBondContact O-CB 3.17Å; L149-L153 VanDerWaalsContact O-CG 3.28Å; L149-L153 WeakPolarHBondContact O-CG 3.39Å; L149-L153 PolarHBondContact O-N 3.3Å
150	L	96.3	Very high	96.2	Very high	60 Å²	60	46.1 Å²	46.1	31%	0.314	26%	0.263	S	S	.	.	H	α-helix	trans	-56.3	-48.1	171.9	-77.4	165	0	0	0	111.1	F135 G146 A147 L148 L152 L153 H154 V159	F135-L150 HydrophobicContact CE1-CD2 3.68Å; F135-L150 HydrophobicContact CE1-CG 3.73Å; F135-L150 HydrophobicContact CZ-CD1 4.17Å; F135-L150 HydrophobicContact CZ-CD2 4.15Å; F135-L150 HydrophobicContact CZ-CG 3.73Å; G146-L150 WeakPolarHBondContact O-CG 3.35Å; G146-L150 PolarHBondContact O-N 2.97Å; A147-L150 PolarHBondContact O-N 3.09Å; L148-L150 PolarHBondContact O-N 3.48Å; L150-L152 VanDerWaalsContact C-N 3.34Å; L150-L152 PolarHBondContact O-N 3.06Å; L150-L153 PolarHBondContact O-N 3.1Å; L150-H154 PolarHBondContact O-N 3.27Å; L150-V159 HydrophobicContact CD2-CB 4.06Å; L150-V159 HydrophobicContact CD2-CG1 3.83Å; L150-V159 WeakPolarHBondContact CD2-O 3.33Å
151	S	95	Very high	96.3	Very high	40 Å²	40	47.7 Å²	47.7	28%	0.28	27%	0.269	S	S	.	.	H	α-helix	trans	-64.2	-37.7	179.7	-155.4	0	0	0	0	112.6	D4 A147 L148 L149 H154	D4-S151 WeakPolarHBondContact OD2-CB 3.5Å; D4-S151 PolarHBondContact OD2-OG 2.9Å; A147-S151 PolarHBondContact O-N 3.45Å; L148-S151 PolarHBondContact O-N 3.06Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-S151 PolarHBondContact O-N 3.48Å; S151-H154 PolarHBondContact O-CE1 3.43Å; S151-H154 PolarHBondContact O-ND1 2.95Å
152	L	95.7	Very high	96.3	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-68.3	-34.9	176.2	-70.7	175.9	0	0	0	112.7	D4 I9 M25 V30 V68 L148 L149 L150	D4-L152 HydrophobicContact CB-CD2 4.49Å; I9-L152 HydrophobicContact CD1-CD2 3.86Å; M25-L152 HydrophobicContact CE-CB 3.96Å; M25-L152 WeakPolarHBondContact CG-O 3.12Å; V30-L152 HydrophobicContact CG2-CD2 3.94Å; V68-L152 HydrophobicContact CG2-CD1 4.07Å; L148-L152 HydrophobicContact CD1-CD1 4.14Å; L148-L152 HydrophobicContact CD1-CG 4.08Å; L148-L152 HydrophobicContact CG-CD1 4.11Å; L148-L152 HydrophobicContact CG-CG 4.46Å; L148-L152 WeakPolarHBondContact O-CG 3.47Å; L148-L152 PolarHBondContact O-N 3.14Å; L149-L152 PolarHBondContact O-N 2.94Å; L150-L152 VanDerWaalsContact C-N 3.34Å; L150-L152 PolarHBondContact O-N 3.06Å
153	L	96.5	Very high	96.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-100.4	-7.5	-170	-62.3	-179.1	0	0	0	114.7	I21 M25 F70 L120 L133 L149 L150 C155 C156 V159	I21-L153 HydrophobicContact CG2-CD2 3.53Å; M25-L153 HydrophobicContact CE-CD2 3.61Å; F70-L153 HydrophobicContact CE1-CD2 4.33Å; F70-L153 HydrophobicContact CZ-CD2 4.24Å; L120-L153 HydrophobicContact CD1-CD1 3.9Å; L120-L153 HydrophobicContact CD2-CD1 3.69Å; L133-L153 HydrophobicContact CD2-CD1 4.3Å; L149-L153 HydrophobicContact CD1-CD1 3.68Å; L149-L153 HydrophobicContact CD1-CG 4.03Å; L149-L153 HydrophobicContact CD2-CD1 4.29Å; L149-L153 HydrophobicContact CG-CD1 3.69Å; L149-L153 HydrophobicContact CG-CG 4.28Å; L149-L153 WeakPolarHBondContact O-CB 3.17Å; L149-L153 VanDerWaalsContact O-CG 3.28Å; L149-L153 WeakPolarHBondContact O-CG 3.39Å; L149-L153 PolarHBondContact O-N 3.3Å; L150-L153 PolarHBondContact O-N 3.1Å; L153-C155 PolarHBondContact O-N 3.44Å; L153-C156 WeakPolarHBondContact O-CA 3.45Å; L153-C156 WeakPolarHBondContact O-CB 3.41Å; L153-C156 PolarHBondContact O-N 2.79Å; L153-C156 PolarHBondContact O-SG 3.35Å; L153-V159 HydrophobicContact CB-CG1 4.09Å; L153-V159 HydrophobicContact CB-CG2 3.75Å; L153-V159 HydrophobicContact CD1-CG1 4.3Å; L153-V159 WeakPolarHBondContact O-CG2 3.39Å
154	H	94.9	Very high	96.4	Very high	103 Å²	103	45.5 Å²	45.5	48%	0.477	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-54.9	-29.6	-173.2	75.4	-76.4	0	0	0	114.6	L150 S151 C156	L150-H154 PolarHBondContact O-N 3.27Å; S151-H154 PolarHBondContact O-CE1 3.43Å; S151-H154 PolarHBondContact O-ND1 2.95Å; H154-C156 VanDerWaalsContact C-N 3.29Å; H154-C156 PolarHBondContact O-N 2.93Å
155	C	95.7	Very high	96.3	Very high	34 Å²	34	42.8 Å²	42.8	23%	0.23	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-80.4	-3.9	175.6	-73.6	0	0	0	0	114.4	G24 G28 Q129 L153	G24-C155 WeakPolarHBondContact O-CB 3.36Å; G28-C155 WeakPolarHBondContact CA-SG 3.25Å; Q129-C155 WeakPolarHBondContact CB-O 3.35Å; Q129-C155 PolarHBondContact OE1-O 2.87Å; L153-C155 PolarHBondContact O-N 3.44Å
156	C	95.2	Very high	96.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-80.4	-16.9	177.4	-59.6	0	0	0	0	113.3	Q129 G131 L133 L153 H154	Q129-C156 CarbonylContact C-O 3.59Å; Q129-C156 VanDerWaalsContact OE1-CA 3.31Å; G131-C156 WeakPolarHBondContact CA-O 3.28Å; G131-C156 PolarHBondContact N-O 3.28Å; L133-C156 HydrophobicContact CD1-CB 3.75Å; L133-C156 HydrophobicContact CD2-CB 4.08Å; L153-C156 WeakPolarHBondContact O-CA 3.45Å; L153-C156 WeakPolarHBondContact O-CB 3.41Å; L153-C156 PolarHBondContact O-N 2.79Å; L153-C156 PolarHBondContact O-SG 3.35Å; H154-C156 VanDerWaalsContact C-N 3.29Å; H154-C156 PolarHBondContact O-N 2.93Å
157	G	95.6	Very high	96.3	Very high	24 Å²	24	48.9 Å²	48.9	25%	0.247	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	133.2	-144.4	-174.7	0	0	0	0	0	111.3	G131	G131-G157 CarbonylContact O-C 3.58Å; G131-G157 WeakPolarHBondContact O-CA 3.49Å
158	L	96.8	Very high	96.1	Very high	101 Å²	101	47.3 Å²	47.3	53%	0.529	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	124.7	173.7	177.3	66.2	0	0	0	110	G131 A132 L133 E160	G131-L158 PolarHBondContact O-N 3.14Å; A132-L158 CarbonylContact C-O 3.58Å; A132-L158 WeakPolarHBondContact CA-O 3.16Å; L133-L158 PolarHBondContact N-O 3.45Å; L158-E160 HydrophobicContact CD1-CG 4.05Å; L158-E160 HydrophobicContact CG-CG 4.25Å
159	V	97.6	Very high	96.1	Very high	15 Å²	15	48.4 Å²	48.4	9%	0.091	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	125.1	177.3	-167.1	0	0	0	0	109.4	L133 F135 L150 L153	L133-V159 HydrophobicContact CB-CG1 4.29Å; L133-V159 HydrophobicContact CB-CG2 4.28Å; L133-V159 HydrophobicContact CD1-CG2 4.13Å; L133-V159 VanDerWaalsContact O-CA 3.3Å; L133-V159 WeakPolarHBondContact O-CA 3.48Å; F135-V159 HydrophobicContact CD1-CG1 4.01Å; F135-V159 HydrophobicContact CE1-CG1 3.98Å; L150-V159 HydrophobicContact CD2-CB 4.06Å; L150-V159 HydrophobicContact CD2-CG1 3.83Å; L150-V159 WeakPolarHBondContact CD2-O 3.33Å; L153-V159 HydrophobicContact CB-CG1 4.09Å; L153-V159 HydrophobicContact CB-CG2 3.75Å; L153-V159 HydrophobicContact CD1-CG1 4.3Å; L153-V159 WeakPolarHBondContact O-CG2 3.39Å
160	E	97.8	Very high	96.1	Very high	99 Å²	99	48.7 Å²	48.7	46%	0.463	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	137.9	-177.7	-68.8	-67.8	164.7	0	0	111.9	L133 L134 F135 L158 V162	L133-E160 PolarHBondContact O-N 2.9Å; L134-E160 WeakPolarHBondContact CA-O 3.42Å; L134-E160 HydrophobicContact CD1-CB 4.29Å; L134-E160 HydrophobicContact CG-CB 4.43Å; F135-E160 WeakPolarHBondContact CD1-O 3.14Å; F135-E160 PolarHBondContact N-O 2.79Å; L158-E160 HydrophobicContact CD1-CG 4.05Å; L158-E160 HydrophobicContact CG-CG 4.25Å; E160-V162 HydrophobicContact CB-CG1 4.38Å
161	E	98.1	Very high	96	Very high	91 Å²	91	46.7 Å²	46.7	43%	0.425	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	130.4	167.7	-171.7	179.9	140.1	0	0	109.5	F135 L137	F135-E161 HydrophobicContact CD2-CB 4.49Å; F135-E161 HydrophobicContact CD2-CG 4.26Å; F135-E161 HydrophobicContact CE1-CB 4.05Å; F135-E161 HydrophobicContact CE2-CB 3.77Å; F135-E161 HydrophobicContact CE2-CG 3.65Å; F135-E161 HydrophobicContact CZ-CB 3.52Å; F135-E161 HydrophobicContact CZ-CG 3.96Å; F135-E161 WeakPolarHBondContact O-CA 3.41Å; L137-E161 WeakPolarHBondContact CD1-OE1 3.35Å
162	V	97.8	Very high	96	Very high	19 Å²	19	44.8 Å²	44.8	12%	0.115	24%	0.241	C	C	.	.			trans	-142.3	161.3	-175.9	-64.7	0	0	0	0	112.3	L134 F135 A136 E160 W166 I167	L134-V162 HydrophobicContact CB-CG2 3.87Å; L134-V162 HydrophobicContact CD2-CB 4.33Å; L134-V162 HydrophobicContact CD2-CG1 3.73Å; L134-V162 HydrophobicContact CD2-CG2 3.81Å; L134-V162 HydrophobicContact CG-CG1 3.87Å; L134-V162 HydrophobicContact CG-CG2 3.89Å; F135-V162 PolarHBondContact O-N 3.07Å; A136-V162 WeakPolarHBondContact CB-O 3.33Å; E160-V162 HydrophobicContact CB-CG1 4.38Å; V162-W166 HydrophobicContact CB-CB 4.29Å; V162-W166 HydrophobicContact CB-CD2 4.48Å; V162-W166 HydrophobicContact CB-CE3 3.77Å; V162-W166 HydrophobicContact CB-CZ3 4.49Å; V162-W166 HydrophobicContact CG1-CE3 3.7Å; V162-W166 HydrophobicContact CG1-CZ3 4.22Å; V162-W166 HydrophobicContact CG2-CB 4.26Å; V162-I167 HydrophobicContact CG2-CG1 4.23Å
163	P	97.3	Very high	96.1	Very high	75 Å²	75	49.4 Å²	49.4	49%	0.487	27%	0.266	S	S	.	.			trans	-56.3	140.4	162.6	-23.1	34.2	0	0	0	111.3	A165 W166	P163-A165 PolarHBondContact O-N 2.9Å; P163-W166 HydrophobicContact CG-CD2 4.37Å; P163-W166 HydrophobicContact CG-CZ2 4.44Å; P163-W166 WeakPolarHBondContact O-CB 3.32Å; P163-W166 PolarHBondContact O-N 3.17Å
164	E	96.4	Very high	96	Very high	54 Å²	54	50.2 Å²	50.2	25%	0.252	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-34	-178	-169.3	-174.8	-171.6	0	0	112.8	T103 L104 R119 A136 W166 I167	T103-E164 VanDerWaalsContact CA-OE1 3.23Å; T103-E164 WeakPolarHBondContact CA-OE1 3.24Å; L104-E164 HydrophobicContact CD1-CB 4.1Å; L104-E164 HydrophobicContact CD1-CG 4.07Å; L104-E164 HydrophobicContact CG-CG 4.39Å; L104-E164 PolarHBondContact N-OE1 3.5Å; R119-E164 VanDerWaalsContact CD-OE1 3.28Å; R119-E164 WeakPolarHBondContact CD-OE1 3.36Å; R119-E164 IonicContact CZ-OE1 2.83Å; R119-E164 IonicContact NE-OE1 3.47Å; R119-E164 IonicContact NH1-OE1 3.91Å; R119-E164 PolarHBondContact NH1-OE1 3.19Å; A136-E164 HydrophobicContact CB-CB 3.87Å; A136-E164 HydrophobicContact CB-CG 4.33Å; E164-W166 PolarHBondContact O-N 2.91Å; E164-I167 HydrophobicContact CG-CD1 4.36Å; E164-I167 WeakPolarHBondContact O-CB 3.46Å; E164-I167 PolarHBondContact O-N 3.24Å
165	A	93.4	Very high	95.9	Very high	69 Å²	69	46.6 Å²	46.6	57%	0.57	26%	0.262	S	S	*	.	H	α-helix	trans	-57	-21.9	178	0	0	0	0	0	113.9	P163	P163-A165 PolarHBondContact O-N 2.9Å
166	W	96.6	Very high	95.9	Very high	147 Å²	147	46.9 Å²	46.9	56%	0.557	26%	0.264	S	S	*	.	H	α-helix	trans	-86.8	-13.1	177.5	-63.5	-2	0	0	0	113.1	V162 P163 E164 D168 V169 H170	V162-W166 HydrophobicContact CB-CB 4.29Å; V162-W166 HydrophobicContact CB-CD2 4.48Å; V162-W166 HydrophobicContact CB-CE3 3.77Å; V162-W166 HydrophobicContact CB-CZ3 4.49Å; V162-W166 HydrophobicContact CG1-CE3 3.7Å; V162-W166 HydrophobicContact CG1-CZ3 4.22Å; V162-W166 HydrophobicContact CG2-CB 4.26Å; P163-W166 HydrophobicContact CG-CD2 4.37Å; P163-W166 HydrophobicContact CG-CZ2 4.44Å; P163-W166 WeakPolarHBondContact O-CB 3.32Å; P163-W166 PolarHBondContact O-N 3.17Å; E164-W166 PolarHBondContact O-N 2.91Å; W166-D168 PolarHBondContact O-N 3.17Å; W166-V169 WeakPolarHBondContact O-CB 3.3Å; W166-V169 PolarHBondContact O-N 2.68Å; W166-H170 WeakPolarHBondContact O-CB 3.43Å; W166-H170 PolarHBondContact O-N 2.84Å
167	I	96.3	Very high	96	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.2	-37.5	178.7	-67.4	-177.9	0	0	0	111.5	R119 M121 A136 V162 E164 V169 H170 T171	R119-I167 HydrophobicContact CB-CD1 4.07Å; R119-I167 HydrophobicContact CG-CD1 3.79Å; R119-I167 WeakPolarHBondContact O-CD1 3.43Å; M121-I167 HydrophobicContact CB-CG2 3.62Å; M121-I167 HydrophobicContact CG-CG2 4.19Å; A136-I167 HydrophobicContact CB-CD1 3.63Å; V162-I167 HydrophobicContact CG2-CG1 4.23Å; E164-I167 HydrophobicContact CG-CD1 4.36Å; E164-I167 WeakPolarHBondContact O-CB 3.46Å; E164-I167 PolarHBondContact O-N 3.24Å; I167-V169 VanDerWaalsContact C-N 3.35Å; I167-H170 WeakPolarHBondContact O-CB 3.48Å; I167-H170 PolarHBondContact O-N 2.99Å; I167-T171 WeakPolarHBondContact O-CB 3.23Å; I167-T171 PolarHBondContact O-N 2.88Å; I167-T171 PolarHBondContact O-OG1 2.79Å
168	D	93.1	Very high	96.1	Very high	22 Å²	22	47.1 Å²	47.1	12%	0.118	26%	0.263	C	S	.	.	H	α-helix	trans	-71.9	-32.7	176	-64.4	-18.1	0	0	0	111.6	R119 W166 T171 G172 T262 A265 R266	R119-D168 IonicContact CZ-OD1 3.81Å; R119-D168 IonicContact NH1-OD1 2.61Å; R119-D168 IonicContact NH2-OD1 2.79Å; R119-D168 PolarHBondContact NH2-OD1 2.61Å; W166-D168 PolarHBondContact O-N 3.17Å; D168-T171 WeakPolarHBondContact O-CB 3.31Å; D168-T171 PolarHBondContact O-N 2.83Å; D168-G172 PolarHBondContact O-N 2.85Å; D168-T262 PolarHBondContact O-OG1 2.84Å; D168-A265 HydrophobicContact CB-CB 4.13Å; D168-R266 HydrophobicContact CB-CG 3.87Å; D168-R266 WeakPolarHBondContact OD2-CG 3.4Å
169	V	96.2	Very high	96.1	Very high	55 Å²	55	45.1 Å²	45.1	33%	0.333	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-48	171.9	-177.5	0	0	0	0	109.8	W166 I167 T171 G172 L173 T262	W166-V169 WeakPolarHBondContact O-CB 3.3Å; W166-V169 PolarHBondContact O-N 2.68Å; I167-V169 VanDerWaalsContact C-N 3.35Å; V169-T171 VanDerWaalsContact C-N 3.29Å; V169-T171 PolarHBondContact O-N 2.83Å; V169-G172 PolarHBondContact O-N 2.89Å; V169-G172 VanDerWaalsContact O-N 3.16Å; V169-L173 WeakPolarHBondContact O-CB 3.22Å; V169-L173 PolarHBondContact O-N 3.13Å; V169-T262 HydrophobicContact CB-CG2 4.46Å; V169-T262 HydrophobicContact CG2-CG2 4.04Å
170	H	96.4	Very high	96.2	Very high	11 Å²	11	47.7 Å²	47.7	5%	0.051	27%	0.271	C	S	.	.	H	α-helix	trans	-57.4	-41.7	174.9	-179.2	78.7	0	0	0	112.2	M121 A132 L134 W166 I167 G172 L173 S174 G175	M121-H170 PolarHBondContact O-CD2 2.88Å; M121-H170 PolarHBondContact O-NE2 3.44Å; M121-H170 VanDerWaalsContact O-NE2 3.09Å; A132-H170 PolarHBondContact O-CE1 3.18Å; A132-H170 PolarHBondContact O-NE2 2.8Å; L134-H170 HydrophobicContact CB-CB 4.38Å; L134-H170 VanDerWaalsContact CD1-CE1 3.43Å; L134-H170 WeakPolarHBondContact CD1-CE1 3.13Å; L134-H170 VanDerWaalsContact CD1-ND1 3.31Å; L134-H170 WeakPolarHBondContact CD1-ND1 3.49Å; L134-H170 HydrophobicContact CD2-CB 3.76Å; W166-H170 WeakPolarHBondContact O-CB 3.43Å; W166-H170 PolarHBondContact O-N 2.84Å; I167-H170 WeakPolarHBondContact O-CB 3.48Å; I167-H170 PolarHBondContact O-N 2.99Å; H170-G172 VanDerWaalsContact C-N 3.33Å; H170-G172 PolarHBondContact O-N 3.35Å; H170-L173 CarbonylContact O-C 3.54Å; H170-L173 PolarHBondContact O-N 2.78Å; H170-L173 VanDerWaalsContact O-N 3.16Å; H170-S174 PolarHBondContact CD2-OG 3.16Å; H170-S174 VanDerWaalsContact CD2-OG 3.24Å; H170-S174 VanDerWaalsContact CE1-CB 3.44Å; H170-S174 WeakPolarHBondContact CE1-CB 3.39Å; H170-S174 PolarHBondContact CE1-OG 3.29Å; H170-S174 PolarHBondContact ND1-OG 2.98Å; H170-S174 PolarHBondContact NE2-OG 3.09Å; H170-S174 PolarHBondContact O-N 3.12Å; H170-S174 PolarHBondContact O-OG 3.4Å; H170-S174 VanDerWaalsContact O-OG 3.08Å; H170-G175 PolarHBondContact O-N 3.37Å
171	T	93.9	Very high	96.2	Very high	17 Å²	17	46.2 Å²	46.2	10%	0.104	27%	0.269	C	S	.	.	I	π-helix	trans	-57.2	-46.6	176.1	-60.8	0	0	0	0	111.5	M121 I167 D168 V169 L173 G175 S176 A265	M121-T171 HydrophobicContact CE-CG2 3.83Å; I167-T171 WeakPolarHBondContact O-CB 3.23Å; I167-T171 PolarHBondContact O-N 2.88Å; I167-T171 PolarHBondContact O-OG1 2.79Å; D168-T171 WeakPolarHBondContact O-CB 3.31Å; D168-T171 PolarHBondContact O-N 2.83Å; V169-T171 VanDerWaalsContact C-N 3.29Å; V169-T171 PolarHBondContact O-N 2.83Å; T171-L173 VanDerWaalsContact C-N 3.35Å; T171-G175 CarbonylContact O-C 3.56Å; T171-G175 WeakPolarHBondContact O-CA 3.34Å; T171-G175 PolarHBondContact O-N 2.91Å; T171-S176 PolarHBondContact O-N 2.91Å; T171-S176 PolarHBondContact O-OG 3.03Å; T171-A265 HydrophobicContact CG2-CB 3.78Å
172	G	95.7	Very high	96.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.274	C	S	.	.	I	π-helix	trans	-71.7	-26.8	177.5	0	0	0	0	0	114.3	D168 V169 H170	D168-G172 PolarHBondContact O-N 2.85Å; V169-G172 PolarHBondContact O-N 2.89Å; V169-G172 VanDerWaalsContact O-N 3.16Å; H170-G172 VanDerWaalsContact C-N 3.33Å; H170-G172 PolarHBondContact O-N 3.35Å
173	L	97.3	Very high	96.3	Very high	102 Å²	102	52.9 Å²	52.9	53%	0.534	30%	0.297	S	S	.	.	I	π-helix	trans	-88	-68	179.8	179.2	62.7	0	0	0	112.8	V169 H170 T171 G177 V258	V169-L173 WeakPolarHBondContact O-CB 3.22Å; V169-L173 PolarHBondContact O-N 3.13Å; H170-L173 CarbonylContact O-C 3.54Å; H170-L173 PolarHBondContact O-N 2.78Å; H170-L173 VanDerWaalsContact O-N 3.16Å; T171-L173 VanDerWaalsContact C-N 3.35Å; L173-G177 WeakPolarHBondContact O-CA 3.44Å; L173-G177 PolarHBondContact O-N 3Å; L173-V258 HydrophobicContact CB-CG1 4.24Å; L173-V258 HydrophobicContact CD1-CG1 4.49Å; L173-V258 HydrophobicContact CD1-CG2 4.08Å
174	S	95.1	Very high	96.3	Very high	17 Å²	17	54 Å²	54	12%	0.119	29%	0.294	C	S	.	.	I	π-helix	trans	-85.7	-34.1	-172.8	78.9	0	0	0	0	112.5	N123 H170 V178	N123-S174 WeakPolarHBondContact CB-O 3.38Å; N123-S174 PolarHBondContact ND2-O 2.73Å; N123-S174 VanDerWaalsContact ND2-O 3.16Å; H170-S174 PolarHBondContact CD2-OG 3.16Å; H170-S174 VanDerWaalsContact CD2-OG 3.24Å; H170-S174 VanDerWaalsContact CE1-CB 3.44Å; H170-S174 WeakPolarHBondContact CE1-CB 3.39Å; H170-S174 PolarHBondContact CE1-OG 3.29Å; H170-S174 PolarHBondContact ND1-OG 2.98Å; H170-S174 PolarHBondContact NE2-OG 3.09Å; H170-S174 PolarHBondContact O-N 3.12Å; H170-S174 PolarHBondContact O-OG 3.4Å; H170-S174 VanDerWaalsContact O-OG 3.08Å; S174-V178 WeakPolarHBondContact O-CG2 3.49Å
175	G	92.3	Very high	96.4	Very high	26 Å²	26	52.3 Å²	52.3	27%	0.268	29%	0.289	S	S	.	.	I	π-helix	trans	-73.3	-59.9	-176.2	0	0	0	0	0	109.8	H170 T171	H170-G175 PolarHBondContact O-N 3.37Å; T171-G175 CarbonylContact O-C 3.56Å; T171-G175 WeakPolarHBondContact O-CA 3.34Å; T171-G175 PolarHBondContact O-N 2.91Å
176	S	95.8	Very high	96.7	Very high	41 Å²	41	53.7 Å²	53.7	29%	0.287	28%	0.284	S	S	.	.	H	α-helix	trans	-71.5	-28.8	174.2	-57.1	0	0	0	0	113.1	T171 V178 A179 F180	T171-S176 PolarHBondContact O-N 2.91Å; T171-S176 PolarHBondContact O-OG 3.03Å; S176-V178 PolarHBondContact O-N 3.26Å; S176-V178 VanDerWaalsContact O-N 3.12Å; S176-A179 WeakPolarHBondContact O-CB 3.44Å; S176-A179 PolarHBondContact O-N 3.42Å; S176-F180 PolarHBondContact O-N 2.97Å
177	G	97.4	Very high	96.8	Very high	12 Å²	12	49.3 Å²	49.3	12%	0.124	28%	0.279	C	S	.	.	H	α-helix	trans	-57.8	-27.8	-178	0	0	0	0	0	115.2	L173 A179 F180 V181	L173-G177 WeakPolarHBondContact O-CA 3.44Å; L173-G177 PolarHBondContact O-N 3Å; G177-A179 VanDerWaalsContact C-N 3.26Å; G177-A179 PolarHBondContact O-N 3.49Å; G177-F180 WeakPolarHBondContact O-CB 3.47Å; G177-F180 PolarHBondContact O-N 3.49Å; G177-F180 VanDerWaalsContact O-N 3.1Å; G177-V181 WeakPolarHBondContact O-CG2 3.46Å; G177-V181 PolarHBondContact O-N 3.37Å
178	V	96.8	Very high	96.9	Very high	17 Å²	17	52.7 Å²	52.7	10%	0.103	30%	0.297	C	S	.	.	H	α-helix	trans	-56.8	-43.9	174.5	-177.6	0	0	0	0	110.7	L124 P125 S174 S176 V181 Y182	L124-V178 HydrophobicContact CB-CG1 4.49Å; L124-V178 HydrophobicContact CB-CG2 4.49Å; L124-V178 HydrophobicContact CD2-CG1 4.42Å; P125-V178 HydrophobicContact CG-CG2 3.94Å; S174-V178 WeakPolarHBondContact O-CG2 3.49Å; S176-V178 PolarHBondContact O-N 3.26Å; S176-V178 VanDerWaalsContact O-N 3.12Å; V178-V181 PolarHBondContact O-N 2.98Å; V178-Y182 HydrophobicContact CG1-CD2 4.27Å; V178-Y182 HydrophobicContact CG1-CE1 4.05Å; V178-Y182 HydrophobicContact CG1-CE2 3.57Å; V178-Y182 VanDerWaalsContact CG1-CZ 3.43Å; V178-Y182 WeakPolarHBondContact CG1-OH 3.42Å; V178-Y182 VanDerWaalsContact O-CG 3.3Å; V178-Y182 PolarHBondContact O-N 2.85Å
179	A	98	Very high	97.1	Very high	58 Å²	58	51.6 Å²	51.6	48%	0.479	29%	0.291	S	S	.	.	H	α-helix	trans	-69.2	-35.1	177.6	0	0	0	0	0	112	S176 G177 V181 Y182 L183	S176-A179 WeakPolarHBondContact O-CB 3.44Å; S176-A179 PolarHBondContact O-N 3.42Å; G177-A179 VanDerWaalsContact C-N 3.26Å; G177-A179 PolarHBondContact O-N 3.49Å; A179-V181 VanDerWaalsContact C-N 3.31Å; A179-V181 PolarHBondContact O-N 3.27Å; A179-Y182 PolarHBondContact O-N 3.49Å; A179-L183 PolarHBondContact O-N 3.21Å
180	F	98.3	Very high	97.3	Very high	70 Å²	70	54.6 Å²	54.6	31%	0.307	30%	0.301	S	S	.	.	H	α-helix	trans	-63.9	-40.1	176	-50.5	-20.3	0	0	0	110.9	S176 G177 L183 F184 A257 V258 A261	S176-F180 PolarHBondContact O-N 2.97Å; G177-F180 WeakPolarHBondContact O-CB 3.47Å; G177-F180 PolarHBondContact O-N 3.49Å; G177-F180 VanDerWaalsContact O-N 3.1Å; F180-L183 PolarHBondContact O-N 3.12Å; F180-F184 PolarHBondContact O-N 3.28Å; F180-A257 HydrophobicContact CE2-CB 4.12Å; F180-A257 HydrophobicContact CZ-CB 4.1Å; F180-V258 HydrophobicContact CE2-CG2 4.34Å; F180-A261 HydrophobicContact CZ-CB 4.29Å
181	V	98.3	Very high	97.4	Very high	68 Å²	68	55.9 Å²	55.9	41%	0.412	32%	0.317	S	S	.	.	H	α-helix	trans	-67.2	-38.9	175.3	173.6	0	0	0	0	111.4	G177 V178 A179 F184 A185 V210	G177-V181 WeakPolarHBondContact O-CG2 3.46Å; G177-V181 PolarHBondContact O-N 3.37Å; V178-V181 PolarHBondContact O-N 2.98Å; A179-V181 VanDerWaalsContact C-N 3.31Å; A179-V181 PolarHBondContact O-N 3.27Å; V181-F184 PolarHBondContact O-N 3.47Å; V181-A185 WeakPolarHBondContact O-CB 3.3Å; V181-A185 PolarHBondContact O-N 3.08Å; V181-V210 HydrophobicContact CG1-CG1 3.47Å; V181-V210 VanDerWaalsContact CG1-CG1 3.47Å
182	Y	98.3	Very high	97.6	Very high	137 Å²	137	56.3 Å²	56.3	54%	0.537	32%	0.323	S	S	.	.	H	α-helix	trans	-62.2	-45.1	174.1	-65.5	-21.5	0	0	0	112.3	V178 A179 F184 A185 E186	V178-Y182 HydrophobicContact CG1-CD2 4.27Å; V178-Y182 HydrophobicContact CG1-CE1 4.05Å; V178-Y182 HydrophobicContact CG1-CE2 3.57Å; V178-Y182 VanDerWaalsContact CG1-CZ 3.43Å; V178-Y182 WeakPolarHBondContact CG1-OH 3.42Å; V178-Y182 VanDerWaalsContact O-CG 3.3Å; V178-Y182 PolarHBondContact O-N 2.85Å; A179-Y182 PolarHBondContact O-N 3.49Å; Y182-F184 VanDerWaalsContact C-N 3.3Å; Y182-F184 PolarHBondContact O-N 2.96Å; Y182-A185 PolarHBondContact O-N 3.4Å; Y182-E186 WeakPolarHBondContact O-CB 3.33Å; Y182-E186 PolarHBondContact O-N 3.14Å
183	L	98.6	Very high	97.8	Very high	113 Å²	113	59.2 Å²	59.2	59%	0.592	34%	0.34	S	S	*	.	H	α-helix	trans	-59.3	-42.4	174.8	178.1	64.8	0	0	0	111.5	A179 F180 E186 A187	A179-L183 PolarHBondContact O-N 3.21Å; F180-L183 PolarHBondContact O-N 3.12Å; L183-E186 PolarHBondContact O-N 3.03Å; L183-A187 WeakPolarHBondContact O-CB 3.35Å; L183-A187 PolarHBondContact O-N 2.54Å
184	F	98.4	Very high	97.8	Very high	99 Å²	99	63.2 Å²	63.2	43%	0.434	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-42.9	177.1	-175.7	-104.7	0	0	0	112.2	F180 V181 Y182 A187 L188 V210	F180-F184 PolarHBondContact O-N 3.28Å; V181-F184 PolarHBondContact O-N 3.47Å; Y182-F184 VanDerWaalsContact C-N 3.3Å; Y182-F184 PolarHBondContact O-N 2.96Å; F184-A187 PolarHBondContact O-N 2.98Å; F184-L188 HydrophobicContact CD1-CD1 3.93Å; F184-L188 HydrophobicContact CD1-CG 4.38Å; F184-L188 HydrophobicContact CE1-CD1 3.52Å; F184-L188 HydrophobicContact CE1-CG 4.05Å; F184-L188 HydrophobicContact CZ-CD1 4.1Å; F184-L188 HydrophobicContact CZ-CD2 4.28Å; F184-L188 HydrophobicContact CZ-CG 4.22Å; F184-L188 WeakPolarHBondContact O-CG 3.39Å; F184-L188 PolarHBondContact O-N 3.44Å; F184-V210 HydrophobicContact CD1-CG2 4.43Å
185	A	98.6	Very high	98	Very high	18 Å²	18	70 Å²	70	15%	0.149	39%	0.385	C	S	.	.	H	α-helix	trans	-63.9	-40.2	176.7	0	0	0	0	0	112.2	V181 Y182 L188 A189 A206 V210	V181-A185 WeakPolarHBondContact O-CB 3.3Å; V181-A185 PolarHBondContact O-N 3.08Å; Y182-A185 PolarHBondContact O-N 3.4Å; A185-L188 PolarHBondContact O-N 3.46Å; A185-A189 PolarHBondContact O-N 3.49Å; A185-A189 VanDerWaalsContact O-N 3.09Å; A185-A206 WeakPolarHBondContact O-CB 3.26Å; A185-V210 HydrophobicContact CB-CG2 4.09Å
186	E	98.6	Very high	98.3	Very high	97 Å²	97	72 Å²	72	45%	0.453	41%	0.406	S	S	.	.	H	α-helix	trans	-61.6	-49.8	174.3	-177.7	173	-140.2	0	0	111	Y182 L183 L188 A189 E190	Y182-E186 WeakPolarHBondContact O-CB 3.33Å; Y182-E186 PolarHBondContact O-N 3.14Å; L183-E186 PolarHBondContact O-N 3.03Å; E186-L188 VanDerWaalsContact C-N 3.31Å; E186-L188 PolarHBondContact O-N 3.44Å; E186-A189 WeakPolarHBondContact O-CB 3.38Å; E186-A189 PolarHBondContact O-N 2.71Å; E186-E190 WeakPolarHBondContact O-CG 3.29Å; E186-E190 PolarHBondContact O-N 3.18Å
187	A	98.6	Very high	98.4	Very high	55 Å²	55	73.1 Å²	73.1	46%	0.455	41%	0.407	S	S	.	.	H	α-helix	trans	-60.4	-37.4	177.9	0	0	0	0	0	113	L183 F184 G191	L183-A187 WeakPolarHBondContact O-CB 3.35Å; L183-A187 PolarHBondContact O-N 2.54Å; F184-A187 PolarHBondContact O-N 2.98Å; A187-G191 PolarHBondContact O-N 2.98Å
188	L	98.7	Very high	98.5	Very high	71 Å²	71	76.8 Å²	76.8	37%	0.372	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-45.2	172.9	-76	177.7	0	0	0	111.8	F184 A185 E186 G191 A192 A206	F184-L188 HydrophobicContact CD1-CD1 3.93Å; F184-L188 HydrophobicContact CD1-CG 4.38Å; F184-L188 HydrophobicContact CE1-CD1 3.52Å; F184-L188 HydrophobicContact CE1-CG 4.05Å; F184-L188 HydrophobicContact CZ-CD1 4.1Å; F184-L188 HydrophobicContact CZ-CD2 4.28Å; F184-L188 HydrophobicContact CZ-CG 4.22Å; F184-L188 WeakPolarHBondContact O-CG 3.39Å; F184-L188 PolarHBondContact O-N 3.44Å; A185-L188 PolarHBondContact O-N 3.46Å; E186-L188 VanDerWaalsContact C-N 3.31Å; E186-L188 PolarHBondContact O-N 3.44Å; L188-G191 PolarHBondContact O-N 2.91Å; L188-A192 PolarHBondContact O-N 2.99Å; L188-A206 HydrophobicContact CB-CB 4.03Å
189	A	98.8	Very high	98.6	Very high	0 Å²	0	79 Å²	79	0%	0	45%	0.445	C	S	.	.	H	α-helix	trans	-64.3	-45.5	179.2	0	0	0	0	0	111.4	A185 E186 G191 A192 V193 A202 H203 A206	A185-A189 PolarHBondContact O-N 3.49Å; A185-A189 VanDerWaalsContact O-N 3.09Å; E186-A189 WeakPolarHBondContact O-CB 3.38Å; E186-A189 PolarHBondContact O-N 2.71Å; A189-G191 VanDerWaalsContact C-N 3.31Å; A189-G191 PolarHBondContact O-N 3.46Å; A189-A192 PolarHBondContact O-N 3.43Å; A189-A192 VanDerWaalsContact O-N 3.12Å; A189-V193 WeakPolarHBondContact O-CG2 3.44Å; A189-V193 PolarHBondContact O-N 3.47Å; A189-A202 HydrophobicContact CB-CB 4.23Å; A189-H203 HydrophobicContact CB-CB 4.48Å; A189-H203 WeakPolarHBondContact CB-ND1 3.43Å; A189-A206 HydrophobicContact CB-CB 4.02Å
190	E	98.7	Very high	98.6	Very high	118 Å²	118	79.8 Å²	79.8	55%	0.551	45%	0.451	S	S	*	.	H	α-helix	trans	-61.5	-39.5	175.8	-69.5	-173.6	164.7	0	0	112.1	E186 A192 V193 K194	E186-E190 WeakPolarHBondContact O-CG 3.29Å; E186-E190 PolarHBondContact O-N 3.18Å; E190-A192 VanDerWaalsContact C-N 3.34Å; E190-A192 PolarHBondContact O-N 3.3Å; E190-V193 PolarHBondContact O-N 2.78Å; E190-K194 WeakPolarHBondContact O-CB 3.44Å; E190-K194 PolarHBondContact O-N 3.02Å
191	G	98.8	Very high	98.6	Very high	37 Å²	37	80.7 Å²	80.7	38%	0.381	46%	0.459	S	S	.	.	H	α-helix	trans	-58.4	-43.2	172	0	0	0	0	0	112.6	A187 L188 A189 K194 M195	A187-G191 PolarHBondContact O-N 2.98Å; L188-G191 PolarHBondContact O-N 2.91Å; A189-G191 VanDerWaalsContact C-N 3.31Å; A189-G191 PolarHBondContact O-N 3.46Å; G191-K194 WeakPolarHBondContact O-CB 3.37Å; G191-K194 PolarHBondContact O-N 3.24Å; G191-M195 WeakPolarHBondContact O-CG 3.27Å; G191-M195 PolarHBondContact O-N 3.45Å
192	A	98.8	Very high	98.6	Very high	27 Å²	27	77.6 Å²	77.6	22%	0.223	44%	0.44	C	S	.	.	H	α-helix	trans	-68.6	-38	176.7	0	0	0	0	0	112.7	L188 A189 E190 K194 M195 G196 M197 A202	L188-A192 PolarHBondContact O-N 2.99Å; A189-A192 PolarHBondContact O-N 3.43Å; A189-A192 VanDerWaalsContact O-N 3.12Å; E190-A192 VanDerWaalsContact C-N 3.34Å; E190-A192 PolarHBondContact O-N 3.3Å; A192-K194 VanDerWaalsContact C-N 3.33Å; A192-M195 CarbonylContact O-C 3.48Å; A192-M195 WeakPolarHBondContact O-CA 3.31Å; A192-M195 PolarHBondContact O-N 2.98Å; A192-M195 VanDerWaalsContact O-N 3.09Å; A192-G196 PolarHBondContact O-N 2.96Å; A192-M197 HydrophobicContact CB-CB 4.21Å; A192-M197 HydrophobicContact CB-CE 4.45Å; A192-M197 HydrophobicContact CB-SD 4.09Å; A192-M197 VanDerWaalsContact O-CB 3.32Å; A192-M197 WeakPolarHBondContact O-CB 3.34Å; A192-M197 PolarHBondContact O-N 3.47Å; A192-M197 VanDerWaalsContact O-N 3.1Å; A192-A202 HydrophobicContact CB-CB 3.94Å
193	V	98.8	Very high	98.6	Very high	61 Å²	61	75.1 Å²	75.1	37%	0.37	43%	0.433	S	S	.	.	H	α-helix	trans	-61.9	-42.5	173.9	171.9	0	0	0	0	111	A189 E190 M195 G196 M197 A202	A189-V193 WeakPolarHBondContact O-CG2 3.44Å; A189-V193 PolarHBondContact O-N 3.47Å; E190-V193 PolarHBondContact O-N 2.78Å; V193-M195 PolarHBondContact O-N 3.28Å; V193-G196 WeakPolarHBondContact O-CA 3.44Å; V193-G196 PolarHBondContact O-N 3.43Å; V193-M197 WeakPolarHBondContact CA-O 3.45Å; V193-A202 HydrophobicContact CG2-CB 3.89Å
194	K	98.8	Very high	98.6	Very high	185 Å²	185	73.4 Å²	73.4	80%	0.804	43%	0.431	S	S	*	.	H	α-helix	trans	-57.9	-29.1	174.3	-177.4	178.4	177.9	-179.2	0	112.6	E190 G191 A192 G196	E190-K194 WeakPolarHBondContact O-CB 3.44Å; E190-K194 PolarHBondContact O-N 3.02Å; G191-K194 WeakPolarHBondContact O-CB 3.37Å; G191-K194 PolarHBondContact O-N 3.24Å; A192-K194 VanDerWaalsContact C-N 3.33Å; K194-G196 VanDerWaalsContact C-N 3.31Å
195	M	98.7	Very high	98.6	Very high	161 Å²	161	72.4 Å²	72.4	79%	0.793	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	6.3	175.4	-59.4	-49.6	-58.9	0	0	113.9	G191 A192 V193	G191-M195 WeakPolarHBondContact O-CG 3.27Å; G191-M195 PolarHBondContact O-N 3.45Å; A192-M195 CarbonylContact O-C 3.48Å; A192-M195 WeakPolarHBondContact O-CA 3.31Å; A192-M195 PolarHBondContact O-N 2.98Å; A192-M195 VanDerWaalsContact O-N 3.09Å; V193-M195 PolarHBondContact O-N 3.28Å
196	G	98.6	Very high	98.6	Very high	67 Å²	67	71.9 Å²	71.9	69%	0.691	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.4	8.1	173.8	0	0	0	0	0	115.4	A192 V193 K194	A192-G196 PolarHBondContact O-N 2.96Å; V193-G196 WeakPolarHBondContact O-CA 3.44Å; V193-G196 PolarHBondContact O-N 3.43Å; K194-G196 VanDerWaalsContact C-N 3.31Å
197	M	98.6	Very high	98.6	Very high	65 Å²	65	70.9 Å²	70.9	32%	0.32	43%	0.429	S	S	.	.			trans	-76.3	140.8	176.6	-170.3	176.5	-70.3	0	0	111.8	A192 V193 S199 L201 A202 I205	A192-M197 HydrophobicContact CB-CB 4.21Å; A192-M197 HydrophobicContact CB-CE 4.45Å; A192-M197 HydrophobicContact CB-SD 4.09Å; A192-M197 VanDerWaalsContact O-CB 3.32Å; A192-M197 WeakPolarHBondContact O-CB 3.34Å; A192-M197 PolarHBondContact O-N 3.47Å; A192-M197 VanDerWaalsContact O-N 3.1Å; V193-M197 WeakPolarHBondContact CA-O 3.45Å; M197-S199 PolarHBondContact O-N 2.84Å; M197-L201 HydrophobicContact CG-CB 4.34Å; M197-L201 HydrophobicContact CG-CD2 4.25Å; M197-L201 HydrophobicContact CG-CG 4.35Å; M197-L201 HydrophobicContact SD-CB 4.44Å; M197-L201 HydrophobicContact SD-CD2 4.36Å; M197-L201 HydrophobicContact SD-CG 4.07Å; M197-A202 HydrophobicContact CB-CB 4.46Å; M197-A202 HydrophobicContact CG-CB 4.17Å; M197-A202 VanDerWaalsContact SD-CA 3.52Å; M197-A202 HydrophobicContact SD-CB 3.83Å; M197-I205 HydrophobicContact CE-CD1 4.07Å; M197-I205 HydrophobicContact SD-CD1 3.97Å
198	P	98.7	Very high	98.6	Very high	88 Å²	88	74 Å²	74	57%	0.571	43%	0.434	S	S	*	.			trans	-59.1	133.9	170	-24.6	34.6	0	0	0	112.3	A200 L201 A202	P198-A200 PolarHBondContact O-N 3.1Å; P198-L201 PolarHBondContact O-N 3.17Å; P198-L201 VanDerWaalsContact O-N 3.08Å; P198-A202 PolarHBondContact O-N 3.4Å
199	S	98.4	Very high	98.6	Very high	63 Å²	63	74.2 Å²	74.2	44%	0.441	44%	0.438	S	S	.	.	H	α-helix	trans	-52.1	-48.9	-174.1	166.2	0	0	0	0	113.7	M197 L201 A202 H203	M197-S199 PolarHBondContact O-N 2.84Å; S199-L201 VanDerWaalsContact C-N 3.28Å; S199-L201 PolarHBondContact O-N 3.28Å; S199-A202 WeakPolarHBondContact O-CB 3.47Å; S199-A202 PolarHBondContact O-N 3.23Å; S199-A202 VanDerWaalsContact O-N 3.12Å; S199-H203 PolarHBondContact O-CD2 3.17Å; S199-H203 PolarHBondContact O-N 2.9Å; S199-H203 PolarHBondContact OG-CD2 3.11Å
200	A	98.5	Very high	98.6	Very high	75 Å²	75	76 Å²	76	62%	0.62	45%	0.45	S	S	*	.	H	α-helix	trans	-59.4	-38.6	-179.3	0	0	0	0	0	113.1	P198 S204	P198-A200 PolarHBondContact O-N 3.1Å; A200-S204 WeakPolarHBondContact O-CB 3.44Å; A200-S204 PolarHBondContact O-N 3.18Å; A200-S204 PolarHBondContact O-OG 3.34Å
201	L	98.7	Very high	98.6	Very high	90 Å²	90	74.4 Å²	74.4	47%	0.471	44%	0.444	S	S	.	.	H	α-helix	trans	-70.8	-42.3	176.7	-177.7	60.2	0	0	0	110.9	M197 P198 S199 H203 S204 I205	M197-L201 HydrophobicContact CG-CB 4.34Å; M197-L201 HydrophobicContact CG-CD2 4.25Å; M197-L201 HydrophobicContact CG-CG 4.35Å; M197-L201 HydrophobicContact SD-CB 4.44Å; M197-L201 HydrophobicContact SD-CD2 4.36Å; M197-L201 HydrophobicContact SD-CG 4.07Å; P198-L201 PolarHBondContact O-N 3.17Å; P198-L201 VanDerWaalsContact O-N 3.08Å; S199-L201 VanDerWaalsContact C-N 3.28Å; S199-L201 PolarHBondContact O-N 3.28Å; L201-H203 PolarHBondContact O-N 2.83Å; L201-S204 PolarHBondContact O-N 3.19Å; L201-I205 HydrophobicContact CD1-CD1 3.8Å; L201-I205 HydrophobicContact CD1-CG1 4.07Å; L201-I205 HydrophobicContact CD2-CD1 4.4Å; L201-I205 HydrophobicContact CG-CD1 3.77Å; L201-I205 HydrophobicContact CG-CG1 4.38Å; L201-I205 WeakPolarHBondContact O-CG1 3.23Å; L201-I205 PolarHBondContact O-N 2.99Å
202	A	98.8	Very high	98.6	Very high	2 Å²	2	73.9 Å²	73.9	2%	0.017	44%	0.439	C	S	.	.	H	α-helix	trans	-58.6	-47.6	177.6	0	0	0	0	0	112.3	A189 A192 V193 M197 P198 S199 S204 I205 A206	A189-A202 HydrophobicContact CB-CB 4.23Å; A192-A202 HydrophobicContact CB-CB 3.94Å; V193-A202 HydrophobicContact CG2-CB 3.89Å; M197-A202 HydrophobicContact CB-CB 4.46Å; M197-A202 HydrophobicContact CG-CB 4.17Å; M197-A202 VanDerWaalsContact SD-CA 3.52Å; M197-A202 HydrophobicContact SD-CB 3.83Å; P198-A202 PolarHBondContact O-N 3.4Å; S199-A202 WeakPolarHBondContact O-CB 3.47Å; S199-A202 PolarHBondContact O-N 3.23Å; S199-A202 VanDerWaalsContact O-N 3.12Å; A202-S204 PolarHBondContact O-N 3.33Å; A202-I205 PolarHBondContact O-N 3.1Å; A202-A206 VanDerWaalsContact O-CB 3.29Å; A202-A206 WeakPolarHBondContact O-CB 3.28Å; A202-A206 PolarHBondContact O-N 2.96Å
203	H	98.4	Very high	98.5	Very high	85 Å²	85	75.4 Å²	75.4	39%	0.394	45%	0.452	S	S	.	.	H	α-helix	trans	-63.1	-41.4	176.6	-73.6	-72.4	0	0	0	112.3	A189 S199 L201 A206 S207	A189-H203 HydrophobicContact CB-CB 4.48Å; A189-H203 WeakPolarHBondContact CB-ND1 3.43Å; S199-H203 PolarHBondContact O-CD2 3.17Å; S199-H203 PolarHBondContact O-N 2.9Å; S199-H203 PolarHBondContact OG-CD2 3.11Å; L201-H203 PolarHBondContact O-N 2.83Å; H203-A206 PolarHBondContact O-N 3.17Å; H203-S207 WeakPolarHBondContact O-CB 3.47Å; H203-S207 PolarHBondContact O-N 3.35Å
204	S	98.6	Very high	98.5	Very high	78 Å²	78	74.3 Å²	74.3	55%	0.545	45%	0.452	S	S	.	.	H	α-helix	trans	-63.4	-45.3	178.1	-59.1	0	0	0	0	111.8	A200 L201 A202 Q208	A200-S204 WeakPolarHBondContact O-CB 3.44Å; A200-S204 PolarHBondContact O-N 3.18Å; A200-S204 PolarHBondContact O-OG 3.34Å; L201-S204 PolarHBondContact O-N 3.19Å; A202-S204 PolarHBondContact O-N 3.33Å; S204-Q208 WeakPolarHBondContact O-CB 3.31Å; S204-Q208 PolarHBondContact O-N 3.34Å
205	I	98.7	Very high	98.4	Very high	77 Å²	77	70 Å²	70	40%	0.395	43%	0.434	S	S	.	.	H	α-helix	trans	-67.3	-41.5	178	-69.2	174.7	0	0	0	111.2	M197 L201 A202 Q208 T209	M197-I205 HydrophobicContact CE-CD1 4.07Å; M197-I205 HydrophobicContact SD-CD1 3.97Å; L201-I205 HydrophobicContact CD1-CD1 3.8Å; L201-I205 HydrophobicContact CD1-CG1 4.07Å; L201-I205 HydrophobicContact CD2-CD1 4.4Å; L201-I205 HydrophobicContact CG-CD1 3.77Å; L201-I205 HydrophobicContact CG-CG1 4.38Å; L201-I205 WeakPolarHBondContact O-CG1 3.23Å; L201-I205 PolarHBondContact O-N 2.99Å; A202-I205 PolarHBondContact O-N 3.1Å; I205-Q208 PolarHBondContact O-N 3.05Å; I205-T209 WeakPolarHBondContact O-CB 3.23Å; I205-T209 PolarHBondContact O-N 3.29Å; I205-T209 PolarHBondContact O-OG1 3.28Å
206	A	98.8	Very high	98.3	Very high	7 Å²	7	68 Å²	68	6%	0.058	43%	0.425	C	S	.	.	H	α-helix	trans	-61.8	-46.1	177.8	0	0	0	0	0	111.6	A185 L188 A189 A202 H203 Q208 T209 V210	A185-A206 WeakPolarHBondContact O-CB 3.26Å; L188-A206 HydrophobicContact CB-CB 4.03Å; A189-A206 HydrophobicContact CB-CB 4.02Å; A202-A206 VanDerWaalsContact O-CB 3.29Å; A202-A206 WeakPolarHBondContact O-CB 3.28Å; A202-A206 PolarHBondContact O-N 2.96Å; H203-A206 PolarHBondContact O-N 3.17Å; A206-Q208 PolarHBondContact O-N 3.49Å; A206-T209 PolarHBondContact O-N 3.37Å; A206-V210 WeakPolarHBondContact O-CG2 3.33Å; A206-V210 PolarHBondContact O-N 3.29Å
207	S	98.4	Very high	98.3	Very high	77 Å²	77	68.7 Å²	68.7	54%	0.538	41%	0.413	S	S	.	.	H	α-helix	trans	-58.3	-48	174.7	-178	0	0	0	0	111.9	H203 T209 V210 L211	H203-S207 WeakPolarHBondContact O-CB 3.47Å; H203-S207 PolarHBondContact O-N 3.35Å; S207-T209 VanDerWaalsContact C-N 3.32Å; S207-T209 PolarHBondContact O-N 3.07Å; S207-V210 PolarHBondContact O-N 3.04Å; S207-L211 PolarHBondContact O-N 3.43Å
208	Q	98.7	Very high	98.1	Very high	119 Å²	119	71.8 Å²	71.8	56%	0.556	42%	0.421	S	S	*	.	H	α-helix	trans	-65	-34.9	178.8	-174.7	58.4	56.1	0	0	112.7	S204 I205 A206 L211 G212	S204-Q208 WeakPolarHBondContact O-CB 3.31Å; S204-Q208 PolarHBondContact O-N 3.34Å; I205-Q208 PolarHBondContact O-N 3.05Å; A206-Q208 PolarHBondContact O-N 3.49Å; Q208-L211 PolarHBondContact O-N 3.38Å; Q208-G212 PolarHBondContact O-N 2.9Å
209	T	98.7	Very high	98	Very high	76 Å²	76	72.6 Å²	72.6	47%	0.466	42%	0.421	S	S	.	.	H	α-helix	trans	-65	-46.4	176.8	-60.3	0	0	0	0	110.7	I205 A206 S207 G212 A213	I205-T209 WeakPolarHBondContact O-CB 3.23Å; I205-T209 PolarHBondContact O-N 3.29Å; I205-T209 PolarHBondContact O-OG1 3.28Å; A206-T209 PolarHBondContact O-N 3.37Å; S207-T209 VanDerWaalsContact C-N 3.32Å; S207-T209 PolarHBondContact O-N 3.07Å; T209-G212 PolarHBondContact O-N 3.32Å; T209-A213 VanDerWaalsContact O-CB 3.3Å; T209-A213 WeakPolarHBondContact O-CB 3.2Å; T209-A213 PolarHBondContact O-N 3.47Å
210	V	98.4	Very high	97.9	Very high	39 Å²	39	71.7 Å²	71.7	24%	0.236	42%	0.415	C	S	.	.	H	α-helix	trans	-61.7	-47.1	176	169.7	0	0	0	0	111	V181 F184 A185 A206 S207 G212 A213 G214	V181-V210 HydrophobicContact CG1-CG1 3.47Å; V181-V210 VanDerWaalsContact CG1-CG1 3.47Å; F184-V210 HydrophobicContact CD1-CG2 4.43Å; A185-V210 HydrophobicContact CB-CG2 4.09Å; A206-V210 WeakPolarHBondContact O-CG2 3.33Å; A206-V210 PolarHBondContact O-N 3.29Å; S207-V210 PolarHBondContact O-N 3.04Å; V210-G212 PolarHBondContact O-N 2.96Å; V210-A213 PolarHBondContact O-N 3.3Å; V210-G214 PolarHBondContact O-N 2.93Å
211	L	98.3	Very high	97.7	Very high	83 Å²	83	71.9 Å²	71.9	44%	0.435	42%	0.423	S	S	.	.	H	α-helix	trans	-59	-49.4	178	177.9	64	0	0	0	112	S207 Q208 G214 K215	S207-L211 PolarHBondContact O-N 3.43Å; Q208-L211 PolarHBondContact O-N 3.38Å; L211-G214 PolarHBondContact O-N 3.14Å; L211-K215 WeakPolarHBondContact O-CG 3.31Å; L211-K215 PolarHBondContact O-N 3.02Å
212	G	98.3	Very high	97.7	Very high	26 Å²	26	71.2 Å²	71.2	27%	0.268	42%	0.417	S	S	.	.	H	α-helix	trans	-63.5	-45.1	-178.8	0	0	0	0	0	112.5	Q208 T209 V210 G214 K215 L216	Q208-G212 PolarHBondContact O-N 2.9Å; T209-G212 PolarHBondContact O-N 3.32Å; V210-G212 PolarHBondContact O-N 2.96Å; G212-G214 PolarHBondContact O-N 3.29Å; G212-K215 PolarHBondContact O-N 2.78Å; G212-L216 WeakPolarHBondContact O-CG 3.4Å; G212-L216 PolarHBondContact O-N 3.09Å
213	A	98.1	Very high	97.6	Very high	60 Å²	60	77.3 Å²	77.3	50%	0.496	45%	0.445	S	S	.	.	H	α-helix	trans	-62.9	-41.8	176.6	0	0	0	0	0	112	T209 V210 L216 L217	T209-A213 VanDerWaalsContact O-CB 3.3Å; T209-A213 WeakPolarHBondContact O-CB 3.2Å; T209-A213 PolarHBondContact O-N 3.47Å; V210-A213 PolarHBondContact O-N 3.3Å; A213-L216 PolarHBondContact O-N 2.63Å; A213-L217 WeakPolarHBondContact O-CB 3.43Å; A213-L217 PolarHBondContact O-N 3.07Å
214	G	97	Very high	97.5	Very high	37 Å²	37	76.8 Å²	76.8	38%	0.381	45%	0.448	S	S	.	.	H	α-helix	trans	-61.3	-45.1	176.3	0	0	0	0	0	112.9	V210 L211 G212 L217 R218	V210-G214 PolarHBondContact O-N 2.93Å; L211-G214 PolarHBondContact O-N 3.14Å; G212-G214 PolarHBondContact O-N 3.29Å; G214-L217 PolarHBondContact O-N 2.86Å; G214-R218 WeakPolarHBondContact O-CB 3.48Å; G214-R218 PolarHBondContact O-N 2.83Å
215	K	97.1	Very high	97.5	Very high	95 Å²	95	74.7 Å²	74.7	41%	0.413	44%	0.436	S	S	.	.	H	α-helix	trans	-63.3	-46.6	176.3	-73.8	-172.3	174.4	-171	0	112.4	L211 G212 L217 R218 D219	L211-K215 WeakPolarHBondContact O-CG 3.31Å; L211-K215 PolarHBondContact O-N 3.02Å; G212-K215 PolarHBondContact O-N 2.78Å; K215-L217 VanDerWaalsContact C-N 3.29Å; K215-L217 PolarHBondContact O-N 2.8Å; K215-R218 PolarHBondContact O-N 2.75Å; K215-D219 VanDerWaalsContact O-CB 3.31Å; K215-D219 WeakPolarHBondContact O-CB 3.4Å; K215-D219 VanDerWaalsContact O-CG 3.26Å; K215-D219 PolarHBondContact O-N 3.38Å
216	L	97.3	Very high	97.4	Very high	118 Å²	118	75.5 Å²	75.5	62%	0.618	44%	0.438	S	S	*	.	H	α-helix	trans	-60	-41	176.5	-72.6	172.4	0	0	0	111.8	G212 A213 S220	G212-L216 WeakPolarHBondContact O-CG 3.4Å; G212-L216 PolarHBondContact O-N 3.09Å; A213-L216 PolarHBondContact O-N 2.63Å; L216-S220 WeakPolarHBondContact O-CB 3.47Å; L216-S220 PolarHBondContact O-N 3.35Å; L216-S220 VanDerWaalsContact O-N 3.1Å; L216-S220 PolarHBondContact O-OG 3.36Å
217	L	97.4	Very high	97.4	Very high	83 Å²	83	76.7 Å²	76.7	44%	0.435	44%	0.443	S	S	.	.	H	α-helix	trans	-62.6	-48.2	176.8	176.1	60.5	0	0	0	111.9	A213 G214 K215 P224 L227	A213-L217 WeakPolarHBondContact O-CB 3.43Å; A213-L217 PolarHBondContact O-N 3.07Å; G214-L217 PolarHBondContact O-N 2.86Å; K215-L217 VanDerWaalsContact C-N 3.29Å; K215-L217 PolarHBondContact O-N 2.8Å; L217-P224 HydrophobicContact CD1-CB 4.35Å; L217-P224 HydrophobicContact CD1-CG 3.86Å; L217-L227 HydrophobicContact CB-CD1 4.22Å; L217-L227 HydrophobicContact CD1-CD1 3.8Å
218	R	95.6	Very high	97.3	Very high	129 Å²	129	77.8 Å²	77.8	49%	0.487	44%	0.436	S	S	.	.	H	α-helix	trans	-64.7	-46.5	-179.5	-174.1	-169.3	65.5	-168.1	-2.7	112.1	E130 G214 K215	E130-R218 IonicContact OE1-CZ 3.9Å; E130-R218 IonicContact OE1-NH1 2.81Å; E130-R218 PolarHBondContact OE1-NH1 3.07Å; E130-R218 IonicContact OE2-CZ 2.83Å; E130-R218 IonicContact OE2-NH1 3.92Å; E130-R218 PolarHBondContact OE2-NH1 3.02Å; G214-R218 WeakPolarHBondContact O-CB 3.48Å; G214-R218 PolarHBondContact O-N 2.83Å; K215-R218 PolarHBondContact O-N 2.75Å
219	D	96.3	Very high	97.2	Very high	105 Å²	105	75 Å²	75	56%	0.561	43%	0.434	S	S	*	.	H	α-helix	trans	-89.4	-19.2	-166.1	-59.7	-17.3	0	0	0	113.1	K215	K215-D219 VanDerWaalsContact O-CB 3.31Å; K215-D219 WeakPolarHBondContact O-CB 3.4Å; K215-D219 VanDerWaalsContact O-CG 3.26Å; K215-D219 PolarHBondContact O-N 3.38Å
220	S	96.6	Very high	97.1	Very high	45 Å²	45	76.3 Å²	76.3	32%	0.315	43%	0.434	S	S	.	.	H	α-helix	trans	-81.5	-21.5	-175.5	65.6	0	0	0	0	115	L216 K222	L216-S220 WeakPolarHBondContact O-CB 3.47Å; L216-S220 PolarHBondContact O-N 3.35Å; L216-S220 VanDerWaalsContact O-N 3.1Å; L216-S220 PolarHBondContact O-OG 3.36Å; S220-K222 PolarHBondContact O-N 2.97Å; S220-K222 VanDerWaalsContact O-N 3.12Å; S220-K222 PolarHBondContact OG-N 2.91Å
221	G	94.6	Very high	97	Very high	78 Å²	78	78.9 Å²	78.9	80%	0.804	45%	0.45	S	S	*	.			trans	64	8	-171.1	0	0	0	0	0	114.8
222	K	96.9	Very high	96.9	Very high	77 Å²	77	76.4 Å²	76.4	34%	0.335	44%	0.439	S	S	.	.			trans	-87.5	149.1	-177.9	-67.6	176.6	-179.9	-175.9	0	111.4	S220 L227 E230	S220-K222 PolarHBondContact O-N 2.97Å; S220-K222 VanDerWaalsContact O-N 3.12Å; S220-K222 PolarHBondContact OG-N 2.91Å; K222-L227 HydrophobicContact CB-CD1 4.43Å; K222-L227 HydrophobicContact CB-CD2 4.1Å; K222-L227 HydrophobicContact CB-CG 3.94Å; K222-L227 HydrophobicContact CD-CD2 3.78Å; K222-L227 HydrophobicContact CD-CG 4.44Å; K222-E230 IonicContact NZ-OE1 3.92Å; K222-E230 PolarHBondContact NZ-OE1 3.07Å; K222-E230 IonicContact NZ-OE2 3.63Å; K222-E230 PolarHBondContact NZ-OE2 3.35Å
223	H	97.6	Very high	96.7	Very high	130 Å²	130	79.3 Å²	79.3	60%	0.602	45%	0.452	S	S	*	.			trans	-62.7	139.2	172.3	-172.8	-91.1	0	0	0	110.9	A225 Q226 L227	H223-A225 VanDerWaalsContact ND1-CB 3.32Å; H223-A225 WeakPolarHBondContact ND1-CB 3.13Å; H223-A225 PolarHBondContact ND1-N 3.3Å; H223-A225 VanDerWaalsContact ND1-N 3.16Å; H223-A225 PolarHBondContact O-N 3.32Å; H223-A225 VanDerWaalsContact O-N 3.1Å; H223-Q226 WeakPolarHBondContact O-CA 3.4Å; H223-Q226 WeakPolarHBondContact O-CB 3.3Å; H223-Q226 PolarHBondContact O-N 3.31Å; H223-L227 PolarHBondContact O-N 2.78Å
224	P	97.1	Very high	96.6	Very high	73 Å²	73	82.9 Å²	82.9	47%	0.474	47%	0.47	S	S	.	.	H	α-helix	trans	-53.8	-35.7	-178.3	-26.6	30.8	0	0	0	114.5	L217 Q226 L227 R228	L217-P224 HydrophobicContact CD1-CB 4.35Å; L217-P224 HydrophobicContact CD1-CG 3.86Å; P224-Q226 VanDerWaalsContact C-N 3.28Å; P224-Q226 PolarHBondContact O-N 2.92Å; P224-L227 PolarHBondContact O-N 2.92Å; P224-R228 WeakPolarHBondContact O-CB 3.46Å; P224-R228 PolarHBondContact O-N 3Å
225	A	97.1	Very high	96.6	Very high	34 Å²	34	84 Å²	84	28%	0.281	48%	0.482	S	S	.	.	H	α-helix	trans	-65.2	-31.7	177.4	0	0	0	0	0	112.9	H223 A229	H223-A225 VanDerWaalsContact ND1-CB 3.32Å; H223-A225 WeakPolarHBondContact ND1-CB 3.13Å; H223-A225 PolarHBondContact ND1-N 3.3Å; H223-A225 VanDerWaalsContact ND1-N 3.16Å; H223-A225 PolarHBondContact O-N 3.32Å; H223-A225 VanDerWaalsContact O-N 3.1Å; A225-A229 WeakPolarHBondContact O-CB 3.2Å; A225-A229 PolarHBondContact O-N 3.18Å; A225-A229 VanDerWaalsContact O-N 3.09Å
226	Q	97.9	Very high	96.7	Very high	94 Å²	94	80.2 Å²	80.2	44%	0.439	47%	0.47	S	S	.	.	H	α-helix	trans	-71.1	-49.4	175.5	-179.4	-177.8	-17.3	0	0	110.5	H223 P224 R228 A229 E230	H223-Q226 WeakPolarHBondContact O-CA 3.4Å; H223-Q226 WeakPolarHBondContact O-CB 3.3Å; H223-Q226 PolarHBondContact O-N 3.31Å; P224-Q226 VanDerWaalsContact C-N 3.28Å; P224-Q226 PolarHBondContact O-N 2.92Å; Q226-R228 PolarHBondContact O-N 3.32Å; Q226-A229 WeakPolarHBondContact O-CA 3.42Å; Q226-A229 WeakPolarHBondContact O-CB 3.41Å; Q226-A229 PolarHBondContact O-N 2.78Å; Q226-E230 WeakPolarHBondContact CG-OE1 3.39Å; Q226-E230 PolarHBondContact NE2-OE1 3.09Å; Q226-E230 WeakPolarHBondContact O-CG 3.22Å; Q226-E230 PolarHBondContact O-N 3.3Å
227	L	97.4	Very high	96.7	Very high	33 Å²	33	80.7 Å²	80.7	17%	0.173	48%	0.477	C	S	.	.	H	α-helix	trans	-56.8	-40.4	176.3	-69.9	171.9	0	0	0	111.8	L217 K222 H223 P224 E230 V231	L217-L227 HydrophobicContact CB-CD1 4.22Å; L217-L227 HydrophobicContact CD1-CD1 3.8Å; K222-L227 HydrophobicContact CB-CD1 4.43Å; K222-L227 HydrophobicContact CB-CD2 4.1Å; K222-L227 HydrophobicContact CB-CG 3.94Å; K222-L227 HydrophobicContact CD-CD2 3.78Å; K222-L227 HydrophobicContact CD-CG 4.44Å; H223-L227 PolarHBondContact O-N 2.78Å; P224-L227 PolarHBondContact O-N 2.92Å; L227-E230 PolarHBondContact O-N 3.29Å; L227-V231 PolarHBondContact O-N 2.87Å
228	R	96.3	Very high	96.7	Very high	99 Å²	99	79 Å²	79	37%	0.374	47%	0.471	S	S	.	.	H	α-helix	trans	-62.6	-40.9	174.1	-173.5	-178.4	66.1	-138.8	-0.7	112.3	P224 Q226 V231 C232 L242	P224-R228 WeakPolarHBondContact O-CB 3.46Å; P224-R228 PolarHBondContact O-N 3Å; Q226-R228 PolarHBondContact O-N 3.32Å; R228-V231 VanDerWaalsContact O-CG2 3.31Å; R228-V231 WeakPolarHBondContact O-CG2 3.24Å; R228-V231 PolarHBondContact O-N 3.17Å; R228-C232 VanDerWaalsContact O-CB 3.31Å; R228-C232 WeakPolarHBondContact O-CB 2.89Å; R228-C232 PolarHBondContact O-N 3.34Å; R228-L242 HydrophobicContact CG-CD1 3.71Å; R228-L242 HydrophobicContact CG-CD2 4.31Å
229	A	96.4	Very high	96.9	Very high	62 Å²	62	76.4 Å²	76.4	51%	0.512	47%	0.465	S	S	.	.	H	α-helix	trans	-66.6	-38	177.6	0	0	0	0	0	112	A225 Q226 V231 C232	A225-A229 WeakPolarHBondContact O-CB 3.2Å; A225-A229 PolarHBondContact O-N 3.18Å; A225-A229 VanDerWaalsContact O-N 3.09Å; Q226-A229 WeakPolarHBondContact O-CA 3.42Å; Q226-A229 WeakPolarHBondContact O-CB 3.41Å; Q226-A229 PolarHBondContact O-N 2.78Å; A229-V231 PolarHBondContact O-N 2.83Å; A229-C232 PolarHBondContact O-N 3.12Å
230	E	96.9	Very high	97	Very high	102 Å²	102	78.8 Å²	78.8	48%	0.477	47%	0.468	S	S	.	.	H	α-helix	trans	-61.7	-27.6	179.5	-71.8	174	-171.4	0	0	113.1	K222 Q226 L227	K222-E230 IonicContact NZ-OE1 3.92Å; K222-E230 PolarHBondContact NZ-OE1 3.07Å; K222-E230 IonicContact NZ-OE2 3.63Å; K222-E230 PolarHBondContact NZ-OE2 3.35Å; Q226-E230 WeakPolarHBondContact CG-OE1 3.39Å; Q226-E230 PolarHBondContact NE2-OE1 3.09Å; Q226-E230 WeakPolarHBondContact O-CG 3.22Å; Q226-E230 PolarHBondContact O-N 3.3Å; L227-E230 PolarHBondContact O-N 3.29Å
231	V	96.3	Very high	97	Very high	93 Å²	93	78.4 Å²	78.4	56%	0.564	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	5.6	176.7	-58.4	0	0	0	0	113.7	L227 R228 A229 T238	L227-V231 PolarHBondContact O-N 2.87Å; R228-V231 VanDerWaalsContact O-CG2 3.31Å; R228-V231 WeakPolarHBondContact O-CG2 3.24Å; R228-V231 PolarHBondContact O-N 3.17Å; A229-V231 PolarHBondContact O-N 2.83Å; V231-T238 HydrophobicContact CG2-CG2 4.34Å; V231-T238 WeakPolarHBondContact O-CB 3.41Å; V231-T238 PolarHBondContact O-OG1 3.41Å
232	C	95.6	Very high	97.2	Very high	32 Å²	32	76.5 Å²	76.5	22%	0.216	44%	0.442	C	S	.	.			trans	-110.1	92.2	-174.4	-162.6	0	0	0	0	110.6	R228 A229 T238 I239	R228-C232 VanDerWaalsContact O-CB 3.31Å; R228-C232 WeakPolarHBondContact O-CB 2.89Å; R228-C232 PolarHBondContact O-N 3.34Å; A229-C232 PolarHBondContact O-N 3.12Å; C232-T238 HydrophobicContact CB-CG2 4.42Å; C232-I239 VanDerWaalsContact SG-CB 3.53Å
233	T	94.9	Very high	97.3	Very high	86 Å²	86	78 Å²	78	53%	0.528	45%	0.45	S	S	.	.			trans	-78.9	142.7	176.6	52.6	0	0	0	0	111.3	G235 G236	T233-G235 PolarHBondContact O-N 2.81Å; T233-G236 PolarHBondContact O-N 3.15Å
234	P	96.4	Very high	97.3	Very high	136 Å²	136	76.1 Å²	76.1	88%	0.883	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	122.5	176.9	-26.9	35.3	0	0	0	112	G236	P234-G236 PolarHBondContact O-N 3.43Å
235	G	97.1	Very high	97.3	Very high	61 Å²	61	76.2 Å²	76.2	63%	0.629	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	4.4	-177.3	0	0	0	0	0	115.4	T233	T233-G235 PolarHBondContact O-N 2.81Å
236	G	98.1	Very high	97.4	Very high	15 Å²	15	78.3 Å²	78.3	16%	0.155	45%	0.448	C	S	.	.	S	Bend	trans	-78.1	171.5	-179.2	0	0	0	0	0	114.1	T233 P234 T238 I239 Y240	T233-G236 PolarHBondContact O-N 3.15Å; P234-G236 PolarHBondContact O-N 3.43Å; G236-T238 VanDerWaalsContact C-N 3.28Å; G236-T238 PolarHBondContact O-N 3.3Å; G236-I239 VanDerWaalsContact O-CG2 3.27Å; G236-I239 WeakPolarHBondContact O-CG2 3.4Å; G236-I239 PolarHBondContact O-N 2.78Å; G236-Y240 WeakPolarHBondContact O-CD2 3.19Å
237	T	98.1	Very high	97.4	Very high	128 Å²	128	80.3 Å²	80.3	79%	0.785	46%	0.457	S	S	*	.	H	α-helix	trans	-59.1	-36.8	-177.5	54.8	0	0	0	0	113.1	I239 Y240 G241	T237-I239 PolarHBondContact O-N 2.81Å; T237-Y240 PolarHBondContact O-N 3.12Å; T237-G241 PolarHBondContact O-N 2.87Å; T237-G241 VanDerWaalsContact O-N 3.09Å
238	T	98.1	Very high	97.4	Very high	48 Å²	48	81.3 Å²	81.3	29%	0.294	48%	0.476	S	S	.	.	H	α-helix	trans	-59.3	-44.2	-178.8	-48.9	0	0	0	0	112.7	V231 C232 G236 Y240 G241 L242	V231-T238 HydrophobicContact CG2-CG2 4.34Å; V231-T238 WeakPolarHBondContact O-CB 3.41Å; V231-T238 PolarHBondContact O-OG1 3.41Å; C232-T238 HydrophobicContact CB-CG2 4.42Å; G236-T238 VanDerWaalsContact C-N 3.28Å; G236-T238 PolarHBondContact O-N 3.3Å; T238-Y240 PolarHBondContact O-N 3Å; T238-G241 PolarHBondContact O-N 2.71Å; T238-L242 HydrophobicContact CG2-CD1 4Å; T238-L242 HydrophobicContact CG2-CG 4.32Å; T238-L242 WeakPolarHBondContact O-CB 3.28Å; T238-L242 WeakPolarHBondContact O-CG 3.38Å; T238-L242 PolarHBondContact O-N 3.18Å
239	I	98.2	Very high	97.5	Very high	73 Å²	73	78 Å²	78	37%	0.374	47%	0.472	S	S	.	.	H	α-helix	trans	-69.1	-35.4	-176.5	-169.6	60	0	0	0	112	C232 G236 T237 L242 H243	C232-I239 VanDerWaalsContact SG-CB 3.53Å; G236-I239 VanDerWaalsContact O-CG2 3.27Å; G236-I239 WeakPolarHBondContact O-CG2 3.4Å; G236-I239 PolarHBondContact O-N 2.78Å; T237-I239 PolarHBondContact O-N 2.81Å; I239-L242 PolarHBondContact O-N 3.16Å; I239-H243 WeakPolarHBondContact O-CB 3.3Å; I239-H243 PolarHBondContact O-N 3.46Å
240	Y	98.3	Very high	97.6	Very high	156 Å²	156	77.7 Å²	77.7	61%	0.612	46%	0.464	S	S	*	.	H	α-helix	trans	-67	-40.9	174.9	-77.5	-97.5	0	0	0	111.5	G236 T237 T238 H243 T244	G236-Y240 WeakPolarHBondContact O-CD2 3.19Å; T237-Y240 PolarHBondContact O-N 3.12Å; T238-Y240 PolarHBondContact O-N 3Å; Y240-H243 PolarHBondContact O-N 3.17Å; Y240-T244 PolarHBondContact O-N 2.8Å; Y240-T244 PolarHBondContact O-OG1 3.22Å
241	G	98.2	Very high	97.6	Very high	37 Å²	37	78.9 Å²	78.9	38%	0.381	46%	0.464	S	S	.	.	H	α-helix	trans	-61.9	-48.3	173.2	0	0	0	0	0	112.2	T237 T238 H243 T244 L245	T237-G241 PolarHBondContact O-N 2.87Å; T237-G241 VanDerWaalsContact O-N 3.09Å; T238-G241 PolarHBondContact O-N 2.71Å; G241-H243 PolarHBondContact O-N 2.79Å; G241-T244 PolarHBondContact O-N 3.12Å; G241-L245 WeakPolarHBondContact O-CG 3.34Å; G241-L245 PolarHBondContact O-N 2.86Å
242	L	97.9	Very high	97.7	Very high	38 Å²	38	77.3 Å²	77.3	20%	0.199	46%	0.461	C	S	.	.	H	α-helix	trans	-60	-43.4	177.2	-74.5	173.5	0	0	0	111.9	R228 T238 I239 T244 L245 E246	R228-L242 HydrophobicContact CG-CD1 3.71Å; R228-L242 HydrophobicContact CG-CD2 4.31Å; T238-L242 HydrophobicContact CG2-CD1 4Å; T238-L242 HydrophobicContact CG2-CG 4.32Å; T238-L242 WeakPolarHBondContact O-CB 3.28Å; T238-L242 WeakPolarHBondContact O-CG 3.38Å; T238-L242 PolarHBondContact O-N 3.18Å; I239-L242 PolarHBondContact O-N 3.16Å; L242-T244 VanDerWaalsContact C-N 3.31Å; L242-T244 PolarHBondContact O-N 3.42Å; L242-L245 HydrophobicContact CD2-CD1 4.47Å; L242-L245 PolarHBondContact O-N 2.92Å; L242-L245 VanDerWaalsContact O-N 3.13Å; L242-E246 WeakPolarHBondContact O-CG 3.31Å; L242-E246 PolarHBondContact O-N 3.36Å
243	H	98.3	Very high	97.8	Very high	109 Å²	109	79.4 Å²	79.4	51%	0.505	48%	0.475	S	S	.	.	H	α-helix	trans	-57.9	-43.5	177	-179	-159.6	0	0	0	111.7	I239 Y240 G241 L245 E246 Q247	I239-H243 WeakPolarHBondContact O-CB 3.3Å; I239-H243 PolarHBondContact O-N 3.46Å; Y240-H243 PolarHBondContact O-N 3.17Å; G241-H243 PolarHBondContact O-N 2.79Å; H243-L245 PolarHBondContact O-N 3.39Å; H243-E246 PolarHBondContact O-N 2.77Å; H243-Q247 PolarHBondContact CE1-NE2 3.07Å; H243-Q247 PolarHBondContact NE2-NE2 3.03Å; H243-Q247 WeakPolarHBondContact O-CG 3.5Å; H243-Q247 PolarHBondContact O-N 2.83Å
244	T	98.4	Very high	98	Very high	90 Å²	90	79.2 Å²	79.2	55%	0.552	47%	0.474	S	S	*	.	H	α-helix	trans	-63.4	-39.7	175.5	-58.7	0	0	0	0	112.4	Y240 G241 L242 E246 Q247 G248	Y240-T244 PolarHBondContact O-N 2.8Å; Y240-T244 PolarHBondContact O-OG1 3.22Å; G241-T244 PolarHBondContact O-N 3.12Å; L242-T244 VanDerWaalsContact C-N 3.31Å; L242-T244 PolarHBondContact O-N 3.42Å; T244-E246 VanDerWaalsContact C-N 3.34Å; T244-E246 PolarHBondContact O-N 3.37Å; T244-Q247 PolarHBondContact O-N 3.36Å; T244-G248 PolarHBondContact O-N 3.32Å
245	L	98	Very high	98.1	Very high	74 Å²	74	79.3 Å²	79.3	39%	0.387	46%	0.464	S	S	.	.	H	α-helix	trans	-64.7	-37.4	174.9	-66.6	174	0	0	0	112.2	G241 L242 H243 G248 G249 V250	G241-L245 WeakPolarHBondContact O-CG 3.34Å; G241-L245 PolarHBondContact O-N 2.86Å; L242-L245 HydrophobicContact CD2-CD1 4.47Å; L242-L245 PolarHBondContact O-N 2.92Å; L242-L245 VanDerWaalsContact O-N 3.13Å; H243-L245 PolarHBondContact O-N 3.39Å; L245-G248 PolarHBondContact O-N 3.04Å; L245-G249 PolarHBondContact O-N 2.88Å; L245-V250 HydrophobicContact CB-CG2 4.03Å; L245-V250 HydrophobicContact CD2-CG2 4.05Å; L245-V250 VanDerWaalsContact O-CG2 3.27Å; L245-V250 WeakPolarHBondContact O-CG2 3.27Å; L245-V250 PolarHBondContact O-N 2.92Å
246	E	98.1	Very high	98.1	Very high	78 Å²	78	79.1 Å²	79.1	36%	0.364	45%	0.454	S	S	.	.	H	α-helix	trans	-67.5	-40.9	175.2	-64.6	-65.9	159.4	0	0	111.7	L242 H243 T244 G248 G249 R251	L242-E246 WeakPolarHBondContact O-CG 3.31Å; L242-E246 PolarHBondContact O-N 3.36Å; H243-E246 PolarHBondContact O-N 2.77Å; T244-E246 VanDerWaalsContact C-N 3.34Å; T244-E246 PolarHBondContact O-N 3.37Å; E246-G248 PolarHBondContact O-N 3.45Å; E246-G249 PolarHBondContact O-N 3.21Å; E246-R251 VanDerWaalsContact CD-NH1 3.31Å; E246-R251 IonicContact OE1-CZ 2.73Å; E246-R251 IonicContact OE1-NE 3.76Å; E246-R251 IonicContact OE1-NH1 3.16Å; E246-R251 PolarHBondContact OE1-NH1 3.02Å; E246-R251 VanDerWaalsContact OE1-NH1 3.16Å; E246-R251 IonicContact OE1-NH2 3.33Å; E246-R251 PolarHBondContact OE1-NH2 3.28Å; E246-R251 IonicContact OE2-CZ 2.92Å; E246-R251 IonicContact OE2-NH1 2.77Å; E246-R251 PolarHBondContact OE2-NH1 3.43Å; E246-R251 IonicContact OE2-NH2 2.63Å
247	Q	98.4	Very high	98.2	Very high	137 Å²	137	80 Å²	80	64%	0.64	46%	0.46	S	S	*	.	H	α-helix	trans	-59.7	-35.2	172.9	-71.2	177.8	4.1	0	0	112	H243 T244 G249	H243-Q247 PolarHBondContact CE1-NE2 3.07Å; H243-Q247 PolarHBondContact NE2-NE2 3.03Å; H243-Q247 WeakPolarHBondContact O-CG 3.5Å; H243-Q247 PolarHBondContact O-N 2.83Å; T244-Q247 PolarHBondContact O-N 3.36Å; Q247-G249 PolarHBondContact O-N 2.89Å
248	G	97.6	Very high	98.2	Very high	54 Å²	54	75.5 Å²	75.5	56%	0.557	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-2.1	173.5	0	0	0	0	0	114.9	T244 L245 E246 V250	T244-G248 PolarHBondContact O-N 3.32Å; L245-G248 PolarHBondContact O-N 3.04Å; E246-G248 PolarHBondContact O-N 3.45Å; G248-V250 VanDerWaalsContact C-N 3.34Å; G248-V250 PolarHBondContact O-N 2.77Å
249	G	98	Very high	98.2	Very high	28 Å²	28	79.5 Å²	79.5	29%	0.289	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	28.2	176.1	0	0	0	0	0	114.5	L245 E246 Q247 R251 A252 S253	L245-G249 PolarHBondContact O-N 2.88Å; E246-G249 PolarHBondContact O-N 3.21Å; Q247-G249 PolarHBondContact O-N 2.89Å; G249-R251 PolarHBondContact O-N 3.47Å; G249-R251 VanDerWaalsContact O-N 3.09Å; G249-A252 WeakPolarHBondContact O-CB 3.35Å; G249-A252 PolarHBondContact O-N 3.03Å; G249-S253 PolarHBondContact O-N 3.47Å; G249-S253 VanDerWaalsContact O-N 3.12Å; G249-S253 PolarHBondContact O-OG 3.41Å
250	V	97.6	Very high	98.2	Very high	57 Å²	57	79.7 Å²	79.7	35%	0.345	46%	0.455	S	S	.	.	H	α-helix	trans	-51	-40.7	-172.4	169	0	0	0	0	113.1	L245 G248 A252 S253 V254	L245-V250 HydrophobicContact CB-CG2 4.03Å; L245-V250 HydrophobicContact CD2-CG2 4.05Å; L245-V250 VanDerWaalsContact O-CG2 3.27Å; L245-V250 WeakPolarHBondContact O-CG2 3.27Å; L245-V250 PolarHBondContact O-N 2.92Å; G248-V250 VanDerWaalsContact C-N 3.34Å; G248-V250 PolarHBondContact O-N 2.77Å; V250-A252 PolarHBondContact O-N 3.2Å; V250-S253 PolarHBondContact O-N 3.29Å; V250-V254 HydrophobicContact CG1-CG2 4.19Å; V250-V254 WeakPolarHBondContact O-CB 3.46Å; V250-V254 VanDerWaalsContact O-CG2 3.28Å; V250-V254 WeakPolarHBondContact O-CG2 3.45Å; V250-V254 PolarHBondContact O-N 2.91Å
251	R	97.3	Very high	98.1	Very high	126 Å²	126	73.1 Å²	73.1	48%	0.475	43%	0.433	S	S	.	.	H	α-helix	trans	-60.6	-47.4	178.5	-67.2	-171.9	-175.3	118.4	7.8	112.4	E246 G249 V254 M255	E246-R251 VanDerWaalsContact CD-NH1 3.31Å; E246-R251 IonicContact OE1-CZ 2.73Å; E246-R251 IonicContact OE1-NE 3.76Å; E246-R251 IonicContact OE1-NH1 3.16Å; E246-R251 PolarHBondContact OE1-NH1 3.02Å; E246-R251 VanDerWaalsContact OE1-NH1 3.16Å; E246-R251 IonicContact OE1-NH2 3.33Å; E246-R251 PolarHBondContact OE1-NH2 3.28Å; E246-R251 IonicContact OE2-CZ 2.92Å; E246-R251 IonicContact OE2-NH1 2.77Å; E246-R251 PolarHBondContact OE2-NH1 3.43Å; E246-R251 IonicContact OE2-NH2 2.63Å; G249-R251 PolarHBondContact O-N 3.47Å; G249-R251 VanDerWaalsContact O-N 3.09Å; R251-V254 PolarHBondContact O-N 3.12Å; R251-M255 WeakPolarHBondContact O-CB 3.4Å; R251-M255 VanDerWaalsContact O-CG 3.25Å; R251-M255 WeakPolarHBondContact O-CG 3.38Å; R251-M255 PolarHBondContact O-N 2.93Å
252	A	98.4	Very high	98	Very high	61 Å²	61	71.8 Å²	71.8	50%	0.504	42%	0.417	S	S	.	.	H	α-helix	trans	-62	-48.4	179.8	0	0	0	0	0	110.3	G249 V250 V254 M255 S256	G249-A252 WeakPolarHBondContact O-CB 3.35Å; G249-A252 PolarHBondContact O-N 3.03Å; V250-A252 PolarHBondContact O-N 3.2Å; A252-V254 PolarHBondContact O-N 3.2Å; A252-M255 PolarHBondContact O-N 3.21Å; A252-S256 WeakPolarHBondContact O-CB 3.44Å; A252-S256 PolarHBondContact O-N 2.81Å; A252-S256 PolarHBondContact O-OG 3.4Å
253	S	98.3	Very high	97.9	Very high	75 Å²	75	73.9 Å²	73.9	52%	0.524	43%	0.426	S	S	.	.	H	α-helix	trans	-58.9	-43.8	179.4	-58.2	0	0	0	0	112.8	G249 V250 A257	G249-S253 PolarHBondContact O-N 3.47Å; G249-S253 VanDerWaalsContact O-N 3.12Å; G249-S253 PolarHBondContact O-OG 3.41Å; V250-S253 PolarHBondContact O-N 3.29Å; S253-A257 WeakPolarHBondContact O-CB 3.42Å; S253-A257 PolarHBondContact O-N 3.42Å
254	V	98.2	Very high	97.7	Very high	82 Å²	82	74.6 Å²	74.6	50%	0.497	42%	0.424	S	S	.	.	H	α-helix	trans	-68.4	-42.3	179.1	173.5	0	0	0	0	111.5	V250 R251 A252 A257 V258	V250-V254 HydrophobicContact CG1-CG2 4.19Å; V250-V254 WeakPolarHBondContact O-CB 3.46Å; V250-V254 VanDerWaalsContact O-CG2 3.28Å; V250-V254 WeakPolarHBondContact O-CG2 3.45Å; V250-V254 PolarHBondContact O-N 2.91Å; R251-V254 PolarHBondContact O-N 3.12Å; A252-V254 PolarHBondContact O-N 3.2Å; V254-A257 PolarHBondContact O-N 3.37Å; V254-V258 PolarHBondContact O-N 3.44Å
255	M	98.6	Very high	97.4	Very high	138 Å²	138	70.6 Å²	70.6	68%	0.68	40%	0.401	S	S	*	.	H	α-helix	trans	-61.3	-46.2	176.3	-71.7	173	64.9	0	0	111.5	R251 A252 A257 V258 E259	R251-M255 WeakPolarHBondContact O-CB 3.4Å; R251-M255 VanDerWaalsContact O-CG 3.25Å; R251-M255 WeakPolarHBondContact O-CG 3.38Å; R251-M255 PolarHBondContact O-N 2.93Å; A252-M255 PolarHBondContact O-N 3.21Å; M255-A257 VanDerWaalsContact C-N 3.31Å; M255-A257 PolarHBondContact O-N 3.1Å; M255-V258 PolarHBondContact O-N 2.64Å; M255-E259 PolarHBondContact O-N 2.95Å
256	S	98.6	Very high	97.1	Very high	58 Å²	58	72.1 Å²	72.1	41%	0.406	40%	0.401	S	S	.	.	H	α-helix	trans	-65.4	-31.7	177.5	-63.9	0	0	0	0	113.1	A252 S260	A252-S256 WeakPolarHBondContact O-CB 3.44Å; A252-S256 PolarHBondContact O-N 2.81Å; A252-S256 PolarHBondContact O-OG 3.4Å; S256-S260 VanDerWaalsContact O-CB 3.31Å; S256-S260 WeakPolarHBondContact O-CB 3.25Å; S256-S260 PolarHBondContact O-N 3.37Å; S256-S260 PolarHBondContact O-OG 3.07Å
257	A	98.6	Very high	96.8	Very high	34 Å²	34	72.1 Å²	72.1	28%	0.281	40%	0.401	S	S	.	.	H	α-helix	trans	-64.8	-45.6	174.8	0	0	0	0	0	111.7	F180 S253 V254 M255 S260 A261	F180-A257 HydrophobicContact CE2-CB 4.12Å; F180-A257 HydrophobicContact CZ-CB 4.1Å; S253-A257 WeakPolarHBondContact O-CB 3.42Å; S253-A257 PolarHBondContact O-N 3.42Å; V254-A257 PolarHBondContact O-N 3.37Å; M255-A257 VanDerWaalsContact C-N 3.31Å; M255-A257 PolarHBondContact O-N 3.1Å; A257-S260 PolarHBondContact O-N 3.24Å; A257-A261 WeakPolarHBondContact O-CB 3.25Å; A257-A261 PolarHBondContact O-N 3.06Å
258	V	98.5	Very high	96.1	Very high	32 Å²	32	69.1 Å²	69.1	19%	0.194	39%	0.389	C	S	.	.	H	α-helix	trans	-61.9	-47.6	175.3	175.6	0	0	0	0	110.4	L173 F180 V254 M255 S260 A261 T262	L173-V258 HydrophobicContact CB-CG1 4.24Å; L173-V258 HydrophobicContact CD1-CG1 4.49Å; L173-V258 HydrophobicContact CD1-CG2 4.08Å; F180-V258 HydrophobicContact CE2-CG2 4.34Å; V254-V258 PolarHBondContact O-N 3.44Å; M255-V258 PolarHBondContact O-N 2.64Å; V258-S260 PolarHBondContact O-N 3.01Å; V258-A261 PolarHBondContact O-N 2.88Å; V258-T262 WeakPolarHBondContact O-CB 3.49Å; V258-T262 PolarHBondContact O-N 3.12Å; V258-T262 PolarHBondContact O-OG1 2.96Å; V258-T262 VanDerWaalsContact O-OG1 3.08Å
259	E	98.5	Very high	95.2	Very high	133 Å²	133	67.6 Å²	67.6	62%	0.621	37%	0.373	S	S	*	.	H	α-helix	trans	-56.3	-50.1	177.7	178.8	178.3	-141.2	0	0	112	M255 A261 T262 Q263	M255-E259 PolarHBondContact O-N 2.95Å; E259-A261 PolarHBondContact O-N 3.36Å; E259-T262 PolarHBondContact O-N 3.07Å; E259-Q263 WeakPolarHBondContact O-CB 3.28Å; E259-Q263 PolarHBondContact O-N 3.27Å
260	S	98.4	Very high	94.3	Very high	77 Å²	77	74.5 Å²	74.5	54%	0.538	40%	0.395	S	S	.	.	H	α-helix	trans	-62.3	-42.5	-179.3	-60.2	0	0	0	0	111.8	S256 A257 V258 Q263 R264	S256-S260 VanDerWaalsContact O-CB 3.31Å; S256-S260 WeakPolarHBondContact O-CB 3.25Å; S256-S260 PolarHBondContact O-N 3.37Å; S256-S260 PolarHBondContact O-OG 3.07Å; A257-S260 PolarHBondContact O-N 3.24Å; V258-S260 PolarHBondContact O-N 3.01Å; S260-Q263 PolarHBondContact O-N 3.21Å; S260-R264 WeakPolarHBondContact O-CB 3.27Å; S260-R264 PolarHBondContact O-N 3.22Å
261	A	96.8	Very high	92.5	Very high	18 Å²	18	81.3 Å²	81.3	15%	0.149	42%	0.42	C	S	.	.	H	α-helix	trans	-67.5	-41.4	178.2	0	0	0	0	0	112	F180 A257 V258 E259 R264 A265	F180-A261 HydrophobicContact CZ-CB 4.29Å; A257-A261 WeakPolarHBondContact O-CB 3.25Å; A257-A261 PolarHBondContact O-N 3.06Å; V258-A261 PolarHBondContact O-N 2.88Å; E259-A261 PolarHBondContact O-N 3.36Å; A261-R264 PolarHBondContact O-N 2.67Å; A261-A265 PolarHBondContact O-N 2.88Å
262	T	95.8	Very high	92.2	Very high	8 Å²	8	79.1 Å²	79.1	5%	0.049	42%	0.417	C	S	.	.	H	α-helix	trans	-62.1	-44.4	173.7	-67.6	0	0	0	0	111.6	D168 V169 V258 E259 R264 A265 R266	D168-T262 PolarHBondContact O-OG1 2.84Å; V169-T262 HydrophobicContact CB-CG2 4.46Å; V169-T262 HydrophobicContact CG2-CG2 4.04Å; V258-T262 WeakPolarHBondContact O-CB 3.49Å; V258-T262 PolarHBondContact O-N 3.12Å; V258-T262 PolarHBondContact O-OG1 2.96Å; V258-T262 VanDerWaalsContact O-OG1 3.08Å; E259-T262 PolarHBondContact O-N 3.07Å; T262-R264 VanDerWaalsContact C-N 3.29Å; T262-R264 PolarHBondContact O-N 2.97Å; T262-A265 WeakPolarHBondContact O-CB 3.43Å; T262-A265 PolarHBondContact O-N 3.28Å; T262-R266 WeakPolarHBondContact O-CG 3.26Å; T262-R266 PolarHBondContact O-N 3.19Å
263	Q	95.9	Very high	91.9	Very high	83 Å²	83	80.1 Å²	80.1	39%	0.388	41%	0.413	S	S	.	.	H	α-helix	trans	-62.2	-41.5	177.7	-176.9	57.2	22.3	0	0	111.1	E259 S260 A265 R266 E267	E259-Q263 WeakPolarHBondContact O-CB 3.28Å; E259-Q263 PolarHBondContact O-N 3.27Å; S260-Q263 PolarHBondContact O-N 3.21Å; Q263-A265 PolarHBondContact O-N 3.09Å; Q263-R266 WeakPolarHBondContact O-CB 3.33Å; Q263-R266 PolarHBondContact O-N 3.42Å; Q263-E267 WeakPolarHBondContact O-CG 3.45Å; Q263-E267 PolarHBondContact O-N 3.13Å
264	R	94.3	Very high	91.6	Very high	123 Å²	123	80.3 Å²	80.3	46%	0.464	41%	0.407	S	S	.	.	H	α-helix	trans	-63.6	-39.7	174.8	-177.2	54.5	179.5	175.2	-2	112.7	S260 A261 T262 R266 E267 L268	S260-R264 WeakPolarHBondContact O-CB 3.27Å; S260-R264 PolarHBondContact O-N 3.22Å; A261-R264 PolarHBondContact O-N 2.67Å; T262-R264 VanDerWaalsContact C-N 3.29Å; T262-R264 PolarHBondContact O-N 2.97Å; R264-R266 VanDerWaalsContact C-N 3.32Å; R264-R266 PolarHBondContact O-N 2.8Å; R264-E267 WeakPolarHBondContact CD-OE2 3.46Å; R264-E267 IonicContact CZ-OE2 3.76Å; R264-E267 IonicContact NH1-OE2 2.83Å; R264-E267 PolarHBondContact NH1-OE2 3.32Å; R264-E267 PolarHBondContact O-N 2.93Å; R264-L268 WeakPolarHBondContact O-CG 3.42Å; R264-L268 PolarHBondContact O-N 2.81Å; R264-L268 VanDerWaalsContact O-N 3.14Å
265	A	91.2	Very high	91.2	Very high	7 Å²	7	80.2 Å²	80.2	6%	0.058	40%	0.401	C	S	.	.	H	α-helix	trans	-59.5	-43.6	175.5	0	0	0	0	0	111.6	D168 T171 A261 T262 Q263 E267 L268 G269	D168-A265 HydrophobicContact CB-CB 4.13Å; T171-A265 HydrophobicContact CG2-CB 3.78Å; A261-A265 PolarHBondContact O-N 2.88Å; T262-A265 WeakPolarHBondContact O-CB 3.43Å; T262-A265 PolarHBondContact O-N 3.28Å; Q263-A265 PolarHBondContact O-N 3.09Å; A265-E267 PolarHBondContact O-N 3.11Å; A265-L268 PolarHBondContact O-N 3.05Å; A265-G269 PolarHBondContact O-N 3.32Å
266	R	91.5	Very high	90.7	Very high	105 Å²	105	76.6 Å²	76.6	40%	0.396	38%	0.384	S	S	.	.	H	α-helix	trans	-61.9	-40.8	175.4	-69.1	169.4	177.9	164.2	-0.5	112.7	D168 T262 Q263 R264 L268 G269 K270	D168-R266 HydrophobicContact CB-CG 3.87Å; D168-R266 WeakPolarHBondContact OD2-CG 3.4Å; T262-R266 WeakPolarHBondContact O-CG 3.26Å; T262-R266 PolarHBondContact O-N 3.19Å; Q263-R266 WeakPolarHBondContact O-CB 3.33Å; Q263-R266 PolarHBondContact O-N 3.42Å; R264-R266 VanDerWaalsContact C-N 3.32Å; R264-R266 PolarHBondContact O-N 2.8Å; R266-L268 VanDerWaalsContact C-N 3.29Å; R266-L268 PolarHBondContact O-N 3.07Å; R266-G269 PolarHBondContact O-N 3.48Å; R266-K270 PolarHBondContact O-N 3.26Å
267	E	91.8	Very high	90.2	Very high	79 Å²	79	77.9 Å²	77.9	37%	0.369	38%	0.383	S	S	.	.	H	α-helix	trans	-62.9	-36.4	177	-71.9	169.8	-171.4	0	0	112.6	Q263 R264 A265 G269 K270	Q263-E267 WeakPolarHBondContact O-CG 3.45Å; Q263-E267 PolarHBondContact O-N 3.13Å; R264-E267 WeakPolarHBondContact CD-OE2 3.46Å; R264-E267 IonicContact CZ-OE2 3.76Å; R264-E267 IonicContact NH1-OE2 2.83Å; R264-E267 PolarHBondContact NH1-OE2 3.32Å; R264-E267 PolarHBondContact O-N 2.93Å; A265-E267 PolarHBondContact O-N 3.11Å; E267-G269 VanDerWaalsContact C-N 3.29Å; E267-G269 PolarHBondContact O-N 3.31Å; E267-K270 PolarHBondContact O-N 3.46Å
268	L	85.2	Confident	89.6	Confident	74 Å²	74	81 Å²	81	39%	0.387	39%	0.39	S	S	.	.	H	α-helix	trans	-66.2	-33.4	177.5	-69.1	172.7	0	0	0	111.9	R264 A265 R266 K270	R264-L268 WeakPolarHBondContact O-CG 3.42Å; R264-L268 PolarHBondContact O-N 2.81Å; R264-L268 VanDerWaalsContact O-N 3.14Å; A265-L268 PolarHBondContact O-N 3.05Å; R266-L268 VanDerWaalsContact C-N 3.29Å; R266-L268 PolarHBondContact O-N 3.07Å; L268-K270 VanDerWaalsContact C-N 3.32Å; L268-K270 PolarHBondContact O-N 3.34Å
269	G	78.2	Confident	88.9	Confident	21 Å²	21	84.8 Å²	84.8	22%	0.216	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-0	178.6	0	0	0	0	0	116.4	G101 A265 R266 E267	G101-G269 WeakPolarHBondContact O-CA 3.41Å; A265-G269 PolarHBondContact O-N 3.32Å; R266-G269 PolarHBondContact O-N 3.48Å; E267-G269 VanDerWaalsContact C-N 3.29Å; E267-G269 PolarHBondContact O-N 3.31Å
270	K	79.7	Confident	88.1	Confident	173 Å²	173	80.8 Å²	80.8	75%	0.752	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	0.7	172.5	-68.1	-179.5	-177.5	-176	0	113.4	R266 E267 L268	R266-K270 PolarHBondContact O-N 3.26Å; E267-K270 PolarHBondContact O-N 3.46Å; L268-K270 VanDerWaalsContact C-N 3.32Å; L268-K270 PolarHBondContact O-N 3.34Å
271	K	58.6	Low	87.2	Confident	201 Å²	201	81.1 Å²	81.1	87%	0.874	37%	0.373	S	S	*	.			trans	-101.2	0	-179.3	-71.7	-172.8	175.1	-170.7	0	110.9

Retrieved 271 of 271 residues in 77 ms (Link to these results)

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