A0A087YQI8_POEFO Loading...

ADP-ribosylation factor-like protein 4A

Small GTP-binding protein which cycles between an inactive GDP-bound and an active GTP-bound form, and the rate of cycling is regulated by guanine nucleotide exchange factors (GEF) and GTPase-activating proteins (GAP). GTP-binding protein that does not act as an allosteric activator of the cholera toxin catalytic subunit. Recruits CYTH1, CYTH2, CYTH3 and CYTH4 to the plasma membrane in GDP-bound form.

AlphaFold DB , UniProt , Accession A0A087YQI8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 200 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.1	Very low	43.5	Very low	251 Å²	251	153.3 Å²	153.3	100%	1.236	85%	0.851	S	S	*	*				0	119.1	0	-74.6	175.5	172.9	0	0	107.8
2	G	41.8	Very low	43.7	Very low	78 Å²	78	148.1 Å²	148.1	80%	0.804	83%	0.833	S	S	*	*			trans	69.3	80.7	161.6	0	0	0	0	0	119.3	G4	G2-G4 PolarHBondContact O-N 3.09Å
3	N	39.7	Very low	43.6	Very low	163 Å²	163	143.9 Å²	143.9	87%	0.872	82%	0.82	S	S	*	*			trans	-73.1	111.7	156.6	-82.2	-2.4	0	0	0	108.6	L5	N3-L5 PolarHBondContact O-N 3.35Å; N3-L5 VanDerWaalsContact O-N 3.09Å
4	G	48.2	Very low	43.5	Very low	82 Å²	82	144.6 Å²	144.6	85%	0.845	82%	0.82	S	S	*	*			trans	-71.7	93.7	170	0	0	0	0	0	110.7	G2	G2-G4 PolarHBondContact O-N 3.09Å
5	L	46.1	Very low	43.2	Very low	159 Å²	159	143.3 Å²	143.3	83%	0.832	81%	0.806	S	S	*	*			trans	-89.6	107.7	159.7	-75.6	164.5	0	0	0	106.9	N3 E7	N3-L5 PolarHBondContact O-N 3.35Å; N3-L5 VanDerWaalsContact O-N 3.09Å; L5-E7 PolarHBondContact O-N 3.21Å
6	S	49.2	Very low	43.4	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	80%	0.796	S	S	*	*			trans	-60.4	115.2	167	41.2	0	0	0	0	109	Q8	S6-Q8 PolarHBondContact O-N 3.11Å
7	E	43.2	Very low	43.8	Very low	190 Å²	190	142.1 Å²	142.1	89%	0.888	79%	0.794	S	S	*	*			trans	-63.8	107.1	168.4	-72.3	-169.1	150.7	0	0	108.6	L5	L5-E7 PolarHBondContact O-N 3.21Å
8	Q	48.1	Very low	44.6	Very low	164 Å²	164	144 Å²	144	77%	0.766	79%	0.793	S	S	*	*			trans	-59.5	127.2	165.1	-72.3	-81.5	-20.3	0	0	107.9	S6 K10	S6-Q8 PolarHBondContact O-N 3.11Å; Q8-K10 PolarHBondContact O-N 3.04Å; Q8-K10 VanDerWaalsContact O-N 3.11Å
9	P	39.9	Very low	46.3	Very low	109 Å²	109	139.3 Å²	139.3	71%	0.708	77%	0.765	S	S	*	*			trans	-63.2	122.5	176.2	23.8	-27.7	0	0	0	107.8	F11	P9-F11 VanDerWaalsContact C-N 3.28Å; P9-F11 PolarHBondContact O-N 2.8Å
10	K	40.5	Very low	48.5	Very low	205 Å²	205	135.2 Å²	135.2	89%	0.891	75%	0.746	S	S	*	*			trans	-58.6	98.8	166.8	-72.9	178.4	-179	171.1	0	106.5	Q8 S12	Q8-K10 PolarHBondContact O-N 3.04Å; Q8-K10 VanDerWaalsContact O-N 3.11Å; K10-S12 PolarHBondContact O-N 2.76Å
11	F	42.2	Very low	50.7	Low	181 Å²	181	128.8 Å²	128.8	79%	0.794	71%	0.711	S	S	*	*			trans	-64	90.4	171.8	-154.7	-92.2	0	0	0	106.4	P9 S13	P9-F11 VanDerWaalsContact C-N 3.28Å; P9-F11 PolarHBondContact O-N 2.8Å; F11-S13 VanDerWaalsContact C-N 3.33Å; F11-S13 PolarHBondContact O-N 2.73Å
12	S	45.9	Very low	53.5	Low	91 Å²	91	119.2 Å²	119.2	64%	0.636	66%	0.663	S	S	*	*			trans	-59.3	105.4	167.1	55.5	0	0	0	0	105.2	K10 N14	K10-S12 PolarHBondContact O-N 2.76Å; S12-N14 PolarHBondContact O-N 2.91Å
13	S	42.2	Very low	56.2	Low	94 Å²	94	115.5 Å²	115.5	66%	0.657	63%	0.625	S	S	*	*			trans	-70.8	66.1	177	50.7	0	0	0	0	109.8	F11 M15	F11-S13 VanDerWaalsContact C-N 3.33Å; F11-S13 PolarHBondContact O-N 2.73Å; S13-M15 PolarHBondContact O-N 3.03Å
14	N	41.5	Very low	59	Low	153 Å²	153	107.7 Å²	107.7	82%	0.818	58%	0.583	S	S	*	*			trans	-74.9	41	156.1	-80.9	-18.4	0	0	0	109.7	S12 S16	S12-N14 PolarHBondContact O-N 2.91Å; N14-S16 VanDerWaalsContact C-N 3.34Å; N14-S16 PolarHBondContact O-N 2.99Å
15	M	39.2	Very low	61.4	Low	126 Å²	126	103.8 Å²	103.8	62%	0.621	54%	0.543	S	S	*	.			trans	-66.9	104.1	158.2	-114	166.7	66.4	0	0	104.8	S13 F17	S13-M15 PolarHBondContact O-N 3.03Å; M15-F17 PolarHBondContact O-N 2.75Å
16	S	47	Very low	63.9	Low	91 Å²	91	96.2 Å²	96.2	64%	0.636	50%	0.503	S	S	*	.			trans	-57.9	93.6	161.5	58.1	0	0	0	0	106.3	N14 F18	N14-S16 VanDerWaalsContact C-N 3.34Å; N14-S16 PolarHBondContact O-N 2.99Å; S16-F18 PolarHBondContact O-N 2.92Å
17	F	50.2	Low	66.2	Low	175 Å²	175	91.3 Å²	91.3	77%	0.768	47%	0.469	S	S	*	.			trans	-51.7	112.5	164.2	-85.1	-92.5	0	0	0	105.3	M15 Q19	M15-F17 PolarHBondContact O-N 2.75Å; F17-Q19 VanDerWaalsContact C-N 3.29Å; F17-Q19 PolarHBondContact O-N 3.49Å
18	F	58.1	Low	68.9	Low	176 Å²	176	82.7 Å²	82.7	77%	0.772	43%	0.429	S	S	*	.			trans	-57.4	100.8	172.4	-72.4	-81	0	0	0	106.6	S16 S20	S16-F18 PolarHBondContact O-N 2.92Å; F18-S20 PolarHBondContact O-N 3.36Å
19	Q	77.1	Confident	71.3	Confident	55 Å²	55	77 Å²	77	26%	0.257	40%	0.404	S	S	.	.			trans	-77	98	-174.6	-166.4	169.9	-11.6	0	0	107	F17 F21 T70	F17-Q19 VanDerWaalsContact C-N 3.29Å; F17-Q19 PolarHBondContact O-N 3.49Å; Q19-F21 HydrophobicContact CB-CE2 4.31Å; Q19-F21 HydrophobicContact CB-CZ 4.49Å; Q19-F21 HydrophobicContact CG-CD2 4.49Å; Q19-F21 HydrophobicContact CG-CE1 4.01Å; Q19-F21 HydrophobicContact CG-CE2 3.75Å; Q19-F21 HydrophobicContact CG-CZ 3.51Å; Q19-T70 PolarHBondContact O-N 3.32Å
20	S	89.9	Confident	74	Confident	57 Å²	57	75.6 Å²	75.6	40%	0.399	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	137.9	171.6	-163.7	0	0	0	0	109.8	F18 T70 R190	F18-S20 PolarHBondContact O-N 3.36Å; S20-T70 CarbonylContact C-O 3.5Å; S20-T70 WeakPolarHBondContact CA-O 3.23Å; S20-R190 PolarHBondContact O-NH2 3.42Å
21	F	95.8	Very high	76.8	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.8	175.5	-60.8	-81.4	0	0	0	110.5	Q19 I23 V69 T70 F71 H72 D94 H183 I186 R190	Q19-F21 HydrophobicContact CB-CE2 4.31Å; Q19-F21 HydrophobicContact CB-CZ 4.49Å; Q19-F21 HydrophobicContact CG-CD2 4.49Å; Q19-F21 HydrophobicContact CG-CE1 4.01Å; Q19-F21 HydrophobicContact CG-CE2 3.75Å; Q19-F21 HydrophobicContact CG-CZ 3.51Å; F21-I23 HydrophobicContact CB-CD1 4.21Å; F21-V69 HydrophobicContact CD2-CB 4.41Å; F21-V69 HydrophobicContact CE2-CB 4.05Å; F21-V69 HydrophobicContact CE2-CG1 4.11Å; F21-T70 PolarHBondContact N-O 3.36Å; F21-F71 HydrophobicContact CB-CD1 3.78Å; F21-F71 HydrophobicContact CB-CE1 4.04Å; F21-F71 HydrophobicContact CD2-CD1 4.26Å; F21-F71 AromaticContact CD2-CE1 3.96Å; F21-F71 HydrophobicContact CD2-CE1 3.96Å; F21-F71 HydrophobicContact CD2-CZ 4.36Å; F21-F71 HydrophobicContact CG-CD1 4.4Å; F21-F71 HydrophobicContact CG-CE1 4.23Å; F21-H72 PolarHBondContact O-N 3.12Å; F21-D94 VanDerWaalsContact CA-OD2 3.3Å; F21-D94 WeakPolarHBondContact CA-OD2 3.46Å; F21-D94 HydrophobicContact CB-CB 4.35Å; F21-D94 HydrophobicContact CD1-CB 4.28Å; F21-H183 AromaticContact CE2-CD2 3.49Å; F21-H183 VanDerWaalsContact CE2-CD2 3.49Å; F21-H183 WeakPolarHBondContact CE2-CD2 3.29Å; F21-H183 AromaticContact CE2-NE2 3.56Å; F21-H183 AromaticContact CZ-CD2 3.35Å; F21-H183 WeakPolarHBondContact CZ-CD2 3.44Å; F21-H183 AromaticContact CZ-NE2 3.39Å; F21-H183 WeakPolarHBondContact CZ-NE2 3.33Å; F21-I186 HydrophobicContact CD1-CD1 4.5Å; F21-I186 HydrophobicContact CD1-CG2 3.62Å; F21-I186 HydrophobicContact CE1-CB 4.5Å; F21-I186 HydrophobicContact CE1-CG2 3.53Å; F21-R190 VanDerWaalsContact CE1-CZ 3.49Å; F21-R190 VanDerWaalsContact CE1-NH1 3.27Å
22	H	97.2	Very high	79.5	Confident	50 Å²	50	58 Å²	58	23%	0.231	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115	178.8	-178.3	-157.4	0	0	0	110.1	W74 D94	H22-W74 AromaticContact CD2-CD1 3.23Å; H22-W74 AromaticContact CD2-NE1 3.25Å; H22-W74 PolarHBondContact CD2-NE1 2.93Å; H22-W74 VanDerWaalsContact CD2-NE1 3.25Å; H22-W74 AromaticContact NE2-CD1 2.98Å; H22-W74 AromaticContact NE2-CE2 3.91Å; H22-W74 AromaticContact NE2-CG 3.9Å; H22-W74 AromaticContact NE2-NE1 2.96Å; H22-W74 PolarHBondContact NE2-NE1 3.31Å; H22-D94 PolarHBondContact N-OD2 3.24Å; H22-D94 PolarHBondContact O-N 3.31Å
23	I	98.4	Very high	82	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.2	-174.4	-50	-60.5	0	0	0	110.4	F21 F71 H72 F73 W74 D94 G95 I97 L182 I186	F21-I23 HydrophobicContact CB-CD1 4.21Å; I23-F71 HydrophobicContact CD1-CD1 4.12Å; I23-F71 HydrophobicContact CD1-CE1 4.45Å; I23-F71 HydrophobicContact CG1-CD1 3.67Å; I23-F71 HydrophobicContact CG1-CE1 4.43Å; I23-H72 PolarHBondContact N-O 2.79Å; I23-F73 HydrophobicContact CB-CD1 3.59Å; I23-F73 HydrophobicContact CB-CE1 3.8Å; I23-F73 HydrophobicContact CG1-CD1 4.25Å; I23-F73 HydrophobicContact CG1-CE1 4.02Å; I23-F73 HydrophobicContact CG2-CD1 3.7Å; I23-F73 HydrophobicContact CG2-CE1 3.71Å; I23-F73 CarbonylContact O-C 3.46Å; I23-F73 VanDerWaalsContact O-CA 3.31Å; I23-F73 WeakPolarHBondContact O-CA 3.41Å; I23-W74 PolarHBondContact O-N 2.91Å; I23-D94 HydrophobicContact CD1-CB 4.41Å; I23-G95 WeakPolarHBondContact CA-O 3.31Å; I23-I97 HydrophobicContact CG2-CD1 4.02Å; I23-I97 HydrophobicContact CG2-CG1 3.8Å; I23-L182 HydrophobicContact CD1-CD2 4.17Å; I23-L182 HydrophobicContact CG2-CD2 4.24Å; I23-I186 HydrophobicContact CD1-CD1 3.69Å
24	A	98.6	Very high	84.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	134.2	168.3	0	0	0	0	0	110.3	L26 T90 T93 G95 I96 I97	A24-L26 HydrophobicContact CB-CG 4.37Å; A24-T90 HydrophobicContact CB-CG2 4.09Å; A24-T93 HydrophobicContact CB-CG2 4.05Å; A24-G95 PolarHBondContact N-O 3.14Å; A24-I96 WeakPolarHBondContact O-CA 3.49Å; A24-I97 PolarHBondContact O-N 2.95Å
25	I	98.8	Very high	87.3	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	114	171.9	-49.9	177.7	0	0	0	108.1	K33 L37 F73 W74 D75 V76 I97 V99	I25-K33 HydrophobicContact CG2-CB 3.81Å; I25-K33 HydrophobicContact CG2-CD 4.4Å; I25-K33 HydrophobicContact CG2-CG 4.03Å; I25-L37 HydrophobicContact CD1-CB 3.93Å; I25-L37 HydrophobicContact CD1-CD1 4.06Å; I25-L37 HydrophobicContact CD1-CG 4.43Å; I25-F73 HydrophobicContact CD1-CB 4.04Å; I25-F73 HydrophobicContact CD1-CD1 3.72Å; I25-F73 HydrophobicContact CD1-CE1 4.46Å; I25-F73 HydrophobicContact CD1-CG 4.06Å; I25-F73 HydrophobicContact CG1-CB 4.46Å; I25-F73 HydrophobicContact CG1-CD1 3.86Å; I25-W74 PolarHBondContact N-O 2.96Å; I25-D75 HydrophobicContact CB-CB 4.5Å; I25-V76 PolarHBondContact O-N 2.92Å; I25-I97 CarbonylContact C-O 3.57Å; I25-I97 WeakPolarHBondContact CA-O 3.38Å; I25-I97 HydrophobicContact CG1-CB 4.28Å; I25-I97 HydrophobicContact CG1-CD1 4.44Å; I25-I97 HydrophobicContact CG2-CB 4.38Å; I25-I97 HydrophobicContact CG2-CG2 4.26Å; I25-V99 HydrophobicContact CG2-CG2 3.85Å
26	L	98.8	Very high	90.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	175.1	-175.1	-56.9	-176.9	0	0	0	110.9	A24 K33 V76 W86 T90 I96 I97 F98 V99 I118	A24-L26 HydrophobicContact CB-CG 4.37Å; L26-K33 WeakPolarHBondContact O-CD 3.48Å; L26-V76 HydrophobicContact CD2-CB 3.83Å; L26-V76 HydrophobicContact CD2-CG2 3.87Å; L26-W86 HydrophobicContact CB-CD2 4.4Å; L26-W86 HydrophobicContact CB-CE3 4.39Å; L26-W86 HydrophobicContact CB-CZ3 4.46Å; L26-W86 HydrophobicContact CD1-CB 4.13Å; L26-W86 HydrophobicContact CD1-CD2 4.23Å; L26-W86 HydrophobicContact CD1-CE3 4.15Å; L26-W86 HydrophobicContact CD1-CG 4.27Å; L26-W86 HydrophobicContact CD2-CB 4.06Å; L26-W86 HydrophobicContact CD2-CD2 3.95Å; L26-W86 HydrophobicContact CD2-CG 3.67Å; L26-W86 HydrophobicContact CG-CD2 4.44Å; L26-T90 HydrophobicContact CD1-CG2 3.54Å; L26-I96 HydrophobicContact CD1-CG2 4.29Å; L26-I97 PolarHBondContact N-O 3.02Å; L26-F98 HydrophobicContact CB-CD2 4.09Å; L26-F98 WeakPolarHBondContact O-CA 3.34Å; L26-V99 PolarHBondContact O-N 3.29Å; L26-I118 HydrophobicContact CD1-CG1 4.33Å; L26-I118 HydrophobicContact CD1-CG2 3.97Å
27	G	98.7	Very high	92.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.			trans	128.7	162.9	-174	0	0	0	0	0	111.6	K33 G78 W86 V99	G27-K33 WeakPolarHBondContact O-CD 3.32Å; G27-K33 WeakPolarHBondContact O-CE 3.5Å; G27-K33 PolarHBondContact O-NZ 2.93Å; G27-G78 WeakPolarHBondContact O-CA 3.39Å; G27-W86 VanDerWaalsContact O-CZ2 3.28Å; G27-W86 WeakPolarHBondContact O-CZ2 3.2Å; G27-V99 WeakPolarHBondContact CA-O 3.32Å
28	L	98.7	Very high	94.8	Very high	10 Å²	10	28 Å²	28	5%	0.052	15%	0.15	C	C	.	.			trans	-59.1	159.1	-176.9	-50	-174.2	0	0	0	111.5	A31 K33 R107 E110 A111	L28-A31 WeakPolarHBondContact O-CB 3.36Å; L28-A31 PolarHBondContact O-N 3.28Å; L28-K33 PolarHBondContact O-NZ 3.46Å; L28-R107 HydrophobicContact CD1-CB 3.83Å; L28-E110 HydrophobicContact CD1-CB 4.12Å; L28-E110 HydrophobicContact CD1-CG 4.05Å; L28-E110 HydrophobicContact CD2-CG 4.07Å; L28-A111 HydrophobicContact CD1-CB 3.89Å; L28-A111 HydrophobicContact CG-CB 4.1Å
29	D	98.1	Very high	96.6	Very high	44 Å²	44	20.9 Å²	20.9	24%	0.235	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	151.4	169.5	56.2	-80.3	0	0	0	111.1	A31 G78 Q79 R83 R107	D29-A31 PolarHBondContact O-N 3.42Å; D29-G78 PolarHBondContact N-O 3.48Å; D29-Q79 HydrophobicContact CB-CG 3.91Å; D29-R83 IonicContact OD1-NH2 2.76Å; D29-R107 PolarHBondContact O-NH1 3.15Å; D29-R107 PolarHBondContact O-NH2 2.85Å; D29-R107 IonicContact OD1-NH1 3.14Å; D29-R107 IonicContact OD2-NH1 3.84Å; D29-R107 PolarHBondContact OD2-NH1 3.17Å; D29-R107 VanDerWaalsContact OD2-NH1 3.16Å
30	S	97.9	Very high	97.5	Very high	80 Å²	80	19.6 Å²	19.6	56%	0.559	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.9	-2.1	-178.4	-48.5	0	0	0	0	116.3	G32 K135	S30-G32 PolarHBondContact O-N 2.99Å; S30-K135 VanDerWaalsContact O-CE 3.23Å; S30-K135 WeakPolarHBondContact O-CE 3.23Å; S30-K135 PolarHBondContact O-NZ 3.27Å
31	A	98.4	Very high	97.7	Very high	2 Å²	2	19.7 Å²	19.7	2%	0.017	11%	0.106	C	C	.	.	S	Bend	trans	-65.2	-17	173.9	0	0	0	0	0	114.4	L28 D29 V99 N134	L28-A31 WeakPolarHBondContact O-CB 3.36Å; L28-A31 PolarHBondContact O-N 3.28Å; D29-A31 PolarHBondContact O-N 3.42Å; A31-V99 HydrophobicContact CB-CB 4.34Å; A31-V99 HydrophobicContact CB-CG1 4.12Å; A31-V99 WeakPolarHBondContact CB-O 3.4Å; A31-V99 VanDerWaalsContact O-CG1 3.3Å; A31-V99 WeakPolarHBondContact O-CG1 3.41Å; A31-N134 PolarHBondContact O-ND2 3.12Å
32	G	98.3	Very high	97.6	Very high	13 Å²	13	24.5 Å²	24.5	13%	0.134	13%	0.127	C	C	.	.			trans	96.8	23.8	177.2	0	0	0	0	0	115.5	S30 T34 T35 V36	S30-G32 PolarHBondContact O-N 2.99Å; G32-T34 PolarHBondContact O-N 3.06Å; G32-T35 WeakPolarHBondContact O-CB 3.35Å; G32-T35 PolarHBondContact O-N 3.16Å; G32-V36 WeakPolarHBondContact O-CG2 3.45Å; G32-V36 PolarHBondContact O-N 3.1Å
33	K	98.6	Very high	97.3	Very high	12 Å²	12	27.1 Å²	27.1	5%	0.052	14%	0.143	C	C	.	.	H	α-helix	trans	-54.1	-52.6	179.1	-61.3	-177.7	-62.3	-67.9	0	114	I25 L26 G27 L28 T35 V36 L37 D75 V76 V99	I25-K33 HydrophobicContact CG2-CB 3.81Å; I25-K33 HydrophobicContact CG2-CD 4.4Å; I25-K33 HydrophobicContact CG2-CG 4.03Å; L26-K33 WeakPolarHBondContact O-CD 3.48Å; G27-K33 WeakPolarHBondContact O-CD 3.32Å; G27-K33 WeakPolarHBondContact O-CE 3.5Å; G27-K33 PolarHBondContact O-NZ 2.93Å; L28-K33 PolarHBondContact O-NZ 3.46Å; K33-T35 VanDerWaalsContact C-N 3.28Å; K33-T35 PolarHBondContact O-N 3.33Å; K33-V36 WeakPolarHBondContact O-CB 3.47Å; K33-V36 PolarHBondContact O-N 3.14Å; K33-L37 PolarHBondContact O-N 3.02Å; K33-D75 WeakPolarHBondContact CB-OD1 3.49Å; K33-V76 WeakPolarHBondContact CE-O 3.21Å; K33-V99 HydrophobicContact CB-CG2 4.46Å; K33-V99 HydrophobicContact CG-CB 3.88Å; K33-V99 HydrophobicContact CG-CG2 3.87Å
34	T	98.1	Very high	96.9	Very high	17 Å²	17	33.5 Å²	33.5	10%	0.104	17%	0.173	C	C	.	.	H	α-helix	trans	-64	-36.5	178.2	-45	0	0	0	0	111.4	G32 L37 Y38 T48 T51 D75	G32-T34 PolarHBondContact O-N 3.06Å; T34-L37 PolarHBondContact O-N 3.48Å; T34-Y38 HydrophobicContact CG2-CD2 4.05Å; T34-Y38 HydrophobicContact CG2-CE1 4.36Å; T34-Y38 HydrophobicContact CG2-CE2 3.81Å; T34-Y38 HydrophobicContact CG2-CG 4.45Å; T34-Y38 WeakPolarHBondContact O-CB 3.44Å; T34-Y38 PolarHBondContact O-N 3.16Å; T34-T48 HydrophobicContact CG2-CG2 3.69Å; T34-T51 PolarHBondContact OG1-OG1 3.32Å; T34-T51 VanDerWaalsContact OG1-OG1 3.07Å; T34-D75 WeakPolarHBondContact CA-OD2 3.32Å; T34-D75 WeakPolarHBondContact CB-OD2 3.27Å; T34-D75 PolarHBondContact OG1-OD2 3.3Å
35	T	98.1	Very high	96.6	Very high	17 Å²	17	38.3 Å²	38.3	10%	0.104	19%	0.194	C	C	.	.	H	α-helix	trans	-63.7	-41.6	174.1	-43.9	0	0	0	0	111.7	G32 K33 R39 F45 A169 I170	G32-T35 WeakPolarHBondContact O-CB 3.35Å; G32-T35 PolarHBondContact O-N 3.16Å; K33-T35 VanDerWaalsContact C-N 3.28Å; K33-T35 PolarHBondContact O-N 3.33Å; T35-R39 WeakPolarHBondContact O-CB 3.44Å; T35-R39 PolarHBondContact O-N 2.99Å; T35-F45 HydrophobicContact CG2-CD2 4.12Å; T35-F45 HydrophobicContact CG2-CE2 4Å; T35-A169 HydrophobicContact CG2-CB 3.86Å; T35-I170 HydrophobicContact CG2-CG2 4.27Å
36	V	98.3	Very high	96.3	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-59.1	-48.2	172.8	166.2	0	0	0	0	110.4	G32 K33 R39 L40 V99 V132 A169 L175	G32-V36 WeakPolarHBondContact O-CG2 3.45Å; G32-V36 PolarHBondContact O-N 3.1Å; K33-V36 WeakPolarHBondContact O-CB 3.47Å; K33-V36 PolarHBondContact O-N 3.14Å; V36-R39 PolarHBondContact O-N 3.41Å; V36-L40 HydrophobicContact CG1-CD1 4.12Å; V36-L40 WeakPolarHBondContact O-CG 3.3Å; V36-L40 PolarHBondContact O-N 3.24Å; V36-V99 HydrophobicContact CG2-CG1 4.38Å; V36-V99 HydrophobicContact CG2-CG2 4.37Å; V36-V132 HydrophobicContact CG2-CG1 4.47Å; V36-A169 HydrophobicContact CG2-CB 3.75Å; V36-L175 HydrophobicContact CB-CD2 4.49Å; V36-L175 HydrophobicContact CG1-CD2 3.97Å; V36-L175 HydrophobicContact CG2-CD2 4.01Å
37	L	97.8	Very high	95.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-50.1	-180	-179.7	55	0	0	0	112.1	I25 K33 T34 R39 L40 Q41 E57 V59 F73 D75	I25-L37 HydrophobicContact CD1-CB 3.93Å; I25-L37 HydrophobicContact CD1-CD1 4.06Å; I25-L37 HydrophobicContact CD1-CG 4.43Å; K33-L37 PolarHBondContact O-N 3.02Å; T34-L37 PolarHBondContact O-N 3.48Å; L37-R39 VanDerWaalsContact C-N 3.33Å; L37-R39 PolarHBondContact O-N 3.49Å; L37-L40 PolarHBondContact O-N 2.95Å; L37-Q41 WeakPolarHBondContact O-CB 3.39Å; L37-Q41 PolarHBondContact O-N 2.85Å; L37-E57 HydrophobicContact CD1-CB 4.04Å; L37-E57 HydrophobicContact CD2-CB 4.17Å; L37-E57 HydrophobicContact CD2-CG 3.95Å; L37-E57 HydrophobicContact CG-CB 4.32Å; L37-E57 HydrophobicContact CG-CG 4.27Å; L37-V59 HydrophobicContact CD1-CG2 4.32Å; L37-F73 HydrophobicContact CD1-CB 3.5Å; L37-F73 VanDerWaalsContact CD1-CB 3.5Å; L37-F73 HydrophobicContact CD1-CD2 3.66Å; L37-F73 HydrophobicContact CD1-CG 3.71Å; L37-F73 HydrophobicContact CD2-CB 4.49Å; L37-D75 HydrophobicContact CD2-CB 3.71Å
38	Y	97.1	Very high	95.6	Very high	54 Å²	54	50.2 Å²	50.2	21%	0.212	26%	0.262	C	S	.	.	H	α-helix	trans	-67.2	-35	-179.2	-73.6	-5.9	0	0	0	112.4	T34 L40 Q41 F42 V46 T48 N55	T34-Y38 HydrophobicContact CG2-CD2 4.05Å; T34-Y38 HydrophobicContact CG2-CE1 4.36Å; T34-Y38 HydrophobicContact CG2-CE2 3.81Å; T34-Y38 HydrophobicContact CG2-CG 4.45Å; T34-Y38 WeakPolarHBondContact O-CB 3.44Å; T34-Y38 PolarHBondContact O-N 3.16Å; Y38-L40 VanDerWaalsContact C-N 3.34Å; Y38-L40 PolarHBondContact O-N 3.47Å; Y38-Q41 PolarHBondContact O-N 3.49Å; Y38-F42 HydrophobicContact CD1-CD2 4.31Å; Y38-F42 AromaticContact CD1-CE2 3.66Å; Y38-F42 HydrophobicContact CD1-CE2 3.66Å; Y38-F42 HydrophobicContact CE1-CE2 4.13Å; Y38-F42 HydrophobicContact CG-CD2 4.19Å; Y38-F42 AromaticContact CG-CE2 3.9Å; Y38-F42 HydrophobicContact CG-CE2 3.9Å; Y38-F42 WeakPolarHBondContact O-CD2 3.46Å; Y38-F42 PolarHBondContact O-N 3.37Å; Y38-V46 HydrophobicContact CD2-CB 3.85Å; Y38-V46 HydrophobicContact CD2-CG1 3.84Å; Y38-V46 HydrophobicContact CD2-CG2 4.48Å; Y38-V46 HydrophobicContact CE2-CG1 4.17Å; Y38-T48 HydrophobicContact CD2-CG2 3.88Å; Y38-T48 HydrophobicContact CE2-CG2 4.1Å; Y38-N55 WeakPolarHBondContact CE1-ND2 3.41Å
39	R	96.9	Very high	95.3	Very high	25 Å²	25	55.4 Å²	55.4	9%	0.094	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-43.4	171.8	179.1	56.1	61.4	176.2	1.7	111.8	T35 V36 L37 Q41 N43 E44 A169 I170 G172 L175	T35-R39 WeakPolarHBondContact O-CB 3.44Å; T35-R39 PolarHBondContact O-N 2.99Å; V36-R39 PolarHBondContact O-N 3.41Å; L37-R39 VanDerWaalsContact C-N 3.33Å; L37-R39 PolarHBondContact O-N 3.49Å; R39-Q41 VanDerWaalsContact C-N 3.33Å; R39-N43 PolarHBondContact NH1-O 3.47Å; R39-N43 VanDerWaalsContact O-CA 3.23Å; R39-N43 WeakPolarHBondContact O-CA 3.24Å; R39-N43 PolarHBondContact O-N 2.65Å; R39-E44 VanDerWaalsContact NH1-C 3.27Å; R39-E44 VanDerWaalsContact NH2-C 3.32Å; R39-A169 WeakPolarHBondContact CB-O 3.4Å; R39-A169 WeakPolarHBondContact CG-O 3.4Å; R39-A169 PolarHBondContact NE-O 3.47Å; R39-I170 PolarHBondContact NH2-O 2.84Å; R39-G172 VanDerWaalsContact CG-CA 3.49Å; R39-L175 HydrophobicContact CB-CD1 3.75Å; R39-L175 HydrophobicContact CG-CD1 3.38Å
40	L	94.8	Very high	95.1	Very high	29 Å²	29	57.6 Å²	57.6	15%	0.152	31%	0.31	C	S	.	.	H	α-helix	trans	-65.3	-37.1	176.6	-73.4	170.3	0	0	0	112.3	V36 L37 Y38 V59 F73 L175 L179	V36-L40 HydrophobicContact CG1-CD1 4.12Å; V36-L40 WeakPolarHBondContact O-CG 3.3Å; V36-L40 PolarHBondContact O-N 3.24Å; L37-L40 PolarHBondContact O-N 2.95Å; Y38-L40 VanDerWaalsContact C-N 3.34Å; Y38-L40 PolarHBondContact O-N 3.47Å; L40-V59 HydrophobicContact CB-CG1 4.42Å; L40-V59 WeakPolarHBondContact O-CG1 2.94Å; L40-F73 HydrophobicContact CD1-CE2 4.29Å; L40-F73 HydrophobicContact CD1-CZ 3.99Å; L40-L175 HydrophobicContact CD2-CB 4Å; L40-L175 HydrophobicContact CG-CD1 4.37Å; L40-L179 HydrophobicContact CD2-CD2 4.26Å
41	Q	94.2	Very high	94.8	Very high	59 Å²	59	55.2 Å²	55.2	28%	0.276	29%	0.292	S	S	.	.	H	α-helix	trans	-78.9	-48.6	-176	-178.8	66.6	-24.3	0	0	113.2	L37 Y38 R39 E57 K58 V59	L37-Q41 WeakPolarHBondContact O-CB 3.39Å; L37-Q41 PolarHBondContact O-N 2.85Å; Y38-Q41 PolarHBondContact O-N 3.49Å; R39-Q41 VanDerWaalsContact C-N 3.33Å; Q41-E57 PolarHBondContact NE2-OE2 3.16Å; Q41-K58 PolarHBondContact NE2-O 3.32Å; Q41-K58 PolarHBondContact OE1-O 3.23Å; Q41-V59 HydrophobicContact CB-CG2 4.09Å; Q41-V59 VanDerWaalsContact OE1-CG2 3.29Å
42	F	93.2	Very high	94.2	Very high	100 Å²	100	64.6 Å²	64.6	44%	0.439	33%	0.333	S	S	.	.	H	α-helix	trans	-104.3	-11.6	-169.8	-53.3	-59.8	0	0	0	113.3	Y38 E44 V46	Y38-F42 HydrophobicContact CD1-CD2 4.31Å; Y38-F42 AromaticContact CD1-CE2 3.66Å; Y38-F42 HydrophobicContact CD1-CE2 3.66Å; Y38-F42 HydrophobicContact CE1-CE2 4.13Å; Y38-F42 HydrophobicContact CG-CD2 4.19Å; Y38-F42 AromaticContact CG-CE2 3.9Å; Y38-F42 HydrophobicContact CG-CE2 3.9Å; Y38-F42 WeakPolarHBondContact O-CD2 3.46Å; Y38-F42 PolarHBondContact O-N 3.37Å; F42-E44 PolarHBondContact O-N 3.37Å; F42-E44 VanDerWaalsContact O-N 3.14Å; F42-V46 HydrophobicContact CD2-CG2 4.16Å
43	N	92.6	Very high	93.9	Very high	105 Å²	105	64.9 Å²	64.9	56%	0.561	34%	0.336	S	S	*	.	S	Bend	trans	57.8	18.4	-171.6	-161.4	55.9	0	0	0	113.8	R39	R39-N43 PolarHBondContact NH1-O 3.47Å; R39-N43 VanDerWaalsContact O-CA 3.23Å; R39-N43 WeakPolarHBondContact O-CA 3.24Å; R39-N43 PolarHBondContact O-N 2.65Å
44	E	89.9	Confident	93.7	Very high	134 Å²	134	69.3 Å²	69.3	63%	0.626	36%	0.355	S	S	*	.	S	Bend	trans	-131.6	161.5	-177.1	-71.8	-175.8	176.7	0	0	111.7	R39 F42	R39-E44 VanDerWaalsContact NH1-C 3.27Å; R39-E44 VanDerWaalsContact NH2-C 3.32Å; F42-E44 PolarHBondContact O-N 3.37Å; F42-E44 VanDerWaalsContact O-N 3.14Å
45	F	91.2	Very high	93.5	Very high	102 Å²	102	70.1 Å²	70.1	45%	0.447	36%	0.359	S	S	.	.			trans	-83.5	126.2	174.7	177.8	-117.3	0	0	0	108.5	T35 N47 I170	T35-F45 HydrophobicContact CG2-CD2 4.12Å; T35-F45 HydrophobicContact CG2-CE2 4Å; F45-N47 WeakPolarHBondContact CE1-OD1 3.45Å; F45-N47 WeakPolarHBondContact CZ-OD1 3.48Å; F45-I170 HydrophobicContact CD2-CB 4.09Å; F45-I170 HydrophobicContact CD2-CG2 3.88Å; F45-I170 HydrophobicContact CE2-CB 4.35Å; F45-I170 HydrophobicContact CE2-CG2 3.67Å
46	V	92.4	Very high	93.4	Very high	50 Å²	50	71 Å²	71	30%	0.303	37%	0.365	S	S	.	.			trans	-120.8	127.3	175.6	-179.4	0	0	0	0	107.7	Y38 F42 T48	Y38-V46 HydrophobicContact CD2-CB 3.85Å; Y38-V46 HydrophobicContact CD2-CG1 3.84Å; Y38-V46 HydrophobicContact CD2-CG2 4.48Å; Y38-V46 HydrophobicContact CE2-CG1 4.17Å; F42-V46 HydrophobicContact CD2-CG2 4.16Å; V46-T48 PolarHBondContact O-N 3.06Å
47	N	90.8	Very high	93.4	Very high	142 Å²	142	73.2 Å²	73.2	76%	0.759	38%	0.376	S	S	*	.			trans	-63.6	131.6	172.8	-75.7	-50.1	0	0	0	109.8	F45	F45-N47 WeakPolarHBondContact CE1-OD1 3.45Å; F45-N47 WeakPolarHBondContact CZ-OD1 3.48Å
48	T	93.1	Very high	93.3	Very high	58 Å²	58	79.7 Å²	79.7	36%	0.356	40%	0.404	S	S	.	.			trans	-120.8	147	-176	57.9	0	0	0	0	111.5	T34 Y38 V46	T34-T48 HydrophobicContact CG2-CG2 3.69Å; Y38-T48 HydrophobicContact CD2-CG2 3.88Å; Y38-T48 HydrophobicContact CE2-CG2 4.1Å; V46-T48 PolarHBondContact O-N 3.06Å
49	V	92.3	Very high	93.2	Very high	119 Å²	119	77.3 Å²	77.3	72%	0.721	40%	0.395	S	S	*	.			trans	-102.1	160.7	167.6	-63.2	0	0	0	0	110	T51	V49-T51 PolarHBondContact O-N 3.38Å
50	P	92.9	Very high	93	Very high	89 Å²	89	83.6 Å²	83.6	58%	0.578	42%	0.423	S	S	*	.			trans	-54.9	125.6	176.6	-26.9	35.2	0	0	0	112.7	K52	P50-K52 PolarHBondContact O-N 2.92Å
51	T	90.9	Very high	92.7	Very high	30 Å²	30	83 Å²	83	18%	0.184	42%	0.421	C	S	.	.			trans	-66	115.3	179.9	-47	0	0	0	0	110.7	T34 V49 G53 L82	T34-T51 PolarHBondContact OG1-OG1 3.32Å; T34-T51 VanDerWaalsContact OG1-OG1 3.07Å; V49-T51 PolarHBondContact O-N 3.38Å; T51-G53 PolarHBondContact O-N 3.47Å; T51-L82 VanDerWaalsContact O-CD1 3.23Å; T51-L82 WeakPolarHBondContact O-CD1 3.08Å
52	K	87.7	Confident	92.3	Very high	200 Å²	200	84.5 Å²	84.5	87%	0.87	44%	0.437	S	S	*	.	S	Bend	trans	-80.2	6.8	-179.3	-67.6	-175.8	178.9	177.8	0	114.5	P50	P50-K52 PolarHBondContact O-N 2.92Å
53	G	91.4	Very high	91.6	Very high	19 Å²	19	80.2 Å²	80.2	20%	0.196	42%	0.419	C	S	.	.	S	Bend	trans	-174.5	-100.2	-176.4	0	0	0	0	0	110.1	T51 G77	T51-G53 PolarHBondContact O-N 3.47Å; G53-G77 PolarHBondContact O-N 2.87Å
54	F	94.8	Very high	90.5	Very high	105 Å²	105	78.6 Å²	78.6	46%	0.461	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	162.7	176.4	68.7	-81.7	0	0	0	111.4	W74 D75 Y89	F54-W74 AromaticContact CD2-CE3 3.73Å; F54-W74 HydrophobicContact CD2-CE3 3.73Å; F54-W74 AromaticContact CD2-CZ3 3.79Å; F54-W74 HydrophobicContact CD2-CZ3 3.79Å; F54-W74 AromaticContact CE2-CE3 3.98Å; F54-W74 HydrophobicContact CE2-CE3 3.98Å; F54-W74 AromaticContact CE2-CZ3 3.52Å; F54-W74 HydrophobicContact CE2-CZ3 3.52Å; F54-W74 HydrophobicContact CZ-CZ3 4.38Å; F54-D75 CarbonylContact C-O 3.52Å; F54-D75 WeakPolarHBondContact CA-O 3.43Å; F54-D75 WeakPolarHBondContact CB-O 3.28Å; F54-Y89 HydrophobicContact CB-CE1 4.19Å; F54-Y89 HydrophobicContact CD1-CE1 4.27Å; F54-Y89 AromaticContact CD1-CZ 3.71Å; F54-Y89 WeakPolarHBondContact CD1-OH 3.33Å; F54-Y89 HydrophobicContact CD2-CE1 4.09Å; F54-Y89 WeakPolarHBondContact CE1-OH 2.89Å; F54-Y89 AromaticContact CG-CE1 3.91Å; F54-Y89 HydrophobicContact CG-CE1 3.91Å; F54-Y89 AromaticContact CG-CZ 3.75Å; F54-Y89 WeakPolarHBondContact CG-OH 3.45Å
55	N	94.2	Very high	89.2	Confident	34 Å²	34	84.1 Å²	84.1	18%	0.182	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	151.6	165.6	-174.7	32.6	0	0	0	109.4	Y38 W74 D75	Y38-N55 WeakPolarHBondContact CE1-ND2 3.41Å; N55-W74 CarbonylContact O-C 3.58Å; N55-W74 WeakPolarHBondContact O-CA 3.36Å; N55-D75 HydrophobicContact CB-CB 4.34Å; N55-D75 PolarHBondContact N-O 3.47Å; N55-D75 PolarHBondContact O-N 2.97Å
56	S	95.7	Very high	87.7	Confident	34 Å²	34	86.8 Å²	86.8	24%	0.238	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	127.8	177	-174.7	0	0	0	0	112.2	H72 F73	S56-H72 PolarHBondContact OG-CD2 2.86Å; S56-H72 PolarHBondContact OG-NE2 2.91Å; S56-F73 VanDerWaalsContact CA-O 3.22Å; S56-F73 WeakPolarHBondContact CA-O 3.49Å; S56-F73 PolarHBondContact OG-O 2.92Å
57	E	96.6	Very high	87	Confident	50 Å²	50	92.2 Å²	92.2	23%	0.234	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	144.4	-175.4	-68.9	-65.3	164.6	0	0	111.5	L37 Q41 H72 F73	L37-E57 HydrophobicContact CD1-CB 4.04Å; L37-E57 HydrophobicContact CD2-CB 4.17Å; L37-E57 HydrophobicContact CD2-CG 3.95Å; L37-E57 HydrophobicContact CG-CB 4.32Å; L37-E57 HydrophobicContact CG-CG 4.27Å; Q41-E57 PolarHBondContact NE2-OE2 3.16Å; E57-H72 WeakPolarHBondContact O-CA 3.24Å; E57-F73 PolarHBondContact N-O 3.3Å; E57-F73 PolarHBondContact O-N 3.46Å
58	K	96.3	Very high	86.8	Confident	136 Å²	136	89.5 Å²	89.5	59%	0.591	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	112.6	171.4	-70.6	179.1	-176.3	171.2	0	109.6	Q41 T70 F71 H72	Q41-K58 PolarHBondContact NE2-O 3.32Å; Q41-K58 PolarHBondContact OE1-O 3.23Å; K58-T70 HydrophobicContact CB-CG2 4.33Å; K58-F71 CarbonylContact C-O 3.5Å; K58-F71 WeakPolarHBondContact CA-O 3.43Å; K58-H72 HydrophobicContact CG-CB 4.35Å
59	V	94.9	Very high	86.7	Confident	3 Å²	3	86.9 Å²	86.9	2%	0.018	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	126	-179.9	-172.7	0	0	0	0	109	L37 L40 Q41 V61 T70 F71 F73	L37-V59 HydrophobicContact CD1-CG2 4.32Å; L40-V59 HydrophobicContact CB-CG1 4.42Å; L40-V59 WeakPolarHBondContact O-CG1 2.94Å; Q41-V59 HydrophobicContact CB-CG2 4.09Å; Q41-V59 VanDerWaalsContact OE1-CG2 3.29Å; V59-V61 HydrophobicContact CG1-CG2 3.71Å; V59-T70 WeakPolarHBondContact O-CA 3.42Å; V59-F71 PolarHBondContact N-O 2.98Å; V59-F71 PolarHBondContact O-N 3.35Å; V59-F73 HydrophobicContact CB-CD2 4.15Å; V59-F73 HydrophobicContact CB-CE2 3.82Å; V59-F73 HydrophobicContact CG2-CD2 3.55Å; V59-F73 HydrophobicContact CG2-CE2 3.61Å
60	K	92.9	Very high	86.8	Confident	157 Å²	157	82.1 Å²	82.1	68%	0.683	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.7	170.8	-70.5	-179.4	-178	175.5	0	108.9	T68 V69	K60-T68 HydrophobicContact CB-CG2 3.97Å; K60-T68 HydrophobicContact CD-CG2 4.48Å; K60-T68 HydrophobicContact CG-CG2 4.41Å; K60-V69 WeakPolarHBondContact CA-O 3.47Å
61	V	88.3	Confident	87	Confident	18 Å²	18	77.9 Å²	77.9	11%	0.109	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.8	180	-171.8	0	0	0	0	109.5	V59 L63 T68 V69 F71 L179	V59-V61 HydrophobicContact CG1-CG2 3.71Å; V61-L63 HydrophobicContact CB-CD2 4.28Å; V61-L63 HydrophobicContact CG1-CD2 3.49Å; V61-L63 VanDerWaalsContact CG1-CD2 3.49Å; V61-L63 HydrophobicContact CG1-CG 4.16Å; V61-T68 WeakPolarHBondContact O-CA 3.22Å; V61-V69 HydrophobicContact CB-CG2 4.5Å; V61-V69 PolarHBondContact N-O 2.98Å; V61-V69 WeakPolarHBondContact O-CG2 3.12Å; V61-V69 PolarHBondContact O-N 3.47Å; V61-F71 HydrophobicContact CB-CD2 4.25Å; V61-F71 HydrophobicContact CB-CE2 4.14Å; V61-F71 HydrophobicContact CG2-CD2 3.96Å; V61-F71 HydrophobicContact CG2-CE2 4.26Å; V61-L179 HydrophobicContact CB-CD2 4.3Å; V61-L179 HydrophobicContact CG1-CD2 4.2Å; V61-L179 HydrophobicContact CG2-CD2 3.75Å
62	S	87.2	Confident	87.3	Confident	89 Å²	89	78.7 Å²	78.7	62%	0.622	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	109.6	173.6	-60.3	0	0	0	0	108.5
63	L	78.3	Confident	87.8	Confident	11 Å²	11	69.2 Å²	69.2	6%	0.058	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	132.8	179.5	-52.8	176.4	0	0	0	109.7	V61 R67 V69 F71 D180 H183	V61-L63 HydrophobicContact CB-CD2 4.28Å; V61-L63 HydrophobicContact CG1-CD2 3.49Å; V61-L63 VanDerWaalsContact CG1-CD2 3.49Å; V61-L63 HydrophobicContact CG1-CG 4.16Å; L63-R67 PolarHBondContact N-O 2.98Å; L63-R67 PolarHBondContact O-N 3.26Å; L63-V69 HydrophobicContact CD1-CG1 4.4Å; L63-V69 HydrophobicContact CD1-CG2 3.35Å; L63-V69 HydrophobicContact CG-CG2 3.77Å; L63-F71 HydrophobicContact CD1-CE2 4.01Å; L63-F71 HydrophobicContact CD1-CZ 3.98Å; L63-D180 WeakPolarHBondContact CD2-OD1 3.27Å; L63-H183 HydrophobicContact CD1-CB 3.77Å; L63-H183 VanDerWaalsContact CD1-CG 3.48Å; L63-H183 WeakPolarHBondContact CD1-ND1 3.33Å
64	G	69.1	Low	88.1	Confident	70 Å²	70	71.1 Å²	71.1	72%	0.722	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	-147.7	178.5	0	0	0	0	0	114.8	N66	G64-N66 VanDerWaalsContact C-N 3.31Å; G64-N66 PolarHBondContact O-N 3.35Å
65	R	63.2	Low	88.2	Confident	251 Å²	251	66.1 Å²	66.1	95%	0.947	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	69.5	-176.1	-61.1	-176.9	-172.1	170.3	1.1	112.5
66	N	58.8	Low	88.4	Confident	158 Å²	158	64.5 Å²	64.5	85%	0.845	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	34.3	173.2	-57.7	-11.9	0	0	0	116.6	G64	G64-N66 VanDerWaalsContact C-N 3.31Å; G64-N66 PolarHBondContact O-N 3.35Å
67	R	77	Confident	88.5	Confident	163 Å²	163	62.9 Å²	62.9	62%	0.615	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	107.2	170.2	-127.3	-178.6	-168.9	-175.7	4.2	110.6	L63 V69	L63-R67 PolarHBondContact N-O 2.98Å; L63-R67 PolarHBondContact O-N 3.26Å; R67-V69 PolarHBondContact O-N 3.19Å
68	T	86.6	Confident	88.5	Confident	85 Å²	85	60.7 Å²	60.7	52%	0.521	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	122.2	168	-50.2	0	0	0	0	109.2	K60 V61	K60-T68 HydrophobicContact CB-CG2 3.97Å; K60-T68 HydrophobicContact CD-CG2 4.48Å; K60-T68 HydrophobicContact CG-CG2 4.41Å; V61-T68 WeakPolarHBondContact O-CA 3.22Å
69	V	91.3	Very high	88.6	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.018	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	155.1	169.7	-59.9	0	0	0	0	109.4	F21 K60 V61 L63 R67 F71	F21-V69 HydrophobicContact CD2-CB 4.41Å; F21-V69 HydrophobicContact CE2-CB 4.05Å; F21-V69 HydrophobicContact CE2-CG1 4.11Å; K60-V69 WeakPolarHBondContact CA-O 3.47Å; V61-V69 HydrophobicContact CB-CG2 4.5Å; V61-V69 PolarHBondContact N-O 2.98Å; V61-V69 WeakPolarHBondContact O-CG2 3.12Å; V61-V69 PolarHBondContact O-N 3.47Å; L63-V69 HydrophobicContact CD1-CG1 4.4Å; L63-V69 HydrophobicContact CD1-CG2 3.35Å; L63-V69 HydrophobicContact CG-CG2 3.77Å; R67-V69 PolarHBondContact O-N 3.19Å; V69-F71 HydrophobicContact CG2-CD2 3.98Å; V69-F71 HydrophobicContact CG2-CE2 3.3Å; V69-F71 HydrophobicContact CG2-CZ 3.88Å
70	T	94.8	Very high	88.7	Confident	20 Å²	20	63.9 Å²	63.9	12%	0.123	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127.2	175.2	-56.4	0	0	0	0	108.8	Q19 S20 F21 K58 V59	Q19-T70 PolarHBondContact O-N 3.32Å; S20-T70 CarbonylContact C-O 3.5Å; S20-T70 WeakPolarHBondContact CA-O 3.23Å; F21-T70 PolarHBondContact N-O 3.36Å; K58-T70 HydrophobicContact CB-CG2 4.33Å; V59-T70 WeakPolarHBondContact O-CA 3.42Å
71	F	96.5	Very high	88.8	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	131.9	167.9	-66	-85.6	0	0	0	108.8	F21 I23 K58 V59 V61 L63 V69 F73 L179 H183	F21-F71 HydrophobicContact CB-CD1 3.78Å; F21-F71 HydrophobicContact CB-CE1 4.04Å; F21-F71 HydrophobicContact CD2-CD1 4.26Å; F21-F71 AromaticContact CD2-CE1 3.96Å; F21-F71 HydrophobicContact CD2-CE1 3.96Å; F21-F71 HydrophobicContact CD2-CZ 4.36Å; F21-F71 HydrophobicContact CG-CD1 4.4Å; F21-F71 HydrophobicContact CG-CE1 4.23Å; I23-F71 HydrophobicContact CD1-CD1 4.12Å; I23-F71 HydrophobicContact CD1-CE1 4.45Å; I23-F71 HydrophobicContact CG1-CD1 3.67Å; I23-F71 HydrophobicContact CG1-CE1 4.43Å; K58-F71 CarbonylContact C-O 3.5Å; K58-F71 WeakPolarHBondContact CA-O 3.43Å; V59-F71 PolarHBondContact N-O 2.98Å; V59-F71 PolarHBondContact O-N 3.35Å; V61-F71 HydrophobicContact CB-CD2 4.25Å; V61-F71 HydrophobicContact CB-CE2 4.14Å; V61-F71 HydrophobicContact CG2-CD2 3.96Å; V61-F71 HydrophobicContact CG2-CE2 4.26Å; L63-F71 HydrophobicContact CD1-CE2 4.01Å; L63-F71 HydrophobicContact CD1-CZ 3.98Å; V69-F71 HydrophobicContact CG2-CD2 3.98Å; V69-F71 HydrophobicContact CG2-CE2 3.3Å; V69-F71 HydrophobicContact CG2-CZ 3.88Å; F71-F73 HydrophobicContact CB-CD2 3.9Å; F71-F73 HydrophobicContact CB-CE1 4.21Å; F71-F73 HydrophobicContact CB-CE2 3.31Å; F71-F73 HydrophobicContact CB-CZ 3.48Å; F71-F73 VanDerWaalsContact CB-CZ 3.48Å; F71-F73 HydrophobicContact CD1-CZ 4.37Å; F71-F73 HydrophobicContact CG-CE2 4.16Å; F71-F73 AromaticContact CG-CZ 3.9Å; F71-F73 HydrophobicContact CG-CZ 3.9Å; F71-L179 HydrophobicContact CD1-CD1 4.09Å; F71-L179 HydrophobicContact CD2-CD1 4.28Å; F71-L179 HydrophobicContact CD2-CD2 3.9Å; F71-L179 HydrophobicContact CD2-CG 4.34Å; F71-L179 HydrophobicContact CE1-CD1 3.78Å; F71-L179 HydrophobicContact CE1-CG 4.38Å; F71-L179 HydrophobicContact CE2-CD1 3.97Å; F71-L179 HydrophobicContact CE2-CD2 3.67Å; F71-L179 HydrophobicContact CE2-CG 3.77Å; F71-L179 HydrophobicContact CG-CD1 4.32Å; F71-L179 HydrophobicContact CZ-CD1 3.7Å; F71-L179 HydrophobicContact CZ-CD2 4.21Å; F71-L179 HydrophobicContact CZ-CG 3.79Å; F71-H183 HydrophobicContact CZ-CB 4.19Å
72	H	97.4	Very high	89.2	Confident	47 Å²	47	64.2 Å²	64.2	22%	0.218	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	102.1	170.7	-174.6	-157.6	0	0	0	107.2	F21 I23 S56 E57 K58 W74	F21-H72 PolarHBondContact O-N 3.12Å; I23-H72 PolarHBondContact N-O 2.79Å; S56-H72 PolarHBondContact OG-CD2 2.86Å; S56-H72 PolarHBondContact OG-NE2 2.91Å; E57-H72 WeakPolarHBondContact O-CA 3.24Å; K58-H72 HydrophobicContact CG-CB 4.35Å; H72-W74 AromaticContact CE1-CE2 3.76Å; H72-W74 AromaticContact CE1-CZ2 3.58Å; H72-W74 AromaticContact CE1-NE1 3.56Å; H72-W74 AromaticContact ND1-NE1 3.63Å; H72-W74 AromaticContact NE2-NE1 3.95Å
73	F	98.2	Very high	89.7	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	138.8	-175.8	-68.2	-75.4	0	0	0	110.9	I23 I25 L37 L40 S56 E57 V59 F71 I97 L179	I23-F73 HydrophobicContact CB-CD1 3.59Å; I23-F73 HydrophobicContact CB-CE1 3.8Å; I23-F73 HydrophobicContact CG1-CD1 4.25Å; I23-F73 HydrophobicContact CG1-CE1 4.02Å; I23-F73 HydrophobicContact CG2-CD1 3.7Å; I23-F73 HydrophobicContact CG2-CE1 3.71Å; I23-F73 CarbonylContact O-C 3.46Å; I23-F73 VanDerWaalsContact O-CA 3.31Å; I23-F73 WeakPolarHBondContact O-CA 3.41Å; I25-F73 HydrophobicContact CD1-CB 4.04Å; I25-F73 HydrophobicContact CD1-CD1 3.72Å; I25-F73 HydrophobicContact CD1-CE1 4.46Å; I25-F73 HydrophobicContact CD1-CG 4.06Å; I25-F73 HydrophobicContact CG1-CB 4.46Å; I25-F73 HydrophobicContact CG1-CD1 3.86Å; L37-F73 HydrophobicContact CD1-CB 3.5Å; L37-F73 VanDerWaalsContact CD1-CB 3.5Å; L37-F73 HydrophobicContact CD1-CD2 3.66Å; L37-F73 HydrophobicContact CD1-CG 3.71Å; L37-F73 HydrophobicContact CD2-CB 4.49Å; L40-F73 HydrophobicContact CD1-CE2 4.29Å; L40-F73 HydrophobicContact CD1-CZ 3.99Å; S56-F73 VanDerWaalsContact CA-O 3.22Å; S56-F73 WeakPolarHBondContact CA-O 3.49Å; S56-F73 PolarHBondContact OG-O 2.92Å; E57-F73 PolarHBondContact N-O 3.3Å; E57-F73 PolarHBondContact O-N 3.46Å; V59-F73 HydrophobicContact CB-CD2 4.15Å; V59-F73 HydrophobicContact CB-CE2 3.82Å; V59-F73 HydrophobicContact CG2-CD2 3.55Å; V59-F73 HydrophobicContact CG2-CE2 3.61Å; F71-F73 HydrophobicContact CB-CD2 3.9Å; F71-F73 HydrophobicContact CB-CE1 4.21Å; F71-F73 HydrophobicContact CB-CE2 3.31Å; F71-F73 HydrophobicContact CB-CZ 3.48Å; F71-F73 VanDerWaalsContact CB-CZ 3.48Å; F71-F73 HydrophobicContact CD1-CZ 4.37Å; F71-F73 HydrophobicContact CG-CE2 4.16Å; F71-F73 AromaticContact CG-CZ 3.9Å; F71-F73 HydrophobicContact CG-CZ 3.9Å; F73-I97 HydrophobicContact CD1-CD1 4.4Å; F73-I97 HydrophobicContact CE1-CD1 3.7Å; F73-L179 HydrophobicContact CE1-CD1 4.4Å; F73-L179 HydrophobicContact CZ-CD1 3.99Å; F73-L179 HydrophobicContact CZ-CD2 4.39Å
74	W	98	Very high	90.5	Very high	59 Å²	59	64.9 Å²	64.9	22%	0.223	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	101.5	168	-63.8	79.1	0	0	0	108.5	H22 I23 I25 F54 N55 H72 Y89	H22-W74 AromaticContact CD2-CD1 3.23Å; H22-W74 AromaticContact CD2-NE1 3.25Å; H22-W74 PolarHBondContact CD2-NE1 2.93Å; H22-W74 VanDerWaalsContact CD2-NE1 3.25Å; H22-W74 AromaticContact NE2-CD1 2.98Å; H22-W74 AromaticContact NE2-CE2 3.91Å; H22-W74 AromaticContact NE2-CG 3.9Å; H22-W74 AromaticContact NE2-NE1 2.96Å; H22-W74 PolarHBondContact NE2-NE1 3.31Å; I23-W74 PolarHBondContact O-N 2.91Å; I25-W74 PolarHBondContact N-O 2.96Å; F54-W74 AromaticContact CD2-CE3 3.73Å; F54-W74 HydrophobicContact CD2-CE3 3.73Å; F54-W74 AromaticContact CD2-CZ3 3.79Å; F54-W74 HydrophobicContact CD2-CZ3 3.79Å; F54-W74 AromaticContact CE2-CE3 3.98Å; F54-W74 HydrophobicContact CE2-CE3 3.98Å; F54-W74 AromaticContact CE2-CZ3 3.52Å; F54-W74 HydrophobicContact CE2-CZ3 3.52Å; F54-W74 HydrophobicContact CZ-CZ3 4.38Å; N55-W74 CarbonylContact O-C 3.58Å; N55-W74 WeakPolarHBondContact O-CA 3.36Å; H72-W74 AromaticContact CE1-CE2 3.76Å; H72-W74 AromaticContact CE1-CZ2 3.58Å; H72-W74 AromaticContact CE1-NE1 3.56Å; H72-W74 AromaticContact ND1-NE1 3.63Å; H72-W74 AromaticContact NE2-NE1 3.95Å; W74-Y89 HydrophobicContact CB-CD1 4.11Å; W74-Y89 HydrophobicContact CD2-CD1 4.1Å; W74-Y89 HydrophobicContact CD2-CE1 4.33Å; W74-Y89 AromaticContact CE3-CD1 3.7Å; W74-Y89 HydrophobicContact CE3-CD1 3.7Å; W74-Y89 AromaticContact CE3-CE1 3.49Å; W74-Y89 HydrophobicContact CE3-CE1 3.49Å; W74-Y89 VanDerWaalsContact CE3-CE1 3.49Å; W74-Y89 HydrophobicContact CG-CD1 4.3Å; W74-Y89 HydrophobicContact CZ3-CD1 4.42Å; W74-Y89 AromaticContact CZ3-CE1 3.87Å; W74-Y89 HydrophobicContact CZ3-CE1 3.87Å
75	D	97.7	Very high	91.8	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	119	172.5	170.8	38.5	0	0	0	109	I25 K33 T34 L37 F54 N55	I25-D75 HydrophobicContact CB-CB 4.5Å; K33-D75 WeakPolarHBondContact CB-OD1 3.49Å; T34-D75 WeakPolarHBondContact CA-OD2 3.32Å; T34-D75 WeakPolarHBondContact CB-OD2 3.27Å; T34-D75 PolarHBondContact OG1-OD2 3.3Å; L37-D75 HydrophobicContact CD2-CB 3.71Å; F54-D75 CarbonylContact C-O 3.52Å; F54-D75 WeakPolarHBondContact CA-O 3.43Å; F54-D75 WeakPolarHBondContact CB-O 3.28Å; N55-D75 HydrophobicContact CB-CB 4.34Å; N55-D75 PolarHBondContact N-O 3.47Å; N55-D75 PolarHBondContact O-N 2.97Å
76	V	97.9	Very high	93.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.4	-175.2	-167.4	0	0	0	0	109.9	I25 L26 K33 G78 L85 Y89	I25-V76 PolarHBondContact O-N 2.92Å; L26-V76 HydrophobicContact CD2-CB 3.83Å; L26-V76 HydrophobicContact CD2-CG2 3.87Å; K33-V76 WeakPolarHBondContact CE-O 3.21Å; V76-G78 PolarHBondContact O-N 2.87Å; V76-L85 HydrophobicContact CG1-CB 4.3Å; V76-Y89 HydrophobicContact CG1-CD2 3.98Å; V76-Y89 HydrophobicContact CG1-CE2 4.32Å; V76-Y89 HydrophobicContact CG2-CD1 4.19Å; V76-Y89 HydrophobicContact CG2-CD2 3.76Å; V76-Y89 HydrophobicContact CG2-CG 3.6Å
77	G	97.4	Very high	95.1	Very high	1 Å²	1	50 Å²	50	1%	0.01	24%	0.239	C	C	.	.			trans	-53.7	135.9	178.4	0	0	0	0	0	112.6	G53 W86	G53-G77 PolarHBondContact O-N 2.87Å; G77-W86 PolarHBondContact O-NE1 2.7Å
78	G	97.3	Very high	96	Very high	4 Å²	4	45.9 Å²	45.9	4%	0.041	24%	0.235	C	C	.	.			trans	-98.3	-5.5	-174	0	0	0	0	0	115.8	G27 D29 V76 R83	G27-G78 WeakPolarHBondContact O-CA 3.39Å; D29-G78 PolarHBondContact N-O 3.48Å; V76-G78 PolarHBondContact O-N 2.87Å; G78-R83 PolarHBondContact O-NE 3.07Å; G78-R83 PolarHBondContact O-NH2 3.09Å
79	Q	97.3	Very high	96.4	Very high	55 Å²	55	44 Å²	44	26%	0.257	22%	0.219	S	C	.	.	S	Bend	trans	-61.4	142.1	176.7	-66.8	-178.9	-5.3	0	0	109.1	D29 K81 L82 R83	D29-Q79 HydrophobicContact CB-CG 3.91Å; Q79-K81 VanDerWaalsContact C-N 3.26Å; Q79-K81 HydrophobicContact CB-CG 4.4Å; Q79-K81 PolarHBondContact O-N 2.85Å; Q79-K81 VanDerWaalsContact O-N 3.12Å; Q79-L82 HydrophobicContact CB-CD1 4.38Å; Q79-L82 HydrophobicContact CB-CG 4.43Å; Q79-L82 WeakPolarHBondContact O-CA 3.4Å; Q79-L82 WeakPolarHBondContact O-CB 3.41Å; Q79-L82 PolarHBondContact O-N 2.88Å; Q79-R83 WeakPolarHBondContact O-CG 3.23Å; Q79-R83 PolarHBondContact O-N 3.07Å
80	E	96.6	Very high	96.7	Very high	150 Å²	150	43.9 Å²	43.9	70%	0.701	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-46.1	-48.1	-175.8	-170	-178.7	179.3	0	0	113.1	L82 R83	E80-L82 PolarHBondContact O-N 2.97Å; E80-L82 VanDerWaalsContact O-N 3.09Å; E80-R83 PolarHBondContact O-N 3.41Å; E80-R83 VanDerWaalsContact O-N 3.13Å
81	K	96.6	Very high	96.5	Very high	161 Å²	161	49.8 Å²	49.8	70%	0.7	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-60.1	-20.9	178	72.1	-175.1	-178.1	-171.1	0	115.3	Q79	Q79-K81 VanDerWaalsContact C-N 3.26Å; Q79-K81 HydrophobicContact CB-CG 4.4Å; Q79-K81 PolarHBondContact O-N 2.85Å; Q79-K81 VanDerWaalsContact O-N 3.12Å
82	L	96.1	Very high	96.3	Very high	21 Å²	21	55.5 Å²	55.5	11%	0.11	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-97.8	-18.5	-179.7	-61.5	179.4	0	0	0	112.8	T51 Q79 E80 P84 L85	T51-L82 VanDerWaalsContact O-CD1 3.23Å; T51-L82 WeakPolarHBondContact O-CD1 3.08Å; Q79-L82 HydrophobicContact CB-CD1 4.38Å; Q79-L82 HydrophobicContact CB-CG 4.43Å; Q79-L82 WeakPolarHBondContact O-CA 3.4Å; Q79-L82 WeakPolarHBondContact O-CB 3.41Å; Q79-L82 PolarHBondContact O-N 2.88Å; E80-L82 PolarHBondContact O-N 2.97Å; E80-L82 VanDerWaalsContact O-N 3.09Å; L82-P84 VanDerWaalsContact C-N 3.3Å; L82-L85 HydrophobicContact CD2-CD1 4.28Å; L82-L85 VanDerWaalsContact O-CB 3.22Å; L82-L85 WeakPolarHBondContact O-CB 3.23Å; L82-L85 WeakPolarHBondContact O-CG 3.41Å; L82-L85 PolarHBondContact O-N 3.08Å
83	R	97.3	Very high	96.3	Very high	17 Å²	17	53.5 Å²	53.5	6%	0.064	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-57.6	-29.8	-178.2	-57.8	-173.8	-166.9	152.7	5.4	115	D29 G78 Q79 E80 L85 W86 E110	D29-R83 IonicContact OD1-NH2 2.76Å; G78-R83 PolarHBondContact O-NE 3.07Å; G78-R83 PolarHBondContact O-NH2 3.09Å; Q79-R83 WeakPolarHBondContact O-CG 3.23Å; Q79-R83 PolarHBondContact O-N 3.07Å; E80-R83 PolarHBondContact O-N 3.41Å; E80-R83 VanDerWaalsContact O-N 3.13Å; R83-L85 PolarHBondContact O-N 3.18Å; R83-L85 VanDerWaalsContact O-N 3.08Å; R83-W86 HydrophobicContact CB-CD2 4.24Å; R83-W86 HydrophobicContact CB-CZ2 4.43Å; R83-W86 HydrophobicContact CG-CD2 4.42Å; R83-W86 HydrophobicContact CG-CH2 4.2Å; R83-W86 HydrophobicContact CG-CZ2 3.74Å; R83-W86 VanDerWaalsContact O-CB 3.28Å; R83-W86 WeakPolarHBondContact O-CB 3.39Å; R83-W86 VanDerWaalsContact O-CG 3.26Å; R83-W86 PolarHBondContact O-N 3.44Å; R83-E110 IonicContact CZ-OE1 3.79Å; R83-E110 IonicContact NH1-OE1 2.96Å; R83-E110 PolarHBondContact NH1-OE1 3.12Å; R83-E110 IonicContact NH2-OE1 2.94Å; R83-E110 PolarHBondContact NH2-OE1 2.96Å
84	P	96	Very high	96.3	Very high	98 Å²	98	54.9 Å²	54.9	64%	0.636	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-54.6	-27.2	171.4	-29	37.1	0	0	0	114.1	L82 W86	L82-P84 VanDerWaalsContact C-N 3.3Å; P84-W86 VanDerWaalsContact C-N 3.29Å; P84-W86 PolarHBondContact O-N 3.1Å
85	L	95.1	Very high	96.3	Very high	67 Å²	67	52 Å²	52	35%	0.351	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-68.9	-25.5	178.1	-61	176	0	0	0	113	V76 L82 R83 K87 S88 Y89	V76-L85 HydrophobicContact CG1-CB 4.3Å; L82-L85 HydrophobicContact CD2-CD1 4.28Å; L82-L85 VanDerWaalsContact O-CB 3.22Å; L82-L85 WeakPolarHBondContact O-CB 3.23Å; L82-L85 WeakPolarHBondContact O-CG 3.41Å; L82-L85 PolarHBondContact O-N 3.08Å; R83-L85 PolarHBondContact O-N 3.18Å; R83-L85 VanDerWaalsContact O-N 3.08Å; L85-K87 PolarHBondContact O-N 3.41Å; L85-K87 VanDerWaalsContact O-N 3.11Å; L85-S88 WeakPolarHBondContact O-CB 3.3Å; L85-S88 PolarHBondContact O-N 3.43Å; L85-Y89 HydrophobicContact CB-CD2 4.25Å; L85-Y89 HydrophobicContact CB-CE2 4.08Å; L85-Y89 VanDerWaalsContact O-CD2 3.27Å; L85-Y89 WeakPolarHBondContact O-CD2 3.48Å; L85-Y89 PolarHBondContact O-N 2.86Å
86	W	97.5	Very high	96.3	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-56.4	-33.8	-174.9	-65.4	5.4	0	0	0	112.7	L26 G27 G77 R83 P84 S88 Y89 T90 F98 E114 I118	L26-W86 HydrophobicContact CB-CD2 4.4Å; L26-W86 HydrophobicContact CB-CE3 4.39Å; L26-W86 HydrophobicContact CB-CZ3 4.46Å; L26-W86 HydrophobicContact CD1-CB 4.13Å; L26-W86 HydrophobicContact CD1-CD2 4.23Å; L26-W86 HydrophobicContact CD1-CE3 4.15Å; L26-W86 HydrophobicContact CD1-CG 4.27Å; L26-W86 HydrophobicContact CD2-CB 4.06Å; L26-W86 HydrophobicContact CD2-CD2 3.95Å; L26-W86 HydrophobicContact CD2-CG 3.67Å; L26-W86 HydrophobicContact CG-CD2 4.44Å; G27-W86 VanDerWaalsContact O-CZ2 3.28Å; G27-W86 WeakPolarHBondContact O-CZ2 3.2Å; G77-W86 PolarHBondContact O-NE1 2.7Å; R83-W86 HydrophobicContact CB-CD2 4.24Å; R83-W86 HydrophobicContact CB-CZ2 4.43Å; R83-W86 HydrophobicContact CG-CD2 4.42Å; R83-W86 HydrophobicContact CG-CH2 4.2Å; R83-W86 HydrophobicContact CG-CZ2 3.74Å; R83-W86 VanDerWaalsContact O-CB 3.28Å; R83-W86 WeakPolarHBondContact O-CB 3.39Å; R83-W86 VanDerWaalsContact O-CG 3.26Å; R83-W86 PolarHBondContact O-N 3.44Å; P84-W86 VanDerWaalsContact C-N 3.29Å; P84-W86 PolarHBondContact O-N 3.1Å; W86-S88 VanDerWaalsContact C-N 3.27Å; W86-S88 PolarHBondContact O-N 3.35Å; W86-Y89 PolarHBondContact O-N 2.97Å; W86-T90 WeakPolarHBondContact O-CG2 3.43Å; W86-T90 PolarHBondContact O-N 3.4Å; W86-T90 PolarHBondContact O-OG1 2.95Å; W86-F98 HydrophobicContact CH2-CE2 4.27Å; W86-F98 AromaticContact CZ3-CE2 3.93Å; W86-F98 HydrophobicContact CZ3-CE2 3.93Å; W86-E114 HydrophobicContact CH2-CB 4.33Å; W86-E114 HydrophobicContact CZ3-CB 3.79Å; W86-E114 HydrophobicContact CZ3-CG 4.43Å; W86-I118 HydrophobicContact CB-CD1 3.84Å; W86-I118 HydrophobicContact CE3-CD1 4.18Å; W86-I118 HydrophobicContact CE3-CG1 3.81Å; W86-I118 HydrophobicContact CZ3-CG1 4.45Å
87	K	95.2	Very high	96.4	Very high	100 Å²	100	52.3 Å²	52.3	44%	0.435	27%	0.266	S	S	.	.	H	α-helix	trans	-60.2	-36.9	175.7	-175.7	171.3	-177.1	168.3	0	112.3	L85 T90 R91 E123	L85-K87 PolarHBondContact O-N 3.41Å; L85-K87 VanDerWaalsContact O-N 3.11Å; K87-T90 PolarHBondContact O-OG1 3.47Å; K87-R91 WeakPolarHBondContact O-CG 3.35Å; K87-E123 WeakPolarHBondContact CE-OE1 3.44Å; K87-E123 IonicContact NZ-OE1 3.16Å; K87-E123 PolarHBondContact NZ-OE1 3.27Å; K87-E123 IonicContact NZ-OE2 2.68Å
88	S	94.8	Very high	96.5	Very high	76 Å²	76	52.3 Å²	52.3	53%	0.531	27%	0.266	S	S	.	.	H	α-helix	trans	-73	-39	179.8	-61.9	0	0	0	0	111.9	L85 W86	L85-S88 WeakPolarHBondContact O-CB 3.3Å; L85-S88 PolarHBondContact O-N 3.43Å; W86-S88 VanDerWaalsContact C-N 3.27Å; W86-S88 PolarHBondContact O-N 3.35Å
89	Y	95.8	Very high	96.5	Very high	44 Å²	44	52.1 Å²	52.1	17%	0.173	26%	0.264	C	S	.	.	H	α-helix	trans	-80.8	-18.2	-177.3	-70.2	-81.4	0	0	0	114.2	F54 W74 V76 L85 W86 T93	F54-Y89 HydrophobicContact CB-CE1 4.19Å; F54-Y89 HydrophobicContact CD1-CE1 4.27Å; F54-Y89 AromaticContact CD1-CZ 3.71Å; F54-Y89 WeakPolarHBondContact CD1-OH 3.33Å; F54-Y89 HydrophobicContact CD2-CE1 4.09Å; F54-Y89 WeakPolarHBondContact CE1-OH 2.89Å; F54-Y89 AromaticContact CG-CE1 3.91Å; F54-Y89 HydrophobicContact CG-CE1 3.91Å; F54-Y89 AromaticContact CG-CZ 3.75Å; F54-Y89 WeakPolarHBondContact CG-OH 3.45Å; W74-Y89 HydrophobicContact CB-CD1 4.11Å; W74-Y89 HydrophobicContact CD2-CD1 4.1Å; W74-Y89 HydrophobicContact CD2-CE1 4.33Å; W74-Y89 AromaticContact CE3-CD1 3.7Å; W74-Y89 HydrophobicContact CE3-CD1 3.7Å; W74-Y89 AromaticContact CE3-CE1 3.49Å; W74-Y89 HydrophobicContact CE3-CE1 3.49Å; W74-Y89 VanDerWaalsContact CE3-CE1 3.49Å; W74-Y89 HydrophobicContact CG-CD1 4.3Å; W74-Y89 HydrophobicContact CZ3-CD1 4.42Å; W74-Y89 AromaticContact CZ3-CE1 3.87Å; W74-Y89 HydrophobicContact CZ3-CE1 3.87Å; V76-Y89 HydrophobicContact CG1-CD2 3.98Å; V76-Y89 HydrophobicContact CG1-CE2 4.32Å; V76-Y89 HydrophobicContact CG2-CD1 4.19Å; V76-Y89 HydrophobicContact CG2-CD2 3.76Å; V76-Y89 HydrophobicContact CG2-CG 3.6Å; L85-Y89 HydrophobicContact CB-CD2 4.25Å; L85-Y89 HydrophobicContact CB-CE2 4.08Å; L85-Y89 VanDerWaalsContact O-CD2 3.27Å; L85-Y89 WeakPolarHBondContact O-CD2 3.48Å; L85-Y89 PolarHBondContact O-N 2.86Å; W86-Y89 PolarHBondContact O-N 2.97Å; Y89-T93 WeakPolarHBondContact O-CG2 3.45Å
90	T	96.4	Very high	96.6	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-85.1	-13.4	176.3	48.2	0	0	0	0	113.7	A24 L26 W86 K87 C92 T93 I96 I118 N124	A24-T90 HydrophobicContact CB-CG2 4.09Å; L26-T90 HydrophobicContact CD1-CG2 3.54Å; W86-T90 WeakPolarHBondContact O-CG2 3.43Å; W86-T90 PolarHBondContact O-N 3.4Å; W86-T90 PolarHBondContact O-OG1 2.95Å; K87-T90 PolarHBondContact O-OG1 3.47Å; T90-C92 PolarHBondContact O-N 3.06Å; T90-T93 WeakPolarHBondContact O-CB 3.49Å; T90-T93 WeakPolarHBondContact O-CG2 3.36Å; T90-T93 PolarHBondContact O-N 2.98Å; T90-T93 PolarHBondContact O-OG1 2.97Å; T90-I96 HydrophobicContact CG2-CD1 3.93Å; T90-I96 HydrophobicContact CG2-CG1 4.22Å; T90-I118 HydrophobicContact CG2-CG2 4.04Å; T90-N124 WeakPolarHBondContact CB-OD1 3.22Å; T90-N124 PolarHBondContact O-OD1 2.92Å; T90-N124 PolarHBondContact OG1-ND2 2.9Å
91	R	92.4	Very high	96.7	Very high	144 Å²	144	43.5 Å²	43.5	54%	0.543	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	128.8	177.6	-74.5	-178.5	-177.7	-134.7	2.5	111.4	K87 T93	K87-R91 WeakPolarHBondContact O-CG 3.35Å; R91-T93 PolarHBondContact O-N 3.24Å; R91-T93 VanDerWaalsContact O-N 3.08Å
92	C	91.9	Very high	96.8	Very high	121 Å²	121	35.8 Å²	35.8	82%	0.818	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.1	27.8	176.9	-57.1	0	0	0	0	113.4	T90	T90-C92 PolarHBondContact O-N 3.06Å
93	T	97.2	Very high	96.9	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.031	20%	0.197	C	C	.	.			trans	-73.6	147.3	171.2	54.4	0	0	0	0	110.5	A24 Y89 T90 R91 R189	A24-T93 HydrophobicContact CB-CG2 4.05Å; Y89-T93 WeakPolarHBondContact O-CG2 3.45Å; T90-T93 WeakPolarHBondContact O-CB 3.49Å; T90-T93 WeakPolarHBondContact O-CG2 3.36Å; T90-T93 PolarHBondContact O-N 2.98Å; T90-T93 PolarHBondContact O-OG1 2.97Å; R91-T93 PolarHBondContact O-N 3.24Å; R91-T93 VanDerWaalsContact O-N 3.08Å; T93-R189 PolarHBondContact O-NH1 3.28Å
94	D	97.8	Very high	97	Very high	28 Å²	28	37.1 Å²	37.1	15%	0.15	20%	0.203	C	C	.	.	S	Bend	trans	-75.1	-36.6	171.4	-74.1	-66.4	0	0	0	111.1	F21 H22 I23 P128 I186 R190	F21-D94 VanDerWaalsContact CA-OD2 3.3Å; F21-D94 WeakPolarHBondContact CA-OD2 3.46Å; F21-D94 HydrophobicContact CB-CB 4.35Å; F21-D94 HydrophobicContact CD1-CB 4.28Å; H22-D94 PolarHBondContact N-OD2 3.24Å; H22-D94 PolarHBondContact O-N 3.31Å; I23-D94 HydrophobicContact CD1-CB 4.41Å; D94-P128 VanDerWaalsContact O-CD 3.23Å; D94-P128 WeakPolarHBondContact O-CD 3.44Å; D94-I186 HydrophobicContact CB-CD1 4.09Å; D94-I186 HydrophobicContact CB-CG1 4.44Å; D94-I186 HydrophobicContact CB-CG2 4.02Å; D94-I186 WeakPolarHBondContact O-CG1 3.28Å; D94-R190 IonicContact OD1-CZ 2.65Å; D94-R190 VanDerWaalsContact OD1-CZ 3.26Å; D94-R190 IonicContact OD1-NE 2.87Å; D94-R190 PolarHBondContact OD1-NE 3.43Å; D94-R190 IonicContact OD1-NH2 3.98Å; D94-R190 PolarHBondContact OD1-NH2 2.96Å; D94-R190 IonicContact OD2-CZ 3.26Å; D94-R190 IonicContact OD2-NH2 2.7Å; D94-R190 PolarHBondContact OD2-NH2 2.96Å
95	G	98.3	Very high	97.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	164.6	179.2	0	0	0	0	0	112.4	I23 A24 P128	I23-G95 WeakPolarHBondContact CA-O 3.31Å; A24-G95 PolarHBondContact N-O 3.14Å; G95-P128 WeakPolarHBondContact CA-O 3.5Å
96	I	98.8	Very high	97.2	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.015	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	136.1	178.3	-64.6	166.1	0	0	0	108.3	A24 L26 T90 I118 V127 P128 V129 L130	A24-I96 WeakPolarHBondContact O-CA 3.49Å; L26-I96 HydrophobicContact CD1-CG2 4.29Å; T90-I96 HydrophobicContact CG2-CD1 3.93Å; T90-I96 HydrophobicContact CG2-CG1 4.22Å; I96-I118 HydrophobicContact CD1-CG2 3.92Å; I96-V127 HydrophobicContact CD1-CG1 3.93Å; I96-V127 HydrophobicContact CG1-CG1 3.86Å; I96-P128 PolarHBondContact N-O 2.88Å; I96-V129 HydrophobicContact CB-CG2 4.45Å; I96-V129 CarbonylContact O-C 3.41Å; I96-V129 WeakPolarHBondContact O-CA 3.3Å; I96-L130 PolarHBondContact O-N 2.9Å
97	I	98.9	Very high	97.3	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.015	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	121.8	164.5	-61.6	-178.2	0	0	0	107	I23 A24 I25 L26 F73 V99 L130 V132 L182	I23-I97 HydrophobicContact CG2-CD1 4.02Å; I23-I97 HydrophobicContact CG2-CG1 3.8Å; A24-I97 PolarHBondContact O-N 2.95Å; I25-I97 CarbonylContact C-O 3.57Å; I25-I97 WeakPolarHBondContact CA-O 3.38Å; I25-I97 HydrophobicContact CG1-CB 4.28Å; I25-I97 HydrophobicContact CG1-CD1 4.44Å; I25-I97 HydrophobicContact CG2-CB 4.38Å; I25-I97 HydrophobicContact CG2-CG2 4.26Å; L26-I97 PolarHBondContact N-O 3.02Å; F73-I97 HydrophobicContact CD1-CD1 4.4Å; F73-I97 HydrophobicContact CE1-CD1 3.7Å; I97-V99 HydrophobicContact CG2-CG2 3.95Å; I97-L130 CarbonylContact C-O 3.56Å; I97-L130 WeakPolarHBondContact CA-O 3.33Å; I97-L130 HydrophobicContact CD1-CD2 4.24Å; I97-L130 HydrophobicContact CG1-CB 4.31Å; I97-L130 HydrophobicContact CG1-CD2 4.1Å; I97-V132 HydrophobicContact CG2-CG2 3.69Å; I97-L182 HydrophobicContact CD1-CD2 4.15Å; I97-L182 HydrophobicContact CG1-CD2 3.73Å
98	F	98.9	Very high	97.4	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	108.2	175.2	-164.8	-89.1	0	0	0	109.2	L26 W86 V100 A111 L115 V129 L130 V131 V132	L26-F98 HydrophobicContact CB-CD2 4.09Å; L26-F98 WeakPolarHBondContact O-CA 3.34Å; W86-F98 HydrophobicContact CH2-CE2 4.27Å; W86-F98 AromaticContact CZ3-CE2 3.93Å; W86-F98 HydrophobicContact CZ3-CE2 3.93Å; F98-V100 HydrophobicContact CD1-CG1 3.77Å; F98-V100 HydrophobicContact CE1-CG1 3.71Å; F98-A111 HydrophobicContact CE1-CB 4.28Å; F98-A111 WeakPolarHBondContact CZ-O 3.4Å; F98-L115 HydrophobicContact CB-CD1 4.03Å; F98-L115 HydrophobicContact CD1-CB 4.18Å; F98-L115 HydrophobicContact CD1-CD1 4.14Å; F98-L115 HydrophobicContact CD1-CD2 4.47Å; F98-L115 HydrophobicContact CD1-CG 4.49Å; F98-L115 HydrophobicContact CD2-CB 4.33Å; F98-L115 HydrophobicContact CD2-CD1 4Å; F98-L115 HydrophobicContact CE1-CB 3.84Å; F98-L115 HydrophobicContact CE2-CB 4Å; F98-L115 HydrophobicContact CE2-CD1 4.5Å; F98-L115 HydrophobicContact CG-CB 4.41Å; F98-L115 HydrophobicContact CG-CD1 3.79Å; F98-L115 HydrophobicContact CZ-CB 3.74Å; F98-V129 HydrophobicContact CB-CG1 4.24Å; F98-L130 PolarHBondContact N-O 3.37Å; F98-V131 CarbonylContact O-C 3.58Å; F98-V131 WeakPolarHBondContact O-CA 3.46Å; F98-V132 PolarHBondContact O-N 3.33Å
99	V	98.9	Very high	97.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128.1	-176.6	-169.2	0	0	0	0	109.6	I25 L26 G27 A31 K33 V36 I97 V132 N134	I25-V99 HydrophobicContact CG2-CG2 3.85Å; L26-V99 PolarHBondContact O-N 3.29Å; G27-V99 WeakPolarHBondContact CA-O 3.32Å; A31-V99 HydrophobicContact CB-CB 4.34Å; A31-V99 HydrophobicContact CB-CG1 4.12Å; A31-V99 WeakPolarHBondContact CB-O 3.4Å; A31-V99 VanDerWaalsContact O-CG1 3.3Å; A31-V99 WeakPolarHBondContact O-CG1 3.41Å; K33-V99 HydrophobicContact CB-CG2 4.46Å; K33-V99 HydrophobicContact CG-CB 3.88Å; K33-V99 HydrophobicContact CG-CG2 3.87Å; V36-V99 HydrophobicContact CG2-CG1 4.38Å; V36-V99 HydrophobicContact CG2-CG2 4.37Å; I97-V99 HydrophobicContact CG2-CG2 3.95Å; V99-V132 HydrophobicContact CG1-CB 4.4Å; V99-V132 HydrophobicContact CG1-CG1 4.29Å; V99-V132 HydrophobicContact CG2-CB 4.31Å; V99-N134 HydrophobicContact CG1-CB 3.8Å
100	V	98.8	Very high	97.7	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.024	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	144.6	172.7	-60	0	0	0	0	110.4	F98 S102 M108 A111 V131 V132 A133 N134 I147 L151	F98-V100 HydrophobicContact CD1-CG1 3.77Å; F98-V100 HydrophobicContact CE1-CG1 3.71Å; V100-S102 PolarHBondContact O-N 2.95Å; V100-M108 HydrophobicContact CB-SD 4.43Å; V100-A111 HydrophobicContact CG1-CB 4.25Å; V100-V131 HydrophobicContact CG2-CG1 4.4Å; V100-V132 WeakPolarHBondContact CG2-O 3.47Å; V100-V132 PolarHBondContact N-O 3.32Å; V100-A133 HydrophobicContact CG2-CB 4.43Å; V100-N134 WeakPolarHBondContact O-CB 3.27Å; V100-N134 PolarHBondContact O-N 3.16Å; V100-I147 HydrophobicContact CG2-CG2 4.06Å; V100-L151 HydrophobicContact CG1-CD1 3.95Å; V100-L151 HydrophobicContact CG1-CD2 4.35Å; V100-L151 HydrophobicContact CG2-CD1 4.37Å
101	D	98.8	Very high	97.8	Very high	20 Å²	20	41.4 Å²	41.4	11%	0.107	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	109.3	170.5	-170.5	-13.9	0	0	0	108.6	A103 D104 K135	D101-A103 PolarHBondContact O-N 2.89Å; D101-A103 WeakPolarHBondContact OD1-CB 3.39Å; D101-A103 PolarHBondContact OD1-N 2.78Å; D101-D104 HydrophobicContact CB-CB 3.8Å; D101-D104 PolarHBondContact O-N 2.87Å; D101-K135 VanDerWaalsContact OD1-CD 3.27Å; D101-K135 WeakPolarHBondContact OD1-CD 3.47Å; D101-K135 IonicContact OD1-NZ 2.82Å; D101-K135 VanDerWaalsContact OD2-CE 3.25Å; D101-K135 WeakPolarHBondContact OD2-CE 3.33Å; D101-K135 IonicContact OD2-NZ 2.79Å; D101-K135 PolarHBondContact OD2-NZ 3.47Å
102	S	98.8	Very high	98.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.7	-179.1	-49.4	0	0	0	0	112.3	V100 D104 N134 Q136 S141 L142 I147	V100-S102 PolarHBondContact O-N 2.95Å; S102-D104 VanDerWaalsContact C-N 3.35Å; S102-N134 WeakPolarHBondContact CB-O 3.42Å; S102-N134 PolarHBondContact N-O 3.49Å; S102-N134 PolarHBondContact OG-N 3.2Å; S102-N134 PolarHBondContact OG-O 3.02Å; S102-Q136 VanDerWaalsContact CB-NE2 3.26Å; S102-Q136 PolarHBondContact OG-NE2 2.89Å; S102-S141 WeakPolarHBondContact O-CA 3.41Å; S102-L142 WeakPolarHBondContact O-CG 3.16Å; S102-L142 PolarHBondContact O-N 3.05Å; S102-I147 WeakPolarHBondContact OG-CD1 3.2Å
103	A	98.5	Very high	98.5	Very high	29 Å²	29	34.7 Å²	34.7	24%	0.24	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.7	180	0	0	0	0	0	113.3	D101 L138 V140	D101-A103 PolarHBondContact O-N 2.89Å; D101-A103 WeakPolarHBondContact OD1-CB 3.39Å; D101-A103 PolarHBondContact OD1-N 2.78Å; A103-L138 HydrophobicContact CB-CB 4.28Å; A103-L138 HydrophobicContact CB-CD1 3.6Å; A103-V140 HydrophobicContact CB-CG2 3.71Å
104	D	98.3	Very high	98.5	Very high	36 Å²	36	35.6 Å²	35.6	19%	0.193	19%	0.187	C	C	.	.			trans	-116.4	75.2	-175.9	-166.6	-21.5	0	0	0	110.4	D101 S102 E106 R107	D101-D104 HydrophobicContact CB-CB 3.8Å; D101-D104 PolarHBondContact O-N 2.87Å; S102-D104 VanDerWaalsContact C-N 3.35Å; D104-E106 PolarHBondContact O-N 3.33Å; D104-R107 PolarHBondContact OD1-N 2.85Å; D104-R107 IonicContact OD1-NE 3.62Å; D104-R107 IonicContact OD2-CZ 3.03Å; D104-R107 IonicContact OD2-NE 3.75Å; D104-R107 PolarHBondContact OD2-NE 3.35Å; D104-R107 IonicContact OD2-NH2 2.62Å; D104-R107 PolarHBondContact OD2-NH2 2.87Å
105	A	97.6	Very high	98.6	Very high	58 Å²	58	34.4 Å²	34.4	48%	0.479	18%	0.181	S	C	.	.	S	Bend	trans	-64.1	-31	-179.1	0	0	0	0	0	112.5	R107 M108 L142	A105-R107 VanDerWaalsContact C-N 3.33Å; A105-R107 PolarHBondContact O-N 2.87Å; A105-M108 WeakPolarHBondContact O-CB 3.24Å; A105-M108 PolarHBondContact O-N 3.1Å; A105-L142 HydrophobicContact CB-CD1 3.99Å; A105-L142 HydrophobicContact CB-CD2 4.42Å; A105-L142 HydrophobicContact CB-CG 4.48Å
106	E	98	Very high	98.6	Very high	186 Å²	186	35.5 Å²	35.5	87%	0.869	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-36.6	-177.1	-63.8	-174.2	170.4	0	0	112.2	D104	D104-E106 PolarHBondContact O-N 3.33Å
107	R	98.4	Very high	98.5	Very high	56 Å²	56	41 Å²	41	21%	0.211	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	8	179.6	-64.3	-165.1	-66	157.3	3.9	114.5	L28 D29 D104 A105 E109 E110 A111	L28-R107 HydrophobicContact CD1-CB 3.83Å; D29-R107 PolarHBondContact O-NH1 3.15Å; D29-R107 PolarHBondContact O-NH2 2.85Å; D29-R107 IonicContact OD1-NH1 3.14Å; D29-R107 IonicContact OD2-NH1 3.84Å; D29-R107 PolarHBondContact OD2-NH1 3.17Å; D29-R107 VanDerWaalsContact OD2-NH1 3.16Å; D104-R107 PolarHBondContact OD1-N 2.85Å; D104-R107 IonicContact OD1-NE 3.62Å; D104-R107 IonicContact OD2-CZ 3.03Å; D104-R107 IonicContact OD2-NE 3.75Å; D104-R107 PolarHBondContact OD2-NE 3.35Å; D104-R107 IonicContact OD2-NH2 2.62Å; D104-R107 PolarHBondContact OD2-NH2 2.87Å; A105-R107 VanDerWaalsContact C-N 3.33Å; A105-R107 PolarHBondContact O-N 2.87Å; R107-E109 PolarHBondContact O-N 2.8Å; R107-E110 WeakPolarHBondContact O-CB 3.48Å; R107-E110 PolarHBondContact O-N 3.38Å; R107-A111 WeakPolarHBondContact O-CB 3.27Å; R107-A111 PolarHBondContact O-N 3.38Å
108	M	98.4	Very high	98.4	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.02	21%	0.212	C	C	.	.	H	α-helix	trans	-67	-34.1	-178.3	-159.8	61.6	69.2	0	0	113	V100 A105 A111 K112 L142 I147 L150 L151	V100-M108 HydrophobicContact CB-SD 4.43Å; A105-M108 WeakPolarHBondContact O-CB 3.24Å; A105-M108 PolarHBondContact O-N 3.1Å; M108-A111 PolarHBondContact O-N 3.16Å; M108-K112 WeakPolarHBondContact O-CB 3.14Å; M108-K112 PolarHBondContact O-N 3.16Å; M108-L142 HydrophobicContact CE-CD1 3.68Å; M108-I147 HydrophobicContact CE-CG1 4.33Å; M108-L150 HydrophobicContact CB-CB 4.34Å; M108-L150 HydrophobicContact CB-CD1 4.36Å; M108-L150 HydrophobicContact CG-CB 3.45Å; M108-L150 VanDerWaalsContact CG-CB 3.45Å; M108-L150 HydrophobicContact CG-CD1 3.94Å; M108-L150 HydrophobicContact CG-CG 4.29Å; M108-L151 HydrophobicContact CG-CD2 4.05Å; M108-L151 HydrophobicContact CG-CG 4.4Å; M108-L151 HydrophobicContact SD-CD1 4.37Å; M108-L151 HydrophobicContact SD-CD2 3.51Å; M108-L151 VanDerWaalsContact SD-CD2 3.51Å; M108-L151 HydrophobicContact SD-CG 3.82Å
109	E	98.6	Very high	98.3	Very high	103 Å²	103	41.6 Å²	41.6	48%	0.481	21%	0.213	S	C	.	.	H	α-helix	trans	-70.2	-35.8	175.9	-173.3	59	-149.5	0	0	112	R107 K112 T113	R107-E109 PolarHBondContact O-N 2.8Å; E109-K112 PolarHBondContact O-N 3.2Å; E109-K112 IonicContact OE1-NZ 3.54Å; E109-K112 PolarHBondContact OE1-NZ 2.8Å; E109-K112 IonicContact OE2-NZ 3.88Å; E109-K112 PolarHBondContact OE2-NZ 2.86Å; E109-T113 PolarHBondContact O-N 3.21Å; E109-T113 PolarHBondContact O-OG1 3.29Å
110	E	98.7	Very high	98	Very high	65 Å²	65	46.8 Å²	46.8	30%	0.304	24%	0.236	S	C	.	.	H	α-helix	trans	-64.1	-45	172.1	-175.8	-173.2	-174.8	0	0	110.5	L28 R83 R107 K112 T113 E114	L28-E110 HydrophobicContact CD1-CB 4.12Å; L28-E110 HydrophobicContact CD1-CG 4.05Å; L28-E110 HydrophobicContact CD2-CG 4.07Å; R83-E110 IonicContact CZ-OE1 3.79Å; R83-E110 IonicContact NH1-OE1 2.96Å; R83-E110 PolarHBondContact NH1-OE1 3.12Å; R83-E110 IonicContact NH2-OE1 2.94Å; R83-E110 PolarHBondContact NH2-OE1 2.96Å; R107-E110 WeakPolarHBondContact O-CB 3.48Å; R107-E110 PolarHBondContact O-N 3.38Å; E110-K112 PolarHBondContact O-N 3.17Å; E110-T113 PolarHBondContact O-N 2.8Å; E110-E114 PolarHBondContact O-N 2.82Å; E110-E114 VanDerWaalsContact O-N 3.09Å
111	A	98.8	Very high	97.8	Very high	4 Å²	4	47.8 Å²	47.8	3%	0.033	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-43.4	176.2	0	0	0	0	0	111.7	L28 F98 V100 R107 M108 E114 L115 L151	L28-A111 HydrophobicContact CD1-CB 3.89Å; L28-A111 HydrophobicContact CG-CB 4.1Å; F98-A111 HydrophobicContact CE1-CB 4.28Å; F98-A111 WeakPolarHBondContact CZ-O 3.4Å; V100-A111 HydrophobicContact CG1-CB 4.25Å; R107-A111 WeakPolarHBondContact O-CB 3.27Å; R107-A111 PolarHBondContact O-N 3.38Å; M108-A111 PolarHBondContact O-N 3.16Å; A111-E114 PolarHBondContact O-N 2.79Å; A111-L115 VanDerWaalsContact O-CB 3.23Å; A111-L115 WeakPolarHBondContact O-CB 3.47Å; A111-L115 PolarHBondContact O-N 3.05Å; A111-L151 HydrophobicContact CB-CD2 4.1Å
112	K	98.8	Very high	97.5	Very high	49 Å²	49	50.9 Å²	50.9	21%	0.213	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-51.2	173.2	173.3	175	147.3	-135.8	0	111.2	M108 E109 E110 E114 L115 H116 L150 L151 A152	M108-K112 WeakPolarHBondContact O-CB 3.14Å; M108-K112 PolarHBondContact O-N 3.16Å; E109-K112 PolarHBondContact O-N 3.2Å; E109-K112 IonicContact OE1-NZ 3.54Å; E109-K112 PolarHBondContact OE1-NZ 2.8Å; E109-K112 IonicContact OE2-NZ 3.88Å; E109-K112 PolarHBondContact OE2-NZ 2.86Å; E110-K112 PolarHBondContact O-N 3.17Å; K112-E114 VanDerWaalsContact C-N 3.33Å; K112-E114 PolarHBondContact O-N 3.35Å; K112-L115 PolarHBondContact O-N 2.81Å; K112-H116 PolarHBondContact O-CD2 2.86Å; K112-H116 PolarHBondContact O-N 3.41Å; K112-L150 WeakPolarHBondContact CD-O 3.4Å; K112-L151 HydrophobicContact CB-CD2 4.09Å; K112-A152 HydrophobicContact CD-CB 3.98Å
113	T	98.6	Very high	97.2	Very high	76 Å²	76	54.4 Å²	54.4	47%	0.466	28%	0.283	S	S	.	.	H	α-helix	trans	-56.5	-48.5	-177.7	-63.9	0	0	0	0	111.2	E109 E110 K117	E109-T113 PolarHBondContact O-N 3.21Å; E109-T113 PolarHBondContact O-OG1 3.29Å; E110-T113 PolarHBondContact O-N 2.8Å; T113-K117 VanDerWaalsContact O-CB 3.29Å; T113-K117 WeakPolarHBondContact O-CB 3.31Å; T113-K117 PolarHBondContact O-N 2.84Å
114	E	98.6	Very high	97.1	Very high	24 Å²	24	53.1 Å²	53.1	11%	0.112	27%	0.272	C	S	.	.	H	α-helix	trans	-71.9	-35.6	-179.9	-70	-63.4	139.9	0	0	113.1	W86 E110 A111 K112 K117 I118	W86-E114 HydrophobicContact CH2-CB 4.33Å; W86-E114 HydrophobicContact CZ3-CB 3.79Å; W86-E114 HydrophobicContact CZ3-CG 4.43Å; E110-E114 PolarHBondContact O-N 2.82Å; E110-E114 VanDerWaalsContact O-N 3.09Å; A111-E114 PolarHBondContact O-N 2.79Å; K112-E114 VanDerWaalsContact C-N 3.33Å; K112-E114 PolarHBondContact O-N 3.35Å; E114-K117 PolarHBondContact O-N 2.88Å; E114-K117 IonicContact OE1-NZ 3.09Å; E114-K117 PolarHBondContact OE1-NZ 3Å; E114-K117 IonicContact OE2-NZ 2.68Å; E114-K117 PolarHBondContact OE2-NZ 3.29Å; E114-I118 WeakPolarHBondContact O-CG1 3.36Å; E114-I118 PolarHBondContact O-N 2.62Å; E114-I118 VanDerWaalsContact O-N 3.07Å
115	L	98.6	Very high	96.8	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-58.5	-52.6	172.8	170.8	60.1	0	0	0	111.1	F98 A111 K112 K117 I118 A119 V129 V131 L151 L153 L156	F98-L115 HydrophobicContact CB-CD1 4.03Å; F98-L115 HydrophobicContact CD1-CB 4.18Å; F98-L115 HydrophobicContact CD1-CD1 4.14Å; F98-L115 HydrophobicContact CD1-CD2 4.47Å; F98-L115 HydrophobicContact CD1-CG 4.49Å; F98-L115 HydrophobicContact CD2-CB 4.33Å; F98-L115 HydrophobicContact CD2-CD1 4Å; F98-L115 HydrophobicContact CE1-CB 3.84Å; F98-L115 HydrophobicContact CE2-CB 4Å; F98-L115 HydrophobicContact CE2-CD1 4.5Å; F98-L115 HydrophobicContact CG-CB 4.41Å; F98-L115 HydrophobicContact CG-CD1 3.79Å; F98-L115 HydrophobicContact CZ-CB 3.74Å; A111-L115 VanDerWaalsContact O-CB 3.23Å; A111-L115 WeakPolarHBondContact O-CB 3.47Å; A111-L115 PolarHBondContact O-N 3.05Å; K112-L115 PolarHBondContact O-N 2.81Å; L115-K117 VanDerWaalsContact C-N 3.34Å; L115-K117 PolarHBondContact O-N 3.45Å; L115-I118 PolarHBondContact O-N 2.98Å; L115-A119 WeakPolarHBondContact O-CB 3.38Å; L115-A119 PolarHBondContact O-N 2.81Å; L115-V129 HydrophobicContact CD1-CG1 3.97Å; L115-V131 HydrophobicContact CD2-CG2 4.32Å; L115-L151 HydrophobicContact CD2-CB 4.37Å; L115-L151 HydrophobicContact CD2-CD1 4.42Å; L115-L153 HydrophobicContact CD2-CD2 3.57Å; L115-L156 HydrophobicContact CG-CD2 4.44Å
116	H	98.3	Very high	96.6	Very high	23 Å²	23	56.1 Å²	56.1	11%	0.106	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-40.8	-178.2	-82.8	-103.1	0	0	0	111.5	K112 I118 A119 K120 L151 A152	K112-H116 PolarHBondContact O-CD2 2.86Å; K112-H116 PolarHBondContact O-N 3.41Å; H116-I118 PolarHBondContact O-N 3.47Å; H116-A119 PolarHBondContact O-N 3.3Å; H116-K120 HydrophobicContact CB-CD 4.48Å; H116-K120 WeakPolarHBondContact ND1-CE 3.37Å; H116-K120 PolarHBondContact ND1-NZ 3.43Å; H116-K120 WeakPolarHBondContact O-CB 3.18Å; H116-K120 WeakPolarHBondContact O-CG 3.49Å; H116-K120 PolarHBondContact O-N 2.84Å; H116-L151 PolarHBondContact NE2-O 3.44Å; H116-A152 PolarHBondContact CE1-O 2.87Å; H116-A152 PolarHBondContact NE2-O 3.2Å
117	K	97.2	Very high	96.6	Very high	119 Å²	119	47.4 Å²	47.4	52%	0.517	24%	0.239	S	C	.	.	H	α-helix	trans	-58.3	-44.4	175.7	175.6	-176.9	169.5	-162.5	0	112.7	T113 E114 L115 S121	T113-K117 VanDerWaalsContact O-CB 3.29Å; T113-K117 WeakPolarHBondContact O-CB 3.31Å; T113-K117 PolarHBondContact O-N 2.84Å; E114-K117 PolarHBondContact O-N 2.88Å; E114-K117 IonicContact OE1-NZ 3.09Å; E114-K117 PolarHBondContact OE1-NZ 3Å; E114-K117 IonicContact OE2-NZ 2.68Å; E114-K117 PolarHBondContact OE2-NZ 3.29Å; L115-K117 VanDerWaalsContact C-N 3.34Å; L115-K117 PolarHBondContact O-N 3.45Å; K117-S121 PolarHBondContact O-N 3.21Å
118	I	96.9	Very high	96.6	Very high	13 Å²	13	44.7 Å²	44.7	7%	0.067	23%	0.229	C	C	.	.	H	α-helix	trans	-73.3	-46.8	178.1	-69.5	-62.5	0	0	0	111.6	L26 W86 T90 I96 E114 L115 H116 K120 S121 N124	L26-I118 HydrophobicContact CD1-CG1 4.33Å; L26-I118 HydrophobicContact CD1-CG2 3.97Å; W86-I118 HydrophobicContact CB-CD1 3.84Å; W86-I118 HydrophobicContact CE3-CD1 4.18Å; W86-I118 HydrophobicContact CE3-CG1 3.81Å; W86-I118 HydrophobicContact CZ3-CG1 4.45Å; T90-I118 HydrophobicContact CG2-CG2 4.04Å; I96-I118 HydrophobicContact CD1-CG2 3.92Å; E114-I118 WeakPolarHBondContact O-CG1 3.36Å; E114-I118 PolarHBondContact O-N 2.62Å; E114-I118 VanDerWaalsContact O-N 3.07Å; L115-I118 PolarHBondContact O-N 2.98Å; H116-I118 PolarHBondContact O-N 3.47Å; I118-K120 VanDerWaalsContact C-N 3.34Å; I118-K120 PolarHBondContact O-N 2.79Å; I118-S121 PolarHBondContact O-N 3.08Å; I118-N124 WeakPolarHBondContact O-CB 3.43Å; I118-N124 PolarHBondContact O-ND2 3.5Å
119	A	95.9	Very high	96.6	Very high	3 Å²	3	44.6 Å²	44.6	3%	0.025	23%	0.229	C	C	.	.	H	α-helix	trans	-68.4	-32.3	-174.6	0	0	0	0	0	113	L115 H116 V129 L156 T160	L115-A119 WeakPolarHBondContact O-CB 3.38Å; L115-A119 PolarHBondContact O-N 2.81Å; H116-A119 PolarHBondContact O-N 3.3Å; A119-V129 HydrophobicContact CB-CG2 4.36Å; A119-L156 HydrophobicContact CB-CD2 3.74Å; A119-T160 HydrophobicContact CB-CG2 4.17Å
120	K	93.7	Very high	96.6	Very high	109 Å²	109	39.9 Å²	39.9	47%	0.474	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-0.6	179.7	-63.4	175.6	172.3	169.3	0	113.6	H116 I118 E155	H116-K120 HydrophobicContact CB-CD 4.48Å; H116-K120 WeakPolarHBondContact ND1-CE 3.37Å; H116-K120 PolarHBondContact ND1-NZ 3.43Å; H116-K120 WeakPolarHBondContact O-CB 3.18Å; H116-K120 WeakPolarHBondContact O-CG 3.49Å; H116-K120 PolarHBondContact O-N 2.84Å; I118-K120 VanDerWaalsContact C-N 3.34Å; I118-K120 PolarHBondContact O-N 2.79Å; K120-E155 WeakPolarHBondContact CE-O 3.34Å; K120-E155 PolarHBondContact NZ-O 3.23Å
121	S	94.2	Very high	96.6	Very high	25 Å²	25	36.8 Å²	36.8	18%	0.175	19%	0.192	C	C	.	.	S	Bend	trans	-61.6	142.9	174.4	134.6	0	0	0	0	110.4	K117 I118 E123 N124 Q125	K117-S121 PolarHBondContact O-N 3.21Å; I118-S121 PolarHBondContact O-N 3.08Å; S121-E123 PolarHBondContact O-N 3.31Å; S121-E123 PolarHBondContact OG-N 3.28Å; S121-E123 PolarHBondContact OG-OE2 3.07Å; S121-N124 PolarHBondContact O-N 2.96Å; S121-Q125 PolarHBondContact O-N 3.05Å
122	S	92.8	Very high	96.6	Very high	85 Å²	85	36.8 Å²	36.8	59%	0.594	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-60.1	-31.2	-179.3	54.3	0	0	0	0	112.2	N124	S122-N124 VanDerWaalsContact C-N 3.26Å; S122-N124 PolarHBondContact O-N 3.25Å
123	E	92.8	Very high	96.6	Very high	74 Å²	74	34.5 Å²	34.5	35%	0.346	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-70	-21.1	176.5	-59.5	92.8	159.3	0	0	113.5	K87 S121	K87-E123 WeakPolarHBondContact CE-OE1 3.44Å; K87-E123 IonicContact NZ-OE1 3.16Å; K87-E123 PolarHBondContact NZ-OE1 3.27Å; K87-E123 IonicContact NZ-OE2 2.68Å; S121-E123 PolarHBondContact O-N 3.31Å; S121-E123 PolarHBondContact OG-N 3.28Å; S121-E123 PolarHBondContact OG-OE2 3.07Å
124	N	95.2	Very high	96.7	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-108.3	11.1	-175.2	-66.9	-27.2	0	0	0	114.1	T90 I118 S121 S122 G126 V127	T90-N124 WeakPolarHBondContact CB-OD1 3.22Å; T90-N124 PolarHBondContact O-OD1 2.92Å; T90-N124 PolarHBondContact OG1-ND2 2.9Å; I118-N124 WeakPolarHBondContact O-CB 3.43Å; I118-N124 PolarHBondContact O-ND2 3.5Å; S121-N124 PolarHBondContact O-N 2.96Å; S122-N124 VanDerWaalsContact C-N 3.26Å; S122-N124 PolarHBondContact O-N 3.25Å; N124-G126 PolarHBondContact O-N 2.92Å; N124-V127 HydrophobicContact CB-CG2 4.21Å; N124-V127 VanDerWaalsContact O-CB 3.27Å; N124-V127 WeakPolarHBondContact O-CB 3.48Å; N124-V127 VanDerWaalsContact O-CG2 3.24Å; N124-V127 WeakPolarHBondContact O-CG2 3.28Å; N124-V127 PolarHBondContact O-N 2.96Å
125	Q	92.4	Very high	96.7	Very high	137 Å²	137	32.3 Å²	32.3	64%	0.64	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	127.9	180	-71.8	-173.3	-6.4	0	0	112.5	S121 V127 R189	S121-Q125 PolarHBondContact O-N 3.05Å; Q125-V127 PolarHBondContact O-N 3.43Å; Q125-R189 PolarHBondContact O-NH2 2.94Å
126	G	94.3	Very high	96.6	Very high	20 Å²	20	35.2 Å²	35.2	21%	0.206	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	-2.9	-178.5	0	0	0	0	0	115.1	N124 P128 A159 R189	N124-G126 PolarHBondContact O-N 2.92Å; G126-P128 WeakPolarHBondContact O-CD 3.35Å; G126-A159 WeakPolarHBondContact CA-O 3.19Å; G126-A159 PolarHBondContact N-O 3.17Å; G126-R189 WeakPolarHBondContact O-CD 2.86Å; G126-R189 PolarHBondContact O-NE 3.24Å
127	V	97.6	Very high	96.6	Very high	3 Å²	3	38 Å²	38	2%	0.018	20%	0.195	C	C	.	.			trans	-67.6	123.4	175.9	-178	0	0	0	0	108.5	I96 N124 Q125	I96-V127 HydrophobicContact CD1-CG1 3.93Å; I96-V127 HydrophobicContact CG1-CG1 3.86Å; N124-V127 HydrophobicContact CB-CG2 4.21Å; N124-V127 VanDerWaalsContact O-CB 3.27Å; N124-V127 WeakPolarHBondContact O-CB 3.48Å; N124-V127 VanDerWaalsContact O-CG2 3.24Å; N124-V127 WeakPolarHBondContact O-CG2 3.28Å; N124-V127 PolarHBondContact O-N 2.96Å; Q125-V127 PolarHBondContact O-N 3.43Å
128	P	98.3	Very high	96.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.189	C	C	.	.			trans	-67.8	141.5	177.2	-20.9	35.6	0	0	0	111.9	D94 G95 I96 G126 P161 L182 M185 I186	D94-P128 VanDerWaalsContact O-CD 3.23Å; D94-P128 WeakPolarHBondContact O-CD 3.44Å; G95-P128 WeakPolarHBondContact CA-O 3.5Å; I96-P128 PolarHBondContact N-O 2.88Å; G126-P128 WeakPolarHBondContact O-CD 3.35Å; P128-P161 CarbonylContact C-O 3.58Å; P128-P161 VanDerWaalsContact CA-O 3.28Å; P128-P161 WeakPolarHBondContact CA-O 3.36Å; P128-P161 HydrophobicContact CB-CB 4.28Å; P128-L182 HydrophobicContact CB-CD1 4.07Å; P128-M185 HydrophobicContact CB-CB 3.56Å; P128-M185 HydrophobicContact CB-CE 4.06Å; P128-M185 HydrophobicContact CB-CG 4.47Å; P128-M185 HydrophobicContact CB-SD 4.13Å; P128-M185 HydrophobicContact CG-CB 3.81Å; P128-I186 HydrophobicContact CG-CG1 4.14Å
129	V	98.8	Very high	96.7	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	116.1	-179.8	-174.4	0	0	0	0	110.2	I96 F98 L115 A119 V131 T160 P161 W162 H163	I96-V129 HydrophobicContact CB-CG2 4.45Å; I96-V129 CarbonylContact O-C 3.41Å; I96-V129 WeakPolarHBondContact O-CA 3.3Å; F98-V129 HydrophobicContact CB-CG1 4.24Å; L115-V129 HydrophobicContact CD1-CG1 3.97Å; A119-V129 HydrophobicContact CB-CG2 4.36Å; V129-V131 HydrophobicContact CG1-CG2 4.15Å; V129-T160 HydrophobicContact CG2-CG2 3.92Å; V129-P161 PolarHBondContact N-O 3.4Å; V129-W162 HydrophobicContact CB-CB 4.41Å; V129-W162 CarbonylContact O-C 3.57Å; V129-W162 WeakPolarHBondContact O-CA 2.93Å; V129-W162 WeakPolarHBondContact O-CB 3.42Å; V129-H163 PolarHBondContact O-N 3.38Å
130	L	98.9	Very high	96.7	Very high	4 Å²	4	52.5 Å²	52.5	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	113.7	165.6	174.7	66.8	0	0	0	108.5	I96 I97 F98 V132 H163 Q165 G178 L182	I96-L130 PolarHBondContact O-N 2.9Å; I97-L130 CarbonylContact C-O 3.56Å; I97-L130 WeakPolarHBondContact CA-O 3.33Å; I97-L130 HydrophobicContact CD1-CD2 4.24Å; I97-L130 HydrophobicContact CG1-CB 4.31Å; I97-L130 HydrophobicContact CG1-CD2 4.1Å; F98-L130 PolarHBondContact N-O 3.37Å; L130-V132 HydrophobicContact CD2-CG2 3.99Å; L130-V132 HydrophobicContact CG-CG2 3.99Å; L130-H163 HydrophobicContact CD1-CB 4.24Å; L130-Q165 HydrophobicContact CD1-CB 3.96Å; L130-G178 VanDerWaalsContact CD2-C 3.48Å; L130-G178 WeakPolarHBondContact CD2-O 3.42Å; L130-L182 HydrophobicContact CB-CB 4.15Å; L130-L182 HydrophobicContact CB-CD1 4.14Å; L130-L182 HydrophobicContact CB-CD2 4.2Å; L130-L182 HydrophobicContact CB-CG 4.39Å; L130-L182 HydrophobicContact CD2-CB 4.31Å; L130-L182 HydrophobicContact CD2-CD2 4.45Å
131	V	98.9	Very high	96.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.2	170.6	-175.5	0	0	0	0	108.2	F98 V100 L115 V129 L151 L153 H163 L164 Q165	F98-V131 CarbonylContact O-C 3.58Å; F98-V131 WeakPolarHBondContact O-CA 3.46Å; V100-V131 HydrophobicContact CG2-CG1 4.4Å; L115-V131 HydrophobicContact CD2-CG2 4.32Å; V129-V131 HydrophobicContact CG1-CG2 4.15Å; V131-L151 HydrophobicContact CG1-CD1 3.74Å; V131-L153 HydrophobicContact CG2-CD1 4.33Å; V131-L153 HydrophobicContact CG2-CD2 3.97Å; V131-H163 PolarHBondContact N-O 3.05Å; V131-L164 HydrophobicContact CB-CD1 3.83Å; V131-L164 HydrophobicContact CG1-CD1 3.6Å; V131-L164 WeakPolarHBondContact O-CA 3.38Å; V131-Q165 PolarHBondContact O-N 3.35Å
132	V	98.9	Very high	97.1	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.024	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	106.3	177.8	174.4	0	0	0	0	108.4	V36 I97 F98 V99 V100 L130 N134 C167 L175	V36-V132 HydrophobicContact CG2-CG1 4.47Å; I97-V132 HydrophobicContact CG2-CG2 3.69Å; F98-V132 PolarHBondContact O-N 3.33Å; V99-V132 HydrophobicContact CG1-CB 4.4Å; V99-V132 HydrophobicContact CG1-CG1 4.29Å; V99-V132 HydrophobicContact CG2-CB 4.31Å; V100-V132 WeakPolarHBondContact CG2-O 3.47Å; V100-V132 PolarHBondContact N-O 3.32Å; L130-V132 HydrophobicContact CD2-CG2 3.99Å; L130-V132 HydrophobicContact CG-CG2 3.99Å; V132-N134 HydrophobicContact CG1-CB 4.17Å; V132-N134 PolarHBondContact O-N 3.35Å; V132-N134 VanDerWaalsContact O-N 3.1Å; V132-C167 HydrophobicContact CG1-CB 3.7Å; V132-L175 HydrophobicContact CG1-CD2 4.47Å
133	A	98.8	Very high	97.4	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	86.9	169.3	0	0	0	0	0	108.8	V100 Q136 I147 L164 Q165 C167	V100-A133 HydrophobicContact CG2-CB 4.43Å; A133-Q136 WeakPolarHBondContact O-CG 3.41Å; A133-I147 HydrophobicContact CB-CD1 3.48Å; A133-I147 VanDerWaalsContact CB-CD1 3.48Å; A133-L164 HydrophobicContact CB-CD1 4.01Å; A133-Q165 PolarHBondContact N-O 3.32Å; A133-C167 PolarHBondContact O-N 2.84Å
134	N	98.8	Very high	97.6	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.027	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	166.2	-173.1	-167.4	29.2	0	0	0	112.3	A31 V99 V100 S102 V132 C167 A169	A31-N134 PolarHBondContact O-ND2 3.12Å; V99-N134 HydrophobicContact CG1-CB 3.8Å; V100-N134 WeakPolarHBondContact O-CB 3.27Å; V100-N134 PolarHBondContact O-N 3.16Å; S102-N134 WeakPolarHBondContact CB-O 3.42Å; S102-N134 PolarHBondContact N-O 3.49Å; S102-N134 PolarHBondContact OG-N 3.2Å; S102-N134 PolarHBondContact OG-O 3.02Å; V132-N134 HydrophobicContact CG1-CB 4.17Å; V132-N134 PolarHBondContact O-N 3.35Å; V132-N134 VanDerWaalsContact O-N 3.1Å; N134-C167 CarbonylContact C-O 3.54Å; N134-C167 WeakPolarHBondContact CA-O 3.1Å; N134-A169 VanDerWaalsContact OD1-CB 3.29Å; N134-A169 WeakPolarHBondContact OD1-CB 3.35Å; N134-A169 PolarHBondContact OD1-N 3.45Å
135	K	98.6	Very high	97.7	Very high	50 Å²	50	49.6 Å²	49.6	22%	0.217	26%	0.262	C	S	.	.			trans	68.3	30.2	178.2	-44	-163.7	-164.7	171.6	0	114.5	S30 D101 D137 L138 S141 C167	S30-K135 VanDerWaalsContact O-CE 3.23Å; S30-K135 WeakPolarHBondContact O-CE 3.23Å; S30-K135 PolarHBondContact O-NZ 3.27Å; D101-K135 VanDerWaalsContact OD1-CD 3.27Å; D101-K135 WeakPolarHBondContact OD1-CD 3.47Å; D101-K135 IonicContact OD1-NZ 2.82Å; D101-K135 VanDerWaalsContact OD2-CE 3.25Å; D101-K135 WeakPolarHBondContact OD2-CE 3.33Å; D101-K135 IonicContact OD2-NZ 2.79Å; D101-K135 PolarHBondContact OD2-NZ 3.47Å; K135-D137 VanDerWaalsContact CA-OD1 3.27Å; K135-D137 WeakPolarHBondContact CA-OD1 3.12Å; K135-D137 PolarHBondContact O-N 3.23Å; K135-L138 HydrophobicContact CB-CD1 3.93Å; K135-L138 HydrophobicContact CB-CG 4.28Å; K135-L138 HydrophobicContact CD-CD1 4.1Å; K135-L138 PolarHBondContact O-N 3.39Å; K135-S141 PolarHBondContact O-OG 3.24Å; K135-C167 PolarHBondContact N-O 2.8Å; K135-C167 VanDerWaalsContact N-O 3.17Å
136	Q	98.5	Very high	98	Very high	63 Å²	63	47.7 Å²	47.7	29%	0.294	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-5.6	179.2	-69.7	-74.5	-30.2	0	0	113.9	S102 A133 L138 L142 A166 C167	S102-Q136 VanDerWaalsContact CB-NE2 3.26Å; S102-Q136 PolarHBondContact OG-NE2 2.89Å; A133-Q136 WeakPolarHBondContact O-CG 3.41Å; Q136-L138 VanDerWaalsContact C-N 3.3Å; Q136-L142 PolarHBondContact NE2-O 2.62Å; Q136-A166 HydrophobicContact CG-CB 4.03Å; Q136-C167 PolarHBondContact N-O 2.97Å
137	D	97.9	Very high	98.2	Very high	80 Å²	80	46.8 Å²	46.8	43%	0.428	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-20.3	168.9	55.9	-67.4	0	0	0	113.9	K135 C168	K135-D137 VanDerWaalsContact CA-OD1 3.27Å; K135-D137 WeakPolarHBondContact CA-OD1 3.12Å; K135-D137 PolarHBondContact O-N 3.23Å; D137-C168 VanDerWaalsContact CG-SG 3.52Å; D137-C168 PolarHBondContact OD1-SG 3.16Å
138	L	98	Very high	98.3	Very high	74 Å²	74	49.1 Å²	49.1	39%	0.387	25%	0.254	S	S	.	.	S	Bend	trans	-83.7	137.3	-178.1	-57	178.9	0	0	0	111.5	A103 K135 Q136 V140 S141	A103-L138 HydrophobicContact CB-CB 4.28Å; A103-L138 HydrophobicContact CB-CD1 3.6Å; K135-L138 HydrophobicContact CB-CD1 3.93Å; K135-L138 HydrophobicContact CB-CG 4.28Å; K135-L138 HydrophobicContact CD-CD1 4.1Å; K135-L138 PolarHBondContact O-N 3.39Å; Q136-L138 VanDerWaalsContact C-N 3.3Å; L138-V140 HydrophobicContact CB-CG2 4.37Å; L138-V140 PolarHBondContact O-N 3.28Å; L138-V140 VanDerWaalsContact O-N 3.16Å; L138-S141 VanDerWaalsContact O-CB 3.23Å; L138-S141 WeakPolarHBondContact O-CB 3.48Å; L138-S141 PolarHBondContact O-N 3.06Å; L138-S141 PolarHBondContact O-OG 3.4Å
139	R	96.6	Very high	98.3	Very high	258 Å²	258	57.1 Å²	57.1	97%	0.974	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.9	-179.2	-66.9	-175.6	-178.8	179.6	0.4	114.3	S141	R139-S141 VanDerWaalsContact C-N 3.29Å
140	V	97.3	Very high	98.3	Very high	109 Å²	109	60.5 Å²	60.5	66%	0.661	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	1.3	-179	-63.5	0	0	0	0	112.7	A103 L138 L142	A103-V140 HydrophobicContact CB-CG2 3.71Å; L138-V140 HydrophobicContact CB-CG2 4.37Å; L138-V140 PolarHBondContact O-N 3.28Å; L138-V140 VanDerWaalsContact O-N 3.16Å; V140-L142 PolarHBondContact O-N 3.21Å
141	S	98.3	Very high	98.3	Very high	23 Å²	23	60.3 Å²	60.3	16%	0.161	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-68.1	131.2	-177.2	-74.7	0	0	0	0	112.2	S102 K135 L138 R139	S102-S141 WeakPolarHBondContact O-CA 3.41Å; K135-S141 PolarHBondContact O-OG 3.24Å; L138-S141 VanDerWaalsContact O-CB 3.23Å; L138-S141 WeakPolarHBondContact O-CB 3.48Å; L138-S141 PolarHBondContact O-N 3.06Å; L138-S141 PolarHBondContact O-OG 3.4Å; R139-S141 VanDerWaalsContact C-N 3.29Å
142	L	98.4	Very high	98.2	Very high	26 Å²	26	60.8 Å²	60.8	14%	0.136	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-62	142.4	174.8	-65.6	167.9	0	0	0	110.8	S102 A105 M108 Q136 V140 E146 I147 L150	S102-L142 WeakPolarHBondContact O-CG 3.16Å; S102-L142 PolarHBondContact O-N 3.05Å; A105-L142 HydrophobicContact CB-CD1 3.99Å; A105-L142 HydrophobicContact CB-CD2 4.42Å; A105-L142 HydrophobicContact CB-CG 4.48Å; M108-L142 HydrophobicContact CE-CD1 3.68Å; Q136-L142 PolarHBondContact NE2-O 2.62Å; V140-L142 PolarHBondContact O-N 3.21Å; L142-E146 HydrophobicContact CB-CB 4.46Å; L142-E146 WeakPolarHBondContact CD2-OE2 3.23Å; L142-I147 HydrophobicContact CB-CD1 4.08Å; L142-I147 HydrophobicContact CB-CG1 3.68Å; L142-I147 HydrophobicContact CD1-CG1 4.37Å; L142-L150 HydrophobicContact CD1-CD1 3.75Å
143	A	98	Very high	98.2	Very high	54 Å²	54	60.6 Å²	60.6	45%	0.446	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-69.9	153.2	173.9	0	0	0	0	0	110.6	G145 E146 I147	A143-G145 PolarHBondContact O-N 3.43Å; A143-G145 VanDerWaalsContact O-N 3.15Å; A143-E146 HydrophobicContact CB-CG 4.44Å; A143-E146 PolarHBondContact N-OE2 3.1Å; A143-E146 WeakPolarHBondContact O-CB 3.39Å; A143-E146 PolarHBondContact O-N 2.95Å; A143-I147 PolarHBondContact O-N 2.87Å
144	Q	97.2	Very high	98.1	Very high	87 Å²	87	68.2 Å²	68.2	41%	0.407	34%	0.341	S	S	.	.	H	α-helix	trans	-53.5	-40.3	179.9	-70.9	-176.2	78.1	0	0	113	E146 I147 E148 L164 A166	Q144-E146 VanDerWaalsContact C-N 3.27Å; Q144-E146 PolarHBondContact O-N 2.89Å; Q144-I147 PolarHBondContact O-N 2.94Å; Q144-E148 WeakPolarHBondContact O-CB 3.3Å; Q144-E148 PolarHBondContact O-N 3.45Å; Q144-L164 HydrophobicContact CB-CD2 4.07Å; Q144-L164 VanDerWaalsContact O-CD2 3.27Å; Q144-L164 WeakPolarHBondContact O-CD2 3.27Å; Q144-A166 VanDerWaalsContact CD-CB 3.43Å; Q144-A166 HydrophobicContact CG-CB 3.74Å
145	G	97.9	Very high	98	Very high	42 Å²	42	74.1 Å²	74.1	43%	0.433	37%	0.368	S	S	.	.	H	α-helix	trans	-66.2	-26.4	178.4	0	0	0	0	0	114.1	A143 K149	A143-G145 PolarHBondContact O-N 3.43Å; A143-G145 VanDerWaalsContact O-N 3.15Å; G145-K149 WeakPolarHBondContact O-CD 3.44Å; G145-K149 VanDerWaalsContact O-CG 3.28Å; G145-K149 WeakPolarHBondContact O-CG 3.29Å; G145-K149 PolarHBondContact O-N 2.67Å
146	E	98.3	Very high	97.9	Very high	98 Å²	98	72 Å²	72	46%	0.458	36%	0.36	S	S	.	.	H	α-helix	trans	-78.8	-44.3	174.2	-63.9	178.3	148.3	0	0	110.6	L142 A143 Q144 E148 K149 L150	L142-E146 HydrophobicContact CB-CB 4.46Å; L142-E146 WeakPolarHBondContact CD2-OE2 3.23Å; A143-E146 HydrophobicContact CB-CG 4.44Å; A143-E146 PolarHBondContact N-OE2 3.1Å; A143-E146 WeakPolarHBondContact O-CB 3.39Å; A143-E146 PolarHBondContact O-N 2.95Å; Q144-E146 VanDerWaalsContact C-N 3.27Å; Q144-E146 PolarHBondContact O-N 2.89Å; E146-E148 VanDerWaalsContact C-N 3.33Å; E146-E148 PolarHBondContact O-N 3.31Å; E146-K149 WeakPolarHBondContact O-CB 3.39Å; E146-K149 PolarHBondContact O-N 2.94Å; E146-K149 VanDerWaalsContact O-N 3.16Å; E146-L150 WeakPolarHBondContact O-CB 3.46Å; E146-L150 WeakPolarHBondContact O-CG 3.4Å; E146-L150 PolarHBondContact O-N 2.83Å
147	I	98.7	Very high	97.5	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-59.7	-44.3	175.9	-63.5	172	0	0	0	110.7	V100 S102 M108 A133 L142 A143 Q144 K149 L150 L151 L164	V100-I147 HydrophobicContact CG2-CG2 4.06Å; S102-I147 WeakPolarHBondContact OG-CD1 3.2Å; M108-I147 HydrophobicContact CE-CG1 4.33Å; A133-I147 HydrophobicContact CB-CD1 3.48Å; A133-I147 VanDerWaalsContact CB-CD1 3.48Å; L142-I147 HydrophobicContact CB-CD1 4.08Å; L142-I147 HydrophobicContact CB-CG1 3.68Å; L142-I147 HydrophobicContact CD1-CG1 4.37Å; A143-I147 PolarHBondContact O-N 2.87Å; Q144-I147 PolarHBondContact O-N 2.94Å; I147-K149 VanDerWaalsContact C-N 3.27Å; I147-K149 PolarHBondContact O-N 2.88Å; I147-L150 PolarHBondContact O-N 2.87Å; I147-L151 HydrophobicContact CG2-CD1 3.57Å; I147-L151 HydrophobicContact CG2-CG 4.12Å; I147-L151 VanDerWaalsContact O-CB 3.3Å; I147-L151 WeakPolarHBondContact O-CB 3.21Å; I147-L151 WeakPolarHBondContact O-CG 3.38Å; I147-L151 PolarHBondContact O-N 3.47Å; I147-L164 HydrophobicContact CB-CD2 4.46Å; I147-L164 HydrophobicContact CG2-CD1 4.11Å; I147-L164 HydrophobicContact CG2-CD2 4.41Å
148	E	98.6	Very high	97	Very high	52 Å²	52	73.4 Å²	73.4	24%	0.243	38%	0.383	C	S	.	.	H	α-helix	trans	-56.7	-42	176.6	-175.7	-178.4	128.1	0	0	112	Q144 E146 A152 L153 K154 W162 L164	Q144-E148 WeakPolarHBondContact O-CB 3.3Å; Q144-E148 PolarHBondContact O-N 3.45Å; E146-E148 VanDerWaalsContact C-N 3.33Å; E146-E148 PolarHBondContact O-N 3.31Å; E148-A152 PolarHBondContact O-N 3.46Å; E148-L153 HydrophobicContact CB-CD1 4.37Å; E148-L153 HydrophobicContact CG-CB 4.19Å; E148-L153 HydrophobicContact CG-CD1 4.19Å; E148-L153 HydrophobicContact CG-CG 4.41Å; E148-L153 PolarHBondContact O-N 2.84Å; E148-L153 VanDerWaalsContact O-N 3.12Å; E148-K154 WeakPolarHBondContact OE1-CE 3.22Å; E148-K154 IonicContact OE1-NZ 3.07Å; E148-W162 HydrophobicContact CG-CH2 4.16Å; E148-L164 HydrophobicContact CB-CD2 3.93Å
149	K	98.5	Very high	96.5	Very high	169 Å²	169	73 Å²	73	74%	0.735	39%	0.391	S	S	*	.	H	α-helix	trans	-70.2	-50.5	178	-72.1	173	-175.1	177.5	0	111.6	G145 E146 I147 L151 A152	G145-K149 WeakPolarHBondContact O-CD 3.44Å; G145-K149 VanDerWaalsContact O-CG 3.28Å; G145-K149 WeakPolarHBondContact O-CG 3.29Å; G145-K149 PolarHBondContact O-N 2.67Å; E146-K149 WeakPolarHBondContact O-CB 3.39Å; E146-K149 PolarHBondContact O-N 2.94Å; E146-K149 VanDerWaalsContact O-N 3.16Å; I147-K149 VanDerWaalsContact C-N 3.27Å; I147-K149 PolarHBondContact O-N 2.88Å; K149-L151 VanDerWaalsContact C-N 3.3Å; K149-L151 PolarHBondContact O-N 2.92Å; K149-A152 WeakPolarHBondContact O-CA 3.34Å; K149-A152 PolarHBondContact O-N 2.86Å
150	L	98.6	Very high	96.5	Very high	73 Å²	73	61.2 Å²	61.2	38%	0.382	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-35.8	-177.1	-70.5	168.9	0	0	0	112.1	M108 K112 L142 E146 I147 A152	M108-L150 HydrophobicContact CB-CB 4.34Å; M108-L150 HydrophobicContact CB-CD1 4.36Å; M108-L150 HydrophobicContact CG-CB 3.45Å; M108-L150 VanDerWaalsContact CG-CB 3.45Å; M108-L150 HydrophobicContact CG-CD1 3.94Å; M108-L150 HydrophobicContact CG-CG 4.29Å; K112-L150 WeakPolarHBondContact CD-O 3.4Å; L142-L150 HydrophobicContact CD1-CD1 3.75Å; E146-L150 WeakPolarHBondContact O-CB 3.46Å; E146-L150 WeakPolarHBondContact O-CG 3.4Å; E146-L150 PolarHBondContact O-N 2.83Å; I147-L150 PolarHBondContact O-N 2.87Å; L150-A152 PolarHBondContact O-N 3.5Å
151	L	98.7	Very high	96.5	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-4.2	174.2	-64.6	179.5	0	0	0	113.6	V100 M108 A111 K112 L115 H116 V131 I147 K149 L153	V100-L151 HydrophobicContact CG1-CD1 3.95Å; V100-L151 HydrophobicContact CG1-CD2 4.35Å; V100-L151 HydrophobicContact CG2-CD1 4.37Å; M108-L151 HydrophobicContact CG-CD2 4.05Å; M108-L151 HydrophobicContact CG-CG 4.4Å; M108-L151 HydrophobicContact SD-CD1 4.37Å; M108-L151 HydrophobicContact SD-CD2 3.51Å; M108-L151 VanDerWaalsContact SD-CD2 3.51Å; M108-L151 HydrophobicContact SD-CG 3.82Å; A111-L151 HydrophobicContact CB-CD2 4.1Å; K112-L151 HydrophobicContact CB-CD2 4.09Å; L115-L151 HydrophobicContact CD2-CB 4.37Å; L115-L151 HydrophobicContact CD2-CD1 4.42Å; H116-L151 PolarHBondContact NE2-O 3.44Å; V131-L151 HydrophobicContact CG1-CD1 3.74Å; I147-L151 HydrophobicContact CG2-CD1 3.57Å; I147-L151 HydrophobicContact CG2-CG 4.12Å; I147-L151 VanDerWaalsContact O-CB 3.3Å; I147-L151 WeakPolarHBondContact O-CB 3.21Å; I147-L151 WeakPolarHBondContact O-CG 3.38Å; I147-L151 PolarHBondContact O-N 3.47Å; K149-L151 VanDerWaalsContact C-N 3.3Å; K149-L151 PolarHBondContact O-N 2.92Å; L151-L153 HydrophobicContact CB-CD2 3.58Å; L151-L153 HydrophobicContact CB-CG 3.89Å; L151-L153 HydrophobicContact CD1-CD2 4.16Å; L151-L153 PolarHBondContact O-N 2.81Å
152	A	98.4	Very high	96.5	Very high	10 Å²	10	60.5 Å²	60.5	8%	0.083	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	48	46.8	-176.5	0	0	0	0	0	112.2	K112 H116 E148 K149 L150 K154 E155	K112-A152 HydrophobicContact CD-CB 3.98Å; H116-A152 PolarHBondContact CE1-O 2.87Å; H116-A152 PolarHBondContact NE2-O 3.2Å; E148-A152 PolarHBondContact O-N 3.46Å; K149-A152 WeakPolarHBondContact O-CA 3.34Å; K149-A152 PolarHBondContact O-N 2.86Å; L150-A152 PolarHBondContact O-N 3.5Å; A152-K154 PolarHBondContact O-N 2.89Å; A152-E155 HydrophobicContact CB-CB 4.26Å; A152-E155 HydrophobicContact CB-CG 4.16Å; A152-E155 WeakPolarHBondContact O-CB 3.41Å; A152-E155 PolarHBondContact O-N 2.61Å
153	L	98.3	Very high	96.5	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-61.5	-31	-171.4	-62	-175.2	0	0	0	112.6	L115 V131 E148 L151 E155 L156 W162 L164	L115-L153 HydrophobicContact CD2-CD2 3.57Å; V131-L153 HydrophobicContact CG2-CD1 4.33Å; V131-L153 HydrophobicContact CG2-CD2 3.97Å; E148-L153 HydrophobicContact CB-CD1 4.37Å; E148-L153 HydrophobicContact CG-CB 4.19Å; E148-L153 HydrophobicContact CG-CD1 4.19Å; E148-L153 HydrophobicContact CG-CG 4.41Å; E148-L153 PolarHBondContact O-N 2.84Å; E148-L153 VanDerWaalsContact O-N 3.12Å; L151-L153 HydrophobicContact CB-CD2 3.58Å; L151-L153 HydrophobicContact CB-CG 3.89Å; L151-L153 HydrophobicContact CD1-CD2 4.16Å; L151-L153 PolarHBondContact O-N 2.81Å; L153-E155 PolarHBondContact O-N 3.3Å; L153-L156 HydrophobicContact CD2-CD1 4.11Å; L153-L156 WeakPolarHBondContact O-CB 3.39Å; L153-L156 WeakPolarHBondContact O-CG 3.47Å; L153-L156 PolarHBondContact O-N 3.33Å; L153-L156 VanDerWaalsContact O-N 3.16Å; L153-W162 HydrophobicContact CB-CD2 4.09Å; L153-W162 HydrophobicContact CB-CE3 4.13Å; L153-W162 HydrophobicContact CB-CH2 3.87Å; L153-W162 HydrophobicContact CB-CZ2 3.8Å; L153-W162 HydrophobicContact CB-CZ3 4.03Å; L153-W162 HydrophobicContact CD1-CE3 3.89Å; L153-W162 HydrophobicContact CD1-CH2 4.35Å; L153-W162 HydrophobicContact CD1-CZ3 3.76Å; L153-W162 PolarHBondContact O-NE1 2.87Å; L153-W162 VanDerWaalsContact O-NE1 3.1Å; L153-L164 HydrophobicContact CD1-CB 4.08Å; L153-L164 HydrophobicContact CD1-CD1 4.38Å; L153-L164 HydrophobicContact CD1-CD2 4.24Å; L153-L164 HydrophobicContact CD1-CG 4.48Å
154	K	96.8	Very high	96.5	Very high	160 Å²	160	59.7 Å²	59.7	70%	0.696	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-62.9	-23.8	174.5	-61.9	-173.8	-173.6	177.9	0	113.1	E148 A152 W162	E148-K154 WeakPolarHBondContact OE1-CE 3.22Å; E148-K154 IonicContact OE1-NZ 3.07Å; A152-K154 PolarHBondContact O-N 2.89Å; K154-W162 HydrophobicContact CG-CZ2 4.44Å
155	E	97.3	Very high	96.6	Very high	128 Å²	128	57 Å²	57	60%	0.598	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-87.8	-1	179.3	-60.5	175.9	-158.5	0	0	113.5	K120 A152 L153 G157	K120-E155 WeakPolarHBondContact CE-O 3.34Å; K120-E155 PolarHBondContact NZ-O 3.23Å; A152-E155 HydrophobicContact CB-CB 4.26Å; A152-E155 HydrophobicContact CB-CG 4.16Å; A152-E155 WeakPolarHBondContact O-CB 3.41Å; A152-E155 PolarHBondContact O-N 2.61Å; L153-E155 PolarHBondContact O-N 3.3Å; E155-G157 PolarHBondContact O-N 3.37Å
156	L	95.3	Very high	96.6	Very high	7 Å²	7	56 Å²	56	4%	0.037	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-63.2	-22.3	169.1	-69.2	176.2	0	0	0	111.9	L115 A119 L153 T160 W162	L115-L156 HydrophobicContact CG-CD2 4.44Å; A119-L156 HydrophobicContact CB-CD2 3.74Å; L153-L156 HydrophobicContact CD2-CD1 4.11Å; L153-L156 WeakPolarHBondContact O-CB 3.39Å; L153-L156 WeakPolarHBondContact O-CG 3.47Å; L153-L156 PolarHBondContact O-N 3.33Å; L153-L156 VanDerWaalsContact O-N 3.16Å; L156-T160 HydrophobicContact CB-CG2 4.35Å; L156-W162 HydrophobicContact CD1-CB 4.24Å; L156-W162 HydrophobicContact CD1-CG 4.09Å
157	G	90.4	Very high	96.6	Very high	27 Å²	27	51.5 Å²	51.5	28%	0.278	28%	0.276	S	S	.	.			trans	85.3	166.4	174.7	0	0	0	0	0	113.7	E155 A159 T160	E155-G157 PolarHBondContact O-N 3.37Å; G157-A159 PolarHBondContact O-N 3.45Å; G157-T160 PolarHBondContact O-N 3.42Å
158	P	87.9	Confident	96.6	Very high	144 Å²	144	51.6 Å²	51.6	94%	0.935	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-18.4	-172	28.1	-36	0	0	0	113.6	T160	P158-T160 VanDerWaalsContact C-N 3.29Å
159	A	87.9	Confident	96.6	Very high	66 Å²	66	49.2 Å²	49.2	55%	0.545	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-12.9	179.3	0	0	0	0	0	113.2	G126 G157 P161	G126-A159 WeakPolarHBondContact CA-O 3.19Å; G126-A159 PolarHBondContact N-O 3.17Å; G157-A159 PolarHBondContact O-N 3.45Å; A159-P161 WeakPolarHBondContact O-CD 3.5Å
160	T	95	Very high	96.6	Very high	11 Å²	11	44.9 Å²	44.9	7%	0.067	25%	0.25	C	C	.	.	S	Bend	trans	-116.3	96.2	-176.7	-57.9	0	0	0	0	109.1	A119 V129 L156 G157 P158 W162	A119-T160 HydrophobicContact CB-CG2 4.17Å; V129-T160 HydrophobicContact CG2-CG2 3.92Å; L156-T160 HydrophobicContact CB-CG2 4.35Å; G157-T160 PolarHBondContact O-N 3.42Å; P158-T160 VanDerWaalsContact C-N 3.29Å; T160-W162 PolarHBondContact O-N 3.17Å
161	P	97.3	Very high	96.5	Very high	44 Å²	44	46.3 Å²	46.3	29%	0.286	26%	0.257	S	S	.	.			trans	-61.7	133.3	173.4	-18.1	31.3	0	0	0	109.7	P128 V129 A159 M185	P128-P161 CarbonylContact C-O 3.58Å; P128-P161 VanDerWaalsContact CA-O 3.28Å; P128-P161 WeakPolarHBondContact CA-O 3.36Å; P128-P161 HydrophobicContact CB-CB 4.28Å; V129-P161 PolarHBondContact N-O 3.4Å; A159-P161 WeakPolarHBondContact O-CD 3.5Å; P161-M185 HydrophobicContact CB-CB 4.49Å; P161-M185 HydrophobicContact CB-CG 4.41Å; P161-M185 HydrophobicContact CB-SD 3.71Å
162	W	98.5	Very high	96.4	Very high	72 Å²	72	47.3 Å²	47.3	27%	0.273	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	157.2	177	62.1	-96.3	0	0	0	112.2	V129 E148 L153 K154 L156 T160 L164	V129-W162 HydrophobicContact CB-CB 4.41Å; V129-W162 CarbonylContact O-C 3.57Å; V129-W162 WeakPolarHBondContact O-CA 2.93Å; V129-W162 WeakPolarHBondContact O-CB 3.42Å; E148-W162 HydrophobicContact CG-CH2 4.16Å; L153-W162 HydrophobicContact CB-CD2 4.09Å; L153-W162 HydrophobicContact CB-CE3 4.13Å; L153-W162 HydrophobicContact CB-CH2 3.87Å; L153-W162 HydrophobicContact CB-CZ2 3.8Å; L153-W162 HydrophobicContact CB-CZ3 4.03Å; L153-W162 HydrophobicContact CD1-CE3 3.89Å; L153-W162 HydrophobicContact CD1-CH2 4.35Å; L153-W162 HydrophobicContact CD1-CZ3 3.76Å; L153-W162 PolarHBondContact O-NE1 2.87Å; L153-W162 VanDerWaalsContact O-NE1 3.1Å; K154-W162 HydrophobicContact CG-CZ2 4.44Å; L156-W162 HydrophobicContact CD1-CB 4.24Å; L156-W162 HydrophobicContact CD1-CG 4.09Å; T160-W162 PolarHBondContact O-N 3.17Å; W162-L164 HydrophobicContact CZ3-CB 4.27Å
163	H	98.7	Very high	96.4	Very high	53 Å²	53	53 Å²	53	25%	0.245	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137.9	171	-179.3	64.6	0	0	0	108.9	V129 L130 V131 Q165 E181 M185	V129-H163 PolarHBondContact O-N 3.38Å; L130-H163 HydrophobicContact CD1-CB 4.24Å; V131-H163 PolarHBondContact N-O 3.05Å; H163-Q165 PolarHBondContact NE2-OE1 2.79Å; H163-Q165 VanDerWaalsContact NE2-OE1 3.08Å; H163-E181 HydrophobicContact CB-CB 4.24Å; H163-M185 HydrophobicContact CB-CE 3.82Å
164	L	98.8	Very high	96.4	Very high	11 Å²	11	53.4 Å²	53.4	6%	0.058	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.3	172.8	178.3	62.3	0	0	0	108.7	V131 A133 Q144 I147 E148 L153 W162	V131-L164 HydrophobicContact CB-CD1 3.83Å; V131-L164 HydrophobicContact CG1-CD1 3.6Å; V131-L164 WeakPolarHBondContact O-CA 3.38Å; A133-L164 HydrophobicContact CB-CD1 4.01Å; Q144-L164 HydrophobicContact CB-CD2 4.07Å; Q144-L164 VanDerWaalsContact O-CD2 3.27Å; Q144-L164 WeakPolarHBondContact O-CD2 3.27Å; I147-L164 HydrophobicContact CB-CD2 4.46Å; I147-L164 HydrophobicContact CG2-CD1 4.11Å; I147-L164 HydrophobicContact CG2-CD2 4.41Å; E148-L164 HydrophobicContact CB-CD2 3.93Å; L153-L164 HydrophobicContact CD1-CB 4.08Å; L153-L164 HydrophobicContact CD1-CD1 4.38Å; L153-L164 HydrophobicContact CD1-CD2 4.24Å; L153-L164 HydrophobicContact CD1-CG 4.48Å; W162-L164 HydrophobicContact CZ3-CB 4.27Å
165	Q	98.8	Very high	96.4	Very high	30 Å²	30	46.2 Å²	46.2	14%	0.14	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	118.2	-179.6	-176	64.6	50.3	0	0	110.5	L130 V131 A133 H163 C167 G174	L130-Q165 HydrophobicContact CD1-CB 3.96Å; V131-Q165 PolarHBondContact O-N 3.35Å; A133-Q165 PolarHBondContact N-O 3.32Å; H163-Q165 PolarHBondContact NE2-OE1 2.79Å; H163-Q165 VanDerWaalsContact NE2-OE1 3.08Å; Q165-C167 VanDerWaalsContact CG-SG 3.53Å; Q165-G174 VanDerWaalsContact CG-O 3.24Å; Q165-G174 WeakPolarHBondContact CG-O 3.45Å
166	A	98.6	Very high	96.2	Very high	21 Å²	21	47.7 Å²	47.7	17%	0.174	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	132.4	164.7	0	0	0	0	0	110.6	Q136 Q144	Q136-A166 HydrophobicContact CG-CB 4.03Å; Q144-A166 VanDerWaalsContact CD-CB 3.43Å; Q144-A166 HydrophobicContact CG-CB 3.74Å
167	C	98.5	Very high	96.3	Very high	3 Å²	3	52 Å²	52	2%	0.02	29%	0.289	C	S	.	.			trans	-144.6	154.8	-177.3	-66.9	0	0	0	0	113	V132 A133 N134 K135 Q136 Q165 E173 L175	V132-C167 HydrophobicContact CG1-CB 3.7Å; A133-C167 PolarHBondContact O-N 2.84Å; N134-C167 CarbonylContact C-O 3.54Å; N134-C167 WeakPolarHBondContact CA-O 3.1Å; K135-C167 PolarHBondContact N-O 2.8Å; K135-C167 VanDerWaalsContact N-O 3.17Å; Q136-C167 PolarHBondContact N-O 2.97Å; Q165-C167 VanDerWaalsContact CG-SG 3.53Å; C167-E173 VanDerWaalsContact CA-O 3.23Å; C167-E173 WeakPolarHBondContact CA-O 3.37Å; C167-E173 WeakPolarHBondContact CB-O 3.08Å; C167-L175 HydrophobicContact CB-CD2 3.9Å
168	C	98.4	Very high	96.6	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.014	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-124.6	97.9	163.4	179.2	0	0	0	0	109.1	D137 I170 I171 G172 E173	D137-C168 VanDerWaalsContact CG-SG 3.52Å; D137-C168 PolarHBondContact OD1-SG 3.16Å; C168-I170 PolarHBondContact O-N 2.88Å; C168-I170 WeakPolarHBondContact SG-CG1 3.35Å; C168-I171 HydrophobicContact CB-CD1 4.01Å; C168-I171 HydrophobicContact CB-CG1 3.8Å; C168-I171 PolarHBondContact O-N 3.38Å; C168-I171 VanDerWaalsContact O-N 3.16Å; C168-G172 WeakPolarHBondContact O-CA 3.27Å; C168-G172 PolarHBondContact O-N 3.26Å; C168-E173 HydrophobicContact CB-CB 4.25Å; C168-E173 PolarHBondContact N-O 2.82Å; C168-E173 VanDerWaalsContact N-O 3.1Å; C168-E173 PolarHBondContact O-N 3.4Å
169	A	97.9	Very high	97	Very high	2 Å²	2	44 Å²	44	2%	0.017	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.6	-175.4	0	0	0	0	0	113.7	T35 V36 R39 N134 I171	T35-A169 HydrophobicContact CG2-CB 3.86Å; V36-A169 HydrophobicContact CG2-CB 3.75Å; R39-A169 WeakPolarHBondContact CB-O 3.4Å; R39-A169 WeakPolarHBondContact CG-O 3.4Å; R39-A169 PolarHBondContact NE-O 3.47Å; N134-A169 VanDerWaalsContact OD1-CB 3.29Å; N134-A169 WeakPolarHBondContact OD1-CB 3.35Å; N134-A169 PolarHBondContact OD1-N 3.45Å; A169-I171 PolarHBondContact O-N 3.05Å
170	I	97.8	Very high	97.4	Very high	78 Å²	78	43.2 Å²	43.2	40%	0.4	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-9.7	179.9	64.4	160.1	0	0	0	113.7	T35 R39 F45 C168	T35-I170 HydrophobicContact CG2-CG2 4.27Å; R39-I170 PolarHBondContact NH2-O 2.84Å; F45-I170 HydrophobicContact CD2-CB 4.09Å; F45-I170 HydrophobicContact CD2-CG2 3.88Å; F45-I170 HydrophobicContact CE2-CB 4.35Å; F45-I170 HydrophobicContact CE2-CG2 3.67Å; C168-I170 PolarHBondContact O-N 2.88Å; C168-I170 WeakPolarHBondContact SG-CG1 3.35Å
171	I	96.9	Very high	97.5	Very high	104 Å²	104	45.6 Å²	45.6	53%	0.533	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128	-10.3	171	68	-173.3	0	0	0	113	C168 A169 E173	C168-I171 HydrophobicContact CB-CD1 4.01Å; C168-I171 HydrophobicContact CB-CG1 3.8Å; C168-I171 PolarHBondContact O-N 3.38Å; C168-I171 VanDerWaalsContact O-N 3.16Å; A169-I171 PolarHBondContact O-N 3.05Å; I171-E173 HydrophobicContact CD1-CB 4.17Å; I171-E173 HydrophobicContact CG1-CB 4Å
172	G	96.9	Very high	97.5	Very high	21 Å²	21	43.5 Å²	43.5	22%	0.216	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	4.9	177.7	0	0	0	0	0	115.8	R39 C168 L175	R39-G172 VanDerWaalsContact CG-CA 3.49Å; C168-G172 WeakPolarHBondContact O-CA 3.27Å; C168-G172 PolarHBondContact O-N 3.26Å; G172-L175 PolarHBondContact O-N 2.99Å
173	E	98	Very high	97.4	Very high	130 Å²	130	40.8 Å²	40.8	61%	0.607	21%	0.205	S	C	*	.	B	Isolated β-bridge	trans	-60.6	137	177.2	-170.8	177	177.6	0	0	111.2	C167 C168 I171 L175	C167-E173 VanDerWaalsContact CA-O 3.23Å; C167-E173 WeakPolarHBondContact CA-O 3.37Å; C167-E173 WeakPolarHBondContact CB-O 3.08Å; C168-E173 HydrophobicContact CB-CB 4.25Å; C168-E173 PolarHBondContact N-O 2.82Å; C168-E173 VanDerWaalsContact N-O 3.1Å; C168-E173 PolarHBondContact O-N 3.4Å; I171-E173 HydrophobicContact CD1-CB 4.17Å; I171-E173 HydrophobicContact CG1-CB 4Å; E173-L175 PolarHBondContact O-N 3.3Å; E173-L175 VanDerWaalsContact O-N 3.09Å
174	G	97.7	Very high	97.3	Very high	8 Å²	8	43.4 Å²	43.4	8%	0.082	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	-16.7	178.3	0	0	0	0	0	115.9	Q165 R176 D177 G178	Q165-G174 VanDerWaalsContact CG-O 3.24Å; Q165-G174 WeakPolarHBondContact CG-O 3.45Å; G174-R176 PolarHBondContact O-N 3.03Å; G174-D177 PolarHBondContact O-N 2.86Å; G174-G178 PolarHBondContact O-N 3.2Å
175	L	96.9	Very high	97.2	Very high	9 Å²	9	44 Å²	44	5%	0.047	22%	0.219	C	C	.	.	H	α-helix	trans	-65.3	-40.7	-174.1	-64.9	-175.2	0	0	0	113.2	V36 R39 L40 V132 C167 G172 E173 L179	V36-L175 HydrophobicContact CB-CD2 4.49Å; V36-L175 HydrophobicContact CG1-CD2 3.97Å; V36-L175 HydrophobicContact CG2-CD2 4.01Å; R39-L175 HydrophobicContact CB-CD1 3.75Å; R39-L175 HydrophobicContact CG-CD1 3.38Å; L40-L175 HydrophobicContact CD2-CB 4Å; L40-L175 HydrophobicContact CG-CD1 4.37Å; V132-L175 HydrophobicContact CG1-CD2 4.47Å; C167-L175 HydrophobicContact CB-CD2 3.9Å; G172-L175 PolarHBondContact O-N 2.99Å; E173-L175 PolarHBondContact O-N 3.3Å; E173-L175 VanDerWaalsContact O-N 3.09Å; L175-L179 WeakPolarHBondContact O-CB 3.23Å; L175-L179 PolarHBondContact O-N 3.3Å
176	R	94.6	Very high	97.1	Very high	159 Å²	159	42.7 Å²	42.7	60%	0.6	21%	0.213	S	C	*	.	H	α-helix	trans	-68.1	-44.5	178	-69.4	-173	-178.5	-168.6	3	111.1	G174 G178 L179 D180	G174-R176 PolarHBondContact O-N 3.03Å; R176-G178 VanDerWaalsContact C-N 3.32Å; R176-G178 PolarHBondContact O-N 2.62Å; R176-L179 PolarHBondContact O-N 3.46Å; R176-L179 VanDerWaalsContact O-N 3.12Å; R176-D180 PolarHBondContact O-N 2.98Å
177	D	96.1	Very high	96.9	Very high	98 Å²	98	44.1 Å²	44.1	52%	0.524	22%	0.216	S	C	.	.	H	α-helix	trans	-60.5	-43.1	178.3	-55.2	-46.2	0	0	0	111.5	G174 L179 D180 E181	G174-D177 PolarHBondContact O-N 2.86Å; D177-L179 PolarHBondContact O-N 3.44Å; D177-D180 WeakPolarHBondContact O-CB 3.4Å; D177-D180 PolarHBondContact O-N 3.48Å; D177-E181 PolarHBondContact O-N 3.37Å
178	G	97.8	Very high	96.7	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-62.6	-41.7	174.3	0	0	0	0	0	112.7	L130 G174 R176 E181 L182	L130-G178 VanDerWaalsContact CD2-C 3.48Å; L130-G178 WeakPolarHBondContact CD2-O 3.42Å; G174-G178 PolarHBondContact O-N 3.2Å; R176-G178 VanDerWaalsContact C-N 3.32Å; R176-G178 PolarHBondContact O-N 2.62Å; G178-E181 PolarHBondContact O-N 3.28Å; G178-L182 WeakPolarHBondContact O-CB 3.25Å; G178-L182 PolarHBondContact O-N 2.92Å
179	L	96.4	Very high	96.5	Very high	2 Å²	2	53 Å²	53	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-68.7	-35.6	178.9	-168.6	61.1	0	0	0	112.3	L40 V61 F71 F73 L175 R176 D177 L182 H183	L40-L179 HydrophobicContact CD2-CD2 4.26Å; V61-L179 HydrophobicContact CB-CD2 4.3Å; V61-L179 HydrophobicContact CG1-CD2 4.2Å; V61-L179 HydrophobicContact CG2-CD2 3.75Å; F71-L179 HydrophobicContact CD1-CD1 4.09Å; F71-L179 HydrophobicContact CD2-CD1 4.28Å; F71-L179 HydrophobicContact CD2-CD2 3.9Å; F71-L179 HydrophobicContact CD2-CG 4.34Å; F71-L179 HydrophobicContact CE1-CD1 3.78Å; F71-L179 HydrophobicContact CE1-CG 4.38Å; F71-L179 HydrophobicContact CE2-CD1 3.97Å; F71-L179 HydrophobicContact CE2-CD2 3.67Å; F71-L179 HydrophobicContact CE2-CG 3.77Å; F71-L179 HydrophobicContact CG-CD1 4.32Å; F71-L179 HydrophobicContact CZ-CD1 3.7Å; F71-L179 HydrophobicContact CZ-CD2 4.21Å; F71-L179 HydrophobicContact CZ-CG 3.79Å; F73-L179 HydrophobicContact CE1-CD1 4.4Å; F73-L179 HydrophobicContact CZ-CD1 3.99Å; F73-L179 HydrophobicContact CZ-CD2 4.39Å; L175-L179 WeakPolarHBondContact O-CB 3.23Å; L175-L179 PolarHBondContact O-N 3.3Å; R176-L179 PolarHBondContact O-N 3.46Å; R176-L179 VanDerWaalsContact O-N 3.12Å; D177-L179 PolarHBondContact O-N 3.44Å; L179-L182 HydrophobicContact CD1-CD2 4.31Å; L179-L182 PolarHBondContact O-N 3.07Å; L179-H183 VanDerWaalsContact O-CB 3.3Å; L179-H183 WeakPolarHBondContact O-CB 3.33Å; L179-H183 PolarHBondContact O-N 2.82Å
180	D	95.5	Very high	96.3	Very high	48 Å²	48	55.7 Å²	55.7	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-58.3	-48.4	170.7	-88.7	38.8	0	0	0	110.8	L63 R176 D177 H183 K184	L63-D180 WeakPolarHBondContact CD2-OD1 3.27Å; R176-D180 PolarHBondContact O-N 2.98Å; D177-D180 WeakPolarHBondContact O-CB 3.4Å; D177-D180 PolarHBondContact O-N 3.48Å; D180-H183 PolarHBondContact O-N 2.9Å; D180-K184 VanDerWaalsContact O-CG 3.32Å; D180-K184 WeakPolarHBondContact O-CG 3.49Å; D180-K184 PolarHBondContact O-N 3.26Å
181	E	97.5	Very high	96	Very high	61 Å²	61	58.2 Å²	58.2	29%	0.285	27%	0.27	S	S	.	.	H	α-helix	trans	-65.1	-43.8	177.7	-71.9	-53.3	139.9	0	0	112.5	H163 D177 G178 H183 K184 M185	H163-E181 HydrophobicContact CB-CB 4.24Å; D177-E181 PolarHBondContact O-N 3.37Å; G178-E181 PolarHBondContact O-N 3.28Å; E181-H183 VanDerWaalsContact C-N 3.29Å; E181-H183 PolarHBondContact O-N 3.5Å; E181-K184 WeakPolarHBondContact O-CB 3.34Å; E181-K184 PolarHBondContact O-N 3.49Å; E181-K184 IonicContact OE1-NZ 2.64Å; E181-K184 PolarHBondContact OE1-NZ 3.06Å; E181-M185 WeakPolarHBondContact O-CG 3.28Å; E181-M185 PolarHBondContact O-N 3.07Å
182	L	97.9	Very high	95.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-56.8	-46.6	174.3	-177.9	57.7	0	0	0	111	I23 I97 P128 L130 G178 L179 K184 M185 I186	I23-L182 HydrophobicContact CD1-CD2 4.17Å; I23-L182 HydrophobicContact CG2-CD2 4.24Å; I97-L182 HydrophobicContact CD1-CD2 4.15Å; I97-L182 HydrophobicContact CG1-CD2 3.73Å; P128-L182 HydrophobicContact CB-CD1 4.07Å; L130-L182 HydrophobicContact CB-CB 4.15Å; L130-L182 HydrophobicContact CB-CD1 4.14Å; L130-L182 HydrophobicContact CB-CD2 4.2Å; L130-L182 HydrophobicContact CB-CG 4.39Å; L130-L182 HydrophobicContact CD2-CB 4.31Å; L130-L182 HydrophobicContact CD2-CD2 4.45Å; G178-L182 WeakPolarHBondContact O-CB 3.25Å; G178-L182 PolarHBondContact O-N 2.92Å; L179-L182 HydrophobicContact CD1-CD2 4.31Å; L179-L182 PolarHBondContact O-N 3.07Å; L182-K184 PolarHBondContact O-N 3.43Å; L182-M185 HydrophobicContact CD1-CE 4.31Å; L182-M185 PolarHBondContact O-N 2.6Å; L182-I186 HydrophobicContact CD1-CD1 4.18Å; L182-I186 HydrophobicContact CD1-CG1 4.37Å; L182-I186 HydrophobicContact CG-CD1 3.9Å; L182-I186 VanDerWaalsContact O-CG1 3.24Å; L182-I186 WeakPolarHBondContact O-CG1 3.43Å; L182-I186 PolarHBondContact O-N 3.37Å
183	H	96.1	Very high	95.4	Very high	16 Å²	16	59.9 Å²	59.9	7%	0.074	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-43.5	177.8	177.3	-129.1	0	0	0	112.4	F21 L63 F71 L179 D180 E181 M185 I186 Q187	F21-H183 AromaticContact CE2-CD2 3.49Å; F21-H183 VanDerWaalsContact CE2-CD2 3.49Å; F21-H183 WeakPolarHBondContact CE2-CD2 3.29Å; F21-H183 AromaticContact CE2-NE2 3.56Å; F21-H183 AromaticContact CZ-CD2 3.35Å; F21-H183 WeakPolarHBondContact CZ-CD2 3.44Å; F21-H183 AromaticContact CZ-NE2 3.39Å; F21-H183 WeakPolarHBondContact CZ-NE2 3.33Å; L63-H183 HydrophobicContact CD1-CB 3.77Å; L63-H183 VanDerWaalsContact CD1-CG 3.48Å; L63-H183 WeakPolarHBondContact CD1-ND1 3.33Å; F71-H183 HydrophobicContact CZ-CB 4.19Å; L179-H183 VanDerWaalsContact O-CB 3.3Å; L179-H183 WeakPolarHBondContact O-CB 3.33Å; L179-H183 PolarHBondContact O-N 2.82Å; D180-H183 PolarHBondContact O-N 2.9Å; E181-H183 VanDerWaalsContact C-N 3.29Å; E181-H183 PolarHBondContact O-N 3.5Å; H183-M185 VanDerWaalsContact C-N 3.35Å; H183-M185 PolarHBondContact O-N 3.44Å; H183-I186 PolarHBondContact O-N 3.09Å; H183-Q187 PolarHBondContact CE1-NE2 3.01Å; H183-Q187 PolarHBondContact NE2-NE2 3.08Å; H183-Q187 WeakPolarHBondContact O-CG 3.14Å; H183-Q187 PolarHBondContact O-N 3.2Å
184	K	95.6	Very high	95	Very high	107 Å²	107	61.8 Å²	61.8	47%	0.465	28%	0.275	S	S	.	.	H	α-helix	trans	-58.6	-46.1	175.3	-70.7	168.6	-165.3	169.2	0	111.1	D180 E181 L182 Q187 K188	D180-K184 VanDerWaalsContact O-CG 3.32Å; D180-K184 WeakPolarHBondContact O-CG 3.49Å; D180-K184 PolarHBondContact O-N 3.26Å; E181-K184 WeakPolarHBondContact O-CB 3.34Å; E181-K184 PolarHBondContact O-N 3.49Å; E181-K184 IonicContact OE1-NZ 2.64Å; E181-K184 PolarHBondContact OE1-NZ 3.06Å; L182-K184 PolarHBondContact O-N 3.43Å; K184-Q187 PolarHBondContact O-N 2.75Å; K184-K188 PolarHBondContact O-N 2.85Å
185	M	97.6	Very high	94.6	Very high	25 Å²	25	67.2 Å²	67.2	12%	0.123	30%	0.298	C	S	.	.	H	α-helix	trans	-62.6	-43.4	177.6	-66.5	-167.2	-75.7	0	0	112.2	P128 P161 H163 E181 L182 H183 Q187 K188 R189	P128-M185 HydrophobicContact CB-CB 3.56Å; P128-M185 HydrophobicContact CB-CE 4.06Å; P128-M185 HydrophobicContact CB-CG 4.47Å; P128-M185 HydrophobicContact CB-SD 4.13Å; P128-M185 HydrophobicContact CG-CB 3.81Å; P161-M185 HydrophobicContact CB-CB 4.49Å; P161-M185 HydrophobicContact CB-CG 4.41Å; P161-M185 HydrophobicContact CB-SD 3.71Å; H163-M185 HydrophobicContact CB-CE 3.82Å; E181-M185 WeakPolarHBondContact O-CG 3.28Å; E181-M185 PolarHBondContact O-N 3.07Å; L182-M185 HydrophobicContact CD1-CE 4.31Å; L182-M185 PolarHBondContact O-N 2.6Å; H183-M185 VanDerWaalsContact C-N 3.35Å; H183-M185 PolarHBondContact O-N 3.44Å; M185-Q187 PolarHBondContact O-N 3.11Å; M185-K188 PolarHBondContact O-N 3.23Å; M185-R189 PolarHBondContact O-N 2.89Å
186	I	96.4	Very high	94.1	Very high	1 Å²	1	72.4 Å²	72.4	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-60.9	-45.8	176.6	-67.2	168.5	0	0	0	110.9	F21 I23 D94 P128 L182 H183 K188 R189 R190	F21-I186 HydrophobicContact CD1-CD1 4.5Å; F21-I186 HydrophobicContact CD1-CG2 3.62Å; F21-I186 HydrophobicContact CE1-CB 4.5Å; F21-I186 HydrophobicContact CE1-CG2 3.53Å; I23-I186 HydrophobicContact CD1-CD1 3.69Å; D94-I186 HydrophobicContact CB-CD1 4.09Å; D94-I186 HydrophobicContact CB-CG1 4.44Å; D94-I186 HydrophobicContact CB-CG2 4.02Å; D94-I186 WeakPolarHBondContact O-CG1 3.28Å; P128-I186 HydrophobicContact CG-CG1 4.14Å; L182-I186 HydrophobicContact CD1-CD1 4.18Å; L182-I186 HydrophobicContact CD1-CG1 4.37Å; L182-I186 HydrophobicContact CG-CD1 3.9Å; L182-I186 VanDerWaalsContact O-CG1 3.24Å; L182-I186 WeakPolarHBondContact O-CG1 3.43Å; L182-I186 PolarHBondContact O-N 3.37Å; H183-I186 PolarHBondContact O-N 3.09Å; I186-K188 VanDerWaalsContact C-N 3.34Å; I186-K188 PolarHBondContact O-N 2.84Å; I186-R189 PolarHBondContact O-N 3.38Å; I186-R190 HydrophobicContact CG2-CG 4.41Å; I186-R190 WeakPolarHBondContact O-CG 2.96Å; I186-R190 PolarHBondContact O-N 2.95Å
187	Q	94	Very high	93.6	Very high	51 Å²	51	72.9 Å²	72.9	24%	0.238	33%	0.329	C	S	.	.	H	α-helix	trans	-61.6	-42.6	177.9	-73.7	-170	-8.3	0	0	111.9	H183 K184 M185 R190 K191	H183-Q187 PolarHBondContact CE1-NE2 3.01Å; H183-Q187 PolarHBondContact NE2-NE2 3.08Å; H183-Q187 WeakPolarHBondContact O-CG 3.14Å; H183-Q187 PolarHBondContact O-N 3.2Å; K184-Q187 PolarHBondContact O-N 2.75Å; M185-Q187 PolarHBondContact O-N 3.11Å; Q187-R190 PolarHBondContact O-N 3.42Å; Q187-K191 WeakPolarHBondContact O-CG 3.48Å; Q187-K191 PolarHBondContact O-N 3.01Å
188	K	95	Very high	92.8	Very high	145 Å²	145	76.9 Å²	76.9	63%	0.63	34%	0.341	S	S	*	.	H	α-helix	trans	-58.8	-48.8	175.6	-172.5	179.3	178.5	-178.8	0	110.6	K184 M185 I186 K191 M192	K184-K188 PolarHBondContact O-N 2.85Å; M185-K188 PolarHBondContact O-N 3.23Å; I186-K188 VanDerWaalsContact C-N 3.34Å; I186-K188 PolarHBondContact O-N 2.84Å; K188-K191 PolarHBondContact O-N 2.76Å; K188-M192 HydrophobicContact CG-CE 4.29Å; K188-M192 WeakPolarHBondContact O-CG 3.47Å; K188-M192 PolarHBondContact O-N 2.68Å
189	R	94.5	Very high	91.6	Very high	46 Å²	46	85.7 Å²	85.7	17%	0.174	38%	0.379	C	S	.	.	H	α-helix	trans	-57	-51.5	175.9	-173.9	-167.7	-173.4	-166.2	5.7	112.3	T93 Q125 G126 M185 I186 K191 M192 L193	T93-R189 PolarHBondContact O-NH1 3.28Å; Q125-R189 PolarHBondContact O-NH2 2.94Å; G126-R189 WeakPolarHBondContact O-CD 2.86Å; G126-R189 PolarHBondContact O-NE 3.24Å; M185-R189 PolarHBondContact O-N 2.89Å; I186-R189 PolarHBondContact O-N 3.38Å; R189-K191 VanDerWaalsContact C-N 3.29Å; R189-K191 PolarHBondContact O-N 3.27Å; R189-M192 HydrophobicContact CB-CE 4.5Å; R189-M192 PolarHBondContact O-N 3.16Å; R189-M192 VanDerWaalsContact O-N 3.16Å; R189-L193 HydrophobicContact CG-CD1 4.1Å; R189-L193 HydrophobicContact CG-CG 4.5Å; R189-L193 WeakPolarHBondContact O-CG 3.4Å; R189-L193 PolarHBondContact O-N 3.33Å
190	R	92.6	Very high	89.9	Confident	60 Å²	60	98.8 Å²	98.8	23%	0.226	43%	0.429	C	S	.	.	H	α-helix	trans	-59.9	-38.1	-179.9	-74.8	-179.1	171.1	-168.7	0.6	111.9	S20 F21 D94 I186 Q187 R194	S20-R190 PolarHBondContact O-NH2 3.42Å; F21-R190 VanDerWaalsContact CE1-CZ 3.49Å; F21-R190 VanDerWaalsContact CE1-NH1 3.27Å; D94-R190 IonicContact OD1-CZ 2.65Å; D94-R190 VanDerWaalsContact OD1-CZ 3.26Å; D94-R190 IonicContact OD1-NE 2.87Å; D94-R190 PolarHBondContact OD1-NE 3.43Å; D94-R190 IonicContact OD1-NH2 3.98Å; D94-R190 PolarHBondContact OD1-NH2 2.96Å; D94-R190 IonicContact OD2-CZ 3.26Å; D94-R190 IonicContact OD2-NH2 2.7Å; D94-R190 PolarHBondContact OD2-NH2 2.96Å; I186-R190 HydrophobicContact CG2-CG 4.41Å; I186-R190 WeakPolarHBondContact O-CG 2.96Å; I186-R190 PolarHBondContact O-N 2.95Å; Q187-R190 PolarHBondContact O-N 3.42Å; R190-R194 VanDerWaalsContact O-CG 3.27Å; R190-R194 WeakPolarHBondContact O-CG 3.49Å; R190-R194 PolarHBondContact O-N 3.3Å; R190-R194 VanDerWaalsContact O-N 3.14Å
191	K	92.3	Very high	89.6	Confident	131 Å²	131	101.3 Å²	101.3	57%	0.57	44%	0.437	S	S	*	.	H	α-helix	trans	-63.4	-47	174.3	-74.1	174.2	-177.3	177.9	0	111.7	Q187 K188 R189 R194 Q195	Q187-K191 WeakPolarHBondContact O-CG 3.48Å; Q187-K191 PolarHBondContact O-N 3.01Å; K188-K191 PolarHBondContact O-N 2.76Å; R189-K191 VanDerWaalsContact C-N 3.29Å; R189-K191 PolarHBondContact O-N 3.27Å; K191-R194 PolarHBondContact O-N 2.68Å; K191-Q195 WeakPolarHBondContact O-CG 3.22Å; K191-Q195 PolarHBondContact O-N 2.64Å; K191-Q195 VanDerWaalsContact O-N 3.1Å
192	M	91.4	Very high	89.2	Confident	80 Å²	80	103.4 Å²	103.4	39%	0.394	45%	0.445	S	S	.	.	H	α-helix	trans	-60.4	-47.1	178.4	-67.7	-175.5	-62.1	0	0	112	K188 R189 R194 Q195 Q196	K188-M192 HydrophobicContact CG-CE 4.29Å; K188-M192 WeakPolarHBondContact O-CG 3.47Å; K188-M192 PolarHBondContact O-N 2.68Å; R189-M192 HydrophobicContact CB-CE 4.5Å; R189-M192 PolarHBondContact O-N 3.16Å; R189-M192 VanDerWaalsContact O-N 3.16Å; M192-R194 VanDerWaalsContact C-N 3.32Å; M192-R194 PolarHBondContact O-N 3.25Å; M192-Q195 PolarHBondContact O-N 2.96Å; M192-Q195 VanDerWaalsContact O-N 3.16Å; M192-Q196 WeakPolarHBondContact O-CG 3.45Å; M192-Q196 PolarHBondContact O-N 3.27Å
193	L	89.4	Confident	88.7	Confident	80 Å²	80	109.2 Å²	109.2	42%	0.419	47%	0.47	S	S	.	.	H	α-helix	trans	-61.9	-38.3	178.6	-68.4	173.6	0	0	0	112.5	R189 Q196 K197	R189-L193 HydrophobicContact CG-CD1 4.1Å; R189-L193 HydrophobicContact CG-CG 4.5Å; R189-L193 WeakPolarHBondContact O-CG 3.4Å; R189-L193 PolarHBondContact O-N 3.33Å; L193-Q196 PolarHBondContact O-N 2.96Å; L193-K197 WeakPolarHBondContact O-CG 3.44Å; L193-K197 PolarHBondContact O-N 3.45Å; L193-K197 VanDerWaalsContact O-N 3.16Å
194	R	90.1	Very high	88.3	Confident	170 Å²	170	114.6 Å²	114.6	64%	0.642	49%	0.493	S	S	*	.	H	α-helix	trans	-65	-38.7	175.2	-75	172.3	177.8	-174.8	-1.3	112.3	R190 K191 M192 K197 K198	R190-R194 VanDerWaalsContact O-CG 3.27Å; R190-R194 WeakPolarHBondContact O-CG 3.49Å; R190-R194 PolarHBondContact O-N 3.3Å; R190-R194 VanDerWaalsContact O-N 3.14Å; K191-R194 PolarHBondContact O-N 2.68Å; M192-R194 VanDerWaalsContact C-N 3.32Å; M192-R194 PolarHBondContact O-N 3.25Å; R194-K197 PolarHBondContact O-N 2.91Å; R194-K198 WeakPolarHBondContact O-CG 3.23Å; R194-K198 PolarHBondContact O-N 3.12Å
195	Q	88.9	Confident	87.8	Confident	122 Å²	122	115.1 Å²	115.1	57%	0.57	50%	0.495	S	S	*	.	H	α-helix	trans	-68.9	-39.4	178	-71.2	171	-6.6	0	0	111.8	K191 M192 K197 K198 K199	K191-Q195 WeakPolarHBondContact O-CG 3.22Å; K191-Q195 PolarHBondContact O-N 2.64Å; K191-Q195 VanDerWaalsContact O-N 3.1Å; M192-Q195 PolarHBondContact O-N 2.96Å; M192-Q195 VanDerWaalsContact O-N 3.16Å; Q195-K197 VanDerWaalsContact C-N 3.33Å; Q195-K197 PolarHBondContact O-N 2.94Å; Q195-K198 PolarHBondContact O-N 3.13Å; Q195-K199 PolarHBondContact O-N 3.23Å
196	Q	86.3	Confident	87.2	Confident	118 Å²	118	121.1 Å²	121.1	55%	0.551	52%	0.52	S	S	*	.	H	α-helix	trans	-62.5	-39.9	175.5	-70.4	172.6	3.5	0	0	112.1	M192 L193 K198 K199 R200	M192-Q196 WeakPolarHBondContact O-CG 3.45Å; M192-Q196 PolarHBondContact O-N 3.27Å; L193-Q196 PolarHBondContact O-N 2.96Å; Q196-K198 VanDerWaalsContact C-N 3.3Å; Q196-K198 PolarHBondContact O-N 3.09Å; Q196-K199 PolarHBondContact O-N 3.3Å; Q196-R200 PolarHBondContact O-N 2.8Å
197	K	83.3	Confident	86.5	Confident	168 Å²	168	129.7 Å²	129.7	73%	0.73	56%	0.556	S	S	*	*	H	α-helix	trans	-66.3	-27.1	175.9	-73.7	-175.4	179.3	-170.4	0	114.2	L193 R194 Q195	L193-K197 WeakPolarHBondContact O-CG 3.44Å; L193-K197 PolarHBondContact O-N 3.45Å; L193-K197 VanDerWaalsContact O-N 3.16Å; R194-K197 PolarHBondContact O-N 2.91Å; Q195-K197 VanDerWaalsContact C-N 3.33Å; Q195-K197 PolarHBondContact O-N 2.94Å
198	K	80.3	Confident	85.9	Confident	183 Å²	183	135.8 Å²	135.8	80%	0.796	58%	0.581	S	S	*	*	H	α-helix	trans	-81.7	-16.6	177.9	-73	-176.6	176.4	-166.9	0	113.7	R194 Q195 Q196	R194-K198 WeakPolarHBondContact O-CG 3.23Å; R194-K198 PolarHBondContact O-N 3.12Å; Q195-K198 PolarHBondContact O-N 3.13Å; Q196-K198 VanDerWaalsContact C-N 3.3Å; Q196-K198 PolarHBondContact O-N 3.09Å
199	K	72.9	Confident	85.2	Confident	185 Å²	185	135 Å²	135	80%	0.804	58%	0.577	S	S	*	*			trans	-95.1	-6.9	179.2	-70.2	-176.2	176.9	-171.4	0	113	Q195 Q196	Q195-K199 PolarHBondContact O-N 3.23Å; Q196-K199 PolarHBondContact O-N 3.3Å
200	R	60.3	Low	84.3	Confident	277 Å²	277	143.1 Å²	143.1	100%	1.045	61%	0.613	S	S	*	*			trans	-100.9	0	173.2	-72.8	-178.1	167.9	-170.9	-3.2	108.3	Q196	Q196-R200 PolarHBondContact O-N 2.8Å

Retrieved 200 of 200 residues in 152.4 ms (Link to these results)

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