A0A087YRT3_POEFO Loading...

Ras homolog family member B

Regulates a signal transduction pathway linking plasma membrane receptors to the assembly of focal adhesions and actin stress fibers.

AlphaFold DB , UniProt , Accession A0A087YRT3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 195 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.2	Low	88.9	Confident	243 Å²	243	66.3 Å²	66.3	100%	1.197	34%	0.344	S	S	*	.				0	139.4	0	-66.8	176.4	-175.7	0	0	107.1	V3	M1-V3 PolarHBondContact O-N 3.47Å
2	A	66.8	Low	89.7	Confident	99 Å²	99	60.8 Å²	60.8	82%	0.818	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-70.5	127.1	177.6	0	0	0	0	0	109.1	Q4	A2-Q4 PolarHBondContact O-N 3.48Å
3	V	81.1	Confident	90.4	Very high	87 Å²	87	57.9 Å²	57.9	53%	0.527	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-66	124.6	173.7	177.6	0	0	0	0	107.7	M1 Q54	M1-V3 PolarHBondContact O-N 3.47Å; V3-Q54 HydrophobicContact CG1-CB 3.89Å
4	Q	91.3	Very high	90.7	Very high	80 Å²	80	56 Å²	56	37%	0.374	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	128.3	176.4	-71	-177.5	86.1	0	0	108.6	A2 Q51 Q52 V53 Q54	A2-Q4 PolarHBondContact O-N 3.48Å; Q4-Q51 VanDerWaalsContact NE2-OE1 3.09Å; Q4-Q52 PolarHBondContact N-O 2.88Å; Q4-V53 CarbonylContact O-C 3.57Å; Q4-V53 WeakPolarHBondContact O-CA 3.46Å; Q4-Q54 PolarHBondContact O-N 3.43Å
5	R	95.7	Very high	91	Very high	163 Å²	163	55.9 Å²	55.9	62%	0.615	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	131.1	174.2	-169.1	174.9	-177.6	-174.4	1.7	109.5	Q54	R5-Q54 CarbonylContact C-O 3.39Å; R5-Q54 WeakPolarHBondContact CA-O 3.33Å
6	K	97.4	Very high	91.5	Very high	32 Å²	32	52.6 Å²	52.6	14%	0.139	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.2	-177.7	-67.2	-65.5	-173.8	169.1	0	110.7	V53 Q54 L55 A56 D78 T178	K6-V53 HydrophobicContact CB-CG1 3.93Å; K6-V53 HydrophobicContact CG-CG1 3.63Å; K6-Q54 PolarHBondContact N-O 3.35Å; K6-L55 HydrophobicContact CB-CD2 3.98Å; K6-L55 CarbonylContact O-C 3.59Å; K6-L55 WeakPolarHBondContact O-CA 3.23Å; K6-A56 PolarHBondContact O-N 3.4Å; K6-D78 WeakPolarHBondContact CA-OD2 3.25Å; K6-D78 HydrophobicContact CB-CB 4.47Å; K6-D78 HydrophobicContact CD-CB 3.97Å; K6-D78 VanDerWaalsContact CD-CG 3.41Å; K6-D78 VanDerWaalsContact CD-OD1 3.29Å; K6-D78 WeakPolarHBondContact CD-OD1 3.44Å; K6-D78 IonicContact NZ-OD1 3.86Å; K6-D78 PolarHBondContact NZ-OD1 3.27Å; K6-T178 HydrophobicContact CD-CG2 4.36Å; K6-T178 WeakPolarHBondContact CG-OG1 3.39Å; K6-T178 PolarHBondContact NZ-O 3.29Å
7	K	97.8	Very high	91.8	Very high	25 Å²	25	50.5 Å²	50.5	11%	0.109	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	121.5	178.2	177.2	169.9	171.4	174.2	0	110.3	V9 W58 S73 P75 D78 V79	K7-V9 HydrophobicContact CG-CG2 4.34Å; K7-W58 HydrophobicContact CD-CD2 4.43Å; K7-W58 HydrophobicContact CD-CZ2 4.43Å; K7-W58 VanDerWaalsContact CE-CD2 3.5Å; K7-W58 VanDerWaalsContact CE-CE2 3.46Å; K7-W58 HydrophobicContact CG-CG 4.46Å; K7-S73 WeakPolarHBondContact CE-O 3.44Å; K7-S73 PolarHBondContact NZ-O 2.98Å; K7-P75 WeakPolarHBondContact CE-O 3.41Å; K7-P75 PolarHBondContact NZ-O 2.74Å; K7-D78 PolarHBondContact N-OD2 2.86Å; K7-D78 WeakPolarHBondContact O-CB 3.39Å; K7-D78 PolarHBondContact O-N 2.86Å; K7-V79 PolarHBondContact O-N 2.87Å
8	L	98.4	Very high	92.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.4	175.9	178.5	159.6	0	0	0	108.7	V10 L22 A56 L57 W58 V79 L81 F171 A174	L8-V10 HydrophobicContact CD2-CG2 3.56Å; L8-L22 HydrophobicContact CD2-CD2 4.47Å; L8-A56 PolarHBondContact N-O 3Å; L8-L57 HydrophobicContact CB-CD2 4.2Å; L8-L57 HydrophobicContact CD1-CD2 4.26Å; L8-L57 HydrophobicContact CD2-CD2 4.08Å; L8-L57 HydrophobicContact CG-CD2 4.42Å; L8-W58 PolarHBondContact O-N 2.88Å; L8-V79 WeakPolarHBondContact CA-O 3.49Å; L8-V79 HydrophobicContact CB-CG1 3.83Å; L8-V79 HydrophobicContact CD1-CG1 4.01Å; L8-V79 HydrophobicContact CG-CG1 3.88Å; L8-L81 HydrophobicContact CD1-CD1 4.04Å; L8-L81 HydrophobicContact CD1-CD2 4.47Å; L8-L81 HydrophobicContact CD1-CG 3.98Å; L8-L81 HydrophobicContact CD2-CD1 3.84Å; L8-L81 HydrophobicContact CD2-CG 3.84Å; L8-L81 HydrophobicContact CG-CD1 4.38Å; L8-L81 HydrophobicContact CG-CG 4.06Å; L8-F171 HydrophobicContact CD1-CD1 3.99Å; L8-F171 HydrophobicContact CD1-CE1 4.21Å; L8-A174 HydrophobicContact CD1-CB 3.85Å
9	V	98.6	Very high	92.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	133.6	176.3	176.7	0	0	0	0	109.5	K7 V11 W58 T60 S73 Y74 T77 V79 I80 L81	K7-V9 HydrophobicContact CG-CG2 4.34Å; V9-V11 HydrophobicContact CG1-CG1 4.13Å; V9-W58 HydrophobicContact CB-CB 4.27Å; V9-W58 HydrophobicContact CG1-CB 4.42Å; V9-W58 HydrophobicContact CG2-CB 3.76Å; V9-W58 HydrophobicContact CG2-CG 4.08Å; V9-T60 HydrophobicContact CG1-CG2 3.9Å; V9-S73 WeakPolarHBondContact CG2-O 3.41Å; V9-Y74 HydrophobicContact CG1-CD1 4.1Å; V9-Y74 HydrophobicContact CG1-CE1 3.94Å; V9-T77 HydrophobicContact CB-CG2 4.04Å; V9-T77 HydrophobicContact CG2-CG2 3.76Å; V9-T77 VanDerWaalsContact CG2-OG1 3.3Å; V9-T77 WeakPolarHBondContact CG2-OG1 3.34Å; V9-V79 PolarHBondContact N-O 2.82Å; V9-V79 VanDerWaalsContact N-O 3.12Å; V9-I80 HydrophobicContact CB-CD1 3.96Å; V9-I80 HydrophobicContact CG1-CD1 4.37Å; V9-I80 WeakPolarHBondContact O-CA 3.36Å; V9-L81 PolarHBondContact O-N 2.73Å
10	V	98.4	Very high	92.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128.4	177.6	-165.2	0	0	0	0	109.8	L8 K18 L22 W58 T60 L81 C83	L8-V10 HydrophobicContact CD2-CG2 3.56Å; V10-K18 HydrophobicContact CG1-CB 3.76Å; V10-K18 HydrophobicContact CG1-CD 3.87Å; V10-K18 HydrophobicContact CG1-CG 3.73Å; V10-L22 HydrophobicContact CB-CD1 4.42Å; V10-L22 HydrophobicContact CG2-CD1 3.8Å; V10-L22 HydrophobicContact CG2-CD2 3.58Å; V10-L22 HydrophobicContact CG2-CG 3.91Å; V10-W58 PolarHBondContact N-O 3.14Å; V10-T60 PolarHBondContact O-OG1 2.82Å; V10-L81 WeakPolarHBondContact CA-O 3.38Å; V10-L81 HydrophobicContact CB-CB 4.42Å; V10-L81 HydrophobicContact CG1-CB 4.06Å; V10-L81 HydrophobicContact CG2-CB 4.14Å; V10-L81 HydrophobicContact CG2-CD1 4.19Å; V10-C83 VanDerWaalsContact CG1-SG 3.57Å
11	V	98.6	Very high	92.9	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	163.8	178.1	-58.2	0	0	0	0	110.4	V9 K18 Y74 I80 L81 M82 C83 W99 V103	V9-V11 HydrophobicContact CG1-CG1 4.13Å; V11-K18 VanDerWaalsContact C-CD 3.49Å; V11-Y74 HydrophobicContact CG1-CE1 3.78Å; V11-Y74 WeakPolarHBondContact CG1-OH 3.45Å; V11-I80 HydrophobicContact CG2-CG2 3.88Å; V11-L81 PolarHBondContact N-O 3.06Å; V11-M82 HydrophobicContact CG2-CB 4.25Å; V11-M82 HydrophobicContact CG2-CE 4.4Å; V11-M82 HydrophobicContact CG2-CG 4.1Å; V11-C83 PolarHBondContact O-N 3.07Å; V11-W99 HydrophobicContact CB-CE3 3.87Å; V11-W99 HydrophobicContact CB-CZ3 4.05Å; V11-W99 HydrophobicContact CG2-CE3 4.23Å; V11-V103 HydrophobicContact CG2-CG2 3.93Å
12	G	98.5	Very high	94.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139.3	168.4	-173.9	0	0	0	0	0	111.8	K18 G62 C83 W99	G12-K18 PolarHBondContact O-NZ 3.27Å; G12-G62 WeakPolarHBondContact O-CA 3.25Å; G12-C83 VanDerWaalsContact CA-O 3.23Å; G12-C83 WeakPolarHBondContact CA-O 3.45Å; G12-W99 VanDerWaalsContact CA-CE2 3.4Å; G12-W99 WeakPolarHBondContact O-CH2 3.09Å; G12-W99 WeakPolarHBondContact O-CZ2 3.4Å
13	D	98.3	Very high	96.2	Very high	24 Å²	24	28.8 Å²	28.8	13%	0.128	16%	0.161	C	C	.	.			trans	-55.6	158.2	-174.3	-77.6	12.1	0	0	0	114.2	C16 K18 S91 N94 W99	D13-C16 HydrophobicContact CB-CB 4.35Å; D13-C16 PolarHBondContact O-N 3.09Å; D13-C16 PolarHBondContact O-SG 3.38Å; D13-K18 PolarHBondContact O-NZ 3.31Å; D13-S91 VanDerWaalsContact OD2-CA 3.28Å; D13-S91 WeakPolarHBondContact OD2-CA 3.2Å; D13-S91 WeakPolarHBondContact OD2-CB 3.43Å; D13-N94 PolarHBondContact OD2-ND2 2.88Å; D13-W99 PolarHBondContact OD1-NE1 2.65Å
14	G	95.4	Very high	97	Very high	31 Å²	31	24.9 Å²	24.9	32%	0.32	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	142.4	166.9	0	0	0	0	0	110.8	C16 G62	G14-C16 PolarHBondContact O-N 2.99Å; G14-G62 PolarHBondContact N-O 3.04Å
15	A	95.4	Very high	97.2	Very high	55 Å²	55	22.3 Å²	22.3	46%	0.455	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	10.8	178.5	0	0	0	0	0	116.9	G17 K118	A15-G17 PolarHBondContact O-N 3.32Å; A15-K118 WeakPolarHBondContact O-CE 3.5Å; A15-K118 PolarHBondContact O-NZ 3.49Å
16	C	97.6	Very high	97.1	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.014	11%	0.107	C	C	.	.	S	Bend	trans	-76	-1.9	176.7	79.6	0	0	0	0	113.9	D13 G14 K18 N117	D13-C16 HydrophobicContact CB-CB 4.35Å; D13-C16 PolarHBondContact O-N 3.09Å; D13-C16 PolarHBondContact O-SG 3.38Å; G14-C16 PolarHBondContact O-N 2.99Å; C16-K18 VanDerWaalsContact SG-CG 3.6Å; C16-N117 WeakPolarHBondContact O-CB 3.2Å; C16-N117 PolarHBondContact O-ND2 3.14Å
17	G	97.5	Very high	96.8	Very high	17 Å²	17	20.8 Å²	20.8	18%	0.175	13%	0.127	C	C	.	.	S	Bend	trans	99.1	12.8	171.9	0	0	0	0	0	116.9	A15 T19 C20 L21	A15-G17 PolarHBondContact O-N 3.32Å; G17-T19 PolarHBondContact O-N 3.3Å; G17-C20 PolarHBondContact O-N 3.39Å; G17-L21 WeakPolarHBondContact O-CB 3.29Å; G17-L21 PolarHBondContact O-N 3.49Å
18	K	97.9	Very high	96.5	Very high	11 Å²	11	24.6 Å²	24.6	5%	0.048	15%	0.149	C	C	.	.	H	α-helix	trans	-51.6	-51.8	178	-57.7	-173.7	-62	-73.8	0	113.3	V10 V11 G12 D13 C16 C20 L21 L22 T60 C83	V10-K18 HydrophobicContact CG1-CB 3.76Å; V10-K18 HydrophobicContact CG1-CD 3.87Å; V10-K18 HydrophobicContact CG1-CG 3.73Å; V11-K18 VanDerWaalsContact C-CD 3.49Å; G12-K18 PolarHBondContact O-NZ 3.27Å; D13-K18 PolarHBondContact O-NZ 3.31Å; C16-K18 VanDerWaalsContact SG-CG 3.6Å; K18-C20 PolarHBondContact O-N 3.07Å; K18-L21 WeakPolarHBondContact O-CB 3.39Å; K18-L21 PolarHBondContact O-N 3.43Å; K18-L22 WeakPolarHBondContact O-CG 3.46Å; K18-L22 PolarHBondContact O-N 2.95Å; K18-L22 VanDerWaalsContact O-N 3.07Å; K18-T60 WeakPolarHBondContact CE-O 3.39Å; K18-C83 HydrophobicContact CG-CB 4.04Å
19	T	96.9	Very high	96.2	Very high	30 Å²	30	30.8 Å²	30.8	18%	0.184	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-44	-178.1	-47.1	0	0	0	0	111.7	G17 L21 L22 I23 T37 D59	G17-T19 PolarHBondContact O-N 3.3Å; T19-L21 VanDerWaalsContact C-N 3.33Å; T19-L21 PolarHBondContact O-N 3.02Å; T19-L22 PolarHBondContact O-N 3.31Å; T19-I23 HydrophobicContact CG2-CD1 3.72Å; T19-I23 HydrophobicContact CG2-CG1 4.36Å; T19-I23 WeakPolarHBondContact O-CB 3.38Å; T19-I23 VanDerWaalsContact O-CG1 3.28Å; T19-I23 WeakPolarHBondContact O-CG1 3.31Å; T19-I23 PolarHBondContact O-N 3.06Å; T19-T37 PolarHBondContact OG1-OG1 3.15Å; T19-D59 WeakPolarHBondContact CA-OD2 3.47Å; T19-D59 VanDerWaalsContact CB-OD2 3.24Å; T19-D59 WeakPolarHBondContact CB-OD2 3.45Å; T19-D59 VanDerWaalsContact CG2-OD2 3.32Å; T19-D59 WeakPolarHBondContact CG2-OD2 3.45Å; T19-D59 PolarHBondContact OG1-OD2 3.12Å
20	C	96.9	Very high	95.8	Very high	26 Å²	26	33.8 Å²	33.8	18%	0.176	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-39.8	176.5	-57.1	0	0	0	0	111.9	G17 K18 V24 F30 P31 A161	G17-C20 PolarHBondContact O-N 3.39Å; K18-C20 PolarHBondContact O-N 3.07Å; C20-V24 WeakPolarHBondContact O-CB 3.38Å; C20-V24 VanDerWaalsContact O-CG2 3.25Å; C20-V24 WeakPolarHBondContact O-CG2 3.49Å; C20-V24 PolarHBondContact O-N 2.73Å; C20-F30 HydrophobicContact CB-CE2 4Å; C20-P31 HydrophobicContact CB-CG 4.38Å; C20-A161 HydrophobicContact CB-CB 3.79Å
21	L	98	Very high	95.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58	-48.5	175	169.9	63	0	0	0	111.2	G17 K18 T19 F25 L81 V115 I167 V170 F171	G17-L21 WeakPolarHBondContact O-CB 3.29Å; G17-L21 PolarHBondContact O-N 3.49Å; K18-L21 WeakPolarHBondContact O-CB 3.39Å; K18-L21 PolarHBondContact O-N 3.43Å; T19-L21 VanDerWaalsContact C-N 3.33Å; T19-L21 PolarHBondContact O-N 3.02Å; L21-F25 WeakPolarHBondContact O-CB 3.43Å; L21-F25 PolarHBondContact O-N 2.77Å; L21-L81 HydrophobicContact CD2-CD1 4.15Å; L21-V115 HydrophobicContact CD2-CG1 4.36Å; L21-I167 HydrophobicContact CD1-CD1 3.45Å; L21-I167 VanDerWaalsContact CD1-CD1 3.45Å; L21-I167 HydrophobicContact CD1-CG2 4.41Å; L21-V170 HydrophobicContact CD2-CG1 4.49Å; L21-F171 HydrophobicContact CD1-CE2 3.65Å; L21-F171 HydrophobicContact CD1-CZ 4.1Å; L21-F171 HydrophobicContact CG-CE2 4.04Å; L21-F171 HydrophobicContact CG-CZ 3.96Å
22	L	97	Very high	94.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-68	-42.6	179.8	-67.4	178.6	0	0	0	113.2	L8 V10 K18 T19 S26 L57 D59 F171	L8-L22 HydrophobicContact CD2-CD2 4.47Å; V10-L22 HydrophobicContact CB-CD1 4.42Å; V10-L22 HydrophobicContact CG2-CD1 3.8Å; V10-L22 HydrophobicContact CG2-CD2 3.58Å; V10-L22 HydrophobicContact CG2-CG 3.91Å; K18-L22 WeakPolarHBondContact O-CG 3.46Å; K18-L22 PolarHBondContact O-N 2.95Å; K18-L22 VanDerWaalsContact O-N 3.07Å; T19-L22 PolarHBondContact O-N 3.31Å; L22-S26 WeakPolarHBondContact O-CB 3.37Å; L22-S26 PolarHBondContact O-N 3Å; L22-S26 PolarHBondContact O-OG 3.29Å; L22-L57 HydrophobicContact CD2-CB 3.94Å; L22-L57 HydrophobicContact CD2-CD1 4.14Å; L22-L57 HydrophobicContact CD2-CD2 4.32Å; L22-L57 HydrophobicContact CD2-CG 4.36Å; L22-D59 HydrophobicContact CD1-CB 3.42Å; L22-D59 VanDerWaalsContact CD1-CB 3.42Å; L22-F171 HydrophobicContact CD2-CE1 3.87Å; L22-F171 HydrophobicContact CD2-CZ 3.86Å
23	I	94.6	Very high	93.9	Very high	22 Å²	22	49.8 Å²	49.8	11%	0.113	28%	0.276	C	S	.	.	H	α-helix	trans	-65.8	-47.1	-179.8	-70.1	174.4	0	0	0	110.4	T19 F25 S26 K27 E29 P31 Y42	T19-I23 HydrophobicContact CG2-CD1 3.72Å; T19-I23 HydrophobicContact CG2-CG1 4.36Å; T19-I23 WeakPolarHBondContact O-CB 3.38Å; T19-I23 VanDerWaalsContact O-CG1 3.28Å; T19-I23 WeakPolarHBondContact O-CG1 3.31Å; T19-I23 PolarHBondContact O-N 3.06Å; I23-F25 VanDerWaalsContact C-N 3.3Å; I23-F25 PolarHBondContact O-N 3.2Å; I23-S26 PolarHBondContact O-N 3.03Å; I23-S26 PolarHBondContact O-OG 2.93Å; I23-K27 HydrophobicContact CG2-CD 4.31Å; I23-K27 WeakPolarHBondContact O-CB 3.3Å; I23-K27 PolarHBondContact O-N 3.46Å; I23-E29 WeakPolarHBondContact CG2-O 3.3Å; I23-P31 HydrophobicContact CD1-CB 4.36Å; I23-P31 HydrophobicContact CD1-CG 4.18Å; I23-Y42 HydrophobicContact CG1-CE1 4.37Å
24	V	96.6	Very high	92.8	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.024	30%	0.296	C	S	.	.	H	α-helix	trans	-63.2	-39.6	180	171	0	0	0	0	110.9	C20 D28 E29 F30 A161 K164 I167	C20-V24 WeakPolarHBondContact O-CB 3.38Å; C20-V24 VanDerWaalsContact O-CG2 3.25Å; C20-V24 WeakPolarHBondContact O-CG2 3.49Å; C20-V24 PolarHBondContact O-N 2.73Å; V24-D28 WeakPolarHBondContact O-CA 3.26Å; V24-D28 PolarHBondContact O-N 3.42Å; V24-E29 WeakPolarHBondContact CG2-O 3.36Å; V24-F30 HydrophobicContact CG2-CB 4.18Å; V24-F30 HydrophobicContact CG2-CD2 4.04Å; V24-A161 HydrophobicContact CB-CB 4.45Å; V24-A161 HydrophobicContact CG2-CB 3.97Å; V24-K164 HydrophobicContact CG1-CG 4Å; V24-I167 HydrophobicContact CG1-CG1 4.13Å; V24-I167 HydrophobicContact CG1-CG2 4.32Å
25	F	96.3	Very high	92.2	Very high	26 Å²	26	58.8 Å²	58.8	11%	0.114	31%	0.311	C	S	.	.	H	α-helix	trans	-64.4	-43.6	175.1	172.8	-113.8	0	0	0	113.2	L21 I23 A44 I46 L55 L57 I167 W168 F171	L21-F25 WeakPolarHBondContact O-CB 3.43Å; L21-F25 PolarHBondContact O-N 2.77Å; I23-F25 VanDerWaalsContact C-N 3.3Å; I23-F25 PolarHBondContact O-N 3.2Å; F25-A44 HydrophobicContact CD1-CB 4.14Å; F25-A44 HydrophobicContact CE1-CB 3.49Å; F25-A44 VanDerWaalsContact CE1-CB 3.49Å; F25-A44 HydrophobicContact CZ-CB 4.14Å; F25-I46 HydrophobicContact CE2-CD1 4.25Å; F25-I46 HydrophobicContact CZ-CB 4.45Å; F25-I46 HydrophobicContact CZ-CD1 4.17Å; F25-L55 HydrophobicContact CE1-CD1 3.99Å; F25-L55 HydrophobicContact CZ-CD1 4.05Å; F25-L57 HydrophobicContact CD1-CD1 3.74Å; F25-L57 HydrophobicContact CE1-CD1 3.99Å; F25-L57 HydrophobicContact CE1-CD2 4.41Å; F25-I167 HydrophobicContact CB-CG2 3.84Å; F25-W168 HydrophobicContact CD2-CE3 4.35Å; F25-W168 AromaticContact CE2-CE3 3.86Å; F25-W168 HydrophobicContact CE2-CE3 3.86Å; F25-W168 AromaticContact CE2-CZ3 3.76Å; F25-W168 HydrophobicContact CE2-CZ3 3.76Å; F25-F171 HydrophobicContact CB-CD2 3.67Å; F25-F171 HydrophobicContact CB-CE1 4.4Å; F25-F171 HydrophobicContact CB-CE2 3.26Å; F25-F171 HydrophobicContact CB-CG 4.42Å; F25-F171 HydrophobicContact CB-CZ 3.66Å; F25-F171 AromaticContact CD1-CD1 3.57Å; F25-F171 HydrophobicContact CD1-CD1 3.57Å; F25-F171 AromaticContact CD1-CD2 3.81Å; F25-F171 HydrophobicContact CD1-CD2 3.81Å; F25-F171 AromaticContact CD1-CE1 3.6Å; F25-F171 HydrophobicContact CD1-CE1 3.6Å; F25-F171 AromaticContact CD1-CE2 3.88Å; F25-F171 HydrophobicContact CD1-CE2 3.88Å; F25-F171 AromaticContact CD1-CG 3.68Å; F25-F171 HydrophobicContact CD1-CG 3.68Å; F25-F171 AromaticContact CD1-CZ 3.75Å; F25-F171 HydrophobicContact CD1-CZ 3.75Å; F25-F171 HydrophobicContact CD2-CB 3.93Å; F25-F171 HydrophobicContact CD2-CD1 4.35Å; F25-F171 AromaticContact CD2-CD2 3.3Å; F25-F171 HydrophobicContact CD2-CD2 3.3Å; F25-F171 AromaticContact CD2-CE2 3.89Å; F25-F171 HydrophobicContact CD2-CE2 3.89Å; F25-F171 AromaticContact CD2-CG 3.59Å; F25-F171 HydrophobicContact CD2-CG 3.59Å; F25-F171 HydrophobicContact CE1-CB 4.12Å; F25-F171 AromaticContact CE1-CD1 3.57Å; F25-F171 HydrophobicContact CE1-CD1 3.57Å; F25-F171 HydrophobicContact CE1-CD2 4.27Å; F25-F171 HydrophobicContact CE1-CE1 4.03Å; F25-F171 AromaticContact CE1-CG 3.71Å; F25-F171 HydrophobicContact CE1-CG 3.71Å; F25-F171 HydrophobicContact CE2-CB 3.49Å; F25-F171 VanDerWaalsContact CE2-CB 3.49Å; F25-F171 HydrophobicContact CE2-CD1 4.35Å; F25-F171 AromaticContact CE2-CD2 3.83Å; F25-F171 HydrophobicContact CE2-CD2 3.83Å; F25-F171 AromaticContact CE2-CG 3.63Å; F25-F171 HydrophobicContact CE2-CG 3.63Å; F25-F171 HydrophobicContact CG-CB 4.41Å; F25-F171 AromaticContact CG-CD1 3.98Å; F25-F171 HydrophobicContact CG-CD1 3.98Å; F25-F171 AromaticContact CG-CD2 3.29Å; F25-F171 HydrophobicContact CG-CD2 3.29Å; F25-F171 HydrophobicContact CG-CE1 4.03Å; F25-F171 AromaticContact CG-CE2 3.4Å; F25-F171 HydrophobicContact CG-CE2 3.4Å; F25-F171 VanDerWaalsContact CG-CE2 3.4Å; F25-F171 AromaticContact CG-CG 3.62Å; F25-F171 HydrophobicContact CG-CG 3.62Å; F25-F171 AromaticContact CG-CZ 3.76Å; F25-F171 HydrophobicContact CG-CZ 3.76Å; F25-F171 HydrophobicContact CZ-CB 3.61Å; F25-F171 AromaticContact CZ-CD1 3.99Å; F25-F171 HydrophobicContact CZ-CD1 3.99Å; F25-F171 HydrophobicContact CZ-CD2 4.29Å; F25-F171 AromaticContact CZ-CG 3.69Å; F25-F171 HydrophobicContact CZ-CG 3.69Å
26	S	92.9	Very high	91.5	Very high	37 Å²	37	59.7 Å²	59.7	26%	0.259	31%	0.312	S	S	.	.	H	α-helix	trans	-84.4	-26.2	-173.5	56.9	0	0	0	0	114.6	L22 I23	L22-S26 WeakPolarHBondContact O-CB 3.37Å; L22-S26 PolarHBondContact O-N 3Å; L22-S26 PolarHBondContact O-OG 3.29Å; I23-S26 PolarHBondContact O-N 3.03Å; I23-S26 PolarHBondContact O-OG 2.93Å
27	K	91.6	Very high	90.9	Very high	127 Å²	127	60.2 Å²	60.2	55%	0.552	32%	0.315	S	S	*	.	H	α-helix	trans	-124.4	-6.6	-172.7	-59.7	-175.9	-174.4	171.6	0	114.2	I23 E29	I23-K27 HydrophobicContact CG2-CD 4.31Å; I23-K27 WeakPolarHBondContact O-CB 3.3Å; I23-K27 PolarHBondContact O-N 3.46Å; K27-E29 PolarHBondContact O-N 3.36Å; K27-E29 VanDerWaalsContact O-N 3.16Å
28	D	92	Very high	90.1	Very high	105 Å²	105	63 Å²	63	56%	0.561	33%	0.329	S	S	*	.	S	Bend	trans	56.1	25.8	-175.3	-163.5	40.7	0	0	0	114.2	V24 K164	V24-D28 WeakPolarHBondContact O-CA 3.26Å; V24-D28 PolarHBondContact O-N 3.42Å; D28-K164 WeakPolarHBondContact O-CE 3.48Å; D28-K164 PolarHBondContact O-NZ 2.96Å; D28-K164 WeakPolarHBondContact OD1-CE 3.47Å; D28-K164 IonicContact OD1-NZ 2.71Å; D28-K164 PolarHBondContact OD1-NZ 3.09Å; D28-K164 IonicContact OD2-NZ 2.89Å; D28-K164 PolarHBondContact OD2-NZ 3.09Å
29	E	91.2	Very high	89.1	Confident	130 Å²	130	66.5 Å²	66.5	61%	0.607	34%	0.344	S	S	*	.			trans	-130.5	136.2	-177.9	-173.4	178.3	-173	0	0	110.6	I23 V24 K27	I23-E29 WeakPolarHBondContact CG2-O 3.3Å; V24-E29 WeakPolarHBondContact CG2-O 3.36Å; K27-E29 PolarHBondContact O-N 3.36Å; K27-E29 VanDerWaalsContact O-N 3.16Å
30	F	90.3	Very high	88.7	Confident	62 Å²	62	69.2 Å²	69.2	27%	0.272	35%	0.354	S	S	.	.			trans	-88.5	125.4	174.2	-174.5	-91	0	0	0	109.9	C20 V24 E32 A161 R162	C20-F30 HydrophobicContact CB-CE2 4Å; V24-F30 HydrophobicContact CG2-CB 4.18Å; V24-F30 HydrophobicContact CG2-CD2 4.04Å; F30-E32 PolarHBondContact O-N 2.89Å; F30-A161 VanDerWaalsContact CD2-C 3.48Å; F30-A161 HydrophobicContact CD2-CB 3.99Å; F30-A161 WeakPolarHBondContact CD2-O 3.41Å; F30-A161 HydrophobicContact CE2-CB 3.9Å; F30-R162 HydrophobicContact CD2-CB 4.43Å; F30-R162 HydrophobicContact CE2-CB 4.11Å; F30-R162 HydrophobicContact CZ-CB 4.48Å
31	P	87.7	Confident	88.3	Confident	34 Å²	34	71.2 Å²	71.2	22%	0.221	37%	0.366	C	S	.	.			trans	-68.5	127.6	-178.9	28.5	-34.5	0	0	0	111.2	C20 I23	C20-P31 HydrophobicContact CB-CG 4.38Å; I23-P31 HydrophobicContact CD1-CB 4.36Å; I23-P31 HydrophobicContact CD1-CG 4.18Å
32	E	83.8	Confident	87.9	Confident	189 Å²	189	72.9 Å²	72.9	88%	0.883	37%	0.372	S	S	*	.	S	Bend	trans	-79.5	-24.4	177.9	-63.5	-166	158.4	0	0	113.3	F30	F30-E32 PolarHBondContact O-N 2.89Å
33	V	83.6	Confident	87.8	Confident	114 Å²	114	76.6 Å²	76.6	69%	0.691	40%	0.395	S	S	*	.	S	Bend	trans	-109.1	124.8	-177.7	-176.8	0	0	0	0	109.7	V35	V33-V35 HydrophobicContact CG1-CG2 4.2Å; V33-V35 PolarHBondContact O-N 3.48Å
34	Y	75.6	Confident	87.7	Confident	141 Å²	141	76.2 Å²	76.2	55%	0.553	40%	0.395	S	S	*	.			trans	-79.9	117.8	172.5	178.7	-109.1	0	0	0	110.7	P36	Y34-P36 HydrophobicContact CD1-CG 4.48Å; Y34-P36 HydrophobicContact CE1-CG 3.8Å
35	V	81.9	Confident	87.7	Confident	103 Å²	103	81 Å²	81	62%	0.624	42%	0.421	S	S	*	.			trans	-120.5	120.6	170.5	-177.6	0	0	0	0	107.5	V33 T37	V33-V35 HydrophobicContact CG1-CG2 4.2Å; V33-V35 PolarHBondContact O-N 3.48Å; V35-T37 PolarHBondContact O-N 3.36Å
36	P	82.2	Confident	87.6	Confident	73 Å²	73	79.9 Å²	79.9	47%	0.474	42%	0.416	S	S	.	.			trans	-59.6	124.7	176.3	-24.2	33.3	0	0	0	112.1	Y34	Y34-P36 HydrophobicContact CD1-CG 4.48Å; Y34-P36 HydrophobicContact CE1-CG 3.8Å
37	T	84	Confident	87.7	Confident	13 Å²	13	82.9 Å²	82.9	8%	0.08	43%	0.426	C	S	.	.			trans	-74.7	135.8	176.9	-56.9	0	0	0	0	111.5	T19 V35 E40 D59 A61	T19-T37 PolarHBondContact OG1-OG1 3.15Å; V35-T37 PolarHBondContact O-N 3.36Å; T37-E40 HydrophobicContact CG2-CG 4.24Å; T37-D59 HydrophobicContact CG2-CB 4.12Å; T37-D59 WeakPolarHBondContact CG2-OD2 3.33Å; T37-D59 PolarHBondContact OG1-OD2 3.36Å; T37-A61 WeakPolarHBondContact O-CA 3.4Å; T37-A61 VanDerWaalsContact O-CB 3.22Å; T37-A61 WeakPolarHBondContact O-CB 3.32Å
38	V	80.4	Confident	87.8	Confident	77 Å²	77	77 Å²	77	47%	0.467	40%	0.4	S	S	.	.	S	Bend	trans	-92.1	-60.8	163	177.9	0	0	0	0	109.2	A61 Y66	V38-A61 WeakPolarHBondContact O-CB 3.33Å; V38-A61 PolarHBondContact O-N 2.87Å; V38-Y66 HydrophobicContact CB-CE1 4.19Å; V38-Y66 HydrophobicContact CG1-CD1 3.95Å; V38-Y66 HydrophobicContact CG1-CE1 3.6Å; V38-Y66 HydrophobicContact CG2-CE1 3.86Å
39	F	77.4	Confident	87.8	Confident	84 Å²	84	76.5 Å²	76.5	37%	0.368	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	129.4	176.2	179	-103.2	0	0	0	109.2	T41 W58 D59 S73	F39-T41 WeakPolarHBondContact CZ-OG1 3.33Å; F39-W58 HydrophobicContact CE1-CE3 4.3Å; F39-W58 HydrophobicContact CE1-CZ3 4.11Å; F39-W58 HydrophobicContact CE2-CB 4.32Å; F39-W58 HydrophobicContact CE2-CD2 4.05Å; F39-W58 AromaticContact CE2-CE3 3.27Å; F39-W58 HydrophobicContact CE2-CE3 3.27Å; F39-W58 AromaticContact CE2-CZ3 3.77Å; F39-W58 HydrophobicContact CE2-CZ3 3.77Å; F39-W58 AromaticContact CZ-CD2 3.75Å; F39-W58 HydrophobicContact CZ-CD2 3.75Å; F39-W58 AromaticContact CZ-CE3 3.07Å; F39-W58 HydrophobicContact CZ-CE3 3.07Å; F39-W58 HydrophobicContact CZ-CG 4.47Å; F39-W58 HydrophobicContact CZ-CH2 4.05Å; F39-W58 AromaticContact CZ-CZ3 3.22Å; F39-W58 HydrophobicContact CZ-CZ3 3.22Å; F39-D59 WeakPolarHBondContact CD2-O 3.38Å; F39-S73 WeakPolarHBondContact CD2-OG 3.08Å; F39-S73 WeakPolarHBondContact CE2-OG 3.43Å
40	E	88.1	Confident	87.7	Confident	86 Å²	86	77.4 Å²	77.4	40%	0.402	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	152.1	175.7	-68.1	-170.2	163.4	0	0	111.1	T37 Y42 D59	T37-E40 HydrophobicContact CG2-CG 4.24Å; E40-Y42 HydrophobicContact CB-CD2 4.5Å; E40-Y42 HydrophobicContact CB-CE2 3.75Å; E40-Y42 VanDerWaalsContact OE2-CZ 3.25Å; E40-Y42 PolarHBondContact OE2-OH 2.69Å; E40-D59 HydrophobicContact CB-CB 4.27Å; E40-D59 PolarHBondContact N-O 3.29Å; E40-D59 PolarHBondContact O-N 3.46Å
41	T	88.6	Confident	87.8	Confident	69 Å²	69	78.3 Å²	78.3	42%	0.423	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	129.4	176.3	-56.6	0	0	0	0	110.2	F39 L57	F39-T41 WeakPolarHBondContact CZ-OG1 3.33Å; T41-L57 VanDerWaalsContact CA-O 3.3Å; T41-L57 WeakPolarHBondContact CA-O 3.34Å
42	Y	90.6	Very high	88.1	Confident	34 Å²	34	81.2 Å²	81.2	13%	0.133	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	159	175.3	-57.3	-96.9	0	0	0	109.9	I23 E40 L57 D59	I23-Y42 HydrophobicContact CG1-CE1 4.37Å; E40-Y42 HydrophobicContact CB-CD2 4.5Å; E40-Y42 HydrophobicContact CB-CE2 3.75Å; E40-Y42 VanDerWaalsContact OE2-CZ 3.25Å; E40-Y42 PolarHBondContact OE2-OH 2.69Å; Y42-L57 PolarHBondContact N-O 2.89Å; Y42-L57 PolarHBondContact O-N 2.74Å; Y42-D59 HydrophobicContact CE2-CB 4.44Å
43	V	93.3	Very high	88.7	Confident	79 Å²	79	72.3 Å²	72.3	48%	0.479	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.6	172.6	-178.6	0	0	0	0	108.1	Q54 L55	V43-Q54 HydrophobicContact CG1-CG 3.52Å; V43-L55 WeakPolarHBondContact CA-O 3.24Å
44	A	94.3	Very high	89.4	Confident	13 Å²	13	69.5 Å²	69.5	11%	0.107	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	138.4	174.8	0	0	0	0	0	109.3	F25 L55 L57	F25-A44 HydrophobicContact CD1-CB 4.14Å; F25-A44 HydrophobicContact CE1-CB 3.49Å; F25-A44 VanDerWaalsContact CE1-CB 3.49Å; F25-A44 HydrophobicContact CZ-CB 4.14Å; A44-L55 PolarHBondContact N-O 3.07Å; A44-L55 VanDerWaalsContact N-O 3.07Å; A44-L55 PolarHBondContact O-N 3.15Å; A44-L57 HydrophobicContact CB-CD1 4.14Å
45	D	95	Very high	90.4	Very high	105 Å²	105	62.8 Å²	62.8	56%	0.561	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	135.5	172.8	-61	-44.1	0	0	0	108.9	Q54	D45-Q54 WeakPolarHBondContact OD1-CB 3.3Å; D45-Q54 WeakPolarHBondContact OD1-CG 3.43Å; D45-Q54 PolarHBondContact OD1-NE2 2.69Å
46	I	95.3	Very high	91.1	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	142.6	-179.3	-175.2	166.8	0	0	0	109.9	F25 V48 V53 L55 W168 F171 T175	F25-I46 HydrophobicContact CE2-CD1 4.25Å; F25-I46 HydrophobicContact CZ-CB 4.45Å; F25-I46 HydrophobicContact CZ-CD1 4.17Å; I46-V48 HydrophobicContact CD1-CG2 3.89Å; I46-V48 HydrophobicContact CG1-CG2 3.8Å; I46-V53 HydrophobicContact CG2-CB 4.12Å; I46-V53 PolarHBondContact N-O 3.03Å; I46-V53 PolarHBondContact O-N 3.48Å; I46-V53 VanDerWaalsContact O-O 3.13Å; I46-L55 HydrophobicContact CG2-CD1 3.8Å; I46-L55 HydrophobicContact CG2-CG 3.84Å; I46-W168 HydrophobicContact CB-CH2 4.41Å; I46-W168 HydrophobicContact CD1-CH2 3.79Å; I46-W168 HydrophobicContact CD1-CZ2 3.95Å; I46-W168 HydrophobicContact CD1-CZ3 4.06Å; I46-W168 HydrophobicContact CG1-CH2 3.5Å; I46-W168 VanDerWaalsContact CG1-CH2 3.5Å; I46-W168 HydrophobicContact CG1-CZ2 3.82Å; I46-W168 HydrophobicContact CG1-CZ3 4.15Å; I46-F171 HydrophobicContact CD1-CB 4.14Å; I46-T175 HydrophobicContact CG2-CG2 4.16Å
47	E	94.6	Very high	91.9	Very high	101 Å²	101	54.6 Å²	54.6	47%	0.472	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	120.4	171.2	-172	173.1	174.7	0	0	109.7	Q51 Q52	E47-Q51 WeakPolarHBondContact CA-O 3.4Å; E47-Q52 VanDerWaalsContact CD-NE2 3.29Å; E47-Q52 PolarHBondContact OE2-NE2 2.87Å
48	V	93.9	Very high	92.5	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.018	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129.3	176.6	-177.6	0	0	0	0	109.1	I46 N50 Q51 E172 T175 R176	I46-V48 HydrophobicContact CD1-CG2 3.89Å; I46-V48 HydrophobicContact CG1-CG2 3.8Å; V48-N50 PolarHBondContact O-N 3.21Å; V48-Q51 PolarHBondContact N-O 2.83Å; V48-Q51 WeakPolarHBondContact O-CA 3.43Å; V48-Q51 WeakPolarHBondContact O-CB 3.46Å; V48-Q51 PolarHBondContact O-N 3.47Å; V48-E172 HydrophobicContact CG1-CG 4.01Å; V48-E172 HydrophobicContact CG2-CG 3.96Å; V48-T175 HydrophobicContact CB-CG2 4.02Å; V48-T175 HydrophobicContact CG2-CG2 3.66Å; V48-R176 HydrophobicContact CG1-CB 4.19Å
49	D	91.2	Very high	93.3	Very high	95 Å²	95	53.2 Å²	53.2	51%	0.508	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	42.1	178.5	-52.9	-25.3	0	0	0	112.7	Q51 R176	D49-Q51 PolarHBondContact O-N 3.37Å; D49-R176 IonicContact OD1-CZ 2.75Å; D49-R176 IonicContact OD1-NE 3.81Å; D49-R176 IonicContact OD1-NH2 3.57Å; D49-R176 PolarHBondContact OD1-NH2 3.45Å; D49-R176 IonicContact OD2-CZ 3.07Å; D49-R176 IonicContact OD2-NE 3.86Å; D49-R176 PolarHBondContact OD2-NE 2.94Å; D49-R176 VanDerWaalsContact OD2-NE 3.09Å; D49-R176 IonicContact OD2-NH2 3.34Å
50	N	90.7	Very high	94.1	Very high	149 Å²	149	49.3 Å²	49.3	80%	0.797	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	22.1	-174.6	-55.4	-32.3	0	0	0	114.8	V48	V48-N50 PolarHBondContact O-N 3.21Å
51	Q	91.5	Very high	94.4	Very high	81 Å²	81	45.4 Å²	45.4	38%	0.379	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.5	174.3	-58	-167	-8.1	0	0	110.4	Q4 E47 V48 D49 V53 L179	Q4-Q51 VanDerWaalsContact NE2-OE1 3.09Å; E47-Q51 WeakPolarHBondContact CA-O 3.4Å; V48-Q51 PolarHBondContact N-O 2.83Å; V48-Q51 WeakPolarHBondContact O-CA 3.43Å; V48-Q51 WeakPolarHBondContact O-CB 3.46Å; V48-Q51 PolarHBondContact O-N 3.47Å; D49-Q51 PolarHBondContact O-N 3.37Å; Q51-V53 PolarHBondContact O-N 3.26Å; Q51-L179 HydrophobicContact CB-CD1 4.34Å
52	Q	95	Very high	94.6	Very high	95 Å²	95	42.4 Å²	42.4	44%	0.444	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	119.3	172.3	-67.7	-70	-24.6	0	0	109.7	Q4 E47	Q4-Q52 PolarHBondContact N-O 2.88Å; E47-Q52 VanDerWaalsContact CD-NE2 3.29Å; E47-Q52 PolarHBondContact OE2-NE2 2.87Å
53	V	96.5	Very high	94.6	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.4	-179	-177.9	0	0	0	0	109.4	Q4 K6 I46 Q51 L55 T175 L179	Q4-V53 CarbonylContact O-C 3.57Å; Q4-V53 WeakPolarHBondContact O-CA 3.46Å; K6-V53 HydrophobicContact CB-CG1 3.93Å; K6-V53 HydrophobicContact CG-CG1 3.63Å; I46-V53 HydrophobicContact CG2-CB 4.12Å; I46-V53 PolarHBondContact N-O 3.03Å; I46-V53 PolarHBondContact O-N 3.48Å; I46-V53 VanDerWaalsContact O-O 3.13Å; Q51-V53 PolarHBondContact O-N 3.26Å; V53-L55 HydrophobicContact CG1-CD2 4.22Å; V53-T175 HydrophobicContact CB-CG2 3.95Å; V53-T175 HydrophobicContact CG1-CG2 4.01Å; V53-T175 HydrophobicContact CG2-CG2 3.85Å; V53-L179 HydrophobicContact CG2-CD1 4.24Å; V53-L179 HydrophobicContact CG2-CD2 4.06Å
54	Q	96.8	Very high	94.4	Very high	56 Å²	56	46.4 Å²	46.4	26%	0.262	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	115.4	168.7	-179	168.7	94.4	0	0	109.5	V3 Q4 R5 K6 V43 D45	V3-Q54 HydrophobicContact CG1-CB 3.89Å; Q4-Q54 PolarHBondContact O-N 3.43Å; R5-Q54 CarbonylContact C-O 3.39Å; R5-Q54 WeakPolarHBondContact CA-O 3.33Å; K6-Q54 PolarHBondContact N-O 3.35Å; V43-Q54 HydrophobicContact CG1-CG 3.52Å; D45-Q54 WeakPolarHBondContact OD1-CB 3.3Å; D45-Q54 WeakPolarHBondContact OD1-CG 3.43Å; D45-Q54 PolarHBondContact OD1-NE2 2.69Å
55	L	97.1	Very high	94.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	122.1	174.3	-65.1	177.3	0	0	0	110.3	K6 F25 V43 A44 I46 V53 L57 F171	K6-L55 HydrophobicContact CB-CD2 3.98Å; K6-L55 CarbonylContact O-C 3.59Å; K6-L55 WeakPolarHBondContact O-CA 3.23Å; F25-L55 HydrophobicContact CE1-CD1 3.99Å; F25-L55 HydrophobicContact CZ-CD1 4.05Å; V43-L55 WeakPolarHBondContact CA-O 3.24Å; A44-L55 PolarHBondContact N-O 3.07Å; A44-L55 VanDerWaalsContact N-O 3.07Å; A44-L55 PolarHBondContact O-N 3.15Å; I46-L55 HydrophobicContact CG2-CD1 3.8Å; I46-L55 HydrophobicContact CG2-CG 3.84Å; V53-L55 HydrophobicContact CG1-CD2 4.22Å; L55-L57 HydrophobicContact CB-CD2 3.7Å; L55-L57 HydrophobicContact CB-CG 4.3Å; L55-L57 HydrophobicContact CD1-CD2 4.13Å; L55-F171 HydrophobicContact CD1-CB 4.48Å; L55-F171 HydrophobicContact CD1-CD1 4.18Å
56	A	97.3	Very high	94.3	Very high	4 Å²	4	51.2 Å²	51.2	3%	0.033	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	108.7	160.4	0	0	0	0	0	107.8	K6 L8	K6-A56 PolarHBondContact O-N 3.4Å; L8-A56 PolarHBondContact N-O 3Å
57	L	97.3	Very high	94.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.2	-175.6	-49.5	172.1	0	0	0	109.2	L8 L22 F25 T41 Y42 A44 L55 F171	L8-L57 HydrophobicContact CB-CD2 4.2Å; L8-L57 HydrophobicContact CD1-CD2 4.26Å; L8-L57 HydrophobicContact CD2-CD2 4.08Å; L8-L57 HydrophobicContact CG-CD2 4.42Å; L22-L57 HydrophobicContact CD2-CB 3.94Å; L22-L57 HydrophobicContact CD2-CD1 4.14Å; L22-L57 HydrophobicContact CD2-CD2 4.32Å; L22-L57 HydrophobicContact CD2-CG 4.36Å; F25-L57 HydrophobicContact CD1-CD1 3.74Å; F25-L57 HydrophobicContact CE1-CD1 3.99Å; F25-L57 HydrophobicContact CE1-CD2 4.41Å; T41-L57 VanDerWaalsContact CA-O 3.3Å; T41-L57 WeakPolarHBondContact CA-O 3.34Å; Y42-L57 PolarHBondContact N-O 2.89Å; Y42-L57 PolarHBondContact O-N 2.74Å; A44-L57 HydrophobicContact CB-CD1 4.14Å; L55-L57 HydrophobicContact CB-CD2 3.7Å; L55-L57 HydrophobicContact CB-CG 4.3Å; L55-L57 HydrophobicContact CD1-CD2 4.13Å; L57-F171 HydrophobicContact CD2-CD1 4.21Å; L57-F171 HydrophobicContact CD2-CE1 3.92Å
58	W	97.4	Very high	94.1	Very high	60 Å²	60	59.9 Å²	59.9	23%	0.227	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	105.8	-178.4	-70.6	59.6	0	0	0	108.7	K7 L8 V9 V10 F39	K7-W58 HydrophobicContact CD-CD2 4.43Å; K7-W58 HydrophobicContact CD-CZ2 4.43Å; K7-W58 VanDerWaalsContact CE-CD2 3.5Å; K7-W58 VanDerWaalsContact CE-CE2 3.46Å; K7-W58 HydrophobicContact CG-CG 4.46Å; L8-W58 PolarHBondContact O-N 2.88Å; V9-W58 HydrophobicContact CB-CB 4.27Å; V9-W58 HydrophobicContact CG1-CB 4.42Å; V9-W58 HydrophobicContact CG2-CB 3.76Å; V9-W58 HydrophobicContact CG2-CG 4.08Å; V10-W58 PolarHBondContact N-O 3.14Å; F39-W58 HydrophobicContact CE1-CE3 4.3Å; F39-W58 HydrophobicContact CE1-CZ3 4.11Å; F39-W58 HydrophobicContact CE2-CB 4.32Å; F39-W58 HydrophobicContact CE2-CD2 4.05Å; F39-W58 AromaticContact CE2-CE3 3.27Å; F39-W58 HydrophobicContact CE2-CE3 3.27Å; F39-W58 AromaticContact CE2-CZ3 3.77Å; F39-W58 HydrophobicContact CE2-CZ3 3.77Å; F39-W58 AromaticContact CZ-CD2 3.75Å; F39-W58 HydrophobicContact CZ-CD2 3.75Å; F39-W58 AromaticContact CZ-CE3 3.07Å; F39-W58 HydrophobicContact CZ-CE3 3.07Å; F39-W58 HydrophobicContact CZ-CG 4.47Å; F39-W58 HydrophobicContact CZ-CH2 4.05Å; F39-W58 AromaticContact CZ-CZ3 3.22Å; F39-W58 HydrophobicContact CZ-CZ3 3.22Å
59	D	96.4	Very high	94.1	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	134.3	172.9	-163	12.5	0	0	0	109.7	T19 L22 T37 F39 E40 Y42	T19-D59 WeakPolarHBondContact CA-OD2 3.47Å; T19-D59 VanDerWaalsContact CB-OD2 3.24Å; T19-D59 WeakPolarHBondContact CB-OD2 3.45Å; T19-D59 VanDerWaalsContact CG2-OD2 3.32Å; T19-D59 WeakPolarHBondContact CG2-OD2 3.45Å; T19-D59 PolarHBondContact OG1-OD2 3.12Å; L22-D59 HydrophobicContact CD1-CB 3.42Å; L22-D59 VanDerWaalsContact CD1-CB 3.42Å; T37-D59 HydrophobicContact CG2-CB 4.12Å; T37-D59 WeakPolarHBondContact CG2-OD2 3.33Å; T37-D59 PolarHBondContact OG1-OD2 3.36Å; F39-D59 WeakPolarHBondContact CD2-O 3.38Å; E40-D59 HydrophobicContact CB-CB 4.27Å; E40-D59 PolarHBondContact N-O 3.29Å; E40-D59 PolarHBondContact O-N 3.46Å; Y42-D59 HydrophobicContact CE2-CB 4.44Å
60	T	96.1	Very high	94.3	Very high	3 Å²	3	60 Å²	60	2%	0.018	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147	-177	74.2	0	0	0	0	112.2	V9 V10 K18 R70	V9-T60 HydrophobicContact CG1-CG2 3.9Å; V10-T60 PolarHBondContact O-OG1 2.82Å; K18-T60 WeakPolarHBondContact CE-O 3.39Å; T60-R70 HydrophobicContact CG2-CG 4.24Å
61	A	93.3	Very high	94.6	Very high	3 Å²	3	54 Å²	54	3%	0.025	25%	0.252	C	S	.	.			trans	-60.9	134.7	171.2	0	0	0	0	0	111.7	T37 V38 Y66 R70	T37-A61 WeakPolarHBondContact O-CA 3.4Å; T37-A61 VanDerWaalsContact O-CB 3.22Å; T37-A61 WeakPolarHBondContact O-CB 3.32Å; V38-A61 WeakPolarHBondContact O-CB 3.33Å; V38-A61 PolarHBondContact O-N 2.87Å; A61-Y66 HydrophobicContact CB-CD1 4.3Å; A61-Y66 HydrophobicContact CB-CD2 3.43Å; A61-Y66 VanDerWaalsContact CB-CD2 3.43Å; A61-Y66 HydrophobicContact CB-CE2 4.21Å; A61-Y66 HydrophobicContact CB-CG 3.48Å; A61-Y66 VanDerWaalsContact CB-CG 3.48Å; A61-R70 PolarHBondContact O-NE 2.98Å; A61-R70 PolarHBondContact O-NH2 2.9Å
62	G	92	Very high	94.7	Very high	7 Å²	7	56.2 Å²	56.2	7%	0.072	27%	0.265	C	S	.	.			trans	-93.1	-7.4	175.9	0	0	0	0	0	114.3	G12 G14	G12-G62 WeakPolarHBondContact O-CA 3.25Å; G14-G62 PolarHBondContact N-O 3.04Å
63	Q	91.6	Very high	94.8	Very high	50 Å²	50	52 Å²	52	23%	0.234	25%	0.246	C	C	.	.	S	Bend	trans	-81.7	148.2	-178	-53.6	81.1	-8.5	0	0	111	D65 Y66 R70	Q63-D65 PolarHBondContact O-N 3.28Å; Q63-Y66 HydrophobicContact CB-CD2 4.07Å; Q63-Y66 HydrophobicContact CB-CE2 4.45Å; Q63-Y66 PolarHBondContact O-N 2.93Å; Q63-Y66 VanDerWaalsContact O-N 3.17Å; Q63-R70 PolarHBondContact O-NH2 3.22Å
64	E	89.9	Confident	94.9	Very high	147 Å²	147	52.2 Å²	52.2	69%	0.687	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-62.7	-30.1	-179.3	-65.1	-176.1	169.7	0	0	113.2	Y66 D67	E64-Y66 PolarHBondContact O-N 3.4Å; E64-D67 WeakPolarHBondContact O-CB 3.39Å; E64-D67 VanDerWaalsContact O-CG 3.32Å; E64-D67 PolarHBondContact O-N 3.33Å
65	D	92.9	Very high	94.9	Very high	147 Å²	147	53.1 Å²	53.1	79%	0.786	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-54.9	-22.4	176.1	-64.8	-33.7	0	0	0	112.9	Q63	Q63-D65 PolarHBondContact O-N 3.28Å
66	Y	92.8	Very high	94.8	Very high	71 Å²	71	60.2 Å²	60.2	28%	0.278	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-106.6	7	-179.3	-58.5	-81	0	0	0	113.9	V38 A61 Q63 E64 R68 L69 R70	V38-Y66 HydrophobicContact CB-CE1 4.19Å; V38-Y66 HydrophobicContact CG1-CD1 3.95Å; V38-Y66 HydrophobicContact CG1-CE1 3.6Å; V38-Y66 HydrophobicContact CG2-CE1 3.86Å; A61-Y66 HydrophobicContact CB-CD1 4.3Å; A61-Y66 HydrophobicContact CB-CD2 3.43Å; A61-Y66 VanDerWaalsContact CB-CD2 3.43Å; A61-Y66 HydrophobicContact CB-CE2 4.21Å; A61-Y66 HydrophobicContact CB-CG 3.48Å; A61-Y66 VanDerWaalsContact CB-CG 3.48Å; Q63-Y66 HydrophobicContact CB-CD2 4.07Å; Q63-Y66 HydrophobicContact CB-CE2 4.45Å; Q63-Y66 PolarHBondContact O-N 2.93Å; Q63-Y66 VanDerWaalsContact O-N 3.17Å; E64-Y66 PolarHBondContact O-N 3.4Å; Y66-R68 PolarHBondContact O-N 2.94Å; Y66-R68 VanDerWaalsContact O-N 3.12Å; Y66-L69 HydrophobicContact CD1-CD1 3.98Å; Y66-L69 PolarHBondContact O-N 3.26Å; Y66-R70 PolarHBondContact O-N 3Å
67	D	93.3	Very high	94.9	Very high	53 Å²	53	60.6 Å²	60.6	28%	0.283	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.9	-178.2	-77.5	-9.1	0	0	0	112.8	E64 R70 P71 K98	E64-D67 WeakPolarHBondContact O-CB 3.39Å; E64-D67 VanDerWaalsContact O-CG 3.32Å; E64-D67 PolarHBondContact O-N 3.33Å; D67-R70 IonicContact OD1-CZ 2.94Å; D67-R70 VanDerWaalsContact OD1-CZ 3.26Å; D67-R70 IonicContact OD1-NH1 3.33Å; D67-R70 PolarHBondContact OD1-NH1 2.98Å; D67-R70 IonicContact OD1-NH2 3.26Å; D67-R70 PolarHBondContact OD1-NH2 2.87Å; D67-P71 WeakPolarHBondContact O-CD 3.37Å; D67-K98 WeakPolarHBondContact OD1-CE 3.21Å; D67-K98 IonicContact OD1-NZ 2.71Å; D67-K98 PolarHBondContact OD1-NZ 2.85Å; D67-K98 IonicContact OD2-NZ 3.16Å; D67-K98 PolarHBondContact OD2-NZ 2.82Å; D67-K98 VanDerWaalsContact OD2-NZ 3.1Å
68	R	93.8	Very high	94.9	Very high	232 Å²	232	63 Å²	63	88%	0.875	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-21.9	175.8	-64.7	-175.2	-179.3	-177.4	1.3	113.9	Y66	Y66-R68 PolarHBondContact O-N 2.94Å; Y66-R68 VanDerWaalsContact O-N 3.12Å
69	L	93.2	Very high	95	Very high	95 Å²	95	60.1 Å²	60.1	50%	0.497	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-36.5	-177.6	-71.6	171.8	0	0	0	111.7	Y66 P71 L72	Y66-L69 HydrophobicContact CD1-CD1 3.98Å; Y66-L69 PolarHBondContact O-N 3.26Å; L69-P71 VanDerWaalsContact C-N 3.28Å; L69-L72 HydrophobicContact CD2-CD1 4.12Å; L69-L72 VanDerWaalsContact O-CB 3.27Å; L69-L72 WeakPolarHBondContact O-CB 3.33Å; L69-L72 WeakPolarHBondContact O-CG 3.45Å; L69-L72 PolarHBondContact O-N 3.02Å
70	R	96.1	Very high	95.1	Very high	6 Å²	6	60.1 Å²	60.1	2%	0.023	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-50.7	-38.8	179.5	-162.5	-178.2	-46.4	111	5.4	113.9	T60 A61 Q63 Y66 D67 L72 S73 Y74 W99 E102	T60-R70 HydrophobicContact CG2-CG 4.24Å; A61-R70 PolarHBondContact O-NE 2.98Å; A61-R70 PolarHBondContact O-NH2 2.9Å; Q63-R70 PolarHBondContact O-NH2 3.22Å; Y66-R70 PolarHBondContact O-N 3Å; D67-R70 IonicContact OD1-CZ 2.94Å; D67-R70 VanDerWaalsContact OD1-CZ 3.26Å; D67-R70 IonicContact OD1-NH1 3.33Å; D67-R70 PolarHBondContact OD1-NH1 2.98Å; D67-R70 IonicContact OD1-NH2 3.26Å; D67-R70 PolarHBondContact OD1-NH2 2.87Å; R70-L72 PolarHBondContact O-N 2.98Å; R70-L72 VanDerWaalsContact O-N 3.08Å; R70-S73 VanDerWaalsContact O-CB 3.29Å; R70-S73 WeakPolarHBondContact O-CB 3.31Å; R70-S73 PolarHBondContact O-N 2.79Å; R70-S73 PolarHBondContact O-OG 3.26Å; R70-Y74 WeakPolarHBondContact CD-OH 3.5Å; R70-W99 VanDerWaalsContact CZ-CH2 3.44Å; R70-W99 VanDerWaalsContact CZ-CZ3 3.44Å; R70-W99 VanDerWaalsContact NH1-CZ3 3.33Å; R70-E102 VanDerWaalsContact CD-OE1 3.31Å; R70-E102 WeakPolarHBondContact CD-OE1 3.32Å; R70-E102 IonicContact CZ-OE1 3.03Å; R70-E102 IonicContact NE-OE1 2.71Å; R70-E102 VanDerWaalsContact NH1-CD 3.27Å; R70-E102 IonicContact NH1-OE1 2.67Å; R70-E102 PolarHBondContact NH1-OE1 3.42Å; R70-E102 IonicContact NH1-OE2 3.9Å; R70-E102 PolarHBondContact NH1-OE2 3.15Å
71	P	96	Very high	95.2	Very high	24 Å²	24	60 Å²	60	16%	0.156	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-59.3	-23.4	178.1	-29.8	38.7	0	0	0	115.5	D67 L69 S73 Y74 F106	D67-P71 WeakPolarHBondContact O-CD 3.37Å; L69-P71 VanDerWaalsContact C-N 3.28Å; P71-S73 PolarHBondContact O-N 2.73Å; P71-Y74 VanDerWaalsContact CA-CD2 3.49Å; P71-Y74 HydrophobicContact CB-CD2 4.23Å; P71-Y74 HydrophobicContact CB-CE2 4.49Å; P71-Y74 PolarHBondContact O-N 3.32Å; P71-F106 HydrophobicContact CB-CD1 4.14Å; P71-F106 HydrophobicContact CB-CD2 4.25Å; P71-F106 HydrophobicContact CB-CE1 3.68Å; P71-F106 HydrophobicContact CB-CE2 3.79Å; P71-F106 HydrophobicContact CB-CG 4.42Å; P71-F106 HydrophobicContact CB-CZ 3.48Å; P71-F106 VanDerWaalsContact CB-CZ 3.48Å; P71-F106 HydrophobicContact CG-CD2 4.32Å; P71-F106 HydrophobicContact CG-CE1 4.24Å; P71-F106 HydrophobicContact CG-CE2 3.56Å; P71-F106 HydrophobicContact CG-CZ 3.51Å
72	L	94.8	Very high	95.5	Very high	126 Å²	126	59.8 Å²	59.8	66%	0.66	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-66.2	-18.6	176.1	-57	177.7	0	0	0	112.3	L69 R70 P75	L69-L72 HydrophobicContact CD2-CD1 4.12Å; L69-L72 VanDerWaalsContact O-CB 3.27Å; L69-L72 WeakPolarHBondContact O-CB 3.33Å; L69-L72 WeakPolarHBondContact O-CG 3.45Å; L69-L72 PolarHBondContact O-N 3.02Å; R70-L72 PolarHBondContact O-N 2.98Å; R70-L72 VanDerWaalsContact O-N 3.08Å; L72-P75 WeakPolarHBondContact O-CD 3.2Å
73	S	96.1	Very high	95.8	Very high	6 Å²	6	59.5 Å²	59.5	4%	0.042	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-81.4	-16	176.9	-55.4	0	0	0	0	113.5	K7 V9 F39 R70 P71	K7-S73 WeakPolarHBondContact CE-O 3.44Å; K7-S73 PolarHBondContact NZ-O 2.98Å; V9-S73 WeakPolarHBondContact CG2-O 3.41Å; F39-S73 WeakPolarHBondContact CD2-OG 3.08Å; F39-S73 WeakPolarHBondContact CE2-OG 3.43Å; R70-S73 VanDerWaalsContact O-CB 3.29Å; R70-S73 WeakPolarHBondContact O-CB 3.31Å; R70-S73 PolarHBondContact O-N 2.79Å; R70-S73 PolarHBondContact O-OG 3.26Å; P71-S73 PolarHBondContact O-N 2.73Å
74	Y	97.8	Very high	96.2	Very high	6 Å²	6	57.1 Å²	57.1	2%	0.024	28%	0.283	C	S	.	.			trans	-82.1	-27	-171.2	-66.4	-36.6	0	0	0	118.7	V9 V11 R70 P71 D76 T77 I80 E102 F106 C107	V9-Y74 HydrophobicContact CG1-CD1 4.1Å; V9-Y74 HydrophobicContact CG1-CE1 3.94Å; V11-Y74 HydrophobicContact CG1-CE1 3.78Å; V11-Y74 WeakPolarHBondContact CG1-OH 3.45Å; R70-Y74 WeakPolarHBondContact CD-OH 3.5Å; P71-Y74 VanDerWaalsContact CA-CD2 3.49Å; P71-Y74 HydrophobicContact CB-CD2 4.23Å; P71-Y74 HydrophobicContact CB-CE2 4.49Å; P71-Y74 PolarHBondContact O-N 3.32Å; Y74-D76 PolarHBondContact O-N 2.89Å; Y74-T77 WeakPolarHBondContact O-CB 3.32Å; Y74-T77 PolarHBondContact O-N 2.96Å; Y74-T77 PolarHBondContact O-OG1 2.87Å; Y74-I80 HydrophobicContact CD1-CD1 4.4Å; Y74-I80 HydrophobicContact CE1-CD1 4.39Å; Y74-E102 HydrophobicContact CE2-CG 4.24Å; Y74-E102 PolarHBondContact OH-OE1 3.48Å; Y74-F106 HydrophobicContact CD2-CB 3.3Å; Y74-F106 HydrophobicContact CD2-CD1 4.37Å; Y74-F106 AromaticContact CD2-CD2 3.56Å; Y74-F106 HydrophobicContact CD2-CD2 3.56Å; Y74-F106 HydrophobicContact CD2-CE2 4.48Å; Y74-F106 AromaticContact CD2-CG 3.5Å; Y74-F106 HydrophobicContact CD2-CG 3.5Å; Y74-F106 VanDerWaalsContact CD2-CG 3.5Å; Y74-F106 HydrophobicContact CE2-CB 4.07Å; Y74-F106 AromaticContact CE2-CD2 3.61Å; Y74-F106 HydrophobicContact CE2-CD2 3.61Å; Y74-F106 HydrophobicContact CE2-CE2 4.36Å; Y74-F106 HydrophobicContact CE2-CG 4.06Å; Y74-F106 HydrophobicContact CG-CB 3.89Å; Y74-F106 HydrophobicContact CG-CG 4.49Å; Y74-C107 VanDerWaalsContact CB-SG 3.59Å
75	P	97.4	Very high	96.6	Very high	76 Å²	76	50.3 Å²	50.3	49%	0.494	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	137.2	179.7	-29.3	36.4	0	0	0	112.3	K7 L72 T77	K7-P75 WeakPolarHBondContact CE-O 3.41Å; K7-P75 PolarHBondContact NZ-O 2.74Å; L72-P75 WeakPolarHBondContact O-CD 3.2Å; P75-T77 PolarHBondContact O-N 2.69Å
76	D	96.2	Very high	96.9	Very high	149 Å²	149	43.3 Å²	43.3	80%	0.797	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	26.5	177.3	-48.6	-49.2	0	0	0	115.2	Y74	Y74-D76 PolarHBondContact O-N 2.89Å
77	T	98.2	Very high	97.1	Very high	12 Å²	12	41.8 Å²	41.8	7%	0.074	21%	0.211	C	C	.	.			trans	-71.6	130.4	176.4	-58	0	0	0	0	111.5	V9 Y74 P75 V79 I80 V110	V9-T77 HydrophobicContact CB-CG2 4.04Å; V9-T77 HydrophobicContact CG2-CG2 3.76Å; V9-T77 VanDerWaalsContact CG2-OG1 3.3Å; V9-T77 WeakPolarHBondContact CG2-OG1 3.34Å; Y74-T77 WeakPolarHBondContact O-CB 3.32Å; Y74-T77 PolarHBondContact O-N 2.96Å; Y74-T77 PolarHBondContact O-OG1 2.87Å; P75-T77 PolarHBondContact O-N 2.69Å; T77-V79 WeakPolarHBondContact CG2-O 3.3Å; T77-I80 HydrophobicContact CG2-CD1 3.81Å; T77-I80 HydrophobicContact CG2-CG1 4.3Å; T77-V110 HydrophobicContact CG2-CG1 3.99Å; T77-V110 VanDerWaalsContact O-CG2 3.3Å; T77-V110 WeakPolarHBondContact O-CG2 3.43Å
78	D	98.3	Very high	97.4	Very high	49 Å²	49	41 Å²	41	26%	0.262	21%	0.209	S	C	.	.	S	Bend	trans	-89.2	-32.9	176.1	-69	-88	0	0	0	112.7	K6 K7 P111 T178	K6-D78 WeakPolarHBondContact CA-OD2 3.25Å; K6-D78 HydrophobicContact CB-CB 4.47Å; K6-D78 HydrophobicContact CD-CB 3.97Å; K6-D78 VanDerWaalsContact CD-CG 3.41Å; K6-D78 VanDerWaalsContact CD-OD1 3.29Å; K6-D78 WeakPolarHBondContact CD-OD1 3.44Å; K6-D78 IonicContact NZ-OD1 3.86Å; K6-D78 PolarHBondContact NZ-OD1 3.27Å; K7-D78 PolarHBondContact N-OD2 2.86Å; K7-D78 WeakPolarHBondContact O-CB 3.39Å; K7-D78 PolarHBondContact O-N 2.86Å; D78-P111 WeakPolarHBondContact O-CD 3.29Å; D78-T178 HydrophobicContact CB-CG2 3.65Å
79	V	98.6	Very high	97.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	146.4	179.3	59.9	0	0	0	0	111.8	K7 L8 V9 T77 P111 I113 A174 T178	K7-V79 PolarHBondContact O-N 2.87Å; L8-V79 WeakPolarHBondContact CA-O 3.49Å; L8-V79 HydrophobicContact CB-CG1 3.83Å; L8-V79 HydrophobicContact CD1-CG1 4.01Å; L8-V79 HydrophobicContact CG-CG1 3.88Å; V9-V79 PolarHBondContact N-O 2.82Å; V9-V79 VanDerWaalsContact N-O 3.12Å; T77-V79 WeakPolarHBondContact CG2-O 3.3Å; V79-P111 HydrophobicContact CB-CG 4.31Å; V79-P111 HydrophobicContact CG2-CG 4.25Å; V79-I113 HydrophobicContact CG2-CG1 4.06Å; V79-A174 HydrophobicContact CG1-CB 4.29Å; V79-A174 HydrophobicContact CG2-CB 4.09Å; V79-T178 HydrophobicContact CB-CG2 3.66Å; V79-T178 HydrophobicContact CG1-CG2 3.56Å
80	I	98.8	Very high	97.8	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	128.4	174.5	-62.8	-72.8	0	0	0	109.6	V9 V11 Y74 T77 M82 V103 V110 P111 I112 I113	V9-I80 HydrophobicContact CB-CD1 3.96Å; V9-I80 HydrophobicContact CG1-CD1 4.37Å; V9-I80 WeakPolarHBondContact O-CA 3.36Å; V11-I80 HydrophobicContact CG2-CG2 3.88Å; Y74-I80 HydrophobicContact CD1-CD1 4.4Å; Y74-I80 HydrophobicContact CE1-CD1 4.39Å; T77-I80 HydrophobicContact CG2-CD1 3.81Å; T77-I80 HydrophobicContact CG2-CG1 4.3Å; I80-M82 HydrophobicContact CG2-CB 4.27Å; I80-V103 HydrophobicContact CB-CG1 4.46Å; I80-V103 HydrophobicContact CD1-CG1 4.33Å; I80-V103 HydrophobicContact CG1-CG1 3.82Å; I80-V103 HydrophobicContact CG2-CG1 4.32Å; I80-V103 HydrophobicContact CG2-CG2 4.25Å; I80-V110 HydrophobicContact CG1-CB 4.47Å; I80-V110 HydrophobicContact CG1-CG1 3.84Å; I80-P111 PolarHBondContact N-O 3.19Å; I80-I112 HydrophobicContact CB-CG1 4.17Å; I80-I112 HydrophobicContact CG2-CG1 4.42Å; I80-I113 PolarHBondContact O-N 2.98Å
81	L	98.8	Very high	98	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	115.2	158	-63.9	-170.9	0	0	0	108.3	L8 V9 V10 V11 L21 I113 V115 V170 F171 A174	L8-L81 HydrophobicContact CD1-CD1 4.04Å; L8-L81 HydrophobicContact CD1-CD2 4.47Å; L8-L81 HydrophobicContact CD1-CG 3.98Å; L8-L81 HydrophobicContact CD2-CD1 3.84Å; L8-L81 HydrophobicContact CD2-CG 3.84Å; L8-L81 HydrophobicContact CG-CD1 4.38Å; L8-L81 HydrophobicContact CG-CG 4.06Å; V9-L81 PolarHBondContact O-N 2.73Å; V10-L81 WeakPolarHBondContact CA-O 3.38Å; V10-L81 HydrophobicContact CB-CB 4.42Å; V10-L81 HydrophobicContact CG1-CB 4.06Å; V10-L81 HydrophobicContact CG2-CB 4.14Å; V10-L81 HydrophobicContact CG2-CD1 4.19Å; V11-L81 PolarHBondContact N-O 3.06Å; L21-L81 HydrophobicContact CD2-CD1 4.15Å; L81-I113 HydrophobicContact CD2-CB 3.72Å; L81-I113 HydrophobicContact CD2-CG1 4Å; L81-I113 HydrophobicContact CD2-CG2 4.26Å; L81-V115 HydrophobicContact CD2-CG2 4.12Å; L81-V170 HydrophobicContact CD1-CG1 3.75Å; L81-V170 HydrophobicContact CD2-CG1 3.98Å; L81-F171 HydrophobicContact CD1-CE1 4.07Å; L81-F171 HydrophobicContact CD1-CZ 4.29Å; L81-A174 HydrophobicContact CD2-CB 3.81Å
82	M	98.8	Very high	98.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	110.5	177.1	-170.1	176.9	-73.9	0	0	108.4	V11 I80 I95 W99 V100 V103 I112 I113 L114 V115 I151	V11-M82 HydrophobicContact CG2-CB 4.25Å; V11-M82 HydrophobicContact CG2-CE 4.4Å; V11-M82 HydrophobicContact CG2-CG 4.1Å; I80-M82 HydrophobicContact CG2-CB 4.27Å; M82-I95 HydrophobicContact CG-CD1 3.68Å; M82-I95 HydrophobicContact SD-CD1 4.12Å; M82-I95 HydrophobicContact SD-CG2 3.71Å; M82-W99 HydrophobicContact CE-CB 3.95Å; M82-W99 HydrophobicContact CG-CB 4.11Å; M82-W99 HydrophobicContact SD-CB 3.84Å; M82-V100 HydrophobicContact CE-CG2 4Å; M82-V100 HydrophobicContact SD-CG2 3.77Å; M82-V103 HydrophobicContact CE-CB 3.97Å; M82-V103 HydrophobicContact CE-CG1 4.42Å; M82-V103 HydrophobicContact CE-CG2 3.72Å; M82-I112 HydrophobicContact CB-CG2 3.69Å; M82-I112 HydrophobicContact CE-CD1 3.98Å; M82-I112 HydrophobicContact CE-CG2 4.04Å; M82-I112 HydrophobicContact SD-CG2 4.2Å; M82-I113 PolarHBondContact N-O 2.77Å; M82-L114 WeakPolarHBondContact O-CA 3.35Å; M82-L114 WeakPolarHBondContact O-CD1 3.27Å; M82-V115 PolarHBondContact O-N 2.91Å; M82-I151 HydrophobicContact SD-CD1 4.18Å
83	C	98.9	Very high	98.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	138.7	-168.4	-64.7	0	0	0	0	112.3	V10 V11 G12 K18 V115	V10-C83 VanDerWaalsContact CG1-SG 3.57Å; V11-C83 PolarHBondContact O-N 3.07Å; G12-C83 VanDerWaalsContact CA-O 3.23Å; G12-C83 WeakPolarHBondContact CA-O 3.45Å; K18-C83 HydrophobicContact CG-CB 4.04Å; C83-V115 WeakPolarHBondContact CA-O 3.49Å
84	Y	98.9	Very high	98.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	173.7	160.7	74.6	-84.6	0	0	0	108.9	S91 L92 L114 V115 A116 N117 V139 G144 Y156	Y84-S91 WeakPolarHBondContact CB-O 3.3Å; Y84-S91 WeakPolarHBondContact CB-OG 3.43Å; Y84-L92 HydrophobicContact CD1-CD1 3.9Å; Y84-L92 HydrophobicContact CD2-CB 3.88Å; Y84-L92 HydrophobicContact CD2-CD1 4.23Å; Y84-L92 HydrophobicContact CE1-CD1 3.75Å; Y84-L92 HydrophobicContact CE2-CB 4.19Å; Y84-L92 HydrophobicContact CE2-CD1 4.13Å; Y84-L92 HydrophobicContact CG-CB 4.22Å; Y84-L92 HydrophobicContact CG-CD1 4.11Å; Y84-L114 HydrophobicContact CD1-CD1 4.01Å; Y84-L114 HydrophobicContact CD1-CG 4.4Å; Y84-L114 HydrophobicContact CE1-CD1 4.3Å; Y84-L114 HydrophobicContact CE1-CD2 4.39Å; Y84-L114 HydrophobicContact CE1-CG 4.19Å; Y84-V115 WeakPolarHBondContact CD1-O 3.41Å; Y84-V115 PolarHBondContact N-O 2.67Å; Y84-A116 HydrophobicContact CD1-CB 4.46Å; Y84-A116 HydrophobicContact CE1-CB 3.64Å; Y84-A116 HydrophobicContact CE2-CB 3.9Å; Y84-A116 VanDerWaalsContact OH-CB 3.29Å; Y84-A116 WeakPolarHBondContact OH-CB 3.5Å; Y84-N117 WeakPolarHBondContact O-CB 3.29Å; Y84-N117 PolarHBondContact O-N 2.87Å; Y84-V139 HydrophobicContact CE2-CB 4.02Å; Y84-V139 HydrophobicContact CE2-CG1 3.68Å; Y84-V139 HydrophobicContact CE2-CG2 4.19Å; Y84-G144 WeakPolarHBondContact OH-CA 3.01Å; Y84-Y156 HydrophobicContact CE1-CE2 4.09Å; Y84-Y156 PolarHBondContact OH-OH 3.41Å
85	S	98.8	Very high	98.4	Very high	4 Å²	4	28.4 Å²	28.4	3%	0.028	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	141.8	175.4	67.7	0	0	0	0	112.7	D87 S88 S91 N117	S85-D87 WeakPolarHBondContact CB-OD1 3.49Å; S85-D87 PolarHBondContact O-N 3.42Å; S85-D87 PolarHBondContact OG-OD1 3.21Å; S85-S88 PolarHBondContact O-N 3.45Å; S85-S91 PolarHBondContact N-OG 3.19Å; S85-S91 PolarHBondContact O-OG 3.28Å; S85-N117 WeakPolarHBondContact CA-O 3.35Å
86	V	98.8	Very high	98.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-28.1	-175.4	170.3	0	0	0	0	112.8	S88 A116 N117 R122 P138 V139	V86-S88 VanDerWaalsContact C-N 3.27Å; V86-S88 PolarHBondContact O-N 2.94Å; V86-A116 HydrophobicContact CG2-CB 3.99Å; V86-N117 WeakPolarHBondContact CG2-O 3.49Å; V86-N117 PolarHBondContact N-O 3.44Å; V86-R122 HydrophobicContact CG1-CB 3.78Å; V86-R122 HydrophobicContact CG1-CG 4.15Å; V86-P138 HydrophobicContact CG1-CB 4.11Å; V86-P138 CarbonylContact O-C 3.46Å; V86-P138 WeakPolarHBondContact O-CA 3.25Å; V86-V139 PolarHBondContact O-N 2.94Å
87	D	98.5	Very high	98.5	Very high	39 Å²	39	26.1 Å²	26.1	21%	0.209	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-1.1	175.6	64	-24.8	0	0	0	113.9	S85 K118 L121 T127	S85-D87 WeakPolarHBondContact CB-OD1 3.49Å; S85-D87 PolarHBondContact O-N 3.42Å; S85-D87 PolarHBondContact OG-OD1 3.21Å; D87-K118 IonicContact OD1-NZ 2.79Å; D87-K118 PolarHBondContact OD1-NZ 3.43Å; D87-K118 IonicContact OD2-NZ 2.83Å; D87-K118 PolarHBondContact OD2-NZ 3.47Å; D87-L121 HydrophobicContact CB-CB 4.27Å; D87-L121 HydrophobicContact CB-CD1 3.78Å; D87-L121 WeakPolarHBondContact OD2-CD1 3.36Å; D87-T127 HydrophobicContact CB-CG2 3.73Å
88	S	98.4	Very high	98.5	Very high	37 Å²	37	27.3 Å²	27.3	26%	0.259	15%	0.153	S	C	.	.			trans	-133.5	93.3	-178.6	179.8	0	0	0	0	111.4	S85 V86 D90 S91	S85-S88 PolarHBondContact O-N 3.45Å; V86-S88 VanDerWaalsContact C-N 3.27Å; V86-S88 PolarHBondContact O-N 2.94Å; S88-D90 PolarHBondContact O-N 3.25Å; S88-S91 WeakPolarHBondContact CB-OG 3.07Å; S88-S91 WeakPolarHBondContact O-CB 3.42Å; S88-S91 PolarHBondContact O-N 3.4Å; S88-S91 VanDerWaalsContact O-N 3.07Å; S88-S91 PolarHBondContact O-OG 3.12Å; S88-S91 PolarHBondContact OG-N 3.16Å
89	P	98.2	Very high	98.5	Very high	33 Å²	33	25 Å²	25	21%	0.214	14%	0.141	C	C	.	.	H	α-helix	trans	-56.4	-36.1	174.9	-28.7	38.2	0	0	0	113.8	S91 L92 G93 L136 E137 V139	P89-S91 VanDerWaalsContact C-N 3.29Å; P89-S91 PolarHBondContact O-N 3.2Å; P89-L92 WeakPolarHBondContact O-CB 3.45Å; P89-L92 PolarHBondContact O-N 2.67Å; P89-L92 VanDerWaalsContact O-N 3.14Å; P89-G93 PolarHBondContact O-N 3.35Å; P89-L136 HydrophobicContact CG-CB 4.37Å; P89-L136 HydrophobicContact CG-CD1 4.49Å; P89-E137 VanDerWaalsContact CG-O 3.25Å; P89-E137 WeakPolarHBondContact CG-O 3.49Å; P89-V139 HydrophobicContact CB-CG2 4.33Å; P89-V139 HydrophobicContact CG-CG2 4.26Å
90	D	98.2	Very high	98.5	Very high	104 Å²	104	25.7 Å²	25.7	56%	0.556	15%	0.145	S	C	*	.	H	α-helix	trans	-60.7	-39.3	176	-64.8	-24.4	0	0	0	111.5	S88 L92 G93 N94	S88-D90 PolarHBondContact O-N 3.25Å; D90-L92 PolarHBondContact O-N 3.37Å; D90-G93 WeakPolarHBondContact O-CA 3.21Å; D90-G93 PolarHBondContact O-N 3Å; D90-N94 PolarHBondContact O-N 3.04Å; D90-N94 PolarHBondContact O-ND2 3.19Å
91	S	98.7	Very high	98.5	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.014	17%	0.167	C	C	.	.	H	α-helix	trans	-63.5	-28.7	178	76	0	0	0	0	113.3	D13 Y84 S85 S88 P89 I95	D13-S91 VanDerWaalsContact OD2-CA 3.28Å; D13-S91 WeakPolarHBondContact OD2-CA 3.2Å; D13-S91 WeakPolarHBondContact OD2-CB 3.43Å; Y84-S91 WeakPolarHBondContact CB-O 3.3Å; Y84-S91 WeakPolarHBondContact CB-OG 3.43Å; S85-S91 PolarHBondContact N-OG 3.19Å; S85-S91 PolarHBondContact O-OG 3.28Å; S88-S91 WeakPolarHBondContact CB-OG 3.07Å; S88-S91 WeakPolarHBondContact O-CB 3.42Å; S88-S91 PolarHBondContact O-N 3.4Å; S88-S91 VanDerWaalsContact O-N 3.07Å; S88-S91 PolarHBondContact O-OG 3.12Å; S88-S91 PolarHBondContact OG-N 3.16Å; P89-S91 VanDerWaalsContact C-N 3.29Å; P89-S91 PolarHBondContact O-N 3.2Å; S91-I95 WeakPolarHBondContact O-CG1 3.37Å
92	L	98.8	Very high	98.5	Very high	18 Å²	18	30.4 Å²	30.4	9%	0.094	17%	0.173	C	C	.	.	H	α-helix	trans	-71.7	-42.6	169.9	178.7	64.7	0	0	0	110.8	Y84 P89 D90 N94 I95 V139 D143 M147	Y84-L92 HydrophobicContact CD1-CD1 3.9Å; Y84-L92 HydrophobicContact CD2-CB 3.88Å; Y84-L92 HydrophobicContact CD2-CD1 4.23Å; Y84-L92 HydrophobicContact CE1-CD1 3.75Å; Y84-L92 HydrophobicContact CE2-CB 4.19Å; Y84-L92 HydrophobicContact CE2-CD1 4.13Å; Y84-L92 HydrophobicContact CG-CB 4.22Å; Y84-L92 HydrophobicContact CG-CD1 4.11Å; P89-L92 WeakPolarHBondContact O-CB 3.45Å; P89-L92 PolarHBondContact O-N 2.67Å; P89-L92 VanDerWaalsContact O-N 3.14Å; D90-L92 PolarHBondContact O-N 3.37Å; L92-N94 VanDerWaalsContact C-N 3.31Å; L92-N94 PolarHBondContact O-N 2.87Å; L92-I95 HydrophobicContact CD1-CG1 4.35Å; L92-I95 WeakPolarHBondContact O-CB 3.39Å; L92-I95 VanDerWaalsContact O-CG1 3.32Å; L92-I95 WeakPolarHBondContact O-CG1 3.34Å; L92-I95 PolarHBondContact O-N 2.91Å; L92-V139 HydrophobicContact CB-CG2 4.39Å; L92-V139 HydrophobicContact CD2-CG1 3.57Å; L92-D143 HydrophobicContact CD2-CB 3.93Å; L92-M147 HydrophobicContact CD1-CB 3.78Å; L92-M147 HydrophobicContact CD1-CE 3.8Å; L92-M147 HydrophobicContact CD1-CG 3.74Å; L92-M147 HydrophobicContact CG-CE 3.8Å; L92-M147 WeakPolarHBondContact O-CE 3.43Å
93	G	98.5	Very high	98.5	Very high	26 Å²	26	30.4 Å²	30.4	27%	0.268	17%	0.173	S	C	.	.	H	α-helix	trans	-57.3	-44.4	175.9	0	0	0	0	0	112.6	P89 D90 I95 S96 E97	P89-G93 PolarHBondContact O-N 3.35Å; D90-G93 WeakPolarHBondContact O-CA 3.21Å; D90-G93 PolarHBondContact O-N 3Å; G93-I95 PolarHBondContact O-N 2.6Å; G93-I95 VanDerWaalsContact O-N 3.1Å; G93-S96 PolarHBondContact O-N 3.12Å; G93-S96 PolarHBondContact O-OG 2.74Å; G93-S96 VanDerWaalsContact O-OG 3.07Å; G93-E97 PolarHBondContact O-N 2.71Å
94	N	98.7	Very high	98.4	Very high	48 Å²	48	35.6 Å²	35.6	26%	0.257	20%	0.196	S	C	.	.	H	α-helix	trans	-61.5	-20.4	179.5	-71.5	-22.9	0	0	0	113.7	D13 D90 L92 S96 E97 K98 W99	D13-N94 PolarHBondContact OD2-ND2 2.88Å; D90-N94 PolarHBondContact O-N 3.04Å; D90-N94 PolarHBondContact O-ND2 3.19Å; L92-N94 VanDerWaalsContact C-N 3.31Å; L92-N94 PolarHBondContact O-N 2.87Å; N94-S96 PolarHBondContact O-N 2.73Å; N94-E97 PolarHBondContact O-N 3.07Å; N94-K98 WeakPolarHBondContact O-CB 3.32Å; N94-K98 PolarHBondContact O-N 2.75Å; N94-W99 VanDerWaalsContact O-CD1 3.3Å; N94-W99 PolarHBondContact O-N 2.91Å; N94-W99 VanDerWaalsContact O-N 3.13Å
95	I	98.7	Very high	98.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.227	C	C	.	.	I	π-helix	trans	-54.4	-52.2	173.8	-63.6	-67.5	0	0	0	110.6	M82 S91 L92 G93 W99 V100 L114 M147 I151	M82-I95 HydrophobicContact CG-CD1 3.68Å; M82-I95 HydrophobicContact SD-CD1 4.12Å; M82-I95 HydrophobicContact SD-CG2 3.71Å; S91-I95 WeakPolarHBondContact O-CG1 3.37Å; L92-I95 HydrophobicContact CD1-CG1 4.35Å; L92-I95 WeakPolarHBondContact O-CB 3.39Å; L92-I95 VanDerWaalsContact O-CG1 3.32Å; L92-I95 WeakPolarHBondContact O-CG1 3.34Å; L92-I95 PolarHBondContact O-N 2.91Å; G93-I95 PolarHBondContact O-N 2.6Å; G93-I95 VanDerWaalsContact O-N 3.1Å; I95-W99 PolarHBondContact O-N 2.92Å; I95-V100 HydrophobicContact CG2-CG2 4.2Å; I95-V100 WeakPolarHBondContact O-CB 3.44Å; I95-V100 VanDerWaalsContact O-CG2 3.25Å; I95-V100 WeakPolarHBondContact O-CG2 3.48Å; I95-V100 PolarHBondContact O-N 3.29Å; I95-L114 HydrophobicContact CD1-CD1 3.78Å; I95-L114 HydrophobicContact CG1-CD1 4.07Å; I95-L114 HydrophobicContact CG2-CD1 3.96Å; I95-M147 HydrophobicContact CB-CE 4.34Å; I95-M147 HydrophobicContact CB-CG 4.26Å; I95-M147 HydrophobicContact CB-SD 4.1Å; I95-M147 HydrophobicContact CG2-CG 3.83Å; I95-M147 HydrophobicContact CG2-SD 3.86Å; I95-I151 HydrophobicContact CG2-CD1 3.89Å; I95-I151 HydrophobicContact CG2-CG2 4.3Å
96	S	98	Very high	98.3	Very high	31 Å²	31	46.3 Å²	46.3	22%	0.217	24%	0.244	C	C	.	.	I	π-helix	trans	-78.7	-31.4	-179.2	51.2	0	0	0	0	113.9	G93 N94 P101 R150	G93-S96 PolarHBondContact O-N 3.12Å; G93-S96 PolarHBondContact O-OG 2.74Å; G93-S96 VanDerWaalsContact O-OG 3.07Å; N94-S96 PolarHBondContact O-N 2.73Å; S96-P101 VanDerWaalsContact O-CD 3.32Å; S96-P101 WeakPolarHBondContact O-CD 3.47Å; S96-R150 PolarHBondContact OG-NH2 3.24Å
97	E	97.9	Very high	98.2	Very high	145 Å²	145	46.7 Å²	46.7	68%	0.678	25%	0.246	S	C	*	.	I	π-helix	trans	-84.2	-33.5	-170.6	-64.4	-176.8	-177.4	0	0	112.3	G93 N94	G93-E97 PolarHBondContact O-N 2.71Å; N94-E97 PolarHBondContact O-N 3.07Å
98	K	97.8	Very high	98.1	Very high	38 Å²	38	49 Å²	49	17%	0.165	26%	0.264	C	S	.	.	I	π-helix	trans	-120.4	-59.5	-175.9	178.8	174.8	179.9	163	0	112.6	D67 N94 P101 E102	D67-K98 WeakPolarHBondContact OD1-CE 3.21Å; D67-K98 IonicContact OD1-NZ 2.71Å; D67-K98 PolarHBondContact OD1-NZ 2.85Å; D67-K98 IonicContact OD2-NZ 3.16Å; D67-K98 PolarHBondContact OD2-NZ 2.82Å; D67-K98 VanDerWaalsContact OD2-NZ 3.1Å; N94-K98 WeakPolarHBondContact O-CB 3.32Å; N94-K98 PolarHBondContact O-N 2.75Å; K98-P101 WeakPolarHBondContact O-CD 3.31Å; K98-E102 WeakPolarHBondContact O-CB 3.1Å; K98-E102 PolarHBondContact O-N 3.28Å; K98-E102 VanDerWaalsContact O-N 3.12Å
99	W	98.6	Very high	97.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.282	C	S	.	.	I	π-helix	trans	-70.6	-40.2	-164.8	-62.4	111.5	0	0	0	113.4	V11 G12 D13 R70 M82 N94 I95 V103	V11-W99 HydrophobicContact CB-CE3 3.87Å; V11-W99 HydrophobicContact CB-CZ3 4.05Å; V11-W99 HydrophobicContact CG2-CE3 4.23Å; G12-W99 VanDerWaalsContact CA-CE2 3.4Å; G12-W99 WeakPolarHBondContact O-CH2 3.09Å; G12-W99 WeakPolarHBondContact O-CZ2 3.4Å; D13-W99 PolarHBondContact OD1-NE1 2.65Å; R70-W99 VanDerWaalsContact CZ-CH2 3.44Å; R70-W99 VanDerWaalsContact CZ-CZ3 3.44Å; R70-W99 VanDerWaalsContact NH1-CZ3 3.33Å; M82-W99 HydrophobicContact CE-CB 3.95Å; M82-W99 HydrophobicContact CG-CB 4.11Å; M82-W99 HydrophobicContact SD-CB 3.84Å; N94-W99 VanDerWaalsContact O-CD1 3.3Å; N94-W99 PolarHBondContact O-N 2.91Å; N94-W99 VanDerWaalsContact O-N 3.13Å; I95-W99 PolarHBondContact O-N 2.92Å; W99-V103 WeakPolarHBondContact O-CB 3.36Å; W99-V103 VanDerWaalsContact O-CG2 3.31Å; W99-V103 WeakPolarHBondContact O-CG2 3.38Å; W99-V103 PolarHBondContact O-N 2.81Å
100	V	98.5	Very high	97.8	Very high	15 Å²	15	52.3 Å²	52.3	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-65.3	-49.9	176.3	167.5	0	0	0	0	112.1	M82 I95 E102 V103 K104 I151	M82-V100 HydrophobicContact CE-CG2 4Å; M82-V100 HydrophobicContact SD-CG2 3.77Å; I95-V100 HydrophobicContact CG2-CG2 4.2Å; I95-V100 WeakPolarHBondContact O-CB 3.44Å; I95-V100 VanDerWaalsContact O-CG2 3.25Å; I95-V100 WeakPolarHBondContact O-CG2 3.48Å; I95-V100 PolarHBondContact O-N 3.29Å; V100-E102 VanDerWaalsContact C-N 3.31Å; V100-E102 PolarHBondContact O-N 3.29Å; V100-V103 PolarHBondContact O-N 3.07Å; V100-K104 HydrophobicContact CG1-CD 3.81Å; V100-K104 HydrophobicContact CG1-CG 4.25Å; V100-K104 VanDerWaalsContact O-CB 3.3Å; V100-K104 WeakPolarHBondContact O-CB 3.28Å; V100-K104 WeakPolarHBondContact O-CG 3.23Å; V100-K104 PolarHBondContact O-N 3.05Å; V100-I151 HydrophobicContact CG2-CB 3.78Å; V100-I151 HydrophobicContact CG2-CD1 3.93Å; V100-I151 HydrophobicContact CG2-CG1 4.45Å; V100-I151 HydrophobicContact CG2-CG2 3.69Å
101	P	98.4	Very high	97.8	Very high	71 Å²	71	48.8 Å²	48.8	46%	0.461	26%	0.26	S	S	.	.	H	α-helix	trans	-53.8	-45.5	173.8	-29.5	34.9	0	0	0	113.5	S96 K98 H105	S96-P101 VanDerWaalsContact O-CD 3.32Å; S96-P101 WeakPolarHBondContact O-CD 3.47Å; K98-P101 WeakPolarHBondContact O-CD 3.31Å; P101-H105 WeakPolarHBondContact O-CB 3.16Å; P101-H105 PolarHBondContact O-N 3.1Å; P101-H105 VanDerWaalsContact O-N 3.07Å
102	E	98.4	Very high	97.8	Very high	28 Å²	28	49.3 Å²	49.3	13%	0.131	26%	0.263	C	S	.	.	H	α-helix	trans	-64.2	-52.2	-180	-173	173.8	132.4	0	0	111.9	R70 Y74 K98 V100 K104 H105 F106	R70-E102 VanDerWaalsContact CD-OE1 3.31Å; R70-E102 WeakPolarHBondContact CD-OE1 3.32Å; R70-E102 IonicContact CZ-OE1 3.03Å; R70-E102 IonicContact NE-OE1 2.71Å; R70-E102 VanDerWaalsContact NH1-CD 3.27Å; R70-E102 IonicContact NH1-OE1 2.67Å; R70-E102 PolarHBondContact NH1-OE1 3.42Å; R70-E102 IonicContact NH1-OE2 3.9Å; R70-E102 PolarHBondContact NH1-OE2 3.15Å; Y74-E102 HydrophobicContact CE2-CG 4.24Å; Y74-E102 PolarHBondContact OH-OE1 3.48Å; K98-E102 WeakPolarHBondContact O-CB 3.1Å; K98-E102 PolarHBondContact O-N 3.28Å; K98-E102 VanDerWaalsContact O-N 3.12Å; V100-E102 VanDerWaalsContact C-N 3.31Å; V100-E102 PolarHBondContact O-N 3.29Å; E102-K104 PolarHBondContact O-N 2.89Å; E102-H105 WeakPolarHBondContact O-CB 3.37Å; E102-H105 PolarHBondContact O-N 2.99Å; E102-H105 VanDerWaalsContact O-N 3.15Å; E102-F106 HydrophobicContact CG-CD2 4.18Å; E102-F106 HydrophobicContact CG-CE2 4.21Å; E102-F106 WeakPolarHBondContact O-CD2 3.4Å; E102-F106 PolarHBondContact O-N 3.44Å
103	V	98.3	Very high	97.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.3	-40.4	-179.7	170.7	0	0	0	0	111.3	V11 I80 M82 W99 V100 H105 F106 C107 I112	V11-V103 HydrophobicContact CG2-CG2 3.93Å; I80-V103 HydrophobicContact CB-CG1 4.46Å; I80-V103 HydrophobicContact CD1-CG1 4.33Å; I80-V103 HydrophobicContact CG1-CG1 3.82Å; I80-V103 HydrophobicContact CG2-CG1 4.32Å; I80-V103 HydrophobicContact CG2-CG2 4.25Å; M82-V103 HydrophobicContact CE-CB 3.97Å; M82-V103 HydrophobicContact CE-CG1 4.42Å; M82-V103 HydrophobicContact CE-CG2 3.72Å; W99-V103 WeakPolarHBondContact O-CB 3.36Å; W99-V103 VanDerWaalsContact O-CG2 3.31Å; W99-V103 WeakPolarHBondContact O-CG2 3.38Å; W99-V103 PolarHBondContact O-N 2.81Å; V100-V103 PolarHBondContact O-N 3.07Å; V103-H105 PolarHBondContact O-N 3.17Å; V103-F106 PolarHBondContact O-N 2.8Å; V103-C107 HydrophobicContact CG1-CB 4.14Å; V103-C107 CarbonylContact O-C 3.53Å; V103-C107 VanDerWaalsContact O-CA 3.26Å; V103-C107 WeakPolarHBondContact O-CA 3.45Å; V103-C107 VanDerWaalsContact O-CB 3.31Å; V103-C107 WeakPolarHBondContact O-CB 3.46Å; V103-C107 PolarHBondContact O-N 3.18Å; V103-I112 HydrophobicContact CG1-CD1 3.82Å; V103-I112 HydrophobicContact CG1-CG1 4.07Å
104	K	97.4	Very high	97.9	Very high	108 Å²	108	47.2 Å²	47.2	47%	0.47	25%	0.246	S	C	.	.	H	α-helix	trans	-68	-25.5	177.4	-73.6	-172.6	176.5	176.6	0	112.7	V100 E102 I151	V100-K104 HydrophobicContact CG1-CD 3.81Å; V100-K104 HydrophobicContact CG1-CG 4.25Å; V100-K104 VanDerWaalsContact O-CB 3.3Å; V100-K104 WeakPolarHBondContact O-CB 3.28Å; V100-K104 WeakPolarHBondContact O-CG 3.23Å; V100-K104 PolarHBondContact O-N 3.05Å; E102-K104 PolarHBondContact O-N 2.89Å; K104-I151 PolarHBondContact NZ-O 3.42Å
105	H	97.9	Very high	97.9	Very high	141 Å²	141	45 Å²	45	65%	0.653	23%	0.233	S	C	*	.	H	α-helix	trans	-70.2	-47.5	174.3	-177.3	76.4	0	0	0	112	P101 E102 V103	P101-H105 WeakPolarHBondContact O-CB 3.16Å; P101-H105 PolarHBondContact O-N 3.1Å; P101-H105 VanDerWaalsContact O-N 3.07Å; E102-H105 WeakPolarHBondContact O-CB 3.37Å; E102-H105 PolarHBondContact O-N 2.99Å; E102-H105 VanDerWaalsContact O-N 3.15Å; V103-H105 PolarHBondContact O-N 3.17Å
106	F	98	Very high	97.9	Very high	89 Å²	89	45 Å²	45	39%	0.39	23%	0.233	S	C	.	.	H	α-helix	trans	-93	-25.2	-174.9	-65.8	-72.4	0	0	0	114.5	P71 Y74 E102 V103	P71-F106 HydrophobicContact CB-CD1 4.14Å; P71-F106 HydrophobicContact CB-CD2 4.25Å; P71-F106 HydrophobicContact CB-CE1 3.68Å; P71-F106 HydrophobicContact CB-CE2 3.79Å; P71-F106 HydrophobicContact CB-CG 4.42Å; P71-F106 HydrophobicContact CB-CZ 3.48Å; P71-F106 VanDerWaalsContact CB-CZ 3.48Å; P71-F106 HydrophobicContact CG-CD2 4.32Å; P71-F106 HydrophobicContact CG-CE1 4.24Å; P71-F106 HydrophobicContact CG-CE2 3.56Å; P71-F106 HydrophobicContact CG-CZ 3.51Å; Y74-F106 HydrophobicContact CD2-CB 3.3Å; Y74-F106 HydrophobicContact CD2-CD1 4.37Å; Y74-F106 AromaticContact CD2-CD2 3.56Å; Y74-F106 HydrophobicContact CD2-CD2 3.56Å; Y74-F106 HydrophobicContact CD2-CE2 4.48Å; Y74-F106 AromaticContact CD2-CG 3.5Å; Y74-F106 HydrophobicContact CD2-CG 3.5Å; Y74-F106 VanDerWaalsContact CD2-CG 3.5Å; Y74-F106 HydrophobicContact CE2-CB 4.07Å; Y74-F106 AromaticContact CE2-CD2 3.61Å; Y74-F106 HydrophobicContact CE2-CD2 3.61Å; Y74-F106 HydrophobicContact CE2-CE2 4.36Å; Y74-F106 HydrophobicContact CE2-CG 4.06Å; Y74-F106 HydrophobicContact CG-CB 3.89Å; Y74-F106 HydrophobicContact CG-CG 4.49Å; E102-F106 HydrophobicContact CG-CD2 4.18Å; E102-F106 HydrophobicContact CG-CE2 4.21Å; E102-F106 WeakPolarHBondContact O-CD2 3.4Å; E102-F106 PolarHBondContact O-N 3.44Å; V103-F106 PolarHBondContact O-N 2.8Å
107	C	97.1	Very high	97.9	Very high	7 Å²	7	43.7 Å²	43.7	5%	0.047	22%	0.224	C	C	.	.			trans	-132.9	54.3	-172.5	-61.6	0	0	0	0	112.3	Y74 V103 N109 V110	Y74-C107 VanDerWaalsContact CB-SG 3.59Å; V103-C107 HydrophobicContact CG1-CB 4.14Å; V103-C107 CarbonylContact O-C 3.53Å; V103-C107 VanDerWaalsContact O-CA 3.26Å; V103-C107 WeakPolarHBondContact O-CA 3.45Å; V103-C107 VanDerWaalsContact O-CB 3.31Å; V103-C107 WeakPolarHBondContact O-CB 3.46Å; V103-C107 PolarHBondContact O-N 3.18Å; C107-N109 PolarHBondContact O-N 3.26Å; C107-V110 HydrophobicContact CB-CB 3.84Å; C107-V110 HydrophobicContact CB-CG2 3.63Å; C107-V110 PolarHBondContact O-N 2.9Å; C107-V110 VanDerWaalsContact O-N 3.12Å
108	P	95.4	Very high	97.9	Very high	88 Å²	88	39.3 Å²	39.3	57%	0.571	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-24.4	-166.5	22.6	-35.1	0	0	0	115.7
109	N	93.4	Very high	98	Very high	119 Å²	119	40.1 Å²	40.1	64%	0.636	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.4	8.2	-176.7	-61.8	-52.6	0	0	0	113.2	C107 R182	C107-N109 PolarHBondContact O-N 3.26Å; N109-R182 PolarHBondContact O-NH2 3.13Å
110	V	97.9	Very high	98	Very high	21 Å²	21	42.6 Å²	42.6	13%	0.127	22%	0.22	C	C	.	.	S	Bend	trans	-87.5	128.7	-176.6	-178.4	0	0	0	0	108.6	T77 I80 C107	T77-V110 HydrophobicContact CG2-CG1 3.99Å; T77-V110 VanDerWaalsContact O-CG2 3.3Å; T77-V110 WeakPolarHBondContact O-CG2 3.43Å; I80-V110 HydrophobicContact CG1-CB 4.47Å; I80-V110 HydrophobicContact CG1-CG1 3.84Å; C107-V110 HydrophobicContact CB-CB 3.84Å; C107-V110 HydrophobicContact CB-CG2 3.63Å; C107-V110 PolarHBondContact O-N 2.9Å; C107-V110 VanDerWaalsContact O-N 3.12Å
111	P	98.2	Very high	98	Very high	30 Å²	30	43.6 Å²	43.6	20%	0.195	22%	0.224	C	C	.	.			trans	-61.8	140.6	177	26	-34	0	0	0	110.9	D78 V79 I80 A177	D78-P111 WeakPolarHBondContact O-CD 3.29Å; V79-P111 HydrophobicContact CB-CG 4.31Å; V79-P111 HydrophobicContact CG2-CG 4.25Å; I80-P111 PolarHBondContact N-O 3.19Å; P111-A177 HydrophobicContact CB-CB 4.25Å; P111-A177 HydrophobicContact CG-CB 4.16Å
112	I	98.8	Very high	97.9	Very high	13 Å²	13	42.4 Å²	42.4	7%	0.067	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	126.2	177.4	-62.4	168.2	0	0	0	108.2	I80 M82 V103 I151 A153 Y154	I80-I112 HydrophobicContact CB-CG1 4.17Å; I80-I112 HydrophobicContact CG2-CG1 4.42Å; M82-I112 HydrophobicContact CB-CG2 3.69Å; M82-I112 HydrophobicContact CE-CD1 3.98Å; M82-I112 HydrophobicContact CE-CG2 4.04Å; M82-I112 HydrophobicContact SD-CG2 4.2Å; V103-I112 HydrophobicContact CG1-CD1 3.82Å; V103-I112 HydrophobicContact CG1-CG1 4.07Å; I112-I151 HydrophobicContact CG2-CD1 4.43Å; I112-A153 CarbonylContact O-C 3.58Å; I112-A153 WeakPolarHBondContact O-CA 3.37Å; I112-Y154 PolarHBondContact O-N 2.98Å
113	I	98.8	Very high	97.9	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.1	165.2	-47.2	-60.1	0	0	0	107.3	V79 I80 L81 M82 V115 Y154 D155 L157 T173 A174 A177	V79-I113 HydrophobicContact CG2-CG1 4.06Å; I80-I113 PolarHBondContact O-N 2.98Å; L81-I113 HydrophobicContact CD2-CB 3.72Å; L81-I113 HydrophobicContact CD2-CG1 4Å; L81-I113 HydrophobicContact CD2-CG2 4.26Å; M82-I113 PolarHBondContact N-O 2.77Å; I113-V115 HydrophobicContact CG2-CG2 3.99Å; I113-Y154 HydrophobicContact CD1-CD1 3.39Å; I113-Y154 HydrophobicContact CD1-CE1 4.31Å; I113-Y154 HydrophobicContact CD1-CG 3.99Å; I113-D155 HydrophobicContact CD1-CB 4.39Å; I113-L157 HydrophobicContact CG2-CD1 4.12Å; I113-T173 HydrophobicContact CD1-CG2 4.21Å; I113-A174 HydrophobicContact CG1-CB 4.12Å; I113-A177 HydrophobicContact CD1-CB 4.34Å
114	L	98.9	Very high	97.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	125.2	173.1	-176.2	64.9	0	0	0	108.9	M82 Y84 I95 G144 M147 A148 I151 A153 D155 Y156 L157	M82-L114 WeakPolarHBondContact O-CA 3.35Å; M82-L114 WeakPolarHBondContact O-CD1 3.27Å; Y84-L114 HydrophobicContact CD1-CD1 4.01Å; Y84-L114 HydrophobicContact CD1-CG 4.4Å; Y84-L114 HydrophobicContact CE1-CD1 4.3Å; Y84-L114 HydrophobicContact CE1-CD2 4.39Å; Y84-L114 HydrophobicContact CE1-CG 4.19Å; I95-L114 HydrophobicContact CD1-CD1 3.78Å; I95-L114 HydrophobicContact CG1-CD1 4.07Å; I95-L114 HydrophobicContact CG2-CD1 3.96Å; L114-G144 WeakPolarHBondContact CD2-O 2.9Å; L114-M147 HydrophobicContact CD2-CB 3.86Å; L114-M147 HydrophobicContact CD2-CG 3.64Å; L114-A148 HydrophobicContact CB-CB 4.27Å; L114-A148 HydrophobicContact CD2-CB 3.87Å; L114-I151 HydrophobicContact CD1-CD1 4.48Å; L114-A153 HydrophobicContact CB-CB 4.2Å; L114-D155 PolarHBondContact N-O 3.32Å; L114-Y156 HydrophobicContact CB-CD2 4.29Å; L114-Y156 HydrophobicContact CD2-CD2 3.99Å; L114-Y156 HydrophobicContact CD2-CE2 4.45Å; L114-Y156 HydrophobicContact CG-CD2 4.08Å; L114-Y156 WeakPolarHBondContact O-CA 3.4Å; L114-L157 PolarHBondContact O-N 2.64Å
115	V	98.9	Very high	97.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.8	-175.7	-173.7	0	0	0	0	110.7	L21 L81 M82 C83 Y84 I113 L157 V170	L21-V115 HydrophobicContact CD2-CG1 4.36Å; L81-V115 HydrophobicContact CD2-CG2 4.12Å; M82-V115 PolarHBondContact O-N 2.91Å; C83-V115 WeakPolarHBondContact CA-O 3.49Å; Y84-V115 WeakPolarHBondContact CD1-O 3.41Å; Y84-V115 PolarHBondContact N-O 2.67Å; I113-V115 HydrophobicContact CG2-CG2 3.99Å; V115-L157 CarbonylContact C-O 3.58Å; V115-L157 WeakPolarHBondContact CA-O 3.25Å; V115-V170 HydrophobicContact CG1-CG1 4.45Å; V115-V170 HydrophobicContact CG1-CG2 3.92Å; V115-V170 HydrophobicContact CG2-CG1 3.96Å; V115-V170 HydrophobicContact CG2-CG2 4.34Å
116	A	98.9	Very high	97.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	106.9	170.1	0	0	0	0	0	109.9	Y84 V86 Y156 L157 E158 C159	Y84-A116 HydrophobicContact CD1-CB 4.46Å; Y84-A116 HydrophobicContact CE1-CB 3.64Å; Y84-A116 HydrophobicContact CE2-CB 3.9Å; Y84-A116 VanDerWaalsContact OH-CB 3.29Å; Y84-A116 WeakPolarHBondContact OH-CB 3.5Å; V86-A116 HydrophobicContact CG2-CB 3.99Å; A116-Y156 HydrophobicContact CB-CE2 4.12Å; A116-L157 PolarHBondContact N-O 3.49Å; A116-E158 HydrophobicContact CB-CB 4.22Å; A116-E158 HydrophobicContact CB-CG 3.93Å; A116-E158 WeakPolarHBondContact O-CA 3.35Å; A116-C159 PolarHBondContact O-N 3.39Å
117	N	98.8	Very high	97.8	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.027	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	164.9	176.5	-71.8	-25.3	0	0	0	111.9	C16 Y84 S85 V86 K119 C159	C16-N117 WeakPolarHBondContact O-CB 3.2Å; C16-N117 PolarHBondContact O-ND2 3.14Å; Y84-N117 WeakPolarHBondContact O-CB 3.29Å; Y84-N117 PolarHBondContact O-N 2.87Å; S85-N117 WeakPolarHBondContact CA-O 3.35Å; V86-N117 WeakPolarHBondContact CG2-O 3.49Å; V86-N117 PolarHBondContact N-O 3.44Å; N117-K119 VanDerWaalsContact C-N 3.28Å; N117-K119 PolarHBondContact O-N 3.01Å; N117-C159 CarbonylContact C-O 3.5Å; N117-C159 PolarHBondContact OD1-SG 2.7Å
118	K	98.5	Very high	97.9	Very high	53 Å²	53	47 Å²	47	23%	0.23	24%	0.244	C	C	.	.			trans	58.5	38.5	176.6	-42.8	-172.4	-159.6	165.6	0	112.7	A15 D87 D120 L121 C159	A15-K118 WeakPolarHBondContact O-CE 3.5Å; A15-K118 PolarHBondContact O-NZ 3.49Å; D87-K118 IonicContact OD1-NZ 2.79Å; D87-K118 PolarHBondContact OD1-NZ 3.43Å; D87-K118 IonicContact OD2-NZ 2.83Å; D87-K118 PolarHBondContact OD2-NZ 3.47Å; K118-D120 WeakPolarHBondContact CA-OD1 3.34Å; K118-D120 PolarHBondContact O-N 2.95Å; K118-D120 VanDerWaalsContact O-N 3.08Å; K118-L121 HydrophobicContact CB-CD1 3.82Å; K118-L121 HydrophobicContact CB-CG 4.07Å; K118-L121 HydrophobicContact CD-CD1 3.7Å; K118-L121 HydrophobicContact CG-CD1 4.42Å; K118-L121 WeakPolarHBondContact O-CB 3.42Å; K118-L121 PolarHBondContact O-N 3.08Å; K118-C159 PolarHBondContact N-O 3.23Å; K118-C159 VanDerWaalsContact N-O 3.09Å
119	K	98.6	Very high	98	Very high	54 Å²	54	46.8 Å²	46.8	24%	0.235	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-50.2	-33.9	178.5	-175.2	-171.4	-178.5	-174.4	0	113.2	N117 L121 R122 E158 C159 E165	N117-K119 VanDerWaalsContact C-N 3.28Å; N117-K119 PolarHBondContact O-N 3.01Å; K119-L121 PolarHBondContact O-N 3.02Å; K119-R122 WeakPolarHBondContact O-CB 3.08Å; K119-R122 PolarHBondContact O-N 3.01Å; K119-R122 VanDerWaalsContact O-N 3.16Å; K119-E158 HydrophobicContact CB-CB 4.45Å; K119-E158 HydrophobicContact CD-CB 3.87Å; K119-E158 WeakPolarHBondContact CE-OE2 3.28Å; K119-E158 HydrophobicContact CG-CB 4.22Å; K119-C159 WeakPolarHBondContact CB-O 3.4Å; K119-C159 PolarHBondContact N-O 3.44Å; K119-C159 VanDerWaalsContact N-O 3.07Å; K119-E165 IonicContact NZ-OE1 3.02Å; K119-E165 PolarHBondContact NZ-OE1 3.46Å; K119-E165 IonicContact NZ-OE2 2.69Å
120	D	98.3	Very high	98.2	Very high	53 Å²	53	47 Å²	47	28%	0.283	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-56.4	-30.5	176.9	53.3	-67.5	0	0	0	113.3	K118 R122 S160 T163	K118-D120 WeakPolarHBondContact CA-OD1 3.34Å; K118-D120 PolarHBondContact O-N 2.95Å; K118-D120 VanDerWaalsContact O-N 3.08Å; D120-R122 VanDerWaalsContact C-N 3.28Å; D120-R122 PolarHBondContact O-N 3.25Å; D120-S160 WeakPolarHBondContact OD1-CB 3.34Å; D120-S160 PolarHBondContact OD1-OG 2.86Å; D120-T163 HydrophobicContact CB-CG2 4.08Å
121	L	98.4	Very high	98.2	Very high	35 Å²	35	46.8 Å²	46.8	18%	0.183	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-76.6	-11	-178.4	-59.6	-176.4	0	0	0	114	D87 K118 K119 N123 D124 T127	D87-L121 HydrophobicContact CB-CB 4.27Å; D87-L121 HydrophobicContact CB-CD1 3.78Å; D87-L121 WeakPolarHBondContact OD2-CD1 3.36Å; K118-L121 HydrophobicContact CB-CD1 3.82Å; K118-L121 HydrophobicContact CB-CG 4.07Å; K118-L121 HydrophobicContact CD-CD1 3.7Å; K118-L121 HydrophobicContact CG-CD1 4.42Å; K118-L121 WeakPolarHBondContact O-CB 3.42Å; K118-L121 PolarHBondContact O-N 3.08Å; K119-L121 PolarHBondContact O-N 3.02Å; L121-N123 PolarHBondContact O-N 2.82Å; L121-D124 HydrophobicContact CD2-CB 4.17Å; L121-D124 PolarHBondContact O-N 2.94Å; L121-T127 HydrophobicContact CB-CG2 4.17Å
122	R	98	Very high	98.1	Very high	46 Å²	46	48.5 Å²	48.5	17%	0.174	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-58.2	-38	178.3	-166.6	172	-69.3	130.6	-3.7	112.5	V86 K119 D120 K128 P138 V139 E158	V86-R122 HydrophobicContact CG1-CB 3.78Å; V86-R122 HydrophobicContact CG1-CG 4.15Å; K119-R122 WeakPolarHBondContact O-CB 3.08Å; K119-R122 PolarHBondContact O-N 3.01Å; K119-R122 VanDerWaalsContact O-N 3.16Å; D120-R122 VanDerWaalsContact C-N 3.28Å; D120-R122 PolarHBondContact O-N 3.25Å; R122-K128 VanDerWaalsContact O-CE 3.24Å; R122-K128 WeakPolarHBondContact O-CE 3.17Å; R122-P138 HydrophobicContact CG-CB 4.3Å; R122-V139 PolarHBondContact NE-O 2.9Å; R122-V139 PolarHBondContact NH2-O 2.91Å; R122-E158 IonicContact CZ-OE1 3.7Å; R122-E158 IonicContact CZ-OE2 2.98Å; R122-E158 IonicContact NH1-OE1 3.51Å; R122-E158 IonicContact NH1-OE2 3.61Å; R122-E158 PolarHBondContact NH1-OE2 2.83Å; R122-E158 IonicContact NH2-OE1 2.77Å; R122-E158 PolarHBondContact NH2-OE1 3.07Å; R122-E158 IonicContact NH2-OE2 2.65Å; R122-E158 PolarHBondContact NH2-OE2 3.24Å
123	N	96.4	Very high	98.1	Very high	124 Å²	124	57.8 Å²	57.8	66%	0.663	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-104.8	1.9	-177.2	-67.2	-40.4	0	0	0	112.8	L121 E125 K128	L121-N123 PolarHBondContact O-N 2.82Å; N123-E125 PolarHBondContact O-N 2.64Å; N123-K128 PolarHBondContact O-NZ 2.91Å
124	D	97.9	Very high	98	Very high	53 Å²	53	64 Å²	64	28%	0.283	31%	0.311	S	S	.	.			trans	-72.3	125.4	177.6	175.6	63	0	0	0	110.8	L121 N126 T127 K128	L121-D124 HydrophobicContact CD2-CB 4.17Å; L121-D124 PolarHBondContact O-N 2.94Å; D124-N126 VanDerWaalsContact C-N 3.34Å; D124-N126 PolarHBondContact O-N 3Å; D124-N126 WeakPolarHBondContact OD2-CB 3.48Å; D124-N126 PolarHBondContact OD2-N 3.07Å; D124-T127 PolarHBondContact O-N 3.39Å; D124-T127 WeakPolarHBondContact OD2-CB 3.3Å; D124-T127 PolarHBondContact OD2-N 3.09Å; D124-T127 PolarHBondContact OD2-OG1 2.91Å; D124-K128 WeakPolarHBondContact O-CG 3.44Å; D124-K128 PolarHBondContact O-N 3.29Å
125	E	97.9	Very high	97.9	Very high	108 Å²	108	73.5 Å²	73.5	51%	0.505	35%	0.352	S	S	.	.	H	α-helix	trans	-68.6	-32.8	-175	-68.3	-58.3	123.8	0	0	112.3	N123 K128 N129	N123-E125 PolarHBondContact O-N 2.64Å; E125-K128 IonicContact OE1-NZ 3.66Å; E125-K128 PolarHBondContact OE1-NZ 2.91Å; E125-N129 VanDerWaalsContact O-CB 3.28Å; E125-N129 WeakPolarHBondContact O-CB 3.08Å; E125-N129 PolarHBondContact O-N 3.21Å; E125-N129 PolarHBondContact O-ND2 2.77Å
126	N	97.8	Very high	97.8	Very high	107 Å²	107	76.2 Å²	76.2	57%	0.572	37%	0.366	S	S	*	.	H	α-helix	trans	-67.3	-45.7	177.1	-63.3	-44.8	0	0	0	110.6	D124 K128 N129 E130	D124-N126 VanDerWaalsContact C-N 3.34Å; D124-N126 PolarHBondContact O-N 3Å; D124-N126 WeakPolarHBondContact OD2-CB 3.48Å; D124-N126 PolarHBondContact OD2-N 3.07Å; N126-K128 PolarHBondContact O-N 2.94Å; N126-N129 PolarHBondContact O-N 2.83Å; N126-E130 WeakPolarHBondContact O-CG 3.19Å; N126-E130 PolarHBondContact O-N 3.28Å
127	T	97.8	Very high	97.8	Very high	13 Å²	13	81.5 Å²	81.5	8%	0.08	39%	0.391	C	S	.	.	H	α-helix	trans	-59.2	-46.8	176.8	-58.4	0	0	0	0	111.3	D87 L121 D124 N129 E130 L131 P138	D87-T127 HydrophobicContact CB-CG2 3.73Å; L121-T127 HydrophobicContact CB-CG2 4.17Å; D124-T127 PolarHBondContact O-N 3.39Å; D124-T127 WeakPolarHBondContact OD2-CB 3.3Å; D124-T127 PolarHBondContact OD2-N 3.09Å; D124-T127 PolarHBondContact OD2-OG1 2.91Å; T127-N129 VanDerWaalsContact C-N 3.34Å; T127-N129 PolarHBondContact O-N 3Å; T127-E130 PolarHBondContact O-N 3.18Å; T127-L131 HydrophobicContact CG2-CD1 4.01Å; T127-L131 WeakPolarHBondContact O-CB 3.4Å; T127-L131 WeakPolarHBondContact O-CG 3.45Å; T127-L131 PolarHBondContact O-N 2.85Å; T127-P138 HydrophobicContact CG2-CG 4.45Å
128	K	98.1	Very high	97.7	Very high	65 Å²	65	81.9 Å²	81.9	28%	0.283	39%	0.394	S	S	.	.	H	α-helix	trans	-59.3	-45.3	174.8	-71.8	174.3	-170.1	164.4	0	111.9	R122 N123 D124 E125 N126 S132 P138	R122-K128 VanDerWaalsContact O-CE 3.24Å; R122-K128 WeakPolarHBondContact O-CE 3.17Å; N123-K128 PolarHBondContact O-NZ 2.91Å; D124-K128 WeakPolarHBondContact O-CG 3.44Å; D124-K128 PolarHBondContact O-N 3.29Å; E125-K128 IonicContact OE1-NZ 3.66Å; E125-K128 PolarHBondContact OE1-NZ 2.91Å; N126-K128 PolarHBondContact O-N 2.94Å; K128-S132 VanDerWaalsContact O-CB 3.25Å; K128-S132 WeakPolarHBondContact O-CB 3.46Å; K128-S132 PolarHBondContact O-N 3.5Å; K128-S132 PolarHBondContact O-OG 2.82Å; K128-P138 HydrophobicContact CG-CG 4.02Å
129	N	98	Very high	97.8	Very high	83 Å²	83	79.7 Å²	79.7	44%	0.444	39%	0.385	S	S	.	.	H	α-helix	trans	-63.4	-44	179.9	-75.6	-36.3	0	0	0	111.7	E125 N126 T127 S132 R133	E125-N129 VanDerWaalsContact O-CB 3.28Å; E125-N129 WeakPolarHBondContact O-CB 3.08Å; E125-N129 PolarHBondContact O-N 3.21Å; E125-N129 PolarHBondContact O-ND2 2.77Å; N126-N129 PolarHBondContact O-N 2.83Å; T127-N129 VanDerWaalsContact C-N 3.34Å; T127-N129 PolarHBondContact O-N 3Å; N129-S132 PolarHBondContact O-N 3.21Å; N129-S132 PolarHBondContact O-OG 3.36Å; N129-R133 WeakPolarHBondContact O-CG 3.24Å; N129-R133 PolarHBondContact O-N 3.23Å
130	E	97.3	Very high	97.8	Very high	123 Å²	123	81.1 Å²	81.1	58%	0.575	39%	0.391	S	S	*	.	H	α-helix	trans	-62.3	-49.5	177.3	-73.9	178.4	179.2	0	0	112	N126 T127 S132 R133	N126-E130 WeakPolarHBondContact O-CG 3.19Å; N126-E130 PolarHBondContact O-N 3.28Å; T127-E130 PolarHBondContact O-N 3.18Å; E130-S132 VanDerWaalsContact C-N 3.34Å; E130-S132 PolarHBondContact O-N 3.29Å; E130-R133 WeakPolarHBondContact O-CB 3.29Å; E130-R133 PolarHBondContact O-N 3.39Å
131	L	97.6	Very high	97.8	Very high	17 Å²	17	79.3 Å²	79.3	9%	0.089	38%	0.383	C	S	.	.	H	α-helix	trans	-63.7	-38.9	178	-72.7	171.8	0	0	0	112.2	T127 R133 M134 K135 L136 P138	T127-L131 HydrophobicContact CG2-CD1 4.01Å; T127-L131 WeakPolarHBondContact O-CB 3.4Å; T127-L131 WeakPolarHBondContact O-CG 3.45Å; T127-L131 PolarHBondContact O-N 2.85Å; L131-R133 PolarHBondContact O-N 2.95Å; L131-M134 CarbonylContact O-C 3.43Å; L131-M134 WeakPolarHBondContact O-CA 3.18Å; L131-M134 WeakPolarHBondContact O-CB 3.38Å; L131-M134 PolarHBondContact O-N 3.03Å; L131-K135 PolarHBondContact O-N 3.1Å; L131-L136 CarbonylContact C-O 3.55Å; L131-L136 HydrophobicContact CB-CB 4.12Å; L131-L136 HydrophobicContact CD2-CB 4Å; L131-L136 HydrophobicContact CD2-CD1 4.31Å; L131-L136 PolarHBondContact O-N 2.71Å; L131-P138 HydrophobicContact CD1-CB 4.29Å; L131-P138 HydrophobicContact CD1-CG 3.84Å
132	S	97.3	Very high	97.8	Very high	66 Å²	66	82.9 Å²	82.9	46%	0.462	40%	0.399	S	S	.	.	H	α-helix	trans	-61.8	-31.6	179.2	75.3	0	0	0	0	113.1	K128 N129 E130 M134 K135 L136	K128-S132 VanDerWaalsContact O-CB 3.25Å; K128-S132 WeakPolarHBondContact O-CB 3.46Å; K128-S132 PolarHBondContact O-N 3.5Å; K128-S132 PolarHBondContact O-OG 2.82Å; N129-S132 PolarHBondContact O-N 3.21Å; N129-S132 PolarHBondContact O-OG 3.36Å; E130-S132 VanDerWaalsContact C-N 3.34Å; E130-S132 PolarHBondContact O-N 3.29Å; S132-M134 PolarHBondContact O-N 2.71Å; S132-K135 PolarHBondContact O-N 2.89Å; S132-L136 PolarHBondContact N-O 2.94Å
133	R	97.1	Very high	97.8	Very high	208 Å²	208	84.3 Å²	84.3	79%	0.785	41%	0.41	S	S	*	.	H	α-helix	trans	-62.3	-28.2	173.8	-68.9	171	-178.6	174.6	2.5	112	N129 E130 L131	N129-R133 WeakPolarHBondContact O-CG 3.24Å; N129-R133 PolarHBondContact O-N 3.23Å; E130-R133 WeakPolarHBondContact O-CB 3.29Å; E130-R133 PolarHBondContact O-N 3.39Å; L131-R133 PolarHBondContact O-N 2.95Å
134	M	96.6	Very high	97.9	Very high	132 Å²	132	78.4 Å²	78.4	65%	0.65	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	6.3	175.1	-60.9	177.4	63.5	0	0	112.8	L131 S132 L136	L131-M134 CarbonylContact O-C 3.43Å; L131-M134 WeakPolarHBondContact O-CA 3.18Å; L131-M134 WeakPolarHBondContact O-CB 3.38Å; L131-M134 PolarHBondContact O-N 3.03Å; S132-M134 PolarHBondContact O-N 2.71Å; M134-L136 HydrophobicContact CB-CD1 4.17Å; M134-L136 HydrophobicContact CB-CG 4.24Å; M134-L136 HydrophobicContact CE-CD1 4.41Å; M134-L136 PolarHBondContact O-N 2.76Å
135	K	97.3	Very high	97.9	Very high	198 Å²	198	81.5 Å²	81.5	86%	0.861	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	31.2	-173	-52.8	178.2	-179.4	176.8	0	113.4	L131 S132	L131-K135 PolarHBondContact O-N 3.1Å; S132-K135 PolarHBondContact O-N 2.89Å
136	L	97.5	Very high	98	Very high	58 Å²	58	79.1 Å²	79.1	30%	0.304	39%	0.385	S	S	.	.			trans	-110.1	165.8	175	-63.6	176.1	0	0	0	110	P89 L131 S132 M134	P89-L136 HydrophobicContact CG-CB 4.37Å; P89-L136 HydrophobicContact CG-CD1 4.49Å; L131-L136 CarbonylContact C-O 3.55Å; L131-L136 HydrophobicContact CB-CB 4.12Å; L131-L136 HydrophobicContact CD2-CB 4Å; L131-L136 HydrophobicContact CD2-CD1 4.31Å; L131-L136 PolarHBondContact O-N 2.71Å; S132-L136 PolarHBondContact N-O 2.94Å; M134-L136 HydrophobicContact CB-CD1 4.17Å; M134-L136 HydrophobicContact CB-CG 4.24Å; M134-L136 HydrophobicContact CE-CD1 4.41Å; M134-L136 PolarHBondContact O-N 2.76Å
137	E	97.9	Very high	98	Very high	110 Å²	110	74.6 Å²	74.6	51%	0.514	36%	0.36	S	S	.	.			trans	-133.5	156.2	171.8	61.1	180	161.9	0	0	109.7	P89 K140	P89-E137 VanDerWaalsContact CG-O 3.25Å; P89-E137 WeakPolarHBondContact CG-O 3.49Å; E137-K140 VanDerWaalsContact CD-CE 3.48Å; E137-K140 VanDerWaalsContact CD-NZ 3.25Å; E137-K140 WeakPolarHBondContact OE1-CE 3.32Å; E137-K140 IonicContact OE1-NZ 3.1Å; E137-K140 PolarHBondContact OE1-NZ 3.12Å; E137-K140 VanDerWaalsContact OE2-CE 3.25Å; E137-K140 WeakPolarHBondContact OE2-CE 3.48Å; E137-K140 IonicContact OE2-NZ 3.09Å; E137-K140 PolarHBondContact OE2-NZ 3.3Å; E137-K140 VanDerWaalsContact OE2-NZ 3.16Å
138	P	98.5	Very high	98.1	Very high	14 Å²	14	74.3 Å²	74.3	9%	0.091	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-56.1	145.3	172.8	-22.4	31.4	0	0	0	111.6	V86 R122 T127 K128 L131 K140	V86-P138 HydrophobicContact CG1-CB 4.11Å; V86-P138 CarbonylContact O-C 3.46Å; V86-P138 WeakPolarHBondContact O-CA 3.25Å; R122-P138 HydrophobicContact CG-CB 4.3Å; T127-P138 HydrophobicContact CG2-CG 4.45Å; K128-P138 HydrophobicContact CG-CG 4.02Å; L131-P138 HydrophobicContact CD1-CB 4.29Å; L131-P138 HydrophobicContact CD1-CG 3.84Å; P138-K140 PolarHBondContact O-N 3.36Å
139	V	98.6	Very high	98.1	Very high	7 Å²	7	78.5 Å²	78.5	4%	0.042	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-62.7	128.6	-177.1	-179.2	0	0	0	0	111.1	Y84 V86 P89 L92 R122 D143	Y84-V139 HydrophobicContact CE2-CB 4.02Å; Y84-V139 HydrophobicContact CE2-CG1 3.68Å; Y84-V139 HydrophobicContact CE2-CG2 4.19Å; V86-V139 PolarHBondContact O-N 2.94Å; P89-V139 HydrophobicContact CB-CG2 4.33Å; P89-V139 HydrophobicContact CG-CG2 4.26Å; L92-V139 HydrophobicContact CB-CG2 4.39Å; L92-V139 HydrophobicContact CD2-CG1 3.57Å; R122-V139 PolarHBondContact NE-O 2.9Å; R122-V139 PolarHBondContact NH2-O 2.91Å; V139-D143 HydrophobicContact CG1-CB 4.23Å
140	K	98.6	Very high	98.1	Very high	83 Å²	83	82 Å²	82	36%	0.361	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-80	152.8	177.4	-60.1	174.8	-177	151.4	0	110.7	E137 P138 E142 D143 G144	E137-K140 VanDerWaalsContact CD-CE 3.48Å; E137-K140 VanDerWaalsContact CD-NZ 3.25Å; E137-K140 WeakPolarHBondContact OE1-CE 3.32Å; E137-K140 IonicContact OE1-NZ 3.1Å; E137-K140 PolarHBondContact OE1-NZ 3.12Å; E137-K140 VanDerWaalsContact OE2-CE 3.25Å; E137-K140 WeakPolarHBondContact OE2-CE 3.48Å; E137-K140 IonicContact OE2-NZ 3.09Å; E137-K140 PolarHBondContact OE2-NZ 3.3Å; E137-K140 VanDerWaalsContact OE2-NZ 3.16Å; P138-K140 PolarHBondContact O-N 3.36Å; K140-E142 WeakPolarHBondContact CB-OE2 3.44Å; K140-E142 PolarHBondContact O-N 3.07Å; K140-D143 WeakPolarHBondContact CB-OD2 3.39Å; K140-D143 PolarHBondContact O-N 3.37Å; K140-G144 PolarHBondContact O-N 2.91Å
141	A	98.4	Very high	98.2	Very high	15 Å²	15	76.7 Å²	76.7	12%	0.124	36%	0.364	C	S	.	.	H	α-helix	trans	-62.8	-29.5	178.2	0	0	0	0	0	111.8	R145 E158	A141-R145 WeakPolarHBondContact O-CB 3.41Å; A141-R145 WeakPolarHBondContact O-CG 3.33Å; A141-R145 PolarHBondContact O-N 3.35Å; A141-R145 PolarHBondContact O-NE 2.67Å; A141-E158 VanDerWaalsContact CA-OE1 3.3Å; A141-E158 WeakPolarHBondContact CA-OE1 3.46Å; A141-E158 WeakPolarHBondContact CB-OE1 3.46Å
142	E	98.6	Very high	98.2	Very high	110 Å²	110	78.9 Å²	78.9	51%	0.514	39%	0.391	S	S	.	.	H	α-helix	trans	-66.1	-40.3	177.6	-65.1	62.8	-128	0	0	111.4	K140 R145 A146	K140-E142 WeakPolarHBondContact CB-OE2 3.44Å; K140-E142 PolarHBondContact O-N 3.07Å; E142-R145 PolarHBondContact O-N 3.04Å; E142-R145 IonicContact OE1-NH2 3.46Å; E142-R145 PolarHBondContact OE1-NH2 3.42Å; E142-A146 WeakPolarHBondContact O-CB 3.38Å; E142-A146 PolarHBondContact O-N 3.21Å
143	D	98.6	Very high	98.2	Very high	76 Å²	76	76.7 Å²	76.7	41%	0.406	38%	0.377	S	S	.	.	H	α-helix	trans	-68.7	-41.7	179.2	-58.5	-40	0	0	0	111.1	L92 V139 K140 A146 M147	L92-D143 HydrophobicContact CD2-CB 3.93Å; V139-D143 HydrophobicContact CG1-CB 4.23Å; K140-D143 WeakPolarHBondContact CB-OD2 3.39Å; K140-D143 PolarHBondContact O-N 3.37Å; D143-A146 PolarHBondContact O-N 3.18Å; D143-M147 WeakPolarHBondContact O-CB 3.17Å; D143-M147 PolarHBondContact O-N 2.83Å
144	G	98.7	Very high	98.3	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-61.5	-44.4	173.2	0	0	0	0	0	112.5	Y84 L114 K140 M147 A148	Y84-G144 WeakPolarHBondContact OH-CA 3.01Å; L114-G144 WeakPolarHBondContact CD2-O 2.9Å; K140-G144 PolarHBondContact O-N 2.91Å; G144-M147 WeakPolarHBondContact O-CB 3.24Å; G144-M147 PolarHBondContact O-N 2.78Å; G144-A148 PolarHBondContact O-N 3.33Å
145	R	98.8	Very high	98.4	Very high	119 Å²	119	67.9 Å²	67.9	45%	0.449	34%	0.342	S	S	.	.	H	α-helix	trans	-61.9	-44.3	174.1	-78.1	-176.3	-91.4	-137.7	5.4	112.4	A141 E142 M147 A148 M149 Y156	A141-R145 WeakPolarHBondContact O-CB 3.41Å; A141-R145 WeakPolarHBondContact O-CG 3.33Å; A141-R145 PolarHBondContact O-N 3.35Å; A141-R145 PolarHBondContact O-NE 2.67Å; E142-R145 PolarHBondContact O-N 3.04Å; E142-R145 IonicContact OE1-NH2 3.46Å; E142-R145 PolarHBondContact OE1-NH2 3.42Å; R145-M147 VanDerWaalsContact C-N 3.31Å; R145-M147 PolarHBondContact O-N 3.46Å; R145-A148 PolarHBondContact O-N 2.59Å; R145-M149 WeakPolarHBondContact O-CG 3.45Å; R145-M149 PolarHBondContact O-N 2.8Å; R145-M149 VanDerWaalsContact O-N 3.07Å; R145-Y156 HydrophobicContact CB-CD1 4.43Å; R145-Y156 HydrophobicContact CG-CD1 3.37Å; R145-Y156 HydrophobicContact CG-CE1 3.75Å; R145-Y156 HydrophobicContact CG-CG 4.1Å
146	A	98.8	Very high	98.4	Very high	57 Å²	57	59.7 Å²	59.7	47%	0.471	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-40.7	176.7	0	0	0	0	0	111.5	E142 D143 M149 R150	E142-A146 WeakPolarHBondContact O-CB 3.38Å; E142-A146 PolarHBondContact O-N 3.21Å; D143-A146 PolarHBondContact O-N 3.18Å; A146-M149 PolarHBondContact O-N 3.27Å; A146-R150 WeakPolarHBondContact O-CB 3.49Å; A146-R150 PolarHBondContact O-N 3.24Å
147	M	98.8	Very high	98.5	Very high	12 Å²	12	58.5 Å²	58.5	6%	0.059	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-48.6	173.3	179.5	67.1	69.9	0	0	111.7	L92 I95 L114 D143 G144 R145 M149 R150 I151	L92-M147 HydrophobicContact CD1-CB 3.78Å; L92-M147 HydrophobicContact CD1-CE 3.8Å; L92-M147 HydrophobicContact CD1-CG 3.74Å; L92-M147 HydrophobicContact CG-CE 3.8Å; L92-M147 WeakPolarHBondContact O-CE 3.43Å; I95-M147 HydrophobicContact CB-CE 4.34Å; I95-M147 HydrophobicContact CB-CG 4.26Å; I95-M147 HydrophobicContact CB-SD 4.1Å; I95-M147 HydrophobicContact CG2-CG 3.83Å; I95-M147 HydrophobicContact CG2-SD 3.86Å; L114-M147 HydrophobicContact CD2-CB 3.86Å; L114-M147 HydrophobicContact CD2-CG 3.64Å; D143-M147 WeakPolarHBondContact O-CB 3.17Å; D143-M147 PolarHBondContact O-N 2.83Å; G144-M147 WeakPolarHBondContact O-CB 3.24Å; G144-M147 PolarHBondContact O-N 2.78Å; R145-M147 VanDerWaalsContact C-N 3.31Å; R145-M147 PolarHBondContact O-N 3.46Å; M147-M149 VanDerWaalsContact C-N 3.33Å; M147-M149 PolarHBondContact O-N 3.23Å; M147-R150 WeakPolarHBondContact O-CB 3.24Å; M147-R150 PolarHBondContact O-N 3.35Å; M147-R150 VanDerWaalsContact O-N 3.09Å; M147-R150 PolarHBondContact SD-NH2 2.94Å; M147-I151 HydrophobicContact CG-CG2 4.39Å; M147-I151 WeakPolarHBondContact O-CG1 3.38Å; M147-I151 WeakPolarHBondContact O-CG2 3.41Å; M147-I151 PolarHBondContact O-N 3.08Å; M147-I151 HydrophobicContact SD-CG2 3.82Å
148	A	98.8	Very high	98.6	Very high	7 Å²	7	54.7 Å²	54.7	6%	0.058	28%	0.282	C	S	.	.	H	α-helix	trans	-56.7	-46.3	179.7	0	0	0	0	0	111.9	L114 G144 R145 R150 I151 G152 A153 Y156	L114-A148 HydrophobicContact CB-CB 4.27Å; L114-A148 HydrophobicContact CD2-CB 3.87Å; G144-A148 PolarHBondContact O-N 3.33Å; R145-A148 PolarHBondContact O-N 2.59Å; A148-R150 PolarHBondContact O-N 3.16Å; A148-I151 PolarHBondContact O-N 3.16Å; A148-G152 PolarHBondContact O-N 3.39Å; A148-G152 VanDerWaalsContact O-N 3.15Å; A148-A153 HydrophobicContact CB-CB 4.02Å; A148-A153 PolarHBondContact O-N 2.98Å; A148-Y156 HydrophobicContact CB-CD2 4.43Å; A148-Y156 HydrophobicContact CB-CG 4.38Å
149	M	98.5	Very high	98.6	Very high	153 Å²	153	54 Å²	54	75%	0.754	28%	0.278	S	S	*	.	H	α-helix	trans	-60.6	-45.3	174.6	-65.7	179.7	-153.9	0	0	111.5	R145 A146 M147 I151 G152	R145-M149 WeakPolarHBondContact O-CG 3.45Å; R145-M149 PolarHBondContact O-N 2.8Å; R145-M149 VanDerWaalsContact O-N 3.07Å; A146-M149 PolarHBondContact O-N 3.27Å; M147-M149 VanDerWaalsContact C-N 3.33Å; M147-M149 PolarHBondContact O-N 3.23Å; M149-I151 VanDerWaalsContact C-N 3.32Å; M149-I151 PolarHBondContact O-N 2.79Å; M149-G152 PolarHBondContact O-N 3.42Å
150	R	98.3	Very high	98.6	Very high	156 Å²	156	53.7 Å²	53.7	59%	0.589	28%	0.276	S	S	*	.	H	α-helix	trans	-60.5	-39.4	-179	-177.7	172.9	69.7	150.7	0.8	112.8	S96 A146 M147 A148	S96-R150 PolarHBondContact OG-NH2 3.24Å; A146-R150 WeakPolarHBondContact O-CB 3.49Å; A146-R150 PolarHBondContact O-N 3.24Å; M147-R150 WeakPolarHBondContact O-CB 3.24Å; M147-R150 PolarHBondContact O-N 3.35Å; M147-R150 VanDerWaalsContact O-N 3.09Å; M147-R150 PolarHBondContact SD-NH2 2.94Å; A148-R150 PolarHBondContact O-N 3.16Å
151	I	97.9	Very high	98.5	Very high	12 Å²	12	50.3 Å²	50.3	6%	0.062	26%	0.263	C	S	.	.	H	α-helix	trans	-86.9	-12.1	-176.4	70.9	171.8	0	0	0	113.1	M82 I95 V100 K104 I112 L114 M147 A148 M149 A153	M82-I151 HydrophobicContact SD-CD1 4.18Å; I95-I151 HydrophobicContact CG2-CD1 3.89Å; I95-I151 HydrophobicContact CG2-CG2 4.3Å; V100-I151 HydrophobicContact CG2-CB 3.78Å; V100-I151 HydrophobicContact CG2-CD1 3.93Å; V100-I151 HydrophobicContact CG2-CG1 4.45Å; V100-I151 HydrophobicContact CG2-CG2 3.69Å; K104-I151 PolarHBondContact NZ-O 3.42Å; I112-I151 HydrophobicContact CG2-CD1 4.43Å; L114-I151 HydrophobicContact CD1-CD1 4.48Å; M147-I151 HydrophobicContact CG-CG2 4.39Å; M147-I151 WeakPolarHBondContact O-CG1 3.38Å; M147-I151 WeakPolarHBondContact O-CG2 3.41Å; M147-I151 PolarHBondContact O-N 3.08Å; M147-I151 HydrophobicContact SD-CG2 3.82Å; A148-I151 PolarHBondContact O-N 3.16Å; M149-I151 VanDerWaalsContact C-N 3.32Å; M149-I151 PolarHBondContact O-N 2.79Å; I151-A153 HydrophobicContact CD1-CB 4.1Å; I151-A153 HydrophobicContact CG1-CB 3.94Å
152	G	97.9	Very high	98.4	Very high	63 Å²	63	57.2 Å²	57.2	65%	0.649	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	38.7	-172.8	0	0	0	0	0	112.2	A148 M149	A148-G152 PolarHBondContact O-N 3.39Å; A148-G152 VanDerWaalsContact O-N 3.15Å; M149-G152 PolarHBondContact O-N 3.42Å
153	A	98.4	Very high	98.3	Very high	21 Å²	21	55.8 Å²	55.8	17%	0.174	29%	0.285	C	S	.	.			trans	-63.8	146.7	174.4	0	0	0	0	0	110	I112 L114 A148 I151 D155	I112-A153 CarbonylContact O-C 3.58Å; I112-A153 WeakPolarHBondContact O-CA 3.37Å; L114-A153 HydrophobicContact CB-CB 4.2Å; A148-A153 HydrophobicContact CB-CB 4.02Å; A148-A153 PolarHBondContact O-N 2.98Å; I151-A153 HydrophobicContact CD1-CB 4.1Å; I151-A153 HydrophobicContact CG1-CB 3.94Å; A153-D155 VanDerWaalsContact C-N 3.32Å
154	Y	98.3	Very high	98.3	Very high	84 Å²	84	56.6 Å²	56.6	33%	0.329	29%	0.285	S	S	.	.	S	Bend	trans	-64.8	-39.1	174.4	173.4	-79.7	0	0	0	110.9	I112 I113 T173 A177 Q180	I112-Y154 PolarHBondContact O-N 2.98Å; I113-Y154 HydrophobicContact CD1-CD1 3.39Å; I113-Y154 HydrophobicContact CD1-CE1 4.31Å; I113-Y154 HydrophobicContact CD1-CG 3.99Å; Y154-T173 HydrophobicContact CD1-CG2 4.39Å; Y154-T173 HydrophobicContact CE1-CG2 4.06Å; Y154-A177 HydrophobicContact CD1-CB 3.91Å; Y154-A177 HydrophobicContact CD2-CB 4.08Å; Y154-A177 HydrophobicContact CE1-CB 3.86Å; Y154-A177 HydrophobicContact CE2-CB 4.02Å; Y154-A177 HydrophobicContact CG-CB 4.05Å; Y154-Q180 PolarHBondContact OH-NE2 2.77Å
155	D	98.6	Very high	98.3	Very high	71 Å²	71	61 Å²	61	38%	0.38	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	168.4	172.7	-146.8	-21.1	0	0	0	111.9	I113 L114 A153 T173	I113-D155 HydrophobicContact CD1-CB 4.39Å; L114-D155 PolarHBondContact N-O 3.32Å; A153-D155 VanDerWaalsContact C-N 3.32Å; D155-T173 HydrophobicContact CB-CG2 3.89Å
156	Y	98.8	Very high	98.2	Very high	25 Å²	25	56 Å²	56	10%	0.098	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.5	172.4	172.3	-105.1	0	0	0	110.8	Y84 L114 A116 R145 A148 E158	Y84-Y156 HydrophobicContact CE1-CE2 4.09Å; Y84-Y156 PolarHBondContact OH-OH 3.41Å; L114-Y156 HydrophobicContact CB-CD2 4.29Å; L114-Y156 HydrophobicContact CD2-CD2 3.99Å; L114-Y156 HydrophobicContact CD2-CE2 4.45Å; L114-Y156 HydrophobicContact CG-CD2 4.08Å; L114-Y156 WeakPolarHBondContact O-CA 3.4Å; A116-Y156 HydrophobicContact CB-CE2 4.12Å; R145-Y156 HydrophobicContact CB-CD1 4.43Å; R145-Y156 HydrophobicContact CG-CD1 3.37Å; R145-Y156 HydrophobicContact CG-CE1 3.75Å; R145-Y156 HydrophobicContact CG-CG 4.1Å; A148-Y156 HydrophobicContact CB-CD2 4.43Å; A148-Y156 HydrophobicContact CB-CG 4.38Å; Y156-E158 HydrophobicContact CE1-CG 3.71Å; Y156-E158 WeakPolarHBondContact OH-CG 3.32Å; Y156-E158 PolarHBondContact OH-OE1 2.87Å
157	L	98.9	Very high	98.2	Very high	34 Å²	34	53.7 Å²	53.7	18%	0.178	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	154	179.5	-64.9	167.6	0	0	0	111.2	I113 L114 V115 A116 V170 T173	I113-L157 HydrophobicContact CG2-CD1 4.12Å; L114-L157 PolarHBondContact O-N 2.64Å; V115-L157 CarbonylContact C-O 3.58Å; V115-L157 WeakPolarHBondContact CA-O 3.25Å; A116-L157 PolarHBondContact N-O 3.49Å; L157-V170 HydrophobicContact CB-CG2 3.85Å; L157-V170 HydrophobicContact CD1-CB 4.4Å; L157-V170 HydrophobicContact CD1-CG2 4.05Å; L157-T173 HydrophobicContact CD1-CG2 4.01Å
158	E	98.8	Very high	98.1	Very high	30 Å²	30	58.9 Å²	58.9	14%	0.14	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.3	174.2	-49.4	-168.1	154.4	0	0	109.6	A116 K119 R122 A141 Y156	A116-E158 HydrophobicContact CB-CB 4.22Å; A116-E158 HydrophobicContact CB-CG 3.93Å; A116-E158 WeakPolarHBondContact O-CA 3.35Å; K119-E158 HydrophobicContact CB-CB 4.45Å; K119-E158 HydrophobicContact CD-CB 3.87Å; K119-E158 WeakPolarHBondContact CE-OE2 3.28Å; K119-E158 HydrophobicContact CG-CB 4.22Å; R122-E158 IonicContact CZ-OE1 3.7Å; R122-E158 IonicContact CZ-OE2 2.98Å; R122-E158 IonicContact NH1-OE1 3.51Å; R122-E158 IonicContact NH1-OE2 3.61Å; R122-E158 PolarHBondContact NH1-OE2 2.83Å; R122-E158 IonicContact NH2-OE1 2.77Å; R122-E158 PolarHBondContact NH2-OE1 3.07Å; R122-E158 IonicContact NH2-OE2 2.65Å; R122-E158 PolarHBondContact NH2-OE2 3.24Å; A141-E158 VanDerWaalsContact CA-OE1 3.3Å; A141-E158 WeakPolarHBondContact CA-OE1 3.46Å; A141-E158 WeakPolarHBondContact CB-OE1 3.46Å; Y156-E158 HydrophobicContact CE1-CG 3.71Å; Y156-E158 WeakPolarHBondContact OH-CG 3.32Å; Y156-E158 PolarHBondContact OH-OE1 2.87Å
159	C	98.8	Very high	98.1	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.308	C	S	.	.			trans	-144.3	162.2	178.4	64.6	0	0	0	0	112.4	A116 N117 K118 K119 E165 I167 V170	A116-C159 PolarHBondContact O-N 3.39Å; N117-C159 CarbonylContact C-O 3.5Å; N117-C159 PolarHBondContact OD1-SG 2.7Å; K118-C159 PolarHBondContact N-O 3.23Å; K118-C159 VanDerWaalsContact N-O 3.09Å; K119-C159 WeakPolarHBondContact CB-O 3.4Å; K119-C159 PolarHBondContact N-O 3.44Å; K119-C159 VanDerWaalsContact N-O 3.07Å; C159-E165 CarbonylContact C-O 3.5Å; C159-E165 WeakPolarHBondContact CA-O 3.43Å; C159-E165 VanDerWaalsContact CB-O 3.29Å; C159-E165 WeakPolarHBondContact CB-O 3.37Å; C159-I167 HydrophobicContact CB-CD1 3.92Å; C159-V170 HydrophobicContact CB-CG2 4.22Å
160	S	98.6	Very high	98.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.272	C	S	.	.			trans	-129.9	108.2	171.5	169.1	0	0	0	0	108.5	D120 R162 T163 K164 E165	D120-S160 WeakPolarHBondContact OD1-CB 3.34Å; D120-S160 PolarHBondContact OD1-OG 2.86Å; S160-R162 PolarHBondContact O-N 3.26Å; S160-R162 PolarHBondContact OG-N 3.1Å; S160-T163 WeakPolarHBondContact CB-OG1 3.42Å; S160-T163 PolarHBondContact O-N 3.49Å; S160-T163 PolarHBondContact OG-N 2.55Å; S160-T163 VanDerWaalsContact OG-N 3.1Å; S160-T163 PolarHBondContact OG-OG1 3.44Å; S160-K164 CarbonylContact O-C 3.18Å; S160-K164 VanDerWaalsContact O-CA 3.24Å; S160-K164 WeakPolarHBondContact O-CA 3.39Å; S160-K164 PolarHBondContact O-N 3.43Å; S160-E165 PolarHBondContact N-O 2.99Å; S160-E165 PolarHBondContact O-N 2.9Å
161	A	97.9	Very high	98.1	Very high	12 Å²	12	48.4 Å²	48.4	10%	0.099	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-31.5	172.2	0	0	0	0	0	111.2	C20 V24 F30 I167	C20-A161 HydrophobicContact CB-CB 3.79Å; V24-A161 HydrophobicContact CB-CB 4.45Å; V24-A161 HydrophobicContact CG2-CB 3.97Å; F30-A161 VanDerWaalsContact CD2-C 3.48Å; F30-A161 HydrophobicContact CD2-CB 3.99Å; F30-A161 WeakPolarHBondContact CD2-O 3.41Å; F30-A161 HydrophobicContact CE2-CB 3.9Å; A161-I167 HydrophobicContact CB-CD1 4.2Å
162	R	96.1	Very high	98.1	Very high	159 Å²	159	50.5 Å²	50.5	60%	0.6	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-41.7	-179.3	-176.8	60.8	175.2	179.8	2.1	112.9	F30 S160	F30-R162 HydrophobicContact CD2-CB 4.43Å; F30-R162 HydrophobicContact CE2-CB 4.11Å; F30-R162 HydrophobicContact CZ-CB 4.48Å; S160-R162 PolarHBondContact O-N 3.26Å; S160-R162 PolarHBondContact OG-N 3.1Å
163	T	96.9	Very high	98.1	Very high	80 Å²	80	48.1 Å²	48.1	49%	0.491	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-3.8	-179.1	62.9	0	0	0	0	113	D120 S160 E165	D120-T163 HydrophobicContact CB-CG2 4.08Å; S160-T163 WeakPolarHBondContact CB-OG1 3.42Å; S160-T163 PolarHBondContact O-N 3.49Å; S160-T163 PolarHBondContact OG-N 2.55Å; S160-T163 VanDerWaalsContact OG-N 3.1Å; S160-T163 PolarHBondContact OG-OG1 3.44Å; T163-E165 PolarHBondContact O-N 2.81Å; T163-E165 WeakPolarHBondContact OG1-CB 3.42Å; T163-E165 PolarHBondContact OG1-N 2.91Å
164	K	97.4	Very high	98.1	Very high	93 Å²	93	47.1 Å²	47.1	40%	0.404	22%	0.218	S	C	.	.			trans	63.5	5.5	-171.8	-51.3	-178	175.3	-170.5	0	114.7	V24 D28 S160	V24-K164 HydrophobicContact CG1-CG 4Å; D28-K164 WeakPolarHBondContact O-CE 3.48Å; D28-K164 PolarHBondContact O-NZ 2.96Å; D28-K164 WeakPolarHBondContact OD1-CE 3.47Å; D28-K164 IonicContact OD1-NZ 2.71Å; D28-K164 PolarHBondContact OD1-NZ 3.09Å; D28-K164 IonicContact OD2-NZ 2.89Å; D28-K164 PolarHBondContact OD2-NZ 3.09Å; S160-K164 CarbonylContact O-C 3.18Å; S160-K164 VanDerWaalsContact O-CA 3.24Å; S160-K164 WeakPolarHBondContact O-CA 3.39Å; S160-K164 PolarHBondContact O-N 3.43Å
165	E	98.3	Very high	98.1	Very high	94 Å²	94	43.1 Å²	43.1	44%	0.439	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	132.6	177.9	-169.7	-169.8	173.1	0	0	111.1	K119 C159 S160 T163 I167	K119-E165 IonicContact NZ-OE1 3.02Å; K119-E165 PolarHBondContact NZ-OE1 3.46Å; K119-E165 IonicContact NZ-OE2 2.69Å; C159-E165 CarbonylContact C-O 3.5Å; C159-E165 WeakPolarHBondContact CA-O 3.43Å; C159-E165 VanDerWaalsContact CB-O 3.29Å; C159-E165 WeakPolarHBondContact CB-O 3.37Å; S160-E165 PolarHBondContact N-O 2.99Å; S160-E165 PolarHBondContact O-N 2.9Å; T163-E165 PolarHBondContact O-N 2.81Å; T163-E165 WeakPolarHBondContact OG1-CB 3.42Å; T163-E165 PolarHBondContact OG1-N 2.91Å; E165-I167 PolarHBondContact O-N 3.35Å
166	G	98.2	Very high	98	Very high	13 Å²	13	42.5 Å²	42.5	13%	0.134	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	-2.5	172	0	0	0	0	0	115.2	E169 V170	G166-E169 WeakPolarHBondContact CA-OE2 3.48Å; G166-V170 WeakPolarHBondContact O-CG2 3.25Å; G166-V170 PolarHBondContact O-N 3.2Å
167	I	98.2	Very high	97.9	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.041	20%	0.195	C	C	.	.	H	α-helix	trans	-65.6	-50	-175.6	-61.3	-66.2	0	0	0	110	L21 V24 F25 C159 A161 E165 E169 V170 F171	L21-I167 HydrophobicContact CD1-CD1 3.45Å; L21-I167 VanDerWaalsContact CD1-CD1 3.45Å; L21-I167 HydrophobicContact CD1-CG2 4.41Å; V24-I167 HydrophobicContact CG1-CG1 4.13Å; V24-I167 HydrophobicContact CG1-CG2 4.32Å; F25-I167 HydrophobicContact CB-CG2 3.84Å; C159-I167 HydrophobicContact CB-CD1 3.92Å; A161-I167 HydrophobicContact CB-CD1 4.2Å; E165-I167 PolarHBondContact O-N 3.35Å; I167-E169 VanDerWaalsContact C-N 3.34Å; I167-E169 PolarHBondContact O-N 2.76Å; I167-V170 PolarHBondContact O-N 3.4Å; I167-F171 HydrophobicContact CG2-CD2 4.28Å; I167-F171 HydrophobicContact CG2-CE2 4.08Å; I167-F171 WeakPolarHBondContact O-CD2 3.42Å; I167-F171 PolarHBondContact O-N 3.16Å
168	W	97	Very high	97.7	Very high	121 Å²	121	40.9 Å²	40.9	46%	0.458	19%	0.19	S	C	.	.	H	α-helix	trans	-62	-43.4	-177.6	-176	-103	0	0	0	112	F25 I46 V170 F171 E172	F25-W168 HydrophobicContact CD2-CE3 4.35Å; F25-W168 AromaticContact CE2-CE3 3.86Å; F25-W168 HydrophobicContact CE2-CE3 3.86Å; F25-W168 AromaticContact CE2-CZ3 3.76Å; F25-W168 HydrophobicContact CE2-CZ3 3.76Å; I46-W168 HydrophobicContact CB-CH2 4.41Å; I46-W168 HydrophobicContact CD1-CH2 3.79Å; I46-W168 HydrophobicContact CD1-CZ2 3.95Å; I46-W168 HydrophobicContact CD1-CZ3 4.06Å; I46-W168 HydrophobicContact CG1-CH2 3.5Å; I46-W168 VanDerWaalsContact CG1-CH2 3.5Å; I46-W168 HydrophobicContact CG1-CZ2 3.82Å; I46-W168 HydrophobicContact CG1-CZ3 4.15Å; W168-V170 VanDerWaalsContact C-N 3.26Å; W168-V170 PolarHBondContact O-N 2.96Å; W168-F171 PolarHBondContact O-N 3.17Å; W168-F171 VanDerWaalsContact O-N 3.15Å; W168-E172 PolarHBondContact NE1-OE2 2.92Å; W168-E172 WeakPolarHBondContact O-CB 3.22Å; W168-E172 PolarHBondContact O-N 3.27Å
169	E	98.4	Very high	97.4	Very high	97 Å²	97	41.2 Å²	41.2	45%	0.453	19%	0.193	S	C	.	.	H	α-helix	trans	-60.3	-35.6	-179.5	-64.8	83.4	170.5	0	0	112.1	G166 I167 T173	G166-E169 WeakPolarHBondContact CA-OE2 3.48Å; I167-E169 VanDerWaalsContact C-N 3.34Å; I167-E169 PolarHBondContact O-N 2.76Å; E169-T173 VanDerWaalsContact O-CB 3.23Å; E169-T173 WeakPolarHBondContact O-CB 3.48Å; E169-T173 PolarHBondContact O-N 2.94Å; E169-T173 PolarHBondContact O-OG1 3.25Å
170	V	98.7	Very high	96.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-51.5	174.3	168.1	0	0	0	0	111.3	L21 L81 V115 L157 C159 G166 I167 W168 A174	L21-V170 HydrophobicContact CD2-CG1 4.49Å; L81-V170 HydrophobicContact CD1-CG1 3.75Å; L81-V170 HydrophobicContact CD2-CG1 3.98Å; V115-V170 HydrophobicContact CG1-CG1 4.45Å; V115-V170 HydrophobicContact CG1-CG2 3.92Å; V115-V170 HydrophobicContact CG2-CG1 3.96Å; V115-V170 HydrophobicContact CG2-CG2 4.34Å; L157-V170 HydrophobicContact CB-CG2 3.85Å; L157-V170 HydrophobicContact CD1-CB 4.4Å; L157-V170 HydrophobicContact CD1-CG2 4.05Å; C159-V170 HydrophobicContact CB-CG2 4.22Å; G166-V170 WeakPolarHBondContact O-CG2 3.25Å; G166-V170 PolarHBondContact O-N 3.2Å; I167-V170 PolarHBondContact O-N 3.4Å; W168-V170 VanDerWaalsContact C-N 3.26Å; W168-V170 PolarHBondContact O-N 2.96Å; V170-A174 VanDerWaalsContact O-CB 3.3Å; V170-A174 WeakPolarHBondContact O-CB 3.5Å; V170-A174 PolarHBondContact O-N 3.27Å
171	F	98.3	Very high	94.5	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-75.7	-32.4	-176.6	-68	-84.2	0	0	0	112.7	L8 L21 L22 F25 I46 L55 L57 L81 I167 W168 T175	L8-F171 HydrophobicContact CD1-CD1 3.99Å; L8-F171 HydrophobicContact CD1-CE1 4.21Å; L21-F171 HydrophobicContact CD1-CE2 3.65Å; L21-F171 HydrophobicContact CD1-CZ 4.1Å; L21-F171 HydrophobicContact CG-CE2 4.04Å; L21-F171 HydrophobicContact CG-CZ 3.96Å; L22-F171 HydrophobicContact CD2-CE1 3.87Å; L22-F171 HydrophobicContact CD2-CZ 3.86Å; F25-F171 HydrophobicContact CB-CD2 3.67Å; F25-F171 HydrophobicContact CB-CE1 4.4Å; F25-F171 HydrophobicContact CB-CE2 3.26Å; F25-F171 HydrophobicContact CB-CG 4.42Å; F25-F171 HydrophobicContact CB-CZ 3.66Å; F25-F171 AromaticContact CD1-CD1 3.57Å; F25-F171 HydrophobicContact CD1-CD1 3.57Å; F25-F171 AromaticContact CD1-CD2 3.81Å; F25-F171 HydrophobicContact CD1-CD2 3.81Å; F25-F171 AromaticContact CD1-CE1 3.6Å; F25-F171 HydrophobicContact CD1-CE1 3.6Å; F25-F171 AromaticContact CD1-CE2 3.88Å; F25-F171 HydrophobicContact CD1-CE2 3.88Å; F25-F171 AromaticContact CD1-CG 3.68Å; F25-F171 HydrophobicContact CD1-CG 3.68Å; F25-F171 AromaticContact CD1-CZ 3.75Å; F25-F171 HydrophobicContact CD1-CZ 3.75Å; F25-F171 HydrophobicContact CD2-CB 3.93Å; F25-F171 HydrophobicContact CD2-CD1 4.35Å; F25-F171 AromaticContact CD2-CD2 3.3Å; F25-F171 HydrophobicContact CD2-CD2 3.3Å; F25-F171 AromaticContact CD2-CE2 3.89Å; F25-F171 HydrophobicContact CD2-CE2 3.89Å; F25-F171 AromaticContact CD2-CG 3.59Å; F25-F171 HydrophobicContact CD2-CG 3.59Å; F25-F171 HydrophobicContact CE1-CB 4.12Å; F25-F171 AromaticContact CE1-CD1 3.57Å; F25-F171 HydrophobicContact CE1-CD1 3.57Å; F25-F171 HydrophobicContact CE1-CD2 4.27Å; F25-F171 HydrophobicContact CE1-CE1 4.03Å; F25-F171 AromaticContact CE1-CG 3.71Å; F25-F171 HydrophobicContact CE1-CG 3.71Å; F25-F171 HydrophobicContact CE2-CB 3.49Å; F25-F171 VanDerWaalsContact CE2-CB 3.49Å; F25-F171 HydrophobicContact CE2-CD1 4.35Å; F25-F171 AromaticContact CE2-CD2 3.83Å; F25-F171 HydrophobicContact CE2-CD2 3.83Å; F25-F171 AromaticContact CE2-CG 3.63Å; F25-F171 HydrophobicContact CE2-CG 3.63Å; F25-F171 HydrophobicContact CG-CB 4.41Å; F25-F171 AromaticContact CG-CD1 3.98Å; F25-F171 HydrophobicContact CG-CD1 3.98Å; F25-F171 AromaticContact CG-CD2 3.29Å; F25-F171 HydrophobicContact CG-CD2 3.29Å; F25-F171 HydrophobicContact CG-CE1 4.03Å; F25-F171 AromaticContact CG-CE2 3.4Å; F25-F171 HydrophobicContact CG-CE2 3.4Å; F25-F171 VanDerWaalsContact CG-CE2 3.4Å; F25-F171 AromaticContact CG-CG 3.62Å; F25-F171 HydrophobicContact CG-CG 3.62Å; F25-F171 AromaticContact CG-CZ 3.76Å; F25-F171 HydrophobicContact CG-CZ 3.76Å; F25-F171 HydrophobicContact CZ-CB 3.61Å; F25-F171 AromaticContact CZ-CD1 3.99Å; F25-F171 HydrophobicContact CZ-CD1 3.99Å; F25-F171 HydrophobicContact CZ-CD2 4.29Å; F25-F171 AromaticContact CZ-CG 3.69Å; F25-F171 HydrophobicContact CZ-CG 3.69Å; I46-F171 HydrophobicContact CD1-CB 4.14Å; L55-F171 HydrophobicContact CD1-CB 4.48Å; L55-F171 HydrophobicContact CD1-CD1 4.18Å; L57-F171 HydrophobicContact CD2-CD1 4.21Å; L57-F171 HydrophobicContact CD2-CE1 3.92Å; L81-F171 HydrophobicContact CD1-CE1 4.07Å; L81-F171 HydrophobicContact CD1-CZ 4.29Å; I167-F171 HydrophobicContact CG2-CD2 4.28Å; I167-F171 HydrophobicContact CG2-CE2 4.08Å; I167-F171 WeakPolarHBondContact O-CD2 3.42Å; I167-F171 PolarHBondContact O-N 3.16Å; W168-F171 PolarHBondContact O-N 3.17Å; W168-F171 VanDerWaalsContact O-N 3.15Å; F171-T175 VanDerWaalsContact O-CB 3.24Å; F171-T175 WeakPolarHBondContact O-CB 3.28Å; F171-T175 PolarHBondContact O-N 3.46Å; F171-T175 PolarHBondContact O-OG1 3.32Å
172	E	97.8	Very high	92.4	Very high	55 Å²	55	63.4 Å²	63.4	26%	0.257	28%	0.284	S	S	.	.	H	α-helix	trans	-62.3	-48.5	172.5	-170.7	-172.7	145.3	0	0	110.7	V48 W168 T175 R176	V48-E172 HydrophobicContact CG1-CG 4.01Å; V48-E172 HydrophobicContact CG2-CG 3.96Å; W168-E172 PolarHBondContact NE1-OE2 2.92Å; W168-E172 WeakPolarHBondContact O-CB 3.22Å; W168-E172 PolarHBondContact O-N 3.27Å; E172-T175 PolarHBondContact O-N 2.91Å; E172-R176 WeakPolarHBondContact O-CB 3.21Å; E172-R176 PolarHBondContact O-N 3.43Å; E172-R176 IonicContact OE1-CZ 3.04Å; E172-R176 IonicContact OE1-NH1 3.94Å; E172-R176 PolarHBondContact OE1-NH1 3.17Å; E172-R176 IonicContact OE1-NH2 3.03Å; E172-R176 PolarHBondContact OE1-NH2 3.45Å
173	T	98.4	Very high	89.8	Confident	13 Å²	13	61 Å²	61	8%	0.08	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-43.8	179.4	-57.1	0	0	0	0	111.6	I113 Y154 D155 L157 E169 T175 R176 A177	I113-T173 HydrophobicContact CD1-CG2 4.21Å; Y154-T173 HydrophobicContact CD1-CG2 4.39Å; Y154-T173 HydrophobicContact CE1-CG2 4.06Å; D155-T173 HydrophobicContact CB-CG2 3.89Å; L157-T173 HydrophobicContact CD1-CG2 4.01Å; E169-T173 VanDerWaalsContact O-CB 3.23Å; E169-T173 WeakPolarHBondContact O-CB 3.48Å; E169-T173 PolarHBondContact O-N 2.94Å; E169-T173 PolarHBondContact O-OG1 3.25Å; T173-T175 VanDerWaalsContact C-N 3.35Å; T173-T175 PolarHBondContact O-N 3.31Å; T173-R176 PolarHBondContact O-N 2.75Å; T173-A177 PolarHBondContact O-N 3.01Å
174	A	98.1	Very high	87	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-43.9	175.6	0	0	0	0	0	111.6	L8 V79 L81 I113 V170 A177 T178	L8-A174 HydrophobicContact CD1-CB 3.85Å; V79-A174 HydrophobicContact CG1-CB 4.29Å; V79-A174 HydrophobicContact CG2-CB 4.09Å; L81-A174 HydrophobicContact CD2-CB 3.81Å; I113-A174 HydrophobicContact CG1-CB 4.12Å; V170-A174 VanDerWaalsContact O-CB 3.3Å; V170-A174 WeakPolarHBondContact O-CB 3.5Å; V170-A174 PolarHBondContact O-N 3.27Å; A174-A177 WeakPolarHBondContact O-CB 3.39Å; A174-A177 PolarHBondContact O-N 3.39Å; A174-T178 WeakPolarHBondContact O-CG2 3.47Å; A174-T178 PolarHBondContact O-N 2.83Å
175	T	97.4	Very high	84.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-47.5	177.3	-59.7	0	0	0	0	110.8	I46 V48 V53 F171 E172 T173 A177 T178 L179	I46-T175 HydrophobicContact CG2-CG2 4.16Å; V48-T175 HydrophobicContact CB-CG2 4.02Å; V48-T175 HydrophobicContact CG2-CG2 3.66Å; V53-T175 HydrophobicContact CB-CG2 3.95Å; V53-T175 HydrophobicContact CG1-CG2 4.01Å; V53-T175 HydrophobicContact CG2-CG2 3.85Å; F171-T175 VanDerWaalsContact O-CB 3.24Å; F171-T175 WeakPolarHBondContact O-CB 3.28Å; F171-T175 PolarHBondContact O-N 3.46Å; F171-T175 PolarHBondContact O-OG1 3.32Å; E172-T175 PolarHBondContact O-N 2.91Å; T173-T175 VanDerWaalsContact C-N 3.35Å; T173-T175 PolarHBondContact O-N 3.31Å; T175-A177 VanDerWaalsContact C-N 3.27Å; T175-A177 PolarHBondContact O-N 2.86Å; T175-T178 WeakPolarHBondContact O-CA 3.47Å; T175-T178 WeakPolarHBondContact O-CB 3.44Å; T175-T178 PolarHBondContact O-N 3.26Å; T175-T178 PolarHBondContact O-OG1 2.91Å; T175-L179 HydrophobicContact CG2-CD1 4.26Å; T175-L179 PolarHBondContact O-N 3.46Å
176	R	96.8	Very high	81.6	Confident	59 Å²	59	62 Å²	62	22%	0.223	33%	0.326	C	S	.	.	H	α-helix	trans	-56.2	-41	176.9	-173.7	175.5	-67.2	113.9	0.1	112.3	V48 D49 E172 T173 T178 L179 Q180	V48-R176 HydrophobicContact CG1-CB 4.19Å; D49-R176 IonicContact OD1-CZ 2.75Å; D49-R176 IonicContact OD1-NE 3.81Å; D49-R176 IonicContact OD1-NH2 3.57Å; D49-R176 PolarHBondContact OD1-NH2 3.45Å; D49-R176 IonicContact OD2-CZ 3.07Å; D49-R176 IonicContact OD2-NE 3.86Å; D49-R176 PolarHBondContact OD2-NE 2.94Å; D49-R176 VanDerWaalsContact OD2-NE 3.09Å; D49-R176 IonicContact OD2-NH2 3.34Å; E172-R176 WeakPolarHBondContact O-CB 3.21Å; E172-R176 PolarHBondContact O-N 3.43Å; E172-R176 IonicContact OE1-CZ 3.04Å; E172-R176 IonicContact OE1-NH1 3.94Å; E172-R176 PolarHBondContact OE1-NH1 3.17Å; E172-R176 IonicContact OE1-NH2 3.03Å; E172-R176 PolarHBondContact OE1-NH2 3.45Å; T173-R176 PolarHBondContact O-N 2.75Å; R176-T178 PolarHBondContact O-N 3.04Å; R176-L179 PolarHBondContact O-N 3.38Å; R176-L179 VanDerWaalsContact O-N 3.09Å; R176-Q180 PolarHBondContact O-N 3.02Å
177	A	96.8	Very high	78.9	Confident	11 Å²	11	68.2 Å²	68.2	9%	0.091	36%	0.356	C	S	.	.	H	α-helix	trans	-60.1	-26.4	176	0	0	0	0	0	113.1	P111 I113 Y154 T173 A174 T175	P111-A177 HydrophobicContact CB-CB 4.25Å; P111-A177 HydrophobicContact CG-CB 4.16Å; I113-A177 HydrophobicContact CD1-CB 4.34Å; Y154-A177 HydrophobicContact CD1-CB 3.91Å; Y154-A177 HydrophobicContact CD2-CB 4.08Å; Y154-A177 HydrophobicContact CE1-CB 3.86Å; Y154-A177 HydrophobicContact CE2-CB 4.02Å; Y154-A177 HydrophobicContact CG-CB 4.05Å; T173-A177 PolarHBondContact O-N 3.01Å; A174-A177 WeakPolarHBondContact O-CB 3.39Å; A174-A177 PolarHBondContact O-N 3.39Å; T175-A177 VanDerWaalsContact C-N 3.27Å; T175-A177 PolarHBondContact O-N 2.86Å
178	T	95.2	Very high	76.4	Confident	14 Å²	14	73.3 Å²	73.3	9%	0.086	39%	0.391	C	S	.	.	H	α-helix	trans	-85	-17.2	176.6	75.3	0	0	0	0	114.9	K6 D78 V79 A174 T175 R176	K6-T178 HydrophobicContact CD-CG2 4.36Å; K6-T178 WeakPolarHBondContact CG-OG1 3.39Å; K6-T178 PolarHBondContact NZ-O 3.29Å; D78-T178 HydrophobicContact CB-CG2 3.65Å; V79-T178 HydrophobicContact CB-CG2 3.66Å; V79-T178 HydrophobicContact CG1-CG2 3.56Å; A174-T178 WeakPolarHBondContact O-CG2 3.47Å; A174-T178 PolarHBondContact O-N 2.83Å; T175-T178 WeakPolarHBondContact O-CA 3.47Å; T175-T178 WeakPolarHBondContact O-CB 3.44Å; T175-T178 PolarHBondContact O-N 3.26Å; T175-T178 PolarHBondContact O-OG1 2.91Å; R176-T178 PolarHBondContact O-N 3.04Å
179	L	91.1	Very high	73.8	Confident	36 Å²	36	77.3 Å²	77.3	19%	0.188	41%	0.412	C	S	.	.	H	α-helix	trans	-93.3	-23.4	-176.1	-64.2	178.9	0	0	0	112.3	Q51 V53 T175 R176 K181	Q51-L179 HydrophobicContact CB-CD1 4.34Å; V53-L179 HydrophobicContact CG2-CD1 4.24Å; V53-L179 HydrophobicContact CG2-CD2 4.06Å; T175-L179 HydrophobicContact CG2-CD1 4.26Å; T175-L179 PolarHBondContact O-N 3.46Å; R176-L179 PolarHBondContact O-N 3.38Å; R176-L179 VanDerWaalsContact O-N 3.09Å; L179-K181 PolarHBondContact O-N 2.81Å
180	Q	80.7	Confident	71.1	Confident	107 Å²	107	82.2 Å²	82.2	50%	0.5	43%	0.432	S	S	.	.	S	Bend	trans	-64.1	123.8	174.4	-69.5	-179.2	8.7	0	0	109.9	Y154 R176 R182	Y154-Q180 PolarHBondContact OH-NE2 2.77Å; R176-Q180 PolarHBondContact O-N 3.02Å; Q180-R182 PolarHBondContact O-N 3.4Å; Q180-R182 VanDerWaalsContact O-N 3.14Å
181	K	57.8	Low	68.3	Low	204 Å²	204	88.3 Å²	88.3	89%	0.887	47%	0.473	S	S	*	.			trans	-60.4	120.4	173.1	-71.2	-177.4	178.9	178.9	0	107.7	L179 S183	L179-K181 PolarHBondContact O-N 2.81Å; K181-S183 PolarHBondContact O-N 3.31Å
182	R	53	Low	65.4	Low	168 Å²	168	94.6 Å²	94.6	63%	0.634	52%	0.515	S	S	*	.			trans	-53.1	107.2	165.3	-74.2	-176.8	176.9	158.1	3.9	107	N109 Q180 T184	N109-R182 PolarHBondContact O-NH2 3.13Å; Q180-R182 PolarHBondContact O-N 3.4Å; Q180-R182 VanDerWaalsContact O-N 3.14Å; R182-T184 PolarHBondContact O-N 3.44Å
183	S	41	Very low	62.9	Low	107 Å²	107	98.5 Å²	98.5	75%	0.748	54%	0.543	S	S	*	.			trans	-61.7	108.1	164.9	50.2	0	0	0	0	105.9	K181	K181-S183 PolarHBondContact O-N 3.31Å
184	T	37.6	Very low	59.9	Low	88 Å²	88	106.4 Å²	106.4	54%	0.54	58%	0.581	S	S	.	*			trans	-57.6	136.9	168.3	42.7	0	0	0	0	107.5	R182 G186	R182-T184 PolarHBondContact O-N 3.44Å; T184-G186 PolarHBondContact O-N 2.49Å
185	P	39.7	Very low	57	Low	143 Å²	143	118.4 Å²	118.4	93%	0.929	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	83	169.3	26.9	-29.9	0	0	0	107.7
186	G	43.8	Very low	55	Low	57 Å²	57	124.4 Å²	124.4	59%	0.588	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-176.6	-23.7	-172.7	0	0	0	0	0	114.5	T184 C188	T184-G186 PolarHBondContact O-N 2.49Å; G186-C188 PolarHBondContact O-N 3.39Å
187	D	41.4	Very low	52.8	Low	144 Å²	144	127.8 Å²	127.8	77%	0.77	70%	0.7	S	S	*	*	S	Bend	trans	-87.3	2.7	-177.9	-86.6	-17.6	0	0	0	115	F189	D187-F189 PolarHBondContact O-N 3.48Å
188	C	45.6	Very low	50.4	Low	116 Å²	116	134.3 Å²	134.3	78%	0.784	73%	0.734	S	S	*	*			trans	-99.9	52.8	177.5	-161.7	0	0	0	0	113.1	G186	G186-C188 PolarHBondContact O-N 3.39Å
189	F	43.1	Very low	47.7	Very low	204 Å²	204	141.4 Å²	141.4	90%	0.895	77%	0.772	S	S	*	*	S	Bend	trans	-145.3	29	168.1	-88.4	-70.8	0	0	0	114.6	D187	D187-F189 PolarHBondContact O-N 3.48Å
190	K	41.8	Very low	45	Very low	201 Å²	201	147.9 Å²	147.9	87%	0.874	81%	0.808	S	S	*	*	S	Bend	trans	-139.8	64.2	167.8	-79.2	-171	176.1	175.5	0	112.3
191	C	38.6	Very low	42.6	Very low	128 Å²	128	150.7 Å²	150.7	87%	0.865	83%	0.829	S	S	*	*	S	Bend	trans	-157.1	36.4	159.3	-124.4	0	0	0	0	114.2
192	C	38.6	Very low	41.5	Very low	131 Å²	131	146.9 Å²	146.9	89%	0.885	83%	0.825	S	S	*	*			trans	-140.4	58.5	167.9	-91.9	0	0	0	0	110.8
193	V	43.9	Very low	40.7	Very low	137 Å²	137	145.2 Å²	145.2	83%	0.83	84%	0.839	S	S	*	*			trans	-141.3	102.4	151.1	-170.2	0	0	0	0	106.7
194	M	36.6	Very low	40.6	Very low	180 Å²	180	148.4 Å²	148.4	89%	0.887	85%	0.847	S	S	*	*			trans	155.5	86	147.9	-84.9	-157.5	-64.7	0	0	108.6
195	L	36.8	Very low	40.9	Very low	252 Å²	252	153.9 Å²	153.9	100%	1.319	88%	0.875	S	S	*	*				-174.7	0	118.7	-91.4	164.7	0	0	0	108.7

Retrieved 195 of 195 residues in 139.1 ms (Link to these results)

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