A0A060XF37_ONCMY Loading...

Cell division control protein 42 homolog

Plasma membrane-associated small GTPase which cycles between an active GTP-bound and an inactive GDP-bound state.

AlphaFold DB (A0A0P7UG32), UniProt , Accession A0A060XF37, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 191 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	61.4	Low	93.4	Very high	157 Å²	157	38.5 Å²	38.5	77%	0.773	20%	0.196	S	C	*	.				0	118.8	0	-160.1	145	122.4	0	0	106.4	T52	M1-T52 WeakPolarHBondContact CE-OG1 3.42Å
2	Q	86.8	Confident	93.5	Very high	120 Å²	120	37.9 Å²	37.9	56%	0.561	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	139	178.2	-67.9	-174.6	47.8	0	0	108.6	Y51 T52	Q2-Y51 HydrophobicContact CB-CD1 3.51Å; Q2-Y51 HydrophobicContact CB-CE1 3.41Å; Q2-Y51 VanDerWaalsContact CB-CE1 3.41Å; Q2-Y51 HydrophobicContact CB-CG 4.36Å; Q2-Y51 HydrophobicContact CG-CE1 4.08Å; Q2-Y51 PolarHBondContact NE2-OH 2.91Å; Q2-Y51 WeakPolarHBondContact O-CA 3.5Å; Q2-Y51 VanDerWaalsContact OE1-CE1 3.3Å; Q2-Y51 PolarHBondContact OE1-OH 2.98Å; Q2-T52 PolarHBondContact O-N 3.22Å
3	T	93.8	Very high	93.6	Very high	89 Å²	89	40 Å²	40	55%	0.546	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.4	-179.4	-58.1	0	0	0	0	108.5	T52	T3-T52 CarbonylContact C-O 3.55Å; T3-T52 VanDerWaalsContact CA-O 3.31Å; T3-T52 WeakPolarHBondContact CA-O 3.31Å; T3-T52 HydrophobicContact CG2-CG2 4.31Å
4	I	96.9	Very high	93.9	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.026	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.8	170.7	-61	171.8	0	0	0	106.9	I46 Y51 T52 L53 G54 D76 I173 A176 L177	I4-I46 HydrophobicContact CD1-CD1 4.08Å; I4-Y51 HydrophobicContact CD1-CD1 4.02Å; I4-Y51 HydrophobicContact CG1-CD1 4.22Å; I4-T52 PolarHBondContact N-O 3.25Å; I4-L53 HydrophobicContact CB-CD1 4.03Å; I4-L53 HydrophobicContact CG2-CD1 3.84Å; I4-G54 PolarHBondContact O-N 3.07Å; I4-D76 WeakPolarHBondContact CA-OD2 3.32Å; I4-D76 HydrophobicContact CG2-CB 4.19Å; I4-I173 HydrophobicContact CD1-CB 4.47Å; I4-I173 HydrophobicContact CD1-CG1 4.31Å; I4-I173 HydrophobicContact CD1-CG2 3.98Å; I4-A176 HydrophobicContact CG2-CB 3.65Å; I4-L177 HydrophobicContact CD1-CD1 4.37Å; I4-L177 HydrophobicContact CD1-CD2 4.03Å; I4-L177 HydrophobicContact CD1-CG 4.06Å; I4-L177 HydrophobicContact CG1-CD2 4.49Å
5	K	97.6	Very high	94	Very high	30 Å²	30	35.9 Å²	35.9	13%	0.13	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	113.7	174	176.1	166.3	175.6	-177.2	0	110.3	V7 F56 S71 P73 D76 V77	K5-V7 HydrophobicContact CG-CG2 4.32Å; K5-F56 HydrophobicContact CB-CE2 4.38Å; K5-F56 HydrophobicContact CD-CD2 4.21Å; K5-F56 HydrophobicContact CD-CE1 4.4Å; K5-F56 HydrophobicContact CD-CE2 3.75Å; K5-F56 HydrophobicContact CD-CZ 3.86Å; K5-F56 HydrophobicContact CG-CD2 3.76Å; K5-F56 HydrophobicContact CG-CE2 3.55Å; K5-F56 HydrophobicContact CG-CZ 4.21Å; K5-S71 WeakPolarHBondContact CE-O 3.46Å; K5-S71 PolarHBondContact NZ-O 3.1Å; K5-P73 PolarHBondContact NZ-O 3.25Å; K5-D76 PolarHBondContact N-OD2 3.21Å; K5-D76 PolarHBondContact O-N 3.11Å; K5-V77 PolarHBondContact O-N 2.96Å
6	C	98.2	Very high	94.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	117.4	176.3	175.7	0	0	0	0	110	L53 G54 L55 F56 V77	C6-L53 HydrophobicContact CB-CD1 3.94Å; C6-G54 PolarHBondContact N-O 3.03Å; C6-L55 HydrophobicContact CB-CD2 4.04Å; C6-L55 WeakPolarHBondContact O-CA 3.46Å; C6-F56 PolarHBondContact O-N 3.09Å; C6-V77 WeakPolarHBondContact CA-O 3.38Å; C6-V77 HydrophobicContact CB-CG1 3.9Å
7	V	98.6	Very high	94.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132.8	177.3	178.8	0	0	0	0	110.5	K5 V9 F56 T58 Y72 T75 V77 F78 L79	K5-V7 HydrophobicContact CG-CG2 4.32Å; V7-V9 HydrophobicContact CG1-CG1 4.2Å; V7-F56 HydrophobicContact CB-CB 4.36Å; V7-F56 HydrophobicContact CG1-CB 4.45Å; V7-F56 HydrophobicContact CG2-CB 3.86Å; V7-F56 HydrophobicContact CG2-CG 4.23Å; V7-T58 HydrophobicContact CG1-CG2 3.86Å; V7-Y72 HydrophobicContact CG1-CD1 4.04Å; V7-Y72 HydrophobicContact CG1-CE1 4.01Å; V7-T75 HydrophobicContact CB-CG2 3.95Å; V7-T75 HydrophobicContact CG2-CG2 3.68Å; V7-T75 WeakPolarHBondContact CG2-OG1 3.46Å; V7-V77 PolarHBondContact N-O 3.02Å; V7-V77 VanDerWaalsContact N-O 3.08Å; V7-F78 HydrophobicContact CB-CD1 3.74Å; V7-F78 HydrophobicContact CB-CE1 3.71Å; V7-F78 HydrophobicContact CG1-CD1 4.01Å; V7-F78 HydrophobicContact CG1-CE1 3.82Å; V7-F78 HydrophobicContact CG2-CE1 4.37Å; V7-F78 CarbonylContact O-C 3.54Å; V7-F78 WeakPolarHBondContact O-CA 3.44Å; V7-L79 PolarHBondContact O-N 3Å
8	V	98.5	Very high	94.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124	-179.8	-167.3	0	0	0	0	110.2	K16 L20 F56 T58 L79 C81	V8-K16 HydrophobicContact CG1-CB 3.83Å; V8-K16 HydrophobicContact CG1-CD 3.96Å; V8-K16 HydrophobicContact CG1-CG 3.87Å; V8-L20 HydrophobicContact CG2-CD1 3.97Å; V8-L20 HydrophobicContact CG2-CD2 3.67Å; V8-L20 HydrophobicContact CG2-CG 4.1Å; V8-F56 PolarHBondContact N-O 3.45Å; V8-T58 PolarHBondContact O-OG1 3.05Å; V8-L79 HydrophobicContact CG1-CB 4.19Å; V8-L79 HydrophobicContact CG2-CB 4.28Å; V8-L79 HydrophobicContact CG2-CD1 4.19Å; V8-C81 VanDerWaalsContact CG1-SG 3.57Å
9	V	98.6	Very high	94.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	165.9	178	-59.1	0	0	0	0	110.7	V7 K16 Y72 F78 L79 V80 C81 W97 I101	V7-V9 HydrophobicContact CG1-CG1 4.2Å; V9-K16 VanDerWaalsContact C-CD 3.49Å; V9-Y72 HydrophobicContact CG1-CE1 3.9Å; V9-F78 HydrophobicContact CG1-CD1 4.42Å; V9-L79 PolarHBondContact N-O 3.06Å; V9-V80 HydrophobicContact CG2-CB 4.37Å; V9-V80 HydrophobicContact CG2-CG1 4.44Å; V9-V80 HydrophobicContact CG2-CG2 3.91Å; V9-C81 WeakPolarHBondContact O-CB 3.4Å; V9-C81 PolarHBondContact O-N 3.19Å; V9-W97 HydrophobicContact CB-CE3 3.87Å; V9-W97 HydrophobicContact CB-CZ3 4.21Å; V9-W97 HydrophobicContact CG2-CE3 4.28Å; V9-I101 HydrophobicContact CG1-CG2 4.43Å; V9-I101 HydrophobicContact CG2-CG2 4.04Å
10	G	98.6	Very high	94.6	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	138.5	167.2	-175.3	0	0	0	0	0	111.8	K16 G60 C81 W97	G10-K16 WeakPolarHBondContact O-CE 3.33Å; G10-K16 PolarHBondContact O-NZ 3.37Å; G10-G60 WeakPolarHBondContact O-CA 3.43Å; G10-C81 VanDerWaalsContact CA-O 3.31Å; G10-C81 WeakPolarHBondContact CA-O 3.05Å; G10-W97 VanDerWaalsContact CA-CE2 3.42Å; G10-W97 WeakPolarHBondContact O-CH2 3.44Å; G10-W97 VanDerWaalsContact O-CZ2 3.25Å; G10-W97 WeakPolarHBondContact O-CZ2 3.25Å
11	D	98.3	Very high	94.5	Very high	23 Å²	23	30.3 Å²	30.3	12%	0.123	18%	0.178	C	C	.	.			trans	-54.5	161.1	-176.7	-79.4	19	0	0	0	113.5	V14 K16 S89 N92 W97	D11-V14 HydrophobicContact CB-CG1 3.65Å; D11-V14 VanDerWaalsContact O-CG2 3.25Å; D11-V14 WeakPolarHBondContact O-CG2 3.42Å; D11-K16 PolarHBondContact O-NZ 2.9Å; D11-S89 VanDerWaalsContact OD2-CA 3.29Å; D11-S89 WeakPolarHBondContact OD2-CA 3.41Å; D11-N92 WeakPolarHBondContact OD1-CB 3.48Å; D11-N92 PolarHBondContact OD1-ND2 2.63Å; D11-N92 PolarHBondContact OD2-ND2 2.93Å; D11-W97 PolarHBondContact OD1-NE1 3.2Å
12	G	94.9	Very high	96.1	Very high	31 Å²	31	22.8 Å²	22.8	32%	0.32	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	148	167.2	0	0	0	0	0	111.6	V14	G12-V14 PolarHBondContact O-N 3.27Å
13	A	94.6	Very high	96.4	Very high	65 Å²	65	18.9 Å²	18.9	54%	0.537	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	7.7	175.2	0	0	0	0	0	117.5	G15 Q116	A13-G15 PolarHBondContact O-N 2.94Å; A13-Q116 PolarHBondContact O-NE2 2.97Å
14	V	97.6	Very high	96.4	Very high	4 Å²	4	16.5 Å²	16.5	2%	0.024	11%	0.107	C	C	.	.	S	Bend	trans	-77.2	8.4	173.8	-54	0	0	0	0	113.8	D11 G12 K16 C81 T115	D11-V14 HydrophobicContact CB-CG1 3.65Å; D11-V14 VanDerWaalsContact O-CG2 3.25Å; D11-V14 WeakPolarHBondContact O-CG2 3.42Å; G12-V14 PolarHBondContact O-N 3.27Å; V14-K16 HydrophobicContact CG2-CD 4.44Å; V14-K16 HydrophobicContact CG2-CG 3.81Å; V14-C81 HydrophobicContact CG2-CB 4.06Å; V14-T115 VanDerWaalsContact O-CB 3.31Å; V14-T115 WeakPolarHBondContact O-CB 3.34Å; V14-T115 PolarHBondContact O-OG1 2.99Å
15	G	96.3	Very high	96	Very high	14 Å²	14	19.6 Å²	19.6	14%	0.144	13%	0.126	C	C	.	.	S	Bend	trans	83	21.8	173.9	0	0	0	0	0	116.4	A13 C18 L19	A13-G15 PolarHBondContact O-N 2.94Å; G15-C18 PolarHBondContact O-N 2.97Å; G15-L19 WeakPolarHBondContact O-CB 3.33Å; G15-L19 PolarHBondContact O-N 3.24Å
16	K	97.4	Very high	95.6	Very high	11 Å²	11	23.9 Å²	23.9	5%	0.048	15%	0.151	C	C	.	.	H	α-helix	trans	-54.9	-52.2	174	-58.8	-171.8	-57.6	-77.5	0	112.2	V8 V9 G10 D11 V14 C18 L19 L20 T58 C81	V8-K16 HydrophobicContact CG1-CB 3.83Å; V8-K16 HydrophobicContact CG1-CD 3.96Å; V8-K16 HydrophobicContact CG1-CG 3.87Å; V9-K16 VanDerWaalsContact C-CD 3.49Å; G10-K16 WeakPolarHBondContact O-CE 3.33Å; G10-K16 PolarHBondContact O-NZ 3.37Å; D11-K16 PolarHBondContact O-NZ 2.9Å; V14-K16 HydrophobicContact CG2-CD 4.44Å; V14-K16 HydrophobicContact CG2-CG 3.81Å; K16-C18 PolarHBondContact O-N 3.46Å; K16-L19 WeakPolarHBondContact O-CB 3.15Å; K16-L19 PolarHBondContact O-N 3.03Å; K16-L20 WeakPolarHBondContact O-CG 3.25Å; K16-L20 PolarHBondContact O-N 3.28Å; K16-L20 VanDerWaalsContact O-N 3.08Å; K16-T58 WeakPolarHBondContact CE-O 3.42Å; K16-C81 HydrophobicContact CG-CB 3.99Å
17	T	95.6	Very high	95.1	Very high	27 Å²	27	31.2 Å²	31.2	17%	0.166	18%	0.183	C	C	.	.	H	α-helix	trans	-64	-42.9	179	-43.6	0	0	0	0	111.8	L19 L20 I21 T35 D57	T17-L19 VanDerWaalsContact C-N 3.32Å; T17-L19 PolarHBondContact O-N 3.07Å; T17-L20 PolarHBondContact O-N 2.82Å; T17-I21 HydrophobicContact CG2-CD1 3.75Å; T17-I21 HydrophobicContact CG2-CG1 4.37Å; T17-I21 WeakPolarHBondContact O-CB 3.46Å; T17-I21 WeakPolarHBondContact O-CG1 3.45Å; T17-I21 PolarHBondContact O-N 3.33Å; T17-T35 PolarHBondContact OG1-OG1 3.19Å; T17-D57 WeakPolarHBondContact CA-OD2 3.49Å; T17-D57 VanDerWaalsContact CB-OD2 3.25Å; T17-D57 WeakPolarHBondContact CB-OD2 3.35Å; T17-D57 WeakPolarHBondContact CG2-OD2 3.34Å; T17-D57 PolarHBondContact OG1-OD2 3.26Å
18	C	95.5	Very high	94.5	Very high	22 Å²	22	35.5 Å²	35.5	15%	0.149	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-40.9	176.1	-58.8	0	0	0	0	111.9	G15 K16 S22 F28 P29 A159	G15-C18 PolarHBondContact O-N 2.97Å; K16-C18 PolarHBondContact O-N 3.46Å; C18-S22 WeakPolarHBondContact O-CB 3.2Å; C18-S22 PolarHBondContact O-N 3.33Å; C18-S22 PolarHBondContact O-OG 3.15Å; C18-F28 HydrophobicContact CB-CD2 4.37Å; C18-F28 HydrophobicContact CB-CE2 3.69Å; C18-F28 HydrophobicContact CB-CZ 4.24Å; C18-P29 HydrophobicContact CB-CG 4.29Å; C18-A159 HydrophobicContact CB-CB 3.87Å
19	L	96.5	Very high	93.8	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-57.4	-51.1	174.8	170.9	77.8	0	0	0	110.4	G15 K16 T17 Y23 L79 C157 L165 V168 F169	G15-L19 WeakPolarHBondContact O-CB 3.33Å; G15-L19 PolarHBondContact O-N 3.24Å; K16-L19 WeakPolarHBondContact O-CB 3.15Å; K16-L19 PolarHBondContact O-N 3.03Å; T17-L19 VanDerWaalsContact C-N 3.32Å; T17-L19 PolarHBondContact O-N 3.07Å; L19-Y23 WeakPolarHBondContact O-CB 3.28Å; L19-Y23 PolarHBondContact O-N 3.18Å; L19-Y23 VanDerWaalsContact O-N 3.17Å; L19-L79 HydrophobicContact CD2-CD1 4.19Å; L19-C157 VanDerWaalsContact CD1-SG 3.5Å; L19-L165 HydrophobicContact CD1-CD1 3.37Å; L19-L165 HydrophobicContact CG-CD1 4.32Å; L19-V168 HydrophobicContact CD1-CG1 4.44Å; L19-V168 HydrophobicContact CD1-CG2 4.47Å; L19-V168 HydrophobicContact CD2-CG1 4.44Å; L19-F169 HydrophobicContact CD1-CE2 4.05Å; L19-F169 HydrophobicContact CD1-CZ 4.3Å; L19-F169 HydrophobicContact CD2-CZ 4.35Å; L19-F169 HydrophobicContact CG-CE2 4.17Å; L19-F169 HydrophobicContact CG-CZ 3.91Å
20	L	95.8	Very high	92.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.4	-53.8	-179.1	-65.2	-177.9	0	0	0	112	V8 K16 T17 S22 Y23 T24 Y40 L55 D57 F169	V8-L20 HydrophobicContact CG2-CD1 3.97Å; V8-L20 HydrophobicContact CG2-CD2 3.67Å; V8-L20 HydrophobicContact CG2-CG 4.1Å; K16-L20 WeakPolarHBondContact O-CG 3.25Å; K16-L20 PolarHBondContact O-N 3.28Å; K16-L20 VanDerWaalsContact O-N 3.08Å; T17-L20 PolarHBondContact O-N 2.82Å; L20-S22 VanDerWaalsContact C-N 3.33Å; L20-S22 PolarHBondContact O-N 3.2Å; L20-Y23 PolarHBondContact O-N 2.97Å; L20-Y23 VanDerWaalsContact O-N 3.15Å; L20-T24 WeakPolarHBondContact O-CG2 3.21Å; L20-T24 PolarHBondContact O-N 3.36Å; L20-T24 PolarHBondContact O-OG1 2.78Å; L20-Y40 HydrophobicContact CB-CD2 4.21Å; L20-Y40 HydrophobicContact CB-CE2 4.2Å; L20-Y40 HydrophobicContact CD1-CD2 4.18Å; L20-Y40 HydrophobicContact CD1-CE2 4.18Å; L20-L55 HydrophobicContact CD2-CB 3.9Å; L20-L55 HydrophobicContact CD2-CD1 4.07Å; L20-L55 HydrophobicContact CD2-CD2 4.11Å; L20-L55 HydrophobicContact CD2-CG 4.24Å; L20-D57 HydrophobicContact CD1-CB 3.45Å; L20-D57 VanDerWaalsContact CD1-CB 3.45Å; L20-F169 HydrophobicContact CD2-CE1 3.86Å; L20-F169 HydrophobicContact CD2-CZ 3.89Å
21	I	93.1	Very high	91.7	Very high	37 Å²	37	50.1 Å²	50.1	19%	0.19	29%	0.286	C	S	.	.	H	α-helix	trans	-60.7	-42.5	-178.4	-67.5	175.4	0	0	0	111.3	T17 Y23 T24 T25 P29 Y40	T17-I21 HydrophobicContact CG2-CD1 3.75Å; T17-I21 HydrophobicContact CG2-CG1 4.37Å; T17-I21 WeakPolarHBondContact O-CB 3.46Å; T17-I21 WeakPolarHBondContact O-CG1 3.45Å; T17-I21 PolarHBondContact O-N 3.33Å; I21-Y23 VanDerWaalsContact C-N 3.26Å; I21-Y23 PolarHBondContact O-N 3.4Å; I21-T24 PolarHBondContact O-N 3.26Å; I21-T24 PolarHBondContact O-OG1 3.01Å; I21-T25 HydrophobicContact CG2-CG2 4.22Å; I21-T25 WeakPolarHBondContact O-CB 3.37Å; I21-T25 WeakPolarHBondContact O-CG2 3.49Å; I21-T25 PolarHBondContact O-N 3.47Å; I21-T25 PolarHBondContact O-OG1 3.14Å; I21-P29 HydrophobicContact CB-CG 4.5Å; I21-P29 HydrophobicContact CD1-CB 4.28Å; I21-P29 HydrophobicContact CD1-CG 4.39Å; I21-P29 HydrophobicContact CG2-CB 4.25Å; I21-P29 HydrophobicContact CG2-CG 4.37Å; I21-Y40 HydrophobicContact CG1-CE1 4.4Å
22	S	94.5	Very high	90.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.4	-36.4	-179.8	-57.1	0	0	0	0	111.4	C18 L20 N26 K27 A159	C18-S22 WeakPolarHBondContact O-CB 3.2Å; C18-S22 PolarHBondContact O-N 3.33Å; C18-S22 PolarHBondContact O-OG 3.15Å; L20-S22 VanDerWaalsContact C-N 3.33Å; L20-S22 PolarHBondContact O-N 3.2Å; S22-N26 WeakPolarHBondContact O-CA 3.32Å; S22-N26 PolarHBondContact O-N 2.94Å; S22-K27 VanDerWaalsContact CA-O 3.31Å; S22-K27 WeakPolarHBondContact CA-O 3.46Å; S22-A159 PolarHBondContact OG-O 3.01Å
23	Y	94.6	Very high	89.3	Confident	37 Å²	37	59.1 Å²	59.1	15%	0.145	32%	0.32	C	S	.	.	H	α-helix	trans	-70.8	-41.9	177.8	176.7	-110.8	0	0	0	112.1	L19 L20 I21 V42 L53 L55 F169	L19-Y23 WeakPolarHBondContact O-CB 3.28Å; L19-Y23 PolarHBondContact O-N 3.18Å; L19-Y23 VanDerWaalsContact O-N 3.17Å; L20-Y23 PolarHBondContact O-N 2.97Å; L20-Y23 VanDerWaalsContact O-N 3.15Å; I21-Y23 VanDerWaalsContact C-N 3.26Å; I21-Y23 PolarHBondContact O-N 3.4Å; Y23-V42 HydrophobicContact CE1-CG2 3.75Å; Y23-L53 HydrophobicContact CE1-CD2 4.04Å; Y23-L55 HydrophobicContact CD1-CD1 3.93Å; Y23-L55 HydrophobicContact CE1-CD1 4.28Å; Y23-F169 HydrophobicContact CD1-CD1 4.02Å; Y23-F169 AromaticContact CD1-CD2 3.7Å; Y23-F169 HydrophobicContact CD1-CD2 3.7Å; Y23-F169 HydrophobicContact CD1-CE1 4Å; Y23-F169 AromaticContact CD1-CE2 3.71Å; Y23-F169 HydrophobicContact CD1-CE2 3.71Å; Y23-F169 AromaticContact CD1-CG 3.85Å; Y23-F169 HydrophobicContact CD1-CG 3.85Å; Y23-F169 AromaticContact CD1-CZ 3.83Å; Y23-F169 HydrophobicContact CD1-CZ 3.83Å; Y23-F169 HydrophobicContact CD2-CB 4.45Å; Y23-F169 AromaticContact CD2-CD2 3.27Å; Y23-F169 HydrophobicContact CD2-CD2 3.27Å; Y23-F169 AromaticContact CD2-CE2 3.65Å; Y23-F169 HydrophobicContact CD2-CE2 3.65Å; Y23-F169 AromaticContact CD2-CG 3.98Å; Y23-F169 HydrophobicContact CD2-CG 3.98Å; Y23-F169 HydrophobicContact CE1-CB 4.06Å; Y23-F169 AromaticContact CE1-CD1 3.96Å; Y23-F169 HydrophobicContact CE1-CD1 3.96Å; Y23-F169 AromaticContact CE1-CD2 3.95Å; Y23-F169 HydrophobicContact CE1-CD2 3.95Å; Y23-F169 HydrophobicContact CE1-CE1 4.38Å; Y23-F169 HydrophobicContact CE1-CE2 4.4Å; Y23-F169 AromaticContact CE1-CG 3.7Å; Y23-F169 HydrophobicContact CE1-CG 3.7Å; Y23-F169 HydrophobicContact CE2-CB 3.85Å; Y23-F169 AromaticContact CE2-CD2 3.56Å; Y23-F169 HydrophobicContact CE2-CD2 3.56Å; Y23-F169 HydrophobicContact CE2-CE2 4.36Å; Y23-F169 AromaticContact CE2-CG 3.84Å; Y23-F169 HydrophobicContact CE2-CG 3.84Å; Y23-F169 HydrophobicContact CG-CD1 4.49Å; Y23-F169 AromaticContact CG-CD2 3.34Å; Y23-F169 HydrophobicContact CG-CD2 3.34Å; Y23-F169 HydrophobicContact CG-CE1 4.41Å; Y23-F169 AromaticContact CG-CE2 3.27Å; Y23-F169 HydrophobicContact CG-CE2 3.27Å; Y23-F169 AromaticContact CG-CG 3.98Å; Y23-F169 HydrophobicContact CG-CG 3.98Å; Y23-F169 AromaticContact CG-CZ 3.82Å; Y23-F169 HydrophobicContact CG-CZ 3.82Å; Y23-F169 AromaticContact CZ-CD2 3.89Å; Y23-F169 AromaticContact CZ-CG 3.7Å
24	T	92	Very high	88.4	Confident	39 Å²	39	59.5 Å²	59.5	24%	0.239	32%	0.317	C	S	.	.	H	α-helix	trans	-78.9	-26.7	-177.3	61.6	0	0	0	0	113.6	L20 I21 V42 L55	L20-T24 WeakPolarHBondContact O-CG2 3.21Å; L20-T24 PolarHBondContact O-N 3.36Å; L20-T24 PolarHBondContact O-OG1 2.78Å; I21-T24 PolarHBondContact O-N 3.26Å; I21-T24 PolarHBondContact O-OG1 3.01Å; T24-V42 HydrophobicContact CG2-CG1 3.59Å; T24-L55 HydrophobicContact CG2-CD1 3.64Å
25	T	90.1	Very high	87.5	Confident	71 Å²	71	59.9 Å²	59.9	44%	0.436	32%	0.32	S	S	.	.	H	α-helix	trans	-113.9	-6.5	-173.6	70.3	0	0	0	0	114.5	I21 K27	I21-T25 HydrophobicContact CG2-CG2 4.22Å; I21-T25 WeakPolarHBondContact O-CB 3.37Å; I21-T25 WeakPolarHBondContact O-CG2 3.49Å; I21-T25 PolarHBondContact O-N 3.47Å; I21-T25 PolarHBondContact O-OG1 3.14Å; T25-K27 PolarHBondContact O-N 2.87Å; T25-K27 PolarHBondContact OG1-N 2.89Å; T25-K27 PolarHBondContact OG1-O 3.21Å
26	N	88.5	Confident	86.4	Confident	120 Å²	120	62.4 Å²	62.4	64%	0.642	33%	0.332	S	S	*	.	S	Bend	trans	53.9	26.6	-169.3	-64.5	-54.7	0	0	0	113.4	S22 Q162	S22-N26 WeakPolarHBondContact O-CA 3.32Å; S22-N26 PolarHBondContact O-N 2.94Å; N26-Q162 PolarHBondContact O-NE2 2.89Å
27	K	87.3	Confident	84.8	Confident	154 Å²	154	65 Å²	65	67%	0.67	34%	0.344	S	S	*	.	S	Bend	trans	-140.9	139.4	179.2	-67.1	-176.8	-178.5	-179.9	0	111.2	S22 T25	S22-K27 VanDerWaalsContact CA-O 3.31Å; S22-K27 WeakPolarHBondContact CA-O 3.46Å; T25-K27 PolarHBondContact O-N 2.87Å; T25-K27 PolarHBondContact OG1-N 2.89Å; T25-K27 PolarHBondContact OG1-O 3.21Å
28	F	86	Confident	84.2	Confident	89 Å²	89	67.4 Å²	67.4	39%	0.39	36%	0.356	S	S	.	.			trans	-74.2	134.4	171.2	-169.5	-97.8	0	0	0	110.2	C18 S30 A159 L160	C18-F28 HydrophobicContact CB-CD2 4.37Å; C18-F28 HydrophobicContact CB-CE2 3.69Å; C18-F28 HydrophobicContact CB-CZ 4.24Å; F28-S30 PolarHBondContact O-N 3.13Å; F28-A159 HydrophobicContact CD2-CB 3.99Å; F28-A159 HydrophobicContact CE2-CB 3.92Å; F28-L160 HydrophobicContact CB-CD1 4.38Å; F28-L160 HydrophobicContact CD1-CD1 3.93Å; F28-L160 VanDerWaalsContact CD2-CA 3.44Å; F28-L160 HydrophobicContact CD2-CB 4.07Å; F28-L160 HydrophobicContact CD2-CD1 4.3Å; F28-L160 HydrophobicContact CE1-CD1 4.25Å; F28-L160 HydrophobicContact CE2-CB 4.06Å; F28-L160 HydrophobicContact CG-CD1 3.94Å
29	P	83.9	Confident	83.6	Confident	27 Å²	27	71.4 Å²	71.4	18%	0.175	38%	0.375	C	S	.	.			trans	-66.4	133	178.5	26.4	-33.2	0	0	0	111.3	C18 I21	C18-P29 HydrophobicContact CB-CG 4.29Å; I21-P29 HydrophobicContact CB-CG 4.5Å; I21-P29 HydrophobicContact CD1-CB 4.28Å; I21-P29 HydrophobicContact CD1-CG 4.39Å; I21-P29 HydrophobicContact CG2-CB 4.25Å; I21-P29 HydrophobicContact CG2-CG 4.37Å
30	S	75.7	Confident	83.2	Confident	124 Å²	124	74.1 Å²	74.1	87%	0.867	39%	0.386	S	S	*	.	S	Bend	trans	-81.2	-19.5	179.4	52.4	0	0	0	0	113.9	F28	F28-S30 PolarHBondContact O-N 3.13Å
31	E	77.4	Confident	83	Confident	156 Å²	156	77.6 Å²	77.6	73%	0.729	42%	0.415	S	S	*	.	S	Bend	trans	-119.6	137	-178.7	-66.3	-178.4	-171.7	0	0	110.3
32	Y	68.3	Low	83	Confident	141 Å²	141	77.3 Å²	77.3	55%	0.553	42%	0.415	S	S	*	.			trans	-94	110.1	173.6	-179.6	-104.7	0	0	0	109.9	P34	Y32-P34 HydrophobicContact CD1-CG 4.45Å; Y32-P34 HydrophobicContact CE1-CG 3.86Å
33	V	75.4	Confident	83	Confident	102 Å²	102	81.8 Å²	81.8	62%	0.618	44%	0.442	S	S	*	.			trans	-111.9	120.1	169.8	-178	0	0	0	0	107.4	T35	V33-T35 PolarHBondContact O-N 3.42Å
34	P	75.3	Confident	82.9	Confident	73 Å²	73	81 Å²	81	47%	0.474	44%	0.442	S	S	.	.			trans	-59.6	124.1	176.7	-23.5	32.6	0	0	0	111.9	Y32	Y32-P34 HydrophobicContact CD1-CG 4.45Å; Y32-P34 HydrophobicContact CE1-CG 3.86Å
35	T	79	Confident	82.8	Confident	13 Å²	13	85.2 Å²	85.2	8%	0.08	46%	0.46	C	S	.	.			trans	-72.8	135.8	179.4	-55.5	0	0	0	0	112.1	T17 V33 D57 A59	T17-T35 PolarHBondContact OG1-OG1 3.19Å; V33-T35 PolarHBondContact O-N 3.42Å; T35-D57 HydrophobicContact CG2-CB 4.01Å; T35-D57 WeakPolarHBondContact CG2-OD2 3.49Å; T35-D57 PolarHBondContact OG1-OD2 3.41Å; T35-A59 WeakPolarHBondContact O-CB 3.49Å
36	V	72	Confident	82.7	Confident	67 Å²	67	83.7 Å²	83.7	41%	0.406	45%	0.449	S	S	.	.	S	Bend	trans	-94.8	-63.9	162.8	178.4	0	0	0	0	108.8	A59 Y64	V36-A59 PolarHBondContact O-N 3.03Å; V36-Y64 HydrophobicContact CB-CE1 4.35Å; V36-Y64 HydrophobicContact CG1-CD1 4.17Å; V36-Y64 HydrophobicContact CG1-CE1 3.58Å; V36-Y64 HydrophobicContact CG2-CE1 4.19Å
37	F	64.8	Low	82.6	Confident	65 Å²	65	82.1 Å²	82.1	29%	0.285	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	139.8	166.7	-72.1	-74.6	0	0	0	109.5	T58 L67 S71	F37-T58 HydrophobicContact CD1-CG2 4.35Å; F37-T58 HydrophobicContact CE1-CG2 4.13Å; F37-L67 HydrophobicContact CE2-CB 4.03Å; F37-L67 HydrophobicContact CZ-CB 4.17Å; F37-S71 WeakPolarHBondContact CD1-OG 3.47Å; F37-S71 WeakPolarHBondContact CE1-OG 3.4Å
38	D	81.7	Confident	82.7	Confident	78 Å²	78	77.5 Å²	77.5	42%	0.417	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147	170	-84.9	-53.4	0	0	0	110.4	Y40 D57	D38-Y40 HydrophobicContact CB-CE2 3.85Å; D38-D57 HydrophobicContact CB-CB 4.26Å; D38-D57 PolarHBondContact N-O 3.47Å; D38-D57 PolarHBondContact O-N 2.73Å
39	N	84.2	Confident	82.9	Confident	105 Å²	105	79.2 Å²	79.2	56%	0.561	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	124.3	178	-63.5	-38	0	0	0	109.6	L55 F56	N39-L55 CarbonylContact C-O 3.55Å; N39-L55 WeakPolarHBondContact CA-O 3.49Å; N39-F56 WeakPolarHBondContact OD1-CD1 3.41Å; N39-F56 WeakPolarHBondContact OD1-CE1 3.46Å; N39-F56 WeakPolarHBondContact OD1-CG 3.43Å
40	Y	88.7	Confident	83.3	Confident	58 Å²	58	80.5 Å²	80.5	23%	0.227	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	154.4	173.6	-47.9	-89.4	0	0	0	109.7	L20 I21 D38 L55 D57	L20-Y40 HydrophobicContact CB-CD2 4.21Å; L20-Y40 HydrophobicContact CB-CE2 4.2Å; L20-Y40 HydrophobicContact CD1-CD2 4.18Å; L20-Y40 HydrophobicContact CD1-CE2 4.18Å; I21-Y40 HydrophobicContact CG1-CE1 4.4Å; D38-Y40 HydrophobicContact CB-CE2 3.85Å; Y40-L55 PolarHBondContact N-O 3.13Å; Y40-L55 PolarHBondContact O-N 3.31Å; Y40-D57 HydrophobicContact CE2-CB 4.33Å
41	A	91.5	Very high	84.2	Confident	74 Å²	74	76 Å²	76	61%	0.612	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.1	174.4	0	0	0	0	0	109.7	T52 L53	A41-T52 HydrophobicContact CB-CG2 4.19Å; A41-L53 WeakPolarHBondContact CA-O 3.39Å
42	V	93	Very high	85.1	Confident	31 Å²	31	69.9 Å²	69.9	19%	0.188	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148.2	172.3	-64	0	0	0	0	110.3	Y23 T24 V44 L53	Y23-V42 HydrophobicContact CE1-CG2 3.75Å; T24-V42 HydrophobicContact CG2-CG1 3.59Å; V42-V44 HydrophobicContact CG2-CG1 4.18Å; V42-L53 HydrophobicContact CG2-CB 4Å; V42-L53 HydrophobicContact CG2-CD2 4.35Å; V42-L53 PolarHBondContact N-O 3.49Å; V42-L53 VanDerWaalsContact N-O 3.09Å; V42-L53 PolarHBondContact O-N 3.37Å
43	T	93.1	Very high	86.4	Confident	94 Å²	94	63.2 Å²	63.2	58%	0.577	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	126.1	172.5	-57.7	0	0	0	0	109.1	P50 Y51	T43-P50 HydrophobicContact CG2-CB 4.13Å; T43-Y51 CarbonylContact C-O 3.6Å; T43-Y51 WeakPolarHBondContact CA-O 3.36Å
44	V	92.1	Very high	87.5	Confident	21 Å²	21	58.8 Å²	58.8	13%	0.127	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	146.6	177.2	-62.5	0	0	0	0	110.1	V42 I46 Y51 L53 I173	V42-V44 HydrophobicContact CG2-CG1 4.18Å; V44-I46 HydrophobicContact CG2-CD1 4.15Å; V44-I46 HydrophobicContact CG2-CG1 4.2Å; V44-Y51 PolarHBondContact N-O 3.39Å; V44-Y51 PolarHBondContact O-N 3.34Å; V44-L53 HydrophobicContact CG2-CB 4.44Å; V44-I173 HydrophobicContact CB-CD1 4.43Å; V44-I173 HydrophobicContact CG1-CD1 4.42Å; V44-I173 HydrophobicContact CG2-CD1 3.91Å
45	M	91.1	Very high	88.5	Confident	126 Å²	126	55.3 Å²	55.3	62%	0.621	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.4	177.9	-62.6	-59.2	-65.8	0	0	109.7	G48 E49 P50	M45-G48 WeakPolarHBondContact CE-O 3.48Å; M45-E49 WeakPolarHBondContact CA-O 3.49Å; M45-P50 HydrophobicContact SD-CB 3.95Å
46	I	87.8	Confident	89.3	Confident	39 Å²	39	56.8 Å²	56.8	20%	0.2	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	115.6	-179.6	-51.9	173.6	0	0	0	108	I4 V44 G48 E49 Y51 I173 L177	I4-I46 HydrophobicContact CD1-CD1 4.08Å; V44-I46 HydrophobicContact CG2-CD1 4.15Å; V44-I46 HydrophobicContact CG2-CG1 4.2Å; I46-G48 PolarHBondContact O-N 3.48Å; I46-G48 VanDerWaalsContact O-N 3.14Å; I46-E49 PolarHBondContact N-O 3.16Å; I46-E49 PolarHBondContact O-N 2.75Å; I46-Y51 HydrophobicContact CB-CD2 3.8Å; I46-Y51 HydrophobicContact CB-CE2 3.85Å; I46-Y51 HydrophobicContact CD1-CD1 4.07Å; I46-Y51 HydrophobicContact CD1-CD2 3.67Å; I46-Y51 HydrophobicContact CD1-CE2 4.19Å; I46-Y51 HydrophobicContact CD1-CG 3.62Å; I46-Y51 HydrophobicContact CG1-CD2 3.9Å; I46-Y51 HydrophobicContact CG1-CE2 4.41Å; I46-Y51 HydrophobicContact CG1-CG 4.29Å; I46-I173 HydrophobicContact CD1-CG2 3.26Å; I46-I173 HydrophobicContact CG1-CG2 4.13Å; I46-L177 HydrophobicContact CD1-CD1 3.78Å; I46-L177 HydrophobicContact CG2-CD1 3.88Å
47	G	86.1	Confident	90.5	Very high	87 Å²	87	53.6 Å²	53.6	90%	0.897	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	24.8	-177.1	0	0	0	0	0	114.1	E49	G47-E49 VanDerWaalsContact C-N 3.33Å
48	G	88.8	Confident	91.9	Very high	57 Å²	57	50.5 Å²	50.5	59%	0.588	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	-5.1	-175.4	0	0	0	0	0	114.9	M45 I46	M45-G48 WeakPolarHBondContact CE-O 3.48Å; I46-G48 PolarHBondContact O-N 3.48Å; I46-G48 VanDerWaalsContact O-N 3.14Å
49	E	90.6	Very high	92.4	Very high	126 Å²	126	46.8 Å²	46.8	59%	0.589	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	141	178.2	-68.8	-62.9	142.1	0	0	111.6	M45 I46 G47 Y51	M45-E49 WeakPolarHBondContact CA-O 3.49Å; I46-E49 PolarHBondContact N-O 3.16Å; I46-E49 PolarHBondContact O-N 2.75Å; G47-E49 VanDerWaalsContact C-N 3.33Å; E49-Y51 HydrophobicContact CB-CD2 4.47Å; E49-Y51 HydrophobicContact CB-CE2 3.92Å; E49-Y51 WeakPolarHBondContact O-CD2 3.31Å
50	P	93.3	Very high	92.7	Very high	54 Å²	54	42.1 Å²	42.1	35%	0.351	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	128.9	178.1	31.4	-33.1	0	0	0	112.2	T43 M45	T43-P50 HydrophobicContact CG2-CB 4.13Å; M45-P50 HydrophobicContact SD-CB 3.95Å
51	Y	94.4	Very high	92.8	Very high	30 Å²	30	42 Å²	42	12%	0.118	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145.7	173.7	-74.5	-111	0	0	0	110.5	Q2 I4 T43 V44 I46 E49 L177	Q2-Y51 HydrophobicContact CB-CD1 3.51Å; Q2-Y51 HydrophobicContact CB-CE1 3.41Å; Q2-Y51 VanDerWaalsContact CB-CE1 3.41Å; Q2-Y51 HydrophobicContact CB-CG 4.36Å; Q2-Y51 HydrophobicContact CG-CE1 4.08Å; Q2-Y51 PolarHBondContact NE2-OH 2.91Å; Q2-Y51 WeakPolarHBondContact O-CA 3.5Å; Q2-Y51 VanDerWaalsContact OE1-CE1 3.3Å; Q2-Y51 PolarHBondContact OE1-OH 2.98Å; I4-Y51 HydrophobicContact CD1-CD1 4.02Å; I4-Y51 HydrophobicContact CG1-CD1 4.22Å; T43-Y51 CarbonylContact C-O 3.6Å; T43-Y51 WeakPolarHBondContact CA-O 3.36Å; V44-Y51 PolarHBondContact N-O 3.39Å; V44-Y51 PolarHBondContact O-N 3.34Å; I46-Y51 HydrophobicContact CB-CD2 3.8Å; I46-Y51 HydrophobicContact CB-CE2 3.85Å; I46-Y51 HydrophobicContact CD1-CD1 4.07Å; I46-Y51 HydrophobicContact CD1-CD2 3.67Å; I46-Y51 HydrophobicContact CD1-CE2 4.19Å; I46-Y51 HydrophobicContact CD1-CG 3.62Å; I46-Y51 HydrophobicContact CG1-CD2 3.9Å; I46-Y51 HydrophobicContact CG1-CE2 4.41Å; I46-Y51 HydrophobicContact CG1-CG 4.29Å; E49-Y51 HydrophobicContact CB-CD2 4.47Å; E49-Y51 HydrophobicContact CB-CE2 3.92Å; E49-Y51 WeakPolarHBondContact O-CD2 3.31Å; Y51-L177 HydrophobicContact CE1-CD2 3.95Å
52	T	95.7	Very high	92.7	Very high	27 Å²	27	45.4 Å²	45.4	17%	0.166	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	118.7	166.1	-59.1	0	0	0	0	109.4	M1 Q2 T3 I4 A41	M1-T52 WeakPolarHBondContact CE-OG1 3.42Å; Q2-T52 PolarHBondContact O-N 3.22Å; T3-T52 CarbonylContact C-O 3.55Å; T3-T52 VanDerWaalsContact CA-O 3.31Å; T3-T52 WeakPolarHBondContact CA-O 3.31Å; T3-T52 HydrophobicContact CG2-CG2 4.31Å; I4-T52 PolarHBondContact N-O 3.25Å; A41-T52 HydrophobicContact CB-CG2 4.19Å
53	L	96.2	Very high	92.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	106.6	166.6	-177.7	63.5	0	0	0	108.8	I4 C6 Y23 A41 V42 V44 L55 F169 I173	I4-L53 HydrophobicContact CB-CD1 4.03Å; I4-L53 HydrophobicContact CG2-CD1 3.84Å; C6-L53 HydrophobicContact CB-CD1 3.94Å; Y23-L53 HydrophobicContact CE1-CD2 4.04Å; A41-L53 WeakPolarHBondContact CA-O 3.39Å; V42-L53 HydrophobicContact CG2-CB 4Å; V42-L53 HydrophobicContact CG2-CD2 4.35Å; V42-L53 PolarHBondContact N-O 3.49Å; V42-L53 VanDerWaalsContact N-O 3.09Å; V42-L53 PolarHBondContact O-N 3.37Å; V44-L53 HydrophobicContact CG2-CB 4.44Å; L53-L55 HydrophobicContact CD1-CD2 4.29Å; L53-L55 HydrophobicContact CD2-CD2 3.78Å; L53-L55 HydrophobicContact CD2-CG 4.47Å; L53-L55 HydrophobicContact CG-CD2 3.7Å; L53-L55 HydrophobicContact CG-CG 4.21Å; L53-F169 HydrophobicContact CD2-CB 4.34Å; L53-F169 HydrophobicContact CD2-CD1 4.04Å; L53-I173 HydrophobicContact CD1-CG1 4.26Å; L53-I173 HydrophobicContact CD2-CD1 4.19Å; L53-I173 HydrophobicContact CD2-CG1 4.33Å
54	G	97.2	Very high	92.6	Very high	9 Å²	9	49.6 Å²	49.6	9%	0.093	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	119.8	171.9	0	0	0	0	0	110.3	I4 C6	I4-G54 PolarHBondContact O-N 3.07Å; C6-G54 PolarHBondContact N-O 3.03Å
55	L	96.8	Very high	92.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116	-175.8	-58.9	172.3	0	0	0	109.2	C6 L20 Y23 T24 N39 Y40 L53 F169	C6-L55 HydrophobicContact CB-CD2 4.04Å; C6-L55 WeakPolarHBondContact O-CA 3.46Å; L20-L55 HydrophobicContact CD2-CB 3.9Å; L20-L55 HydrophobicContact CD2-CD1 4.07Å; L20-L55 HydrophobicContact CD2-CD2 4.11Å; L20-L55 HydrophobicContact CD2-CG 4.24Å; Y23-L55 HydrophobicContact CD1-CD1 3.93Å; Y23-L55 HydrophobicContact CE1-CD1 4.28Å; T24-L55 HydrophobicContact CG2-CD1 3.64Å; N39-L55 CarbonylContact C-O 3.55Å; N39-L55 WeakPolarHBondContact CA-O 3.49Å; Y40-L55 PolarHBondContact N-O 3.13Å; Y40-L55 PolarHBondContact O-N 3.31Å; L53-L55 HydrophobicContact CD1-CD2 4.29Å; L53-L55 HydrophobicContact CD2-CD2 3.78Å; L53-L55 HydrophobicContact CD2-CG 4.47Å; L53-L55 HydrophobicContact CG-CD2 3.7Å; L53-L55 HydrophobicContact CG-CG 4.21Å; L55-F169 HydrophobicContact CD1-CE1 4.26Å; L55-F169 HydrophobicContact CD2-CD1 3.9Å; L55-F169 HydrophobicContact CD2-CE1 3.61Å
56	F	96.8	Very high	92.7	Very high	44 Å²	44	56 Å²	56	19%	0.193	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	104.8	-176.4	-70.5	-111.5	0	0	0	108.8	K5 C6 V7 V8 N39	K5-F56 HydrophobicContact CB-CE2 4.38Å; K5-F56 HydrophobicContact CD-CD2 4.21Å; K5-F56 HydrophobicContact CD-CE1 4.4Å; K5-F56 HydrophobicContact CD-CE2 3.75Å; K5-F56 HydrophobicContact CD-CZ 3.86Å; K5-F56 HydrophobicContact CG-CD2 3.76Å; K5-F56 HydrophobicContact CG-CE2 3.55Å; K5-F56 HydrophobicContact CG-CZ 4.21Å; C6-F56 PolarHBondContact O-N 3.09Å; V7-F56 HydrophobicContact CB-CB 4.36Å; V7-F56 HydrophobicContact CG1-CB 4.45Å; V7-F56 HydrophobicContact CG2-CB 3.86Å; V7-F56 HydrophobicContact CG2-CG 4.23Å; V8-F56 PolarHBondContact N-O 3.45Å; N39-F56 WeakPolarHBondContact OD1-CD1 3.41Å; N39-F56 WeakPolarHBondContact OD1-CE1 3.46Å; N39-F56 WeakPolarHBondContact OD1-CG 3.43Å
57	D	95.6	Very high	93	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	137.5	174	-158.8	10.2	0	0	0	110	T17 L20 T35 D38 Y40	T17-D57 WeakPolarHBondContact CA-OD2 3.49Å; T17-D57 VanDerWaalsContact CB-OD2 3.25Å; T17-D57 WeakPolarHBondContact CB-OD2 3.35Å; T17-D57 WeakPolarHBondContact CG2-OD2 3.34Å; T17-D57 PolarHBondContact OG1-OD2 3.26Å; L20-D57 HydrophobicContact CD1-CB 3.45Å; L20-D57 VanDerWaalsContact CD1-CB 3.45Å; T35-D57 HydrophobicContact CG2-CB 4.01Å; T35-D57 WeakPolarHBondContact CG2-OD2 3.49Å; T35-D57 PolarHBondContact OG1-OD2 3.41Å; D38-D57 HydrophobicContact CB-CB 4.26Å; D38-D57 PolarHBondContact N-O 3.47Å; D38-D57 PolarHBondContact O-N 2.73Å; Y40-D57 HydrophobicContact CE2-CB 4.33Å
58	T	95.4	Very high	93.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	145.6	-178	74.5	0	0	0	0	112.2	V7 V8 K16 F37 G60 R68	V7-T58 HydrophobicContact CG1-CG2 3.86Å; V8-T58 PolarHBondContact O-OG1 3.05Å; K16-T58 WeakPolarHBondContact CE-O 3.42Å; F37-T58 HydrophobicContact CD1-CG2 4.35Å; F37-T58 HydrophobicContact CE1-CG2 4.13Å; T58-G60 PolarHBondContact O-N 3.08Å; T58-R68 HydrophobicContact CG2-CG 4.22Å
59	A	91.9	Very high	93.9	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.008	25%	0.251	C	S	.	.			trans	-59.8	135.2	172.6	0	0	0	0	0	111.6	T35 V36 Y64 R68	T35-A59 WeakPolarHBondContact O-CB 3.49Å; V36-A59 PolarHBondContact O-N 3.03Å; A59-Y64 HydrophobicContact CB-CD1 4.25Å; A59-Y64 HydrophobicContact CB-CD2 3.48Å; A59-Y64 VanDerWaalsContact CB-CD2 3.48Å; A59-Y64 HydrophobicContact CB-CE2 4.18Å; A59-Y64 HydrophobicContact CB-CG 3.52Å; A59-R68 PolarHBondContact O-NE 2.67Å; A59-R68 PolarHBondContact O-NH2 2.95Å
60	G	90.4	Very high	94.1	Very high	7 Å²	7	52.2 Å²	52.2	7%	0.072	26%	0.255	C	S	.	.			trans	-93.3	-5.9	177.8	0	0	0	0	0	114.5	G10 T58	G10-G60 WeakPolarHBondContact O-CA 3.43Å; T58-G60 PolarHBondContact O-N 3.08Å
61	Q	90.2	Very high	94.2	Very high	56 Å²	56	50.5 Å²	50.5	26%	0.262	24%	0.244	S	C	.	.	S	Bend	trans	-82.3	147.4	-177	-56.7	83.3	-20.8	0	0	110.6	D63 Y64 R68	Q61-D63 PolarHBondContact O-N 3.22Å; Q61-Y64 HydrophobicContact CB-CD2 4.14Å; Q61-Y64 PolarHBondContact O-N 3.05Å; Q61-Y64 VanDerWaalsContact O-N 3.17Å; Q61-R68 PolarHBondContact O-NH2 2.74Å
62	E	89.4	Confident	94.3	Very high	144 Å²	144	49.2 Å²	49.2	67%	0.673	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-64.2	-28.2	-178.2	-53	-166.7	148.6	0	0	112.9	Y64 D65	E62-Y64 PolarHBondContact O-N 3.35Å; E62-D65 VanDerWaalsContact O-CB 3.31Å; E62-D65 WeakPolarHBondContact O-CB 3.24Å; E62-D65 VanDerWaalsContact O-CG 3.25Å; E62-D65 PolarHBondContact O-N 3.16Å
63	D	92.3	Very high	94.4	Very high	146 Å²	146	51.6 Å²	51.6	78%	0.781	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-54.4	-23.6	175.4	-61.2	-38.9	0	0	0	112.9	Q61	Q61-D63 PolarHBondContact O-N 3.22Å
64	Y	92.4	Very high	94.4	Very high	67 Å²	67	60 Å²	60	26%	0.263	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-103.7	6.9	-179.5	-62.2	-84.4	0	0	0	113.9	V36 A59 Q61 E62 R66 L67 R68	V36-Y64 HydrophobicContact CB-CE1 4.35Å; V36-Y64 HydrophobicContact CG1-CD1 4.17Å; V36-Y64 HydrophobicContact CG1-CE1 3.58Å; V36-Y64 HydrophobicContact CG2-CE1 4.19Å; A59-Y64 HydrophobicContact CB-CD1 4.25Å; A59-Y64 HydrophobicContact CB-CD2 3.48Å; A59-Y64 VanDerWaalsContact CB-CD2 3.48Å; A59-Y64 HydrophobicContact CB-CE2 4.18Å; A59-Y64 HydrophobicContact CB-CG 3.52Å; Q61-Y64 HydrophobicContact CB-CD2 4.14Å; Q61-Y64 PolarHBondContact O-N 3.05Å; Q61-Y64 VanDerWaalsContact O-N 3.17Å; E62-Y64 PolarHBondContact O-N 3.35Å; Y64-R66 PolarHBondContact O-N 3.25Å; Y64-R66 VanDerWaalsContact O-N 3.1Å; Y64-L67 HydrophobicContact CD1-CD1 3.96Å; Y64-L67 HydrophobicContact CE1-CD1 4.48Å; Y64-L67 PolarHBondContact O-N 3.46Å; Y64-R68 WeakPolarHBondContact O-CB 3.38Å; Y64-R68 PolarHBondContact O-N 3.3Å
65	D	93.1	Very high	94.4	Very high	53 Å²	53	60 Å²	60	28%	0.283	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.5	-176.6	-78.2	-6.4	0	0	0	113.4	E62 R68 P69 K96	E62-D65 VanDerWaalsContact O-CB 3.31Å; E62-D65 WeakPolarHBondContact O-CB 3.24Å; E62-D65 VanDerWaalsContact O-CG 3.25Å; E62-D65 PolarHBondContact O-N 3.16Å; D65-R68 IonicContact OD1-CZ 3.45Å; D65-R68 VanDerWaalsContact OD1-CZ 3.26Å; D65-R68 IonicContact OD1-NH1 2.74Å; D65-R68 PolarHBondContact OD1-NH1 2.79Å; D65-R68 IonicContact OD1-NH2 3.26Å; D65-R68 PolarHBondContact OD1-NH2 2.91Å; D65-P69 WeakPolarHBondContact O-CD 3.43Å; D65-K96 VanDerWaalsContact CG-NZ 3.25Å; D65-K96 WeakPolarHBondContact OD1-CE 3.47Å; D65-K96 IonicContact OD1-NZ 2.93Å; D65-K96 PolarHBondContact OD1-NZ 2.9Å; D65-K96 IonicContact OD2-NZ 2.63Å; D65-K96 PolarHBondContact OD2-NZ 2.98Å
66	R	93.3	Very high	94.5	Very high	230 Å²	230	63.1 Å²	63.1	87%	0.868	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-23	176.4	-64.6	-175.4	-179.9	-177.5	1	113.9	Y64	Y64-R66 PolarHBondContact O-N 3.25Å; Y64-R66 VanDerWaalsContact O-N 3.1Å
67	L	93.4	Very high	94.5	Very high	80 Å²	80	61 Å²	61	42%	0.419	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-36	-177.4	-66	175.9	0	0	0	111.4	F37 Y64 P69 L70	F37-L67 HydrophobicContact CE2-CB 4.03Å; F37-L67 HydrophobicContact CZ-CB 4.17Å; Y64-L67 HydrophobicContact CD1-CD1 3.96Å; Y64-L67 HydrophobicContact CE1-CD1 4.48Å; Y64-L67 PolarHBondContact O-N 3.46Å; L67-P69 VanDerWaalsContact C-CD 3.46Å; L67-P69 VanDerWaalsContact C-N 3.33Å; L67-L70 HydrophobicContact CD2-CD1 4.08Å; L67-L70 VanDerWaalsContact O-CB 3.22Å; L67-L70 WeakPolarHBondContact O-CB 3.22Å; L67-L70 VanDerWaalsContact O-CG 3.31Å; L67-L70 WeakPolarHBondContact O-CG 3.37Å; L67-L70 PolarHBondContact O-N 3.18Å
68	R	96.3	Very high	94.7	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-51.1	-43.9	-179.1	-160.4	-174.4	-52.6	106.4	6.3	113.6	T58 A59 Q61 Y64 D65 L70 S71 Y72 W97 E100	T58-R68 HydrophobicContact CG2-CG 4.22Å; A59-R68 PolarHBondContact O-NE 2.67Å; A59-R68 PolarHBondContact O-NH2 2.95Å; Q61-R68 PolarHBondContact O-NH2 2.74Å; Y64-R68 WeakPolarHBondContact O-CB 3.38Å; Y64-R68 PolarHBondContact O-N 3.3Å; D65-R68 IonicContact OD1-CZ 3.45Å; D65-R68 VanDerWaalsContact OD1-CZ 3.26Å; D65-R68 IonicContact OD1-NH1 2.74Å; D65-R68 PolarHBondContact OD1-NH1 2.79Å; D65-R68 IonicContact OD1-NH2 3.26Å; D65-R68 PolarHBondContact OD1-NH2 2.91Å; R68-L70 PolarHBondContact O-N 3.41Å; R68-L70 VanDerWaalsContact O-N 3.1Å; R68-S71 PolarHBondContact O-N 3.02Å; R68-Y72 WeakPolarHBondContact CD-OH 3.37Å; R68-Y72 HydrophobicContact CG-CE1 4.11Å; R68-Y72 WeakPolarHBondContact CG-OH 3.45Å; R68-W97 VanDerWaalsContact CZ-CZ3 3.45Å; R68-E100 WeakPolarHBondContact CD-OE1 3.31Å; R68-E100 IonicContact CZ-OE1 2.72Å; R68-E100 IonicContact NH1-OE1 2.62Å; R68-E100 PolarHBondContact NH1-OE1 3.27Å; R68-E100 IonicContact NH1-OE2 2.83Å; R68-E100 PolarHBondContact NH1-OE2 3.34Å
69	P	96.7	Very high	94.9	Very high	22 Å²	22	61.1 Å²	61.1	14%	0.143	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-65.1	-16.6	-178.9	-24.3	36.9	0	0	0	114.9	D65 L67 S71 Y72 P73 H104	D65-P69 WeakPolarHBondContact O-CD 3.43Å; L67-P69 VanDerWaalsContact C-CD 3.46Å; L67-P69 VanDerWaalsContact C-N 3.33Å; P69-S71 PolarHBondContact O-N 3.41Å; P69-Y72 VanDerWaalsContact CA-CD2 3.47Å; P69-Y72 HydrophobicContact CB-CD2 3.87Å; P69-Y72 HydrophobicContact CB-CE2 4Å; P69-Y72 HydrophobicContact CG-CD2 4.5Å; P69-Y72 HydrophobicContact CG-CE2 4.12Å; P69-Y72 WeakPolarHBondContact O-CB 3.43Å; P69-Y72 PolarHBondContact O-N 3.18Å; P69-Y72 VanDerWaalsContact O-N 3.13Å; P69-P73 WeakPolarHBondContact O-CD 3.28Å; P69-H104 WeakPolarHBondContact CG-NE2 3.1Å
70	L	95	Very high	95.2	Very high	127 Å²	127	61 Å²	61	67%	0.665	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-64.5	-21.3	174.4	-56.9	178.3	0	0	0	112.2	L67 R68 P73	L67-L70 HydrophobicContact CD2-CD1 4.08Å; L67-L70 VanDerWaalsContact O-CB 3.22Å; L67-L70 WeakPolarHBondContact O-CB 3.22Å; L67-L70 VanDerWaalsContact O-CG 3.31Å; L67-L70 WeakPolarHBondContact O-CG 3.37Å; L67-L70 PolarHBondContact O-N 3.18Å; R68-L70 PolarHBondContact O-N 3.41Å; R68-L70 VanDerWaalsContact O-N 3.1Å; L70-P73 WeakPolarHBondContact O-CD 3.29Å
71	S	95.7	Very high	95.6	Very high	18 Å²	18	60.7 Å²	60.7	13%	0.126	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-85.3	-11.6	176.2	-64.2	0	0	0	0	113.8	K5 F37 R68 P69	K5-S71 WeakPolarHBondContact CE-O 3.46Å; K5-S71 PolarHBondContact NZ-O 3.1Å; F37-S71 WeakPolarHBondContact CD1-OG 3.47Å; F37-S71 WeakPolarHBondContact CE1-OG 3.4Å; R68-S71 PolarHBondContact O-N 3.02Å; P69-S71 PolarHBondContact O-N 3.41Å
72	Y	97.7	Very high	96	Very high	2 Å²	2	58 Å²	58	1%	0.008	28%	0.284	C	S	.	.			trans	-79.2	-27.1	-173.4	-60.6	-13.1	0	0	0	117.2	V7 V9 R68 P69 Q74 T75 F78 E100 H104	V7-Y72 HydrophobicContact CG1-CD1 4.04Å; V7-Y72 HydrophobicContact CG1-CE1 4.01Å; V9-Y72 HydrophobicContact CG1-CE1 3.9Å; R68-Y72 WeakPolarHBondContact CD-OH 3.37Å; R68-Y72 HydrophobicContact CG-CE1 4.11Å; R68-Y72 WeakPolarHBondContact CG-OH 3.45Å; P69-Y72 VanDerWaalsContact CA-CD2 3.47Å; P69-Y72 HydrophobicContact CB-CD2 3.87Å; P69-Y72 HydrophobicContact CB-CE2 4Å; P69-Y72 HydrophobicContact CG-CD2 4.5Å; P69-Y72 HydrophobicContact CG-CE2 4.12Å; P69-Y72 WeakPolarHBondContact O-CB 3.43Å; P69-Y72 PolarHBondContact O-N 3.18Å; P69-Y72 VanDerWaalsContact O-N 3.13Å; Y72-Q74 PolarHBondContact O-N 3.35Å; Y72-T75 WeakPolarHBondContact O-CB 3.46Å; Y72-T75 PolarHBondContact O-N 3.49Å; Y72-T75 VanDerWaalsContact O-N 3.15Å; Y72-T75 PolarHBondContact O-OG1 3.47Å; Y72-F78 AromaticContact CD1-CE1 3.61Å; Y72-F78 HydrophobicContact CD1-CE1 3.61Å; Y72-F78 HydrophobicContact CD1-CZ 4Å; Y72-F78 AromaticContact CE1-CE1 3.87Å; Y72-F78 HydrophobicContact CE1-CE1 3.87Å; Y72-F78 HydrophobicContact CG-CE1 4.12Å; Y72-F78 HydrophobicContact CG-CZ 4.04Å; Y72-E100 HydrophobicContact CE2-CG 4.25Å; Y72-E100 PolarHBondContact OH-OE1 3.33Å; Y72-H104 HydrophobicContact CD2-CB 3.66Å; Y72-H104 AromaticContact CD2-CD2 3.95Å; Y72-H104 AromaticContact CD2-CG 3.89Å; Y72-H104 HydrophobicContact CE2-CB 4.39Å; Y72-H104 AromaticContact CE2-CD2 3.94Å
73	P	96.9	Very high	96.5	Very high	77 Å²	77	51.3 Å²	51.3	50%	0.5	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	135.8	-180	-29.1	36.2	0	0	0	112.4	K5 P69 L70 T75	K5-P73 PolarHBondContact NZ-O 3.25Å; P69-P73 WeakPolarHBondContact O-CD 3.28Å; L70-P73 WeakPolarHBondContact O-CD 3.29Å; P73-T75 PolarHBondContact O-N 2.96Å
74	Q	95.5	Very high	96.8	Very high	178 Å²	178	44.4 Å²	44.4	83%	0.832	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	26.8	179.1	-50.4	175.8	-64.4	0	0	114.4	Y72	Y72-Q74 PolarHBondContact O-N 3.35Å
75	T	98	Very high	97.1	Very high	8 Å²	8	42.1 Å²	42.1	5%	0.049	21%	0.209	C	C	.	.			trans	-72.7	128.3	172.7	-57.9	0	0	0	0	110.6	V7 Y72 P73 V77 F78 T108	V7-T75 HydrophobicContact CB-CG2 3.95Å; V7-T75 HydrophobicContact CG2-CG2 3.68Å; V7-T75 WeakPolarHBondContact CG2-OG1 3.46Å; Y72-T75 WeakPolarHBondContact O-CB 3.46Å; Y72-T75 PolarHBondContact O-N 3.49Å; Y72-T75 VanDerWaalsContact O-N 3.15Å; Y72-T75 PolarHBondContact O-OG1 3.47Å; P73-T75 PolarHBondContact O-N 2.96Å; T75-V77 WeakPolarHBondContact CG2-O 3.31Å; T75-F78 HydrophobicContact CG2-CD1 4.16Å; T75-F78 HydrophobicContact CG2-CD2 3.91Å; T75-F78 HydrophobicContact CG2-CE1 3.96Å; T75-F78 HydrophobicContact CG2-CE2 3.68Å; T75-F78 HydrophobicContact CG2-CG 4.14Å; T75-F78 HydrophobicContact CG2-CZ 3.71Å; T75-T108 HydrophobicContact CG2-CG2 4.02Å; T75-T108 WeakPolarHBondContact O-CG2 3.41Å; T75-T108 PolarHBondContact O-OG1 2.71Å
76	D	97.9	Very high	97.3	Very high	66 Å²	66	41.3 Å²	41.3	35%	0.353	21%	0.208	S	C	.	.	S	Bend	trans	-87.4	-32.9	177.6	-59.4	-57.5	0	0	0	111.6	I4 K5 P109 A176	I4-D76 WeakPolarHBondContact CA-OD2 3.32Å; I4-D76 HydrophobicContact CG2-CB 4.19Å; K5-D76 PolarHBondContact N-OD2 3.21Å; K5-D76 PolarHBondContact O-N 3.11Å; D76-P109 WeakPolarHBondContact O-CD 3.14Å; D76-P109 WeakPolarHBondContact O-CG 3.41Å; D76-A176 HydrophobicContact CB-CB 3.97Å
77	V	98.6	Very high	97.6	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	144.3	176.3	63.3	0	0	0	0	111.9	K5 C6 V7 T75 P109 A172 A175 A176	K5-V77 PolarHBondContact O-N 2.96Å; C6-V77 WeakPolarHBondContact CA-O 3.38Å; C6-V77 HydrophobicContact CB-CG1 3.9Å; V7-V77 PolarHBondContact N-O 3.02Å; V7-V77 VanDerWaalsContact N-O 3.08Å; T75-V77 WeakPolarHBondContact CG2-O 3.31Å; V77-P109 WeakPolarHBondContact CA-O 3.33Å; V77-A172 HydrophobicContact CG1-CB 4.13Å; V77-A172 HydrophobicContact CG2-CB 4.35Å; V77-A175 HydrophobicContact CG2-CB 4.15Å; V77-A176 HydrophobicContact CB-CB 4.12Å; V77-A176 HydrophobicContact CG1-CB 4.12Å
78	F	98.8	Very high	97.8	Very high	1 Å²	1	29.9 Å²	29.9	0%	0.004	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	143.5	169.7	-71.2	-85.1	0	0	0	112.3	V7 V9 Y72 T75 I101 C105 T108 P109 F110 L111	V7-F78 HydrophobicContact CB-CD1 3.74Å; V7-F78 HydrophobicContact CB-CE1 3.71Å; V7-F78 HydrophobicContact CG1-CD1 4.01Å; V7-F78 HydrophobicContact CG1-CE1 3.82Å; V7-F78 HydrophobicContact CG2-CE1 4.37Å; V7-F78 CarbonylContact O-C 3.54Å; V7-F78 WeakPolarHBondContact O-CA 3.44Å; V9-F78 HydrophobicContact CG1-CD1 4.42Å; Y72-F78 AromaticContact CD1-CE1 3.61Å; Y72-F78 HydrophobicContact CD1-CE1 3.61Å; Y72-F78 HydrophobicContact CD1-CZ 4Å; Y72-F78 AromaticContact CE1-CE1 3.87Å; Y72-F78 HydrophobicContact CE1-CE1 3.87Å; Y72-F78 HydrophobicContact CG-CE1 4.12Å; Y72-F78 HydrophobicContact CG-CZ 4.04Å; T75-F78 HydrophobicContact CG2-CD1 4.16Å; T75-F78 HydrophobicContact CG2-CD2 3.91Å; T75-F78 HydrophobicContact CG2-CE1 3.96Å; T75-F78 HydrophobicContact CG2-CE2 3.68Å; T75-F78 HydrophobicContact CG2-CG 4.14Å; T75-F78 HydrophobicContact CG2-CZ 3.71Å; F78-I101 HydrophobicContact CB-CD1 4.07Å; F78-I101 HydrophobicContact CD1-CB 4.48Å; F78-I101 HydrophobicContact CD1-CG2 3.89Å; F78-I101 HydrophobicContact CD2-CB 4.3Å; F78-I101 HydrophobicContact CD2-CD1 4.28Å; F78-I101 HydrophobicContact CE1-CB 4.44Å; F78-I101 HydrophobicContact CE1-CG2 3.94Å; F78-I101 HydrophobicContact CE2-CB 4.28Å; F78-I101 HydrophobicContact CG-CB 4.41Å; F78-I101 HydrophobicContact CG-CD1 4.16Å; F78-I101 HydrophobicContact CG-CG2 4.22Å; F78-I101 HydrophobicContact CZ-CB 4.35Å; F78-I101 HydrophobicContact CZ-CG2 4.32Å; F78-C105 HydrophobicContact CE2-CB 3.66Å; F78-C105 HydrophobicContact CZ-CB 4.07Å; F78-T108 HydrophobicContact CD2-CG2 3.49Å; F78-T108 VanDerWaalsContact CD2-CG2 3.49Å; F78-T108 HydrophobicContact CE2-CG2 3.54Å; F78-P109 PolarHBondContact N-O 2.61Å; F78-F110 HydrophobicContact CB-CB 3.73Å; F78-F110 CarbonylContact O-C 3.51Å; F78-F110 WeakPolarHBondContact O-CA 3.33Å; F78-L111 PolarHBondContact O-N 2.97Å
79	L	98.9	Very high	97.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	113	160.6	-62.2	-175.4	0	0	0	108.5	V7 V8 V9 L19 L111 V113 V168 F169 A172	V7-L79 PolarHBondContact O-N 3Å; V8-L79 HydrophobicContact CG1-CB 4.19Å; V8-L79 HydrophobicContact CG2-CB 4.28Å; V8-L79 HydrophobicContact CG2-CD1 4.19Å; V9-L79 PolarHBondContact N-O 3.06Å; L19-L79 HydrophobicContact CD2-CD1 4.19Å; L79-L111 HydrophobicContact CD2-CB 3.83Å; L79-L111 HydrophobicContact CD2-CD1 3.87Å; L79-L111 HydrophobicContact CD2-CG 4.05Å; L79-V113 HydrophobicContact CB-CG2 4.07Å; L79-V113 HydrophobicContact CD2-CG2 3.88Å; L79-V113 HydrophobicContact CG-CG2 4.43Å; L79-V168 HydrophobicContact CD1-CG1 3.73Å; L79-V168 HydrophobicContact CD2-CG1 4.1Å; L79-F169 HydrophobicContact CD1-CE1 4.16Å; L79-A172 HydrophobicContact CD2-CB 3.91Å
80	V	98.9	Very high	98	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	102.6	174.8	-175.7	0	0	0	0	108.1	V9 V93 W97 V98 I101 F110 L111 V113	V9-V80 HydrophobicContact CG2-CB 4.37Å; V9-V80 HydrophobicContact CG2-CG1 4.44Å; V9-V80 HydrophobicContact CG2-CG2 3.91Å; V80-V93 HydrophobicContact CG1-CG1 3.97Å; V80-V93 HydrophobicContact CG1-CG2 4.32Å; V80-W97 HydrophobicContact CG1-CB 3.78Å; V80-V98 HydrophobicContact CG1-CG2 4.42Å; V80-I101 HydrophobicContact CG2-CD1 3.62Å; V80-F110 HydrophobicContact CB-CD2 4.31Å; V80-F110 HydrophobicContact CG2-CB 4.2Å; V80-F110 HydrophobicContact CG2-CD2 3.68Å; V80-F110 HydrophobicContact CG2-CE2 4.42Å; V80-F110 HydrophobicContact CG2-CG 4.22Å; V80-L111 PolarHBondContact N-O 2.77Å; V80-V113 PolarHBondContact O-N 3.34Å
81	C	98.9	Very high	98.2	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	138.7	-172.6	-64.9	0	0	0	0	112.1	V8 V9 G10 V14 K16 V113 T115	V8-C81 VanDerWaalsContact CG1-SG 3.57Å; V9-C81 WeakPolarHBondContact O-CB 3.4Å; V9-C81 PolarHBondContact O-N 3.19Å; G10-C81 VanDerWaalsContact CA-O 3.31Å; G10-C81 WeakPolarHBondContact CA-O 3.05Å; V14-C81 HydrophobicContact CG2-CB 4.06Å; K16-C81 HydrophobicContact CG-CB 3.99Å; C81-V113 WeakPolarHBondContact CA-O 3.18Å; C81-T115 HydrophobicContact CB-CG2 4.24Å
82	F	98.9	Very high	98.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	158	164	73.9	-83.5	0	0	0	109	V84 F90 V93 L112 V113 T115 I137 A142 Y154	F82-V84 HydrophobicContact CE2-CG1 4.01Å; F82-V84 HydrophobicContact CZ-CG1 4.38Å; F82-F90 HydrophobicContact CD1-CD2 4.07Å; F82-F90 HydrophobicContact CD2-CB 3.78Å; F82-F90 AromaticContact CD2-CD2 3.63Å; F82-F90 HydrophobicContact CD2-CD2 3.63Å; F82-F90 HydrophobicContact CD2-CG 4.17Å; F82-F90 AromaticContact CE1-CD2 3.88Å; F82-F90 HydrophobicContact CE1-CD2 3.88Å; F82-F90 HydrophobicContact CE1-CE2 4.18Å; F82-F90 HydrophobicContact CE2-CB 4.25Å; F82-F90 AromaticContact CE2-CD2 3.45Å; F82-F90 HydrophobicContact CE2-CD2 3.45Å; F82-F90 VanDerWaalsContact CE2-CD2 3.45Å; F82-F90 HydrophobicContact CE2-CE2 4.17Å; F82-F90 HydrophobicContact CE2-CG 4.21Å; F82-F90 HydrophobicContact CG-CB 4.29Å; F82-F90 AromaticContact CG-CD2 3.95Å; F82-F90 HydrophobicContact CG-CD2 3.95Å; F82-F90 AromaticContact CZ-CD2 3.58Å; F82-F90 HydrophobicContact CZ-CD2 3.58Å; F82-F90 AromaticContact CZ-CE2 3.89Å; F82-F90 HydrophobicContact CZ-CE2 3.89Å; F82-V93 HydrophobicContact CB-CG2 3.92Å; F82-V93 HydrophobicContact CD1-CG2 4.21Å; F82-V93 HydrophobicContact CG-CG2 4.34Å; F82-L112 HydrophobicContact CD1-CD1 3.76Å; F82-L112 HydrophobicContact CD1-CG 4.23Å; F82-L112 HydrophobicContact CE1-CD1 3.9Å; F82-L112 HydrophobicContact CE1-CD2 4.14Å; F82-L112 HydrophobicContact CE1-CG 3.85Å; F82-V113 WeakPolarHBondContact CD1-O 3.31Å; F82-V113 PolarHBondContact N-O 3.43Å; F82-T115 PolarHBondContact O-N 3.35Å; F82-T115 PolarHBondContact O-OG1 2.81Å; F82-I137 HydrophobicContact CE2-CB 4.07Å; F82-I137 HydrophobicContact CE2-CG1 4.18Å; F82-I137 HydrophobicContact CE2-CG2 3.94Å; F82-I137 HydrophobicContact CZ-CG2 4.3Å; F82-A142 HydrophobicContact CE1-CB 4.36Å; F82-A142 HydrophobicContact CZ-CB 3.75Å; F82-Y154 AromaticContact CE1-CE2 3.76Å; F82-Y154 HydrophobicContact CE1-CE2 3.76Å; F82-Y154 AromaticContact CZ-CE2 3.89Å; F82-Y154 HydrophobicContact CZ-CE2 3.89Å
83	S	98.8	Very high	98.4	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	132.4	173.3	162.8	0	0	0	0	110.4	V85 S86 S89 T115 Q116	S83-V85 PolarHBondContact O-N 3.34Å; S83-V85 VanDerWaalsContact OG-CG2 3.26Å; S83-V85 WeakPolarHBondContact OG-CG2 3.11Å; S83-V85 PolarHBondContact OG-N 2.99Å; S83-S86 PolarHBondContact O-N 2.7Å; S83-S89 PolarHBondContact N-OG 2.83Å; S83-T115 WeakPolarHBondContact CA-OG1 3.35Å; S83-Q116 PolarHBondContact OG-OE1 2.95Å
84	V	98.8	Very high	98.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-9.7	178.7	-53.5	0	0	0	0	112.8	F82 T115 I117 R120 P136 I137	F82-V84 HydrophobicContact CE2-CG1 4.01Å; F82-V84 HydrophobicContact CZ-CG1 4.38Å; V84-T115 PolarHBondContact N-O 3.4Å; V84-I117 HydrophobicContact CG1-CG2 4Å; V84-I117 HydrophobicContact CG2-CB 4.49Å; V84-I117 HydrophobicContact CG2-CG2 4.13Å; V84-R120 VanDerWaalsContact CG1-NH2 3.34Å; V84-R120 HydrophobicContact CG2-CB 4.19Å; V84-P136 CarbonylContact O-C 3.42Å; V84-P136 VanDerWaalsContact O-CA 3.25Å; V84-P136 WeakPolarHBondContact O-CA 3.29Å; V84-I137 PolarHBondContact O-N 3.26Å
85	V	98.5	Very high	98.6	Very high	20 Å²	20	31.3 Å²	31.3	12%	0.121	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	13	174.9	-60.3	0	0	0	0	112.8	S83 L119 T125 L129 P136	S83-V85 PolarHBondContact O-N 3.34Å; S83-V85 VanDerWaalsContact OG-CG2 3.26Å; S83-V85 WeakPolarHBondContact OG-CG2 3.11Å; S83-V85 PolarHBondContact OG-N 2.99Å; V85-L119 HydrophobicContact CB-CB 4.39Å; V85-L119 HydrophobicContact CG1-CB 3.66Å; V85-L119 WeakPolarHBondContact CG1-O 3.31Å; V85-L119 HydrophobicContact CG2-CB 3.92Å; V85-L119 HydrophobicContact CG2-CD1 3.83Å; V85-T125 HydrophobicContact CB-CG2 3.63Å; V85-T125 HydrophobicContact CG1-CG2 3.64Å; V85-T125 HydrophobicContact CG2-CG2 4.12Å; V85-L129 HydrophobicContact CB-CD1 4.23Å; V85-P136 HydrophobicContact CG1-CB 4.34Å; V85-P136 HydrophobicContact CG1-CG 4.46Å
86	S	98.5	Very high	98.6	Very high	36 Å²	36	32.5 Å²	32.5	25%	0.252	17%	0.166	S	C	.	.			trans	-125.8	88.9	172.7	-180	0	0	0	0	110.4	S83 S88 S89 F90	S83-S86 PolarHBondContact O-N 2.7Å; S86-S88 PolarHBondContact O-N 3.45Å; S86-S88 PolarHBondContact OG-OG 2.93Å; S86-S89 WeakPolarHBondContact CB-OG 3.46Å; S86-S89 PolarHBondContact O-N 3.3Å; S86-S89 PolarHBondContact O-OG 3.49Å; S86-S89 PolarHBondContact OG-OG 2.71Å; S86-F90 PolarHBondContact O-N 3.02Å
87	P	98.4	Very high	98.6	Very high	13 Å²	13	29.4 Å²	29.4	8%	0.084	15%	0.149	C	C	.	.	H	α-helix	trans	-57.3	-34.2	-179	-28.4	37.5	0	0	0	114.2	S89 F90 E91 L129 Q134 I137	P87-S89 VanDerWaalsContact C-N 3.34Å; P87-S89 PolarHBondContact O-N 3.05Å; P87-F90 WeakPolarHBondContact O-CB 3.21Å; P87-F90 PolarHBondContact O-N 2.87Å; P87-F90 VanDerWaalsContact O-N 3.16Å; P87-E91 PolarHBondContact O-N 3.2Å; P87-L129 HydrophobicContact CG-CD2 4.25Å; P87-Q134 HydrophobicContact CG-CB 4.11Å; P87-Q134 HydrophobicContact CG-CG 4.21Å; P87-I137 HydrophobicContact CB-CD1 4.25Å; P87-I137 HydrophobicContact CG-CD1 4.42Å
88	S	98.3	Very high	98.6	Very high	56 Å²	56	30 Å²	30	39%	0.392	15%	0.152	S	C	.	.	H	α-helix	trans	-63.4	-39.7	174.9	56.7	0	0	0	0	112	S86 F90 E91 N92	S86-S88 PolarHBondContact O-N 3.45Å; S86-S88 PolarHBondContact OG-OG 2.93Å; S88-F90 PolarHBondContact O-N 3.37Å; S88-E91 PolarHBondContact O-N 2.93Å; S88-N92 WeakPolarHBondContact O-CB 3.34Å; S88-N92 VanDerWaalsContact O-CG 3.26Å; S88-N92 PolarHBondContact O-N 3.38Å; S88-N92 PolarHBondContact O-ND2 3.3Å
89	S	98.8	Very high	98.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-29.6	176.2	75	0	0	0	0	112.7	D11 S83 S86 P87 V93	D11-S89 VanDerWaalsContact OD2-CA 3.29Å; D11-S89 WeakPolarHBondContact OD2-CA 3.41Å; S83-S89 PolarHBondContact N-OG 2.83Å; S86-S89 WeakPolarHBondContact CB-OG 3.46Å; S86-S89 PolarHBondContact O-N 3.3Å; S86-S89 PolarHBondContact O-OG 3.49Å; S86-S89 PolarHBondContact OG-OG 2.71Å; P87-S89 VanDerWaalsContact C-N 3.34Å; P87-S89 PolarHBondContact O-N 3.05Å; S89-V93 WeakPolarHBondContact O-CG2 3.31Å; S89-V93 PolarHBondContact O-N 3.32Å
90	F	98.8	Very high	98.6	Very high	23 Å²	23	34.3 Å²	34.3	10%	0.101	18%	0.178	C	C	.	.	H	α-helix	trans	-72.5	-40.4	175	-179.4	-107.1	0	0	0	112	F82 S86 P87 S88 V93 I137 T141 A142 L145	F82-F90 HydrophobicContact CD1-CD2 4.07Å; F82-F90 HydrophobicContact CD2-CB 3.78Å; F82-F90 AromaticContact CD2-CD2 3.63Å; F82-F90 HydrophobicContact CD2-CD2 3.63Å; F82-F90 HydrophobicContact CD2-CG 4.17Å; F82-F90 AromaticContact CE1-CD2 3.88Å; F82-F90 HydrophobicContact CE1-CD2 3.88Å; F82-F90 HydrophobicContact CE1-CE2 4.18Å; F82-F90 HydrophobicContact CE2-CB 4.25Å; F82-F90 AromaticContact CE2-CD2 3.45Å; F82-F90 HydrophobicContact CE2-CD2 3.45Å; F82-F90 VanDerWaalsContact CE2-CD2 3.45Å; F82-F90 HydrophobicContact CE2-CE2 4.17Å; F82-F90 HydrophobicContact CE2-CG 4.21Å; F82-F90 HydrophobicContact CG-CB 4.29Å; F82-F90 AromaticContact CG-CD2 3.95Å; F82-F90 HydrophobicContact CG-CD2 3.95Å; F82-F90 AromaticContact CZ-CD2 3.58Å; F82-F90 HydrophobicContact CZ-CD2 3.58Å; F82-F90 AromaticContact CZ-CE2 3.89Å; F82-F90 HydrophobicContact CZ-CE2 3.89Å; S86-F90 PolarHBondContact O-N 3.02Å; P87-F90 WeakPolarHBondContact O-CB 3.21Å; P87-F90 PolarHBondContact O-N 2.87Å; P87-F90 VanDerWaalsContact O-N 3.16Å; S88-F90 PolarHBondContact O-N 3.37Å; F90-V93 WeakPolarHBondContact O-CB 3.39Å; F90-V93 PolarHBondContact O-N 3.42Å; F90-I137 HydrophobicContact CB-CD1 4.1Å; F90-I137 HydrophobicContact CB-CG1 3.98Å; F90-I137 HydrophobicContact CD1-CD1 3.9Å; F90-I137 HydrophobicContact CD1-CG1 4.39Å; F90-I137 HydrophobicContact CD1-CG2 4.47Å; F90-I137 HydrophobicContact CD2-CG1 4.48Å; F90-I137 HydrophobicContact CD2-CG2 4.04Å; F90-I137 HydrophobicContact CE1-CG2 4.43Å; F90-I137 HydrophobicContact CE2-CG2 3.99Å; F90-I137 HydrophobicContact CG-CD1 4.04Å; F90-I137 HydrophobicContact CG-CG1 4.04Å; F90-I137 HydrophobicContact CG-CG2 4.26Å; F90-I137 HydrophobicContact CZ-CG2 4.18Å; F90-T141 HydrophobicContact CE1-CG2 3.87Å; F90-T141 HydrophobicContact CZ-CG2 3.96Å; F90-A142 HydrophobicContact CE2-CB 3.83Å; F90-A142 HydrophobicContact CZ-CB 4.37Å; F90-L145 HydrophobicContact CD1-CD2 4.46Å; F90-L145 HydrophobicContact CD2-CD2 3.89Å; F90-L145 HydrophobicContact CE1-CD2 3.98Å; F90-L145 HydrophobicContact CE2-CB 4.01Å; F90-L145 HydrophobicContact CE2-CD2 3.36Å; F90-L145 HydrophobicContact CE2-CG 4.31Å; F90-L145 HydrophobicContact CG-CD2 4.43Å; F90-L145 HydrophobicContact CZ-CB 3.61Å; F90-L145 HydrophobicContact CZ-CD2 3.42Å; F90-L145 VanDerWaalsContact CZ-CD2 3.42Å; F90-L145 HydrophobicContact CZ-CG 4.1Å
91	E	98.6	Very high	98.6	Very high	109 Å²	109	34.5 Å²	34.5	51%	0.509	18%	0.179	S	C	.	.	H	α-helix	trans	-62.2	-45.4	173.7	-69.6	169.6	175.2	0	0	111	P87 S88 V93 K94 E95	P87-E91 PolarHBondContact O-N 3.2Å; S88-E91 PolarHBondContact O-N 2.93Å; E91-V93 PolarHBondContact O-N 2.93Å; E91-V93 VanDerWaalsContact O-N 3.08Å; E91-K94 PolarHBondContact O-N 3.47Å; E91-E95 PolarHBondContact O-N 3.26Å
92	N	98.8	Very high	98.6	Very high	46 Å²	46	37.8 Å²	37.8	25%	0.246	20%	0.199	C	C	.	.	H	α-helix	trans	-60	-21.7	179	-73.5	-20.8	0	0	0	113.9	D11 S88 K94 E95 K96 W97	D11-N92 WeakPolarHBondContact OD1-CB 3.48Å; D11-N92 PolarHBondContact OD1-ND2 2.63Å; D11-N92 PolarHBondContact OD2-ND2 2.93Å; S88-N92 WeakPolarHBondContact O-CB 3.34Å; S88-N92 VanDerWaalsContact O-CG 3.26Å; S88-N92 PolarHBondContact O-N 3.38Å; S88-N92 PolarHBondContact O-ND2 3.3Å; N92-K94 VanDerWaalsContact C-N 3.3Å; N92-K94 PolarHBondContact O-N 2.96Å; N92-E95 PolarHBondContact O-N 2.87Å; N92-K96 WeakPolarHBondContact O-CA 3.46Å; N92-K96 WeakPolarHBondContact O-CB 3.26Å; N92-K96 PolarHBondContact O-N 2.8Å; N92-W97 VanDerWaalsContact O-CD1 3.3Å; N92-W97 PolarHBondContact O-N 2.7Å
93	V	98.8	Very high	98.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-55.2	-48.6	172.1	173.5	0	0	0	0	110.5	V80 F82 S89 F90 E91 V98 L112 L145 L149	V80-V93 HydrophobicContact CG1-CG1 3.97Å; V80-V93 HydrophobicContact CG1-CG2 4.32Å; F82-V93 HydrophobicContact CB-CG2 3.92Å; F82-V93 HydrophobicContact CD1-CG2 4.21Å; F82-V93 HydrophobicContact CG-CG2 4.34Å; S89-V93 WeakPolarHBondContact O-CG2 3.31Å; S89-V93 PolarHBondContact O-N 3.32Å; F90-V93 WeakPolarHBondContact O-CB 3.39Å; F90-V93 PolarHBondContact O-N 3.42Å; E91-V93 PolarHBondContact O-N 2.93Å; E91-V93 VanDerWaalsContact O-N 3.08Å; V93-V98 HydrophobicContact CG1-CG2 3.95Å; V93-V98 WeakPolarHBondContact O-CB 3.48Å; V93-V98 WeakPolarHBondContact O-CG2 3.46Å; V93-V98 PolarHBondContact O-N 3.11Å; V93-L112 HydrophobicContact CB-CD1 4.44Å; V93-L112 HydrophobicContact CG1-CD1 3.6Å; V93-L112 HydrophobicContact CG2-CD1 3.98Å; V93-L145 HydrophobicContact CB-CD2 4.15Å; V93-L145 HydrophobicContact CG1-CD2 4.08Å; V93-L149 HydrophobicContact CG1-CD1 3.6Å
94	K	98.4	Very high	98.5	Very high	134 Å²	134	48.9 Å²	48.9	58%	0.583	25%	0.25	S	S	*	.	I	π-helix	trans	-79.4	-36.1	-177.9	176.8	176.7	176	-170.4	0	112	E91 N92 P99 L145 L149	E91-K94 PolarHBondContact O-N 3.47Å; N92-K94 VanDerWaalsContact C-N 3.3Å; N92-K94 PolarHBondContact O-N 2.96Å; K94-P99 VanDerWaalsContact O-CD 3.28Å; K94-P99 WeakPolarHBondContact O-CD 3.31Å; K94-P99 WeakPolarHBondContact O-CG 3.44Å; K94-L145 HydrophobicContact CB-CD1 4.35Å; K94-L145 HydrophobicContact CD-CD1 4.48Å; K94-L149 HydrophobicContact CB-CD1 4.35Å; K94-L149 HydrophobicContact CB-CD2 4.31Å; K94-L149 HydrophobicContact CG-CD2 4.09Å
95	E	98.3	Very high	98.4	Very high	142 Å²	142	49.8 Å²	49.8	66%	0.664	26%	0.256	S	S	*	.	I	π-helix	trans	-83.6	-30.7	-171.7	-62.7	-173.1	170.8	0	0	113	E91 N92	E91-E95 PolarHBondContact O-N 3.26Å; N92-E95 PolarHBondContact O-N 2.87Å
96	K	98.3	Very high	98.2	Very high	34 Å²	34	53.4 Å²	53.4	15%	0.148	28%	0.28	C	S	.	.	I	π-helix	trans	-125.1	-62.3	-174.1	177	171.9	178.9	148.2	0	113.1	D65 N92 P99 E100	D65-K96 VanDerWaalsContact CG-NZ 3.25Å; D65-K96 WeakPolarHBondContact OD1-CE 3.47Å; D65-K96 IonicContact OD1-NZ 2.93Å; D65-K96 PolarHBondContact OD1-NZ 2.9Å; D65-K96 IonicContact OD2-NZ 2.63Å; D65-K96 PolarHBondContact OD2-NZ 2.98Å; N92-K96 WeakPolarHBondContact O-CA 3.46Å; N92-K96 WeakPolarHBondContact O-CB 3.26Å; N92-K96 PolarHBondContact O-N 2.8Å; K96-P99 WeakPolarHBondContact O-CD 3.11Å; K96-E100 VanDerWaalsContact O-CB 3.31Å; K96-E100 WeakPolarHBondContact O-CB 3.25Å; K96-E100 PolarHBondContact O-N 3.15Å
97	W	98.7	Very high	98	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.31	C	S	.	.	I	π-helix	trans	-69.3	-48	-162.3	-62.3	111.9	0	0	0	113.8	V9 G10 D11 R68 V80 N92 E100 I101	V9-W97 HydrophobicContact CB-CE3 3.87Å; V9-W97 HydrophobicContact CB-CZ3 4.21Å; V9-W97 HydrophobicContact CG2-CE3 4.28Å; G10-W97 VanDerWaalsContact CA-CE2 3.42Å; G10-W97 WeakPolarHBondContact O-CH2 3.44Å; G10-W97 VanDerWaalsContact O-CZ2 3.25Å; G10-W97 WeakPolarHBondContact O-CZ2 3.25Å; D11-W97 PolarHBondContact OD1-NE1 3.2Å; R68-W97 VanDerWaalsContact CZ-CZ3 3.45Å; V80-W97 HydrophobicContact CG1-CB 3.78Å; N92-W97 VanDerWaalsContact O-CD1 3.3Å; N92-W97 PolarHBondContact O-N 2.7Å; W97-E100 PolarHBondContact O-N 2.87Å; W97-I101 PolarHBondContact O-N 2.86Å
98	V	98.6	Very high	97.9	Very high	12 Å²	12	62.1 Å²	62.1	7%	0.073	32%	0.315	C	S	.	.	H	α-helix	trans	-66.3	-44.7	177.4	172.9	0	0	0	0	111.7	V80 V93 E100 I101 T102 F110 L149	V80-V98 HydrophobicContact CG1-CG2 4.42Å; V93-V98 HydrophobicContact CG1-CG2 3.95Å; V93-V98 WeakPolarHBondContact O-CB 3.48Å; V93-V98 WeakPolarHBondContact O-CG2 3.46Å; V93-V98 PolarHBondContact O-N 3.11Å; V98-E100 VanDerWaalsContact C-N 3.32Å; V98-E100 PolarHBondContact O-N 2.84Å; V98-I101 WeakPolarHBondContact O-CG1 3.15Å; V98-T102 WeakPolarHBondContact O-CB 3.17Å; V98-T102 PolarHBondContact O-N 2.87Å; V98-T102 PolarHBondContact O-OG1 3.09Å; V98-F110 HydrophobicContact CG1-CE1 4.41Å; V98-F110 HydrophobicContact CG1-CZ 4.08Å; V98-F110 HydrophobicContact CG2-CD2 4.47Å; V98-F110 HydrophobicContact CG2-CE2 3.74Å; V98-F110 HydrophobicContact CG2-CZ 3.88Å; V98-L149 HydrophobicContact CB-CD1 4.41Å; V98-L149 HydrophobicContact CG2-CD1 3.88Å
99	P	98.6	Very high	97.9	Very high	64 Å²	64	60.3 Å²	60.3	42%	0.416	30%	0.302	S	S	.	.	H	α-helix	trans	-53.7	-44.6	170.5	-29.4	35.7	0	0	0	113.9	K94 K96 T102 H103	K94-P99 VanDerWaalsContact O-CD 3.28Å; K94-P99 WeakPolarHBondContact O-CD 3.31Å; K94-P99 WeakPolarHBondContact O-CG 3.44Å; K96-P99 WeakPolarHBondContact O-CD 3.11Å; P99-T102 PolarHBondContact O-N 3.38Å; P99-H103 WeakPolarHBondContact O-CB 3.19Å; P99-H103 PolarHBondContact O-N 2.89Å
100	E	98.6	Very high	97.9	Very high	29 Å²	29	61.1 Å²	61.1	14%	0.136	31%	0.305	C	S	.	.	H	α-helix	trans	-63.3	-53.3	-178.9	-173.3	-179.9	119.3	0	0	112.1	R68 Y72 K96 W97 V98 T102 H103 H104	R68-E100 WeakPolarHBondContact CD-OE1 3.31Å; R68-E100 IonicContact CZ-OE1 2.72Å; R68-E100 IonicContact NH1-OE1 2.62Å; R68-E100 PolarHBondContact NH1-OE1 3.27Å; R68-E100 IonicContact NH1-OE2 2.83Å; R68-E100 PolarHBondContact NH1-OE2 3.34Å; Y72-E100 HydrophobicContact CE2-CG 4.25Å; Y72-E100 PolarHBondContact OH-OE1 3.33Å; K96-E100 VanDerWaalsContact O-CB 3.31Å; K96-E100 WeakPolarHBondContact O-CB 3.25Å; K96-E100 PolarHBondContact O-N 3.15Å; W97-E100 PolarHBondContact O-N 2.87Å; V98-E100 VanDerWaalsContact C-N 3.32Å; V98-E100 PolarHBondContact O-N 2.84Å; E100-T102 VanDerWaalsContact C-N 3.26Å; E100-T102 PolarHBondContact O-N 2.98Å; E100-H103 WeakPolarHBondContact O-CB 3.45Å; E100-H103 PolarHBondContact O-N 2.97Å; E100-H104 PolarHBondContact O-CD2 3.02Å; E100-H104 PolarHBondContact O-N 2.85Å
101	I	98.4	Very high	97.9	Very high	4 Å²	4	60 Å²	60	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-66.1	-31.8	179.6	68.3	175.4	0	0	0	111.6	V9 F78 V80 W97 V98 C105 F110	V9-I101 HydrophobicContact CG1-CG2 4.43Å; V9-I101 HydrophobicContact CG2-CG2 4.04Å; F78-I101 HydrophobicContact CB-CD1 4.07Å; F78-I101 HydrophobicContact CD1-CB 4.48Å; F78-I101 HydrophobicContact CD1-CG2 3.89Å; F78-I101 HydrophobicContact CD2-CB 4.3Å; F78-I101 HydrophobicContact CD2-CD1 4.28Å; F78-I101 HydrophobicContact CE1-CB 4.44Å; F78-I101 HydrophobicContact CE1-CG2 3.94Å; F78-I101 HydrophobicContact CE2-CB 4.28Å; F78-I101 HydrophobicContact CG-CB 4.41Å; F78-I101 HydrophobicContact CG-CD1 4.16Å; F78-I101 HydrophobicContact CG-CG2 4.22Å; F78-I101 HydrophobicContact CZ-CB 4.35Å; F78-I101 HydrophobicContact CZ-CG2 4.32Å; V80-I101 HydrophobicContact CG2-CD1 3.62Å; W97-I101 PolarHBondContact O-N 2.86Å; V98-I101 WeakPolarHBondContact O-CG1 3.15Å; I101-C105 CarbonylContact O-C 3.43Å; I101-C105 VanDerWaalsContact O-CA 3.31Å; I101-C105 WeakPolarHBondContact O-CA 3.42Å; I101-C105 WeakPolarHBondContact O-CB 3.31Å; I101-C105 PolarHBondContact O-N 2.54Å; I101-F110 HydrophobicContact CD1-CB 3.86Å; I101-F110 HydrophobicContact CD1-CD1 4.11Å; I101-F110 HydrophobicContact CD1-CD2 4.41Å; I101-F110 HydrophobicContact CD1-CG 3.89Å
102	T	97.8	Very high	97.9	Very high	68 Å²	68	54.9 Å²	54.9	42%	0.417	28%	0.277	S	S	.	.	H	α-helix	trans	-70.9	-34.4	177.4	-56.9	0	0	0	0	111.3	V98 P99 E100 P106	V98-T102 WeakPolarHBondContact O-CB 3.17Å; V98-T102 PolarHBondContact O-N 2.87Å; V98-T102 PolarHBondContact O-OG1 3.09Å; P99-T102 PolarHBondContact O-N 3.38Å; E100-T102 VanDerWaalsContact C-N 3.26Å; E100-T102 PolarHBondContact O-N 2.98Å; T102-P106 VanDerWaalsContact O-CA 3.28Å; T102-P106 WeakPolarHBondContact O-CA 3.41Å; T102-P106 WeakPolarHBondContact O-CB 3.42Å
103	H	97.8	Very high	97.9	Very high	149 Å²	149	52.7 Å²	52.7	69%	0.69	27%	0.265	S	S	*	.	H	α-helix	trans	-64.3	-46	175.8	177.9	71.1	0	0	0	111.6	P99 E100	P99-H103 WeakPolarHBondContact O-CB 3.19Å; P99-H103 PolarHBondContact O-N 2.89Å; E100-H103 WeakPolarHBondContact O-CB 3.45Å; E100-H103 PolarHBondContact O-N 2.97Å
104	H	97.9	Very high	98	Very high	88 Å²	88	52.7 Å²	52.7	41%	0.407	27%	0.265	S	S	.	.	H	α-helix	trans	-85.6	-33.5	-176.7	-70.9	-71	0	0	0	114	P69 Y72 E100	P69-H104 WeakPolarHBondContact CG-NE2 3.1Å; Y72-H104 HydrophobicContact CD2-CB 3.66Å; Y72-H104 AromaticContact CD2-CD2 3.95Å; Y72-H104 AromaticContact CD2-CG 3.89Å; Y72-H104 HydrophobicContact CE2-CB 4.39Å; Y72-H104 AromaticContact CE2-CD2 3.94Å; E100-H104 PolarHBondContact O-CD2 3.02Å; E100-H104 PolarHBondContact O-N 2.85Å
105	C	96.9	Very high	98	Very high	18 Å²	18	46.5 Å²	46.5	12%	0.122	24%	0.238	C	C	.	.			trans	-136.9	65.5	-172.4	-64.5	0	0	0	0	111.5	F78 I101 K107 T108	F78-C105 HydrophobicContact CE2-CB 3.66Å; F78-C105 HydrophobicContact CZ-CB 4.07Å; I101-C105 CarbonylContact O-C 3.43Å; I101-C105 VanDerWaalsContact O-CA 3.31Å; I101-C105 WeakPolarHBondContact O-CA 3.42Å; I101-C105 WeakPolarHBondContact O-CB 3.31Å; I101-C105 PolarHBondContact O-N 2.54Å; C105-K107 PolarHBondContact O-N 3.06Å; C105-T108 PolarHBondContact O-N 2.55Å; C105-T108 VanDerWaalsContact O-N 3.09Å
106	P	95.1	Very high	98	Very high	97 Å²	97	42.3 Å²	42.3	63%	0.63	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-13.6	-167.7	24.5	-36.1	0	0	0	115.9	T102	T102-P106 VanDerWaalsContact O-CA 3.28Å; T102-P106 WeakPolarHBondContact O-CA 3.41Å; T102-P106 WeakPolarHBondContact O-CB 3.42Å
107	K	93.8	Very high	98	Very high	199 Å²	199	41.5 Å²	41.5	87%	0.865	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-7.7	-179.2	-63.6	-177.6	-178.3	177	0	113.1	C105	C105-K107 PolarHBondContact O-N 3.06Å
108	T	97.5	Very high	98	Very high	32 Å²	32	44 Å²	44	20%	0.196	23%	0.229	C	C	.	.			trans	-78.1	127.5	-175.2	-59.4	0	0	0	0	109.1	T75 F78 C105	T75-T108 HydrophobicContact CG2-CG2 4.02Å; T75-T108 WeakPolarHBondContact O-CG2 3.41Å; T75-T108 PolarHBondContact O-OG1 2.71Å; F78-T108 HydrophobicContact CD2-CG2 3.49Å; F78-T108 VanDerWaalsContact CD2-CG2 3.49Å; F78-T108 HydrophobicContact CE2-CG2 3.54Å; C105-T108 PolarHBondContact O-N 2.55Å; C105-T108 VanDerWaalsContact O-N 3.09Å
109	P	98.1	Very high	97.9	Very high	18 Å²	18	45.8 Å²	45.8	12%	0.117	24%	0.238	C	C	.	.			trans	-66.1	156.3	176.9	27.8	-34.4	0	0	0	111.1	D76 V77 F78 V152 A175 P179	D76-P109 WeakPolarHBondContact O-CD 3.14Å; D76-P109 WeakPolarHBondContact O-CG 3.41Å; V77-P109 WeakPolarHBondContact CA-O 3.33Å; F78-P109 PolarHBondContact N-O 2.61Å; P109-V152 HydrophobicContact CB-CG2 3.56Å; P109-A175 WeakPolarHBondContact CG-O 3.49Å; P109-P179 HydrophobicContact CG-CB 4.45Å
110	F	98.8	Very high	97.9	Very high	17 Å²	17	44.6 Å²	44.6	8%	0.075	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	150.7	174.1	73.7	-84.1	0	0	0	112	F78 V80 V98 I101 L149 A151 V152	F78-F110 HydrophobicContact CB-CB 3.73Å; F78-F110 CarbonylContact O-C 3.51Å; F78-F110 WeakPolarHBondContact O-CA 3.33Å; V80-F110 HydrophobicContact CB-CD2 4.31Å; V80-F110 HydrophobicContact CG2-CB 4.2Å; V80-F110 HydrophobicContact CG2-CD2 3.68Å; V80-F110 HydrophobicContact CG2-CE2 4.42Å; V80-F110 HydrophobicContact CG2-CG 4.22Å; V98-F110 HydrophobicContact CG1-CE1 4.41Å; V98-F110 HydrophobicContact CG1-CZ 4.08Å; V98-F110 HydrophobicContact CG2-CD2 4.47Å; V98-F110 HydrophobicContact CG2-CE2 3.74Å; V98-F110 HydrophobicContact CG2-CZ 3.88Å; I101-F110 HydrophobicContact CD1-CB 3.86Å; I101-F110 HydrophobicContact CD1-CD1 4.11Å; I101-F110 HydrophobicContact CD1-CD2 4.41Å; I101-F110 HydrophobicContact CD1-CG 3.89Å; F110-L149 HydrophobicContact CZ-CB 4.1Å; F110-L149 WeakPolarHBondContact CZ-O 3.18Å; F110-A151 HydrophobicContact CD2-CB 3.97Å; F110-A151 HydrophobicContact CE2-CB 3.46Å; F110-A151 VanDerWaalsContact CE2-CB 3.46Å; F110-A151 HydrophobicContact CZ-CB 3.82Å; F110-V152 PolarHBondContact O-N 3.23Å
111	L	98.8	Very high	97.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	144.1	166.1	-57	-170.4	0	0	0	110.1	F78 L79 V80 V113 V152 K153 V155 E171 A172 A175	F78-L111 PolarHBondContact O-N 2.97Å; L79-L111 HydrophobicContact CD2-CB 3.83Å; L79-L111 HydrophobicContact CD2-CD1 3.87Å; L79-L111 HydrophobicContact CD2-CG 4.05Å; V80-L111 PolarHBondContact N-O 2.77Å; L111-V113 HydrophobicContact CB-CG2 4.23Å; L111-V152 HydrophobicContact CD2-CB 3.87Å; L111-V152 HydrophobicContact CD2-CG1 4.39Å; L111-K153 HydrophobicContact CD2-CB 3.85Å; L111-V155 HydrophobicContact CD1-CG2 4.26Å; L111-E171 HydrophobicContact CD1-CB 3.7Å; L111-A172 HydrophobicContact CD1-CB 4.02Å; L111-A175 HydrophobicContact CD2-CB 4.32Å
112	L	98.9	Very high	97.8	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	125.3	163.1	-177	63.4	0	0	0	108.3	F82 V93 A142 L145 A146 A151 K153 Y154 V155	F82-L112 HydrophobicContact CD1-CD1 3.76Å; F82-L112 HydrophobicContact CD1-CG 4.23Å; F82-L112 HydrophobicContact CE1-CD1 3.9Å; F82-L112 HydrophobicContact CE1-CD2 4.14Å; F82-L112 HydrophobicContact CE1-CG 3.85Å; V93-L112 HydrophobicContact CB-CD1 4.44Å; V93-L112 HydrophobicContact CG1-CD1 3.6Å; V93-L112 HydrophobicContact CG2-CD1 3.98Å; L112-A142 WeakPolarHBondContact CD2-O 3.46Å; L112-L145 HydrophobicContact CD2-CB 4.37Å; L112-L145 HydrophobicContact CD2-CD2 4.36Å; L112-L145 HydrophobicContact CD2-CG 4.46Å; L112-A146 HydrophobicContact CB-CB 4.13Å; L112-A146 HydrophobicContact CD2-CB 3.86Å; L112-A151 HydrophobicContact CB-CB 4.2Å; L112-K153 PolarHBondContact N-O 3.37Å; L112-Y154 HydrophobicContact CB-CD2 4.06Å; L112-Y154 HydrophobicContact CD2-CD2 3.95Å; L112-Y154 HydrophobicContact CD2-CE2 4.44Å; L112-Y154 HydrophobicContact CG-CD2 3.84Å; L112-Y154 HydrophobicContact CG-CE2 4.3Å; L112-Y154 WeakPolarHBondContact O-CA 3.35Å; L112-Y154 VanDerWaalsContact O-CD2 3.31Å; L112-Y154 WeakPolarHBondContact O-CD2 3.25Å; L112-V155 PolarHBondContact O-N 3.4Å
113	V	98.9	Very high	97.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	115.4	-175.1	-172.1	0	0	0	0	110.5	L79 V80 C81 F82 L111 T115 V155 V168	L79-V113 HydrophobicContact CB-CG2 4.07Å; L79-V113 HydrophobicContact CD2-CG2 3.88Å; L79-V113 HydrophobicContact CG-CG2 4.43Å; V80-V113 PolarHBondContact O-N 3.34Å; C81-V113 WeakPolarHBondContact CA-O 3.18Å; F82-V113 WeakPolarHBondContact CD1-O 3.31Å; F82-V113 PolarHBondContact N-O 3.43Å; L111-V113 HydrophobicContact CB-CG2 4.23Å; V113-T115 HydrophobicContact CG1-CG2 4.15Å; V113-V155 CarbonylContact C-O 3.44Å; V113-V155 WeakPolarHBondContact CA-O 3.2Å; V113-V155 HydrophobicContact CB-CG2 4.4Å; V113-V155 HydrophobicContact CG1-CG2 4.33Å; V113-V155 HydrophobicContact CG2-CG2 3.88Å; V113-V168 HydrophobicContact CG1-CG1 4.19Å; V113-V168 HydrophobicContact CG1-CG2 4.1Å; V113-V168 HydrophobicContact CG2-CG1 4.11Å
114	G	98.9	Very high	97.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	113.8	169.1	0	0	0	0	0	110.6	V155 E156 C157	G114-V155 PolarHBondContact N-O 3.47Å; G114-E156 CarbonylContact O-C 3.36Å; G114-E156 VanDerWaalsContact O-CA 3.31Å; G114-E156 WeakPolarHBondContact O-CA 3.41Å; G114-C157 PolarHBondContact O-N 3.07Å
115	T	98.8	Very high	97.7	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.025	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	169.2	-180	66.2	0	0	0	0	111.5	V14 C81 F82 S83 V84 V113 I117 C157	V14-T115 VanDerWaalsContact O-CB 3.31Å; V14-T115 WeakPolarHBondContact O-CB 3.34Å; V14-T115 PolarHBondContact O-OG1 2.99Å; C81-T115 HydrophobicContact CB-CG2 4.24Å; F82-T115 PolarHBondContact O-N 3.35Å; F82-T115 PolarHBondContact O-OG1 2.81Å; S83-T115 WeakPolarHBondContact CA-OG1 3.35Å; V84-T115 PolarHBondContact N-O 3.4Å; V113-T115 HydrophobicContact CG1-CG2 4.15Å; T115-I117 VanDerWaalsContact C-N 3.32Å; T115-I117 PolarHBondContact O-N 2.57Å; T115-C157 CarbonylContact C-O 3.59Å; T115-C157 WeakPolarHBondContact CA-O 3.47Å
116	Q	98.4	Very high	97.8	Very high	54 Å²	54	48 Å²	48	25%	0.252	26%	0.259	S	S	.	.			trans	61.3	35.8	174.4	-57.2	174.5	-32.7	0	0	113.4	A13 S83 D118 L119 C157	A13-Q116 PolarHBondContact O-NE2 2.97Å; S83-Q116 PolarHBondContact OG-OE1 2.95Å; Q116-D118 PolarHBondContact O-N 2.72Å; Q116-D118 VanDerWaalsContact O-N 3.15Å; Q116-L119 HydrophobicContact CB-CD1 4.08Å; Q116-L119 HydrophobicContact CB-CG 4.39Å; Q116-L119 WeakPolarHBondContact O-CB 3.16Å; Q116-L119 PolarHBondContact O-N 3.2Å; Q116-C157 PolarHBondContact N-O 3.34Å; Q116-C157 VanDerWaalsContact N-O 3.11Å
117	I	98.6	Very high	97.9	Very high	17 Å²	17	48.7 Å²	48.7	9%	0.087	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-64.3	-18.4	-179.3	67.6	179.9	0	0	0	114.3	V84 T115 L119 R120 E156 C157 K163	V84-I117 HydrophobicContact CG1-CG2 4Å; V84-I117 HydrophobicContact CG2-CB 4.49Å; V84-I117 HydrophobicContact CG2-CG2 4.13Å; T115-I117 VanDerWaalsContact C-N 3.32Å; T115-I117 PolarHBondContact O-N 2.57Å; I117-L119 PolarHBondContact O-N 2.87Å; I117-R120 WeakPolarHBondContact O-CB 3.34Å; I117-R120 PolarHBondContact O-N 2.83Å; I117-E156 HydrophobicContact CD1-CB 4.39Å; I117-E156 HydrophobicContact CG2-CB 3.88Å; I117-E156 HydrophobicContact CG2-CG 4.11Å; I117-C157 PolarHBondContact N-O 2.89Å; I117-K163 HydrophobicContact CD1-CB 4.43Å; I117-K163 HydrophobicContact CD1-CD 3.93Å; I117-K163 HydrophobicContact CD1-CG 4.11Å
118	D	98.1	Very high	98.1	Very high	52 Å²	52	45.5 Å²	45.5	28%	0.278	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-62.1	-24.4	170.8	52.4	-75.4	0	0	0	112.9	Q116 S158 T161	Q116-D118 PolarHBondContact O-N 2.72Å; Q116-D118 VanDerWaalsContact O-N 3.15Å; D118-S158 VanDerWaalsContact CG-OG 3.25Å; D118-S158 WeakPolarHBondContact OD1-CB 3.22Å; D118-S158 PolarHBondContact OD1-OG 2.89Å; D118-T161 HydrophobicContact CB-CG2 4.03Å
119	L	98.3	Very high	98.1	Very high	50 Å²	50	44.7 Å²	44.7	26%	0.262	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-88.7	-9.4	179.4	-58.3	-178.4	0	0	0	113.5	V85 Q116 I117 D121 D122 T125	V85-L119 HydrophobicContact CB-CB 4.39Å; V85-L119 HydrophobicContact CG1-CB 3.66Å; V85-L119 WeakPolarHBondContact CG1-O 3.31Å; V85-L119 HydrophobicContact CG2-CB 3.92Å; V85-L119 HydrophobicContact CG2-CD1 3.83Å; Q116-L119 HydrophobicContact CB-CD1 4.08Å; Q116-L119 HydrophobicContact CB-CG 4.39Å; Q116-L119 WeakPolarHBondContact O-CB 3.16Å; Q116-L119 PolarHBondContact O-N 3.2Å; I117-L119 PolarHBondContact O-N 2.87Å; L119-D121 VanDerWaalsContact C-N 3.29Å; L119-D121 PolarHBondContact O-N 3.17Å; L119-D122 HydrophobicContact CD2-CB 4.5Å; L119-D122 PolarHBondContact O-N 3.29Å; L119-T125 HydrophobicContact CB-CG2 4.32Å
120	R	98.1	Very high	98	Very high	39 Å²	39	46.6 Å²	46.6	15%	0.147	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-41.4	-175.6	179.8	178.5	-71.4	138.5	-6.2	112.2	V84 I117 P136 I137 E156	V84-R120 VanDerWaalsContact CG1-NH2 3.34Å; V84-R120 HydrophobicContact CG2-CB 4.19Å; I117-R120 WeakPolarHBondContact O-CB 3.34Å; I117-R120 PolarHBondContact O-N 2.83Å; R120-P136 HydrophobicContact CG-CB 3.91Å; R120-P136 WeakPolarHBondContact O-CG 3.3Å; R120-I137 PolarHBondContact NE-O 3.25Å; R120-I137 PolarHBondContact NH2-O 2.97Å; R120-E156 IonicContact CZ-OE1 2.95Å; R120-E156 IonicContact CZ-OE2 2.73Å; R120-E156 IonicContact NH1-OE1 2.89Å; R120-E156 IonicContact NH1-OE2 3.49Å; R120-E156 PolarHBondContact NH1-OE2 2.99Å; R120-E156 IonicContact NH2-OE1 3.26Å; R120-E156 PolarHBondContact NH2-OE1 2.73Å; R120-E156 IonicContact NH2-OE2 2.87Å; R120-E156 PolarHBondContact NH2-OE2 2.82Å
121	D	96.4	Very high	98	Very high	131 Å²	131	52.7 Å²	52.7	70%	0.701	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	6	-178.4	-57.6	-45.9	0	0	0	112.3	L119 P123	L119-D121 VanDerWaalsContact C-N 3.29Å; L119-D121 PolarHBondContact O-N 3.17Å; D121-P123 WeakPolarHBondContact O-CD 2.9Å
122	D	97.8	Very high	97.8	Very high	50 Å²	50	58.2 Å²	58.2	27%	0.267	31%	0.308	S	S	.	.			trans	-69.3	120.1	178.2	171.8	59.8	0	0	0	110.5	L119 S124 T125 I126	L119-D122 HydrophobicContact CD2-CB 4.5Å; L119-D122 PolarHBondContact O-N 3.29Å; D122-S124 VanDerWaalsContact C-N 3.26Å; D122-S124 PolarHBondContact O-N 2.85Å; D122-S124 WeakPolarHBondContact OD2-CB 3.45Å; D122-S124 PolarHBondContact OD2-N 3.46Å; D122-S124 PolarHBondContact OD2-OG 3.24Å; D122-T125 PolarHBondContact O-N 3.32Å; D122-T125 VanDerWaalsContact O-N 3.11Å; D122-T125 WeakPolarHBondContact OD2-CB 3.5Å; D122-T125 PolarHBondContact OD2-N 3.1Å; D122-T125 PolarHBondContact OD2-OG1 3.48Å; D122-I126 WeakPolarHBondContact O-CG1 3.48Å; D122-I126 PolarHBondContact O-N 3.34Å
123	P	97.8	Very high	97.8	Very high	101 Å²	101	68 Å²	68	66%	0.656	35%	0.35	S	S	*	.	H	α-helix	trans	-57.5	-38	-176.4	-27.1	35.3	0	0	0	113.4	D121 T125 I126 E127	D121-P123 WeakPolarHBondContact O-CD 2.9Å; P123-T125 VanDerWaalsContact C-N 3.33Å; P123-T125 PolarHBondContact O-N 2.91Å; P123-I126 PolarHBondContact O-N 3.33Å; P123-E127 WeakPolarHBondContact O-CB 3.5Å; P123-E127 PolarHBondContact O-N 3.46Å
124	S	97.5	Very high	97.7	Very high	54 Å²	54	71.3 Å²	71.3	38%	0.378	37%	0.365	S	S	.	.	H	α-helix	trans	-67.8	-37.5	-178.6	89.8	0	0	0	0	111.7	D122 K128	D122-S124 VanDerWaalsContact C-N 3.26Å; D122-S124 PolarHBondContact O-N 2.85Å; D122-S124 WeakPolarHBondContact OD2-CB 3.45Å; D122-S124 PolarHBondContact OD2-N 3.46Å; D122-S124 PolarHBondContact OD2-OG 3.24Å; S124-K128 WeakPolarHBondContact O-CD 3.36Å; S124-K128 VanDerWaalsContact O-CG 3.24Å; S124-K128 WeakPolarHBondContact O-CG 3.1Å; S124-K128 PolarHBondContact O-N 3.4Å; S124-K128 VanDerWaalsContact O-N 3.07Å
125	T	97.1	Very high	97.7	Very high	18 Å²	18	79.4 Å²	79.4	11%	0.11	40%	0.4	C	S	.	.	H	α-helix	trans	-71.4	-43.9	178.2	-60.2	0	0	0	0	110.9	V85 L119 D122 P123 E127 K128 L129	V85-T125 HydrophobicContact CB-CG2 3.63Å; V85-T125 HydrophobicContact CG1-CG2 3.64Å; V85-T125 HydrophobicContact CG2-CG2 4.12Å; L119-T125 HydrophobicContact CB-CG2 4.32Å; D122-T125 PolarHBondContact O-N 3.32Å; D122-T125 VanDerWaalsContact O-N 3.11Å; D122-T125 WeakPolarHBondContact OD2-CB 3.5Å; D122-T125 PolarHBondContact OD2-N 3.1Å; D122-T125 PolarHBondContact OD2-OG1 3.48Å; P123-T125 VanDerWaalsContact C-N 3.33Å; P123-T125 PolarHBondContact O-N 2.91Å; T125-E127 VanDerWaalsContact C-N 3.34Å; T125-E127 PolarHBondContact O-N 3.04Å; T125-K128 PolarHBondContact O-N 3.2Å; T125-L129 HydrophobicContact CG2-CD1 4.17Å; T125-L129 WeakPolarHBondContact O-CG 3.22Å; T125-L129 PolarHBondContact O-N 3.2Å
126	I	97.6	Very high	97.6	Very high	74 Å²	74	80.3 Å²	80.3	38%	0.379	41%	0.407	S	S	.	.	H	α-helix	trans	-58.8	-46	174.5	-67.3	168.8	0	0	0	110.6	D122 P123 K128 L129 A130 P136	D122-I126 WeakPolarHBondContact O-CG1 3.48Å; D122-I126 PolarHBondContact O-N 3.34Å; P123-I126 PolarHBondContact O-N 3.33Å; I126-K128 PolarHBondContact O-N 3.33Å; I126-L129 PolarHBondContact O-N 3.49Å; I126-A130 WeakPolarHBondContact O-CB 3.41Å; I126-A130 PolarHBondContact O-N 3.16Å; I126-P136 HydrophobicContact CG1-CG 4.34Å
127	E	97.9	Very high	97.7	Very high	111 Å²	111	78.6 Å²	78.6	52%	0.519	40%	0.399	S	S	.	.	H	α-helix	trans	-62.8	-43.3	179.1	-164.9	-159.7	140.3	0	0	112	P123 T125 A130 K131	P123-E127 WeakPolarHBondContact O-CB 3.5Å; P123-E127 PolarHBondContact O-N 3.46Å; T125-E127 VanDerWaalsContact C-N 3.34Å; T125-E127 PolarHBondContact O-N 3.04Å; E127-A130 PolarHBondContact O-N 2.86Å; E127-K131 WeakPolarHBondContact O-CG 3.31Å; E127-K131 PolarHBondContact O-N 3.48Å; E127-K131 VanDerWaalsContact O-N 3.13Å; E127-K131 WeakPolarHBondContact OE1-CE 3.38Å; E127-K131 IonicContact OE1-NZ 3.9Å; E127-K131 PolarHBondContact OE1-NZ 3.5Å
128	K	97.3	Very high	97.7	Very high	132 Å²	132	80.5 Å²	80.5	57%	0.574	41%	0.411	S	S	*	.	H	α-helix	trans	-60.8	-45.3	176.5	-75.6	167.7	-175	166.7	0	111.9	S124 T125 I126 K131	S124-K128 WeakPolarHBondContact O-CD 3.36Å; S124-K128 VanDerWaalsContact O-CG 3.24Å; S124-K128 WeakPolarHBondContact O-CG 3.1Å; S124-K128 PolarHBondContact O-N 3.4Å; S124-K128 VanDerWaalsContact O-N 3.07Å; T125-K128 PolarHBondContact O-N 3.2Å; I126-K128 PolarHBondContact O-N 3.33Å; K128-K131 WeakPolarHBondContact O-CB 3.42Å; K128-K131 PolarHBondContact O-N 3.27Å
129	L	97.3	Very high	97.7	Very high	15 Å²	15	80 Å²	80	8%	0.079	41%	0.411	C	S	.	.	H	α-helix	trans	-65.9	-40.7	177.5	-73.6	169.5	0	0	0	111.6	V85 P87 T125 I126 K131 N132 K133 Q134 P136	V85-L129 HydrophobicContact CB-CD1 4.23Å; P87-L129 HydrophobicContact CG-CD2 4.25Å; T125-L129 HydrophobicContact CG2-CD1 4.17Å; T125-L129 WeakPolarHBondContact O-CG 3.22Å; T125-L129 PolarHBondContact O-N 3.2Å; I126-L129 PolarHBondContact O-N 3.49Å; L129-K131 VanDerWaalsContact C-N 3.27Å; L129-K131 PolarHBondContact O-N 3.29Å; L129-N132 CarbonylContact O-C 3.58Å; L129-N132 WeakPolarHBondContact O-CA 3.41Å; L129-N132 PolarHBondContact O-N 3.47Å; L129-K133 PolarHBondContact O-N 2.96Å; L129-Q134 CarbonylContact C-O 3.31Å; L129-Q134 VanDerWaalsContact C-O 3.31Å; L129-Q134 HydrophobicContact CB-CB 4.18Å; L129-Q134 HydrophobicContact CD2-CB 3.94Å; L129-Q134 PolarHBondContact O-N 3.04Å; L129-P136 HydrophobicContact CD1-CG 3.79Å
130	A	97.4	Very high	97.7	Very high	59 Å²	59	83.4 Å²	83.4	49%	0.488	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-34.4	178.5	0	0	0	0	0	112.6	I126 E127 N132 K133	I126-A130 WeakPolarHBondContact O-CB 3.41Å; I126-A130 PolarHBondContact O-N 3.16Å; E127-A130 PolarHBondContact O-N 2.86Å; A130-N132 PolarHBondContact O-N 2.9Å; A130-K133 PolarHBondContact O-N 2.56Å
131	K	97.3	Very high	97.7	Very high	144 Å²	144	84.8 Å²	84.8	63%	0.626	44%	0.439	S	S	*	.	H	α-helix	trans	-57.9	-31.1	173.2	-72.6	170.2	-175.7	165.6	0	112.6	E127 K128 L129	E127-K131 WeakPolarHBondContact O-CG 3.31Å; E127-K131 PolarHBondContact O-N 3.48Å; E127-K131 VanDerWaalsContact O-N 3.13Å; E127-K131 WeakPolarHBondContact OE1-CE 3.38Å; E127-K131 IonicContact OE1-NZ 3.9Å; E127-K131 PolarHBondContact OE1-NZ 3.5Å; K128-K131 WeakPolarHBondContact O-CB 3.42Å; K128-K131 PolarHBondContact O-N 3.27Å; L129-K131 VanDerWaalsContact C-N 3.27Å; L129-K131 PolarHBondContact O-N 3.29Å
132	N	96.1	Very high	97.8	Very high	117 Å²	117	78.6 Å²	78.6	63%	0.626	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	14.4	176.1	-63.8	-26.9	0	0	0	113.1	L129 A130 Q134	L129-N132 CarbonylContact O-C 3.58Å; L129-N132 WeakPolarHBondContact O-CA 3.41Å; L129-N132 PolarHBondContact O-N 3.47Å; A130-N132 PolarHBondContact O-N 2.9Å; N132-Q134 HydrophobicContact CB-CG 4.46Å; N132-Q134 PolarHBondContact O-N 3.45Å
133	K	97.4	Very high	97.9	Very high	205 Å²	205	80.3 Å²	80.3	89%	0.891	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	26.6	-175.3	-54.4	178.5	-178.7	176.5	0	113.7	L129 A130	L129-K133 PolarHBondContact O-N 2.96Å; A130-K133 PolarHBondContact O-N 2.56Å
134	Q	97.8	Very high	97.9	Very high	70 Å²	70	81.4 Å²	81.4	33%	0.327	41%	0.406	S	S	.	.			trans	-105.4	165.2	179.4	-76.2	177.2	-27.1	0	0	111	P87 L129 N132	P87-Q134 HydrophobicContact CG-CB 4.11Å; P87-Q134 HydrophobicContact CG-CG 4.21Å; L129-Q134 CarbonylContact C-O 3.31Å; L129-Q134 VanDerWaalsContact C-O 3.31Å; L129-Q134 HydrophobicContact CB-CB 4.18Å; L129-Q134 HydrophobicContact CD2-CB 3.94Å; L129-Q134 PolarHBondContact O-N 3.04Å; N132-Q134 HydrophobicContact CB-CG 4.46Å; N132-Q134 PolarHBondContact O-N 3.45Å
135	K	98	Very high	98	Very high	170 Å²	170	79.8 Å²	79.8	74%	0.739	39%	0.393	S	S	*	.			trans	-138.1	155.9	173.8	-65.3	-176.4	-179	-179	0	109.5
136	P	98.5	Very high	98	Very high	24 Å²	24	79.2 Å²	79.2	16%	0.156	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-54.5	147.2	168.2	-24.9	34.4	0	0	0	111.7	V84 V85 R120 I126 L129 T138	V84-P136 CarbonylContact O-C 3.42Å; V84-P136 VanDerWaalsContact O-CA 3.25Å; V84-P136 WeakPolarHBondContact O-CA 3.29Å; V85-P136 HydrophobicContact CG1-CB 4.34Å; V85-P136 HydrophobicContact CG1-CG 4.46Å; R120-P136 HydrophobicContact CG-CB 3.91Å; R120-P136 WeakPolarHBondContact O-CG 3.3Å; I126-P136 HydrophobicContact CG1-CG 4.34Å; L129-P136 HydrophobicContact CD1-CG 3.79Å; P136-T138 PolarHBondContact O-N 3.08Å
137	I	98.7	Very high	98.1	Very high	17 Å²	17	83.1 Å²	83.1	9%	0.087	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-71.6	126.3	176	-54.1	-56.5	0	0	0	109.1	F82 V84 P87 F90 R120 T141 A142	F82-I137 HydrophobicContact CE2-CB 4.07Å; F82-I137 HydrophobicContact CE2-CG1 4.18Å; F82-I137 HydrophobicContact CE2-CG2 3.94Å; F82-I137 HydrophobicContact CZ-CG2 4.3Å; V84-I137 PolarHBondContact O-N 3.26Å; P87-I137 HydrophobicContact CB-CD1 4.25Å; P87-I137 HydrophobicContact CG-CD1 4.42Å; F90-I137 HydrophobicContact CB-CD1 4.1Å; F90-I137 HydrophobicContact CB-CG1 3.98Å; F90-I137 HydrophobicContact CD1-CD1 3.9Å; F90-I137 HydrophobicContact CD1-CG1 4.39Å; F90-I137 HydrophobicContact CD1-CG2 4.47Å; F90-I137 HydrophobicContact CD2-CG1 4.48Å; F90-I137 HydrophobicContact CD2-CG2 4.04Å; F90-I137 HydrophobicContact CE1-CG2 4.43Å; F90-I137 HydrophobicContact CE2-CG2 3.99Å; F90-I137 HydrophobicContact CG-CD1 4.04Å; F90-I137 HydrophobicContact CG-CG1 4.04Å; F90-I137 HydrophobicContact CG-CG2 4.26Å; F90-I137 HydrophobicContact CZ-CG2 4.18Å; R120-I137 PolarHBondContact NE-O 3.25Å; R120-I137 PolarHBondContact NH2-O 2.97Å; I137-T141 HydrophobicContact CG2-CG2 4.45Å; I137-A142 HydrophobicContact CG2-CB 4.07Å
138	T	98.5	Very high	98.1	Very high	57 Å²	57	83 Å²	83	35%	0.35	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-82.3	152.8	177	82.2	0	0	0	0	110.9	P136 E140 T141 A142	P136-T138 PolarHBondContact O-N 3.08Å; T138-E140 VanDerWaalsContact C-N 3.25Å; T138-E140 WeakPolarHBondContact CB-OE2 3.5Å; T138-E140 PolarHBondContact O-N 3.38Å; T138-E140 PolarHBondContact OG1-OE2 2.64Å; T138-T141 PolarHBondContact O-N 2.79Å; T138-T141 PolarHBondContact OG1-N 3.19Å; T138-T141 PolarHBondContact OG1-OG1 2.9Å; T138-A142 PolarHBondContact O-N 3.24Å; T138-A142 VanDerWaalsContact O-N 3.16Å
139	P	98.5	Very high	98.1	Very high	41 Å²	41	78.2 Å²	78.2	27%	0.266	38%	0.384	S	S	.	.	H	α-helix	trans	-53.6	-42.6	175.9	-25.6	34.1	0	0	0	112.6	T141 A142 E143 E156	P139-T141 VanDerWaalsContact C-N 3.3Å; P139-T141 PolarHBondContact O-N 3.13Å; P139-A142 PolarHBondContact O-N 2.89Å; P139-E143 WeakPolarHBondContact O-CB 3.32Å; P139-E143 WeakPolarHBondContact O-CG 3.11Å; P139-E143 PolarHBondContact O-N 2.89Å; P139-E156 WeakPolarHBondContact CG-OE1 3.31Å
140	E	98.6	Very high	98.1	Very high	123 Å²	123	86.1 Å²	86.1	58%	0.575	42%	0.417	S	S	*	.	H	α-helix	trans	-64.2	-37.3	-176.9	-54.1	73.3	-158.5	0	0	111.9	T138 K144	T138-E140 VanDerWaalsContact C-N 3.25Å; T138-E140 WeakPolarHBondContact CB-OE2 3.5Å; T138-E140 PolarHBondContact O-N 3.38Å; T138-E140 PolarHBondContact OG1-OE2 2.64Å; E140-K144 WeakPolarHBondContact O-CB 3.47Å; E140-K144 PolarHBondContact O-N 3.39Å; E140-K144 VanDerWaalsContact O-N 3.07Å
141	T	98.4	Very high	98.1	Very high	68 Å²	68	84 Å²	84	42%	0.417	40%	0.4	S	S	.	.	H	α-helix	trans	-66.8	-44.8	177.5	-57.5	0	0	0	0	110.4	F90 I137 T138 P139 K144 L145	F90-T141 HydrophobicContact CE1-CG2 3.87Å; F90-T141 HydrophobicContact CZ-CG2 3.96Å; I137-T141 HydrophobicContact CG2-CG2 4.45Å; T138-T141 PolarHBondContact O-N 2.79Å; T138-T141 PolarHBondContact OG1-N 3.19Å; T138-T141 PolarHBondContact OG1-OG1 2.9Å; P139-T141 VanDerWaalsContact C-N 3.3Å; P139-T141 PolarHBondContact O-N 3.13Å; T141-K144 WeakPolarHBondContact O-CB 3.47Å; T141-K144 PolarHBondContact O-N 2.8Å; T141-L145 PolarHBondContact O-N 3.37Å; T141-L145 VanDerWaalsContact O-N 3.13Å
142	A	98.7	Very high	98.2	Very high	0 Å²	0	79.9 Å²	79.9	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-71.5	-38.3	-180	0	0	0	0	0	113	F82 F90 L112 I137 T138 P139 K144 L145 A146 Y154	F82-A142 HydrophobicContact CE1-CB 4.36Å; F82-A142 HydrophobicContact CZ-CB 3.75Å; F90-A142 HydrophobicContact CE2-CB 3.83Å; F90-A142 HydrophobicContact CZ-CB 4.37Å; L112-A142 WeakPolarHBondContact CD2-O 3.46Å; I137-A142 HydrophobicContact CG2-CB 4.07Å; T138-A142 PolarHBondContact O-N 3.24Å; T138-A142 VanDerWaalsContact O-N 3.16Å; P139-A142 PolarHBondContact O-N 2.89Å; A142-K144 VanDerWaalsContact C-N 3.3Å; A142-K144 PolarHBondContact O-N 3.5Å; A142-L145 PolarHBondContact O-N 2.84Å; A142-A146 PolarHBondContact O-N 2.93Å; A142-Y154 HydrophobicContact CB-CD1 4.15Å; A142-Y154 HydrophobicContact CB-CD2 4.09Å; A142-Y154 HydrophobicContact CB-CE1 3.56Å; A142-Y154 HydrophobicContact CB-CE2 3.55Å; A142-Y154 HydrophobicContact CB-CG 4.37Å; A142-Y154 VanDerWaalsContact CB-OH 3.31Å; A142-Y154 WeakPolarHBondContact CB-OH 3.37Å
143	E	98.7	Very high	98.3	Very high	86 Å²	86	78.4 Å²	78.4	40%	0.402	38%	0.375	S	S	.	.	H	α-helix	trans	-60.3	-40.1	171.6	-76.8	-175.1	-173.8	0	0	112.3	P139 L145 A146 R147 Y154	P139-E143 WeakPolarHBondContact O-CB 3.32Å; P139-E143 WeakPolarHBondContact O-CG 3.11Å; P139-E143 PolarHBondContact O-N 2.89Å; E143-L145 VanDerWaalsContact C-N 3.35Å; E143-A146 PolarHBondContact O-N 3.05Å; E143-R147 WeakPolarHBondContact O-CG 3.35Å; E143-R147 PolarHBondContact O-N 3.1Å; E143-R147 IonicContact OE2-NH1 3.46Å; E143-R147 PolarHBondContact OE2-NH1 3.2Å; E143-Y154 HydrophobicContact CB-CD1 4.48Å; E143-Y154 HydrophobicContact CG-CD1 3.62Å; E143-Y154 HydrophobicContact CG-CE1 4.43Å; E143-Y154 HydrophobicContact CG-CG 4.36Å
144	K	98.7	Very high	98.3	Very high	125 Å²	125	69.9 Å²	69.9	54%	0.543	34%	0.337	S	S	.	.	H	α-helix	trans	-60.9	-46.9	175	-175.7	-176.9	175.4	-174.1	0	110.5	E140 T141 A142 A146 R147 D148	E140-K144 WeakPolarHBondContact O-CB 3.47Å; E140-K144 PolarHBondContact O-N 3.39Å; E140-K144 VanDerWaalsContact O-N 3.07Å; T141-K144 WeakPolarHBondContact O-CB 3.47Å; T141-K144 PolarHBondContact O-N 2.8Å; A142-K144 VanDerWaalsContact C-N 3.3Å; A142-K144 PolarHBondContact O-N 3.5Å; K144-A146 PolarHBondContact O-N 3.1Å; K144-R147 PolarHBondContact O-N 2.97Å; K144-D148 VanDerWaalsContact O-CG 3.28Å; K144-D148 PolarHBondContact O-N 2.99Å
145	L	98.6	Very high	98.4	Very high	19 Å²	19	66.8 Å²	66.8	10%	0.099	32%	0.323	C	S	.	.	H	α-helix	trans	-61.6	-43.3	176.9	-174.9	65.8	0	0	0	111.9	F90 V93 K94 L112 T141 A142 E143 R147 D148 L149	F90-L145 HydrophobicContact CD1-CD2 4.46Å; F90-L145 HydrophobicContact CD2-CD2 3.89Å; F90-L145 HydrophobicContact CE1-CD2 3.98Å; F90-L145 HydrophobicContact CE2-CB 4.01Å; F90-L145 HydrophobicContact CE2-CD2 3.36Å; F90-L145 HydrophobicContact CE2-CG 4.31Å; F90-L145 HydrophobicContact CG-CD2 4.43Å; F90-L145 HydrophobicContact CZ-CB 3.61Å; F90-L145 HydrophobicContact CZ-CD2 3.42Å; F90-L145 VanDerWaalsContact CZ-CD2 3.42Å; F90-L145 HydrophobicContact CZ-CG 4.1Å; V93-L145 HydrophobicContact CB-CD2 4.15Å; V93-L145 HydrophobicContact CG1-CD2 4.08Å; K94-L145 HydrophobicContact CB-CD1 4.35Å; K94-L145 HydrophobicContact CD-CD1 4.48Å; L112-L145 HydrophobicContact CD2-CB 4.37Å; L112-L145 HydrophobicContact CD2-CD2 4.36Å; L112-L145 HydrophobicContact CD2-CG 4.46Å; T141-L145 PolarHBondContact O-N 3.37Å; T141-L145 VanDerWaalsContact O-N 3.13Å; A142-L145 PolarHBondContact O-N 2.84Å; E143-L145 VanDerWaalsContact C-N 3.35Å; L145-R147 VanDerWaalsContact C-N 3.3Å; L145-R147 PolarHBondContact O-N 2.62Å; L145-D148 PolarHBondContact O-N 3.42Å; L145-L149 HydrophobicContact CD1-CD1 3.73Å; L145-L149 HydrophobicContact CD1-CD2 4.49Å; L145-L149 HydrophobicContact CD1-CG 3.9Å; L145-L149 HydrophobicContact CD2-CD1 4.14Å; L145-L149 HydrophobicContact CG-CD1 3.67Å; L145-L149 HydrophobicContact CG-CG 4.14Å; L145-L149 WeakPolarHBondContact O-CB 3.39Å; L145-L149 WeakPolarHBondContact O-CG 3.2Å; L145-L149 PolarHBondContact O-N 2.92Å
146	A	98.6	Very high	98.4	Very high	6 Å²	6	60.5 Å²	60.5	5%	0.05	30%	0.297	C	S	.	.	H	α-helix	trans	-57	-43.4	176.6	0	0	0	0	0	112	L112 A142 E143 K144 K150 A151	L112-A146 HydrophobicContact CB-CB 4.13Å; L112-A146 HydrophobicContact CD2-CB 3.86Å; A142-A146 PolarHBondContact O-N 2.93Å; E143-A146 PolarHBondContact O-N 3.05Å; K144-A146 PolarHBondContact O-N 3.1Å; A146-K150 PolarHBondContact O-N 2.95Å; A146-A151 HydrophobicContact CB-CB 4.03Å; A146-A151 PolarHBondContact O-N 3.15Å
147	R	98.3	Very high	98.4	Very high	157 Å²	157	59.5 Å²	59.5	59%	0.592	29%	0.29	S	S	*	.	H	α-helix	trans	-63.9	-46.2	174.8	-72.2	-173.6	-67.8	-93.9	0.8	112.1	E143 K144 L145 L149 K150	E143-R147 WeakPolarHBondContact O-CG 3.35Å; E143-R147 PolarHBondContact O-N 3.1Å; E143-R147 IonicContact OE2-NH1 3.46Å; E143-R147 PolarHBondContact OE2-NH1 3.2Å; K144-R147 PolarHBondContact O-N 2.97Å; L145-R147 VanDerWaalsContact C-N 3.3Å; L145-R147 PolarHBondContact O-N 2.62Å; R147-L149 VanDerWaalsContact C-N 3.29Å; R147-L149 PolarHBondContact O-N 3Å; R147-K150 PolarHBondContact O-N 2.91Å; R147-K150 VanDerWaalsContact O-N 3.15Å
148	D	98.1	Very high	98.4	Very high	109 Å²	109	58.7 Å²	58.7	58%	0.583	29%	0.286	S	S	*	.	H	α-helix	trans	-62.5	-38.1	-179	-69.9	-14.4	0	0	0	111.6	K144 L145 K150	K144-D148 VanDerWaalsContact O-CG 3.28Å; K144-D148 PolarHBondContact O-N 2.99Å; L145-D148 PolarHBondContact O-N 3.42Å; D148-K150 VanDerWaalsContact C-N 3.35Å
149	L	97.9	Very high	98.3	Very high	31 Å²	31	56.5 Å²	56.5	16%	0.162	27%	0.273	C	S	.	.	H	α-helix	trans	-86.5	-3.6	178.5	-60.4	-178.9	0	0	0	113.8	V93 K94 V98 F110 L145 R147 A151	V93-L149 HydrophobicContact CG1-CD1 3.6Å; K94-L149 HydrophobicContact CB-CD1 4.35Å; K94-L149 HydrophobicContact CB-CD2 4.31Å; K94-L149 HydrophobicContact CG-CD2 4.09Å; V98-L149 HydrophobicContact CB-CD1 4.41Å; V98-L149 HydrophobicContact CG2-CD1 3.88Å; F110-L149 HydrophobicContact CZ-CB 4.1Å; F110-L149 WeakPolarHBondContact CZ-O 3.18Å; L145-L149 HydrophobicContact CD1-CD1 3.73Å; L145-L149 HydrophobicContact CD1-CD2 4.49Å; L145-L149 HydrophobicContact CD1-CG 3.9Å; L145-L149 HydrophobicContact CD2-CD1 4.14Å; L145-L149 HydrophobicContact CG-CD1 3.67Å; L145-L149 HydrophobicContact CG-CG 4.14Å; L145-L149 WeakPolarHBondContact O-CB 3.39Å; L145-L149 WeakPolarHBondContact O-CG 3.2Å; L145-L149 PolarHBondContact O-N 2.92Å; R147-L149 VanDerWaalsContact C-N 3.29Å; R147-L149 PolarHBondContact O-N 3Å; L149-A151 VanDerWaalsContact C-N 3.27Å; L149-A151 PolarHBondContact O-N 3.35Å
150	K	97.2	Very high	98.2	Very high	180 Å²	180	59.1 Å²	59.1	78%	0.783	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	36	-177.4	-50.4	170.8	-174.8	166.7	0	113.2	A146 R147 D148	A146-K150 PolarHBondContact O-N 2.95Å; R147-K150 PolarHBondContact O-N 2.91Å; R147-K150 VanDerWaalsContact O-N 3.15Å; D148-K150 VanDerWaalsContact C-N 3.35Å
151	A	98.2	Very high	98.1	Very high	16 Å²	16	57.2 Å²	57.2	13%	0.132	28%	0.282	C	S	.	.			trans	-58.7	148.4	165.3	0	0	0	0	0	109.3	F110 L112 A146 L149 K153	F110-A151 HydrophobicContact CD2-CB 3.97Å; F110-A151 HydrophobicContact CE2-CB 3.46Å; F110-A151 VanDerWaalsContact CE2-CB 3.46Å; F110-A151 HydrophobicContact CZ-CB 3.82Å; L112-A151 HydrophobicContact CB-CB 4.2Å; A146-A151 HydrophobicContact CB-CB 4.03Å; A146-A151 PolarHBondContact O-N 3.15Å; L149-A151 VanDerWaalsContact C-N 3.27Å; L149-A151 PolarHBondContact O-N 3.35Å; A151-K153 VanDerWaalsContact C-N 3.28Å; A151-K153 PolarHBondContact O-N 3.05Å
152	V	97.9	Very high	98	Very high	57 Å²	57	58 Å²	58	35%	0.345	28%	0.281	S	S	.	.	S	Bend	trans	-63.1	-41.6	175.9	179.8	0	0	0	0	110.1	P109 F110 L111 A175 P180	P109-V152 HydrophobicContact CB-CG2 3.56Å; F110-V152 PolarHBondContact O-N 3.23Å; L111-V152 HydrophobicContact CD2-CB 3.87Å; L111-V152 HydrophobicContact CD2-CG1 4.39Å; V152-A175 HydrophobicContact CB-CB 4.25Å; V152-A175 HydrophobicContact CG1-CB 3.95Å; V152-A175 HydrophobicContact CG2-CB 4.23Å; V152-P180 HydrophobicContact CB-CG 4.5Å; V152-P180 HydrophobicContact CG1-CG 4.36Å; V152-P180 HydrophobicContact CG2-CG 3.6Å
153	K	98.1	Very high	98	Very high	85 Å²	85	64.9 Å²	64.9	37%	0.37	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	156.5	176.2	-152.1	172.5	-174.1	166.8	0	111.6	L111 L112 A151 V155 E171	L111-K153 HydrophobicContact CD2-CB 3.85Å; L112-K153 PolarHBondContact N-O 3.37Å; A151-K153 VanDerWaalsContact C-N 3.28Å; A151-K153 PolarHBondContact O-N 3.05Å; K153-V155 HydrophobicContact CD-CG1 4.26Å; K153-V155 HydrophobicContact CG-CG1 4.44Å; K153-E171 HydrophobicContact CD-CG 4.06Å; K153-E171 WeakPolarHBondContact CD-OE2 3.38Å; K153-E171 IonicContact NZ-OE1 2.67Å; K153-E171 PolarHBondContact NZ-OE1 2.88Å; K153-E171 IonicContact NZ-OE2 3.52Å; K153-E171 PolarHBondContact NZ-OE2 2.68Å
154	Y	98.8	Very high	97.9	Very high	27 Å²	27	62.2 Å²	62.2	11%	0.106	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	132.6	160.4	177.2	-123.3	0	0	0	109.7	F82 L112 A142 E143 E156	F82-Y154 AromaticContact CE1-CE2 3.76Å; F82-Y154 HydrophobicContact CE1-CE2 3.76Å; F82-Y154 AromaticContact CZ-CE2 3.89Å; F82-Y154 HydrophobicContact CZ-CE2 3.89Å; L112-Y154 HydrophobicContact CB-CD2 4.06Å; L112-Y154 HydrophobicContact CD2-CD2 3.95Å; L112-Y154 HydrophobicContact CD2-CE2 4.44Å; L112-Y154 HydrophobicContact CG-CD2 3.84Å; L112-Y154 HydrophobicContact CG-CE2 4.3Å; L112-Y154 WeakPolarHBondContact O-CA 3.35Å; L112-Y154 VanDerWaalsContact O-CD2 3.31Å; L112-Y154 WeakPolarHBondContact O-CD2 3.25Å; A142-Y154 HydrophobicContact CB-CD1 4.15Å; A142-Y154 HydrophobicContact CB-CD2 4.09Å; A142-Y154 HydrophobicContact CB-CE1 3.56Å; A142-Y154 HydrophobicContact CB-CE2 3.55Å; A142-Y154 HydrophobicContact CB-CG 4.37Å; A142-Y154 VanDerWaalsContact CB-OH 3.31Å; A142-Y154 WeakPolarHBondContact CB-OH 3.37Å; E143-Y154 HydrophobicContact CB-CD1 4.48Å; E143-Y154 HydrophobicContact CG-CD1 3.62Å; E143-Y154 HydrophobicContact CG-CE1 4.43Å; E143-Y154 HydrophobicContact CG-CG 4.36Å; Y154-E156 HydrophobicContact CE1-CG 3.64Å; Y154-E156 WeakPolarHBondContact CE1-OE1 3.37Å; Y154-E156 HydrophobicContact CE2-CG 4.25Å; Y154-E156 WeakPolarHBondContact OH-CG 3.33Å; Y154-E156 PolarHBondContact OH-OE1 2.96Å
155	V	98.8	Very high	97.8	Very high	5 Å²	5	56.6 Å²	56.6	3%	0.03	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	150	175.4	-68.3	0	0	0	0	110.5	L111 L112 V113 G114 K153 V168 E171	L111-V155 HydrophobicContact CD1-CG2 4.26Å; L112-V155 PolarHBondContact O-N 3.4Å; V113-V155 CarbonylContact C-O 3.44Å; V113-V155 WeakPolarHBondContact CA-O 3.2Å; V113-V155 HydrophobicContact CB-CG2 4.4Å; V113-V155 HydrophobicContact CG1-CG2 4.33Å; V113-V155 HydrophobicContact CG2-CG2 3.88Å; G114-V155 PolarHBondContact N-O 3.47Å; K153-V155 HydrophobicContact CD-CG1 4.26Å; K153-V155 HydrophobicContact CG-CG1 4.44Å; V155-V168 HydrophobicContact CB-CG2 4.34Å; V155-V168 HydrophobicContact CG2-CB 4.34Å; V155-V168 HydrophobicContact CG2-CG1 4.31Å; V155-V168 HydrophobicContact CG2-CG2 3.87Å; V155-E171 HydrophobicContact CG1-CB 4.32Å; V155-E171 HydrophobicContact CG1-CG 4.04Å
156	E	98.8	Very high	97.6	Very high	38 Å²	38	61.8 Å²	61.8	18%	0.178	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	144.2	-180	-80.3	-169.4	-178.3	0	0	111.4	G114 I117 R120 P139 Y154	G114-E156 CarbonylContact O-C 3.36Å; G114-E156 VanDerWaalsContact O-CA 3.31Å; G114-E156 WeakPolarHBondContact O-CA 3.41Å; I117-E156 HydrophobicContact CD1-CB 4.39Å; I117-E156 HydrophobicContact CG2-CB 3.88Å; I117-E156 HydrophobicContact CG2-CG 4.11Å; R120-E156 IonicContact CZ-OE1 2.95Å; R120-E156 IonicContact CZ-OE2 2.73Å; R120-E156 IonicContact NH1-OE1 2.89Å; R120-E156 IonicContact NH1-OE2 3.49Å; R120-E156 PolarHBondContact NH1-OE2 2.99Å; R120-E156 IonicContact NH2-OE1 3.26Å; R120-E156 PolarHBondContact NH2-OE1 2.73Å; R120-E156 IonicContact NH2-OE2 2.87Å; R120-E156 PolarHBondContact NH2-OE2 2.82Å; P139-E156 WeakPolarHBondContact CG-OE1 3.31Å; Y154-E156 HydrophobicContact CE1-CG 3.64Å; Y154-E156 WeakPolarHBondContact CE1-OE1 3.37Å; Y154-E156 HydrophobicContact CE2-CG 4.25Å; Y154-E156 WeakPolarHBondContact OH-CG 3.33Å; Y154-E156 PolarHBondContact OH-OE1 2.96Å
157	C	98.7	Very high	97.6	Very high	2 Å²	2	64.7 Å²	64.7	1%	0.014	32%	0.318	C	S	.	.			trans	-151.5	159.5	175.8	70.3	0	0	0	0	114.1	L19 G114 T115 Q116 I117 K163 V168	L19-C157 VanDerWaalsContact CD1-SG 3.5Å; G114-C157 PolarHBondContact O-N 3.07Å; T115-C157 CarbonylContact C-O 3.59Å; T115-C157 WeakPolarHBondContact CA-O 3.47Å; Q116-C157 PolarHBondContact N-O 3.34Å; Q116-C157 VanDerWaalsContact N-O 3.11Å; I117-C157 PolarHBondContact N-O 2.89Å; C157-K163 CarbonylContact C-O 3.47Å; C157-K163 WeakPolarHBondContact CA-O 3.21Å; C157-V168 HydrophobicContact CB-CG2 3.78Å
158	S	98.4	Very high	97.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.			trans	-122.6	115.2	164.3	166.7	0	0	0	0	107.2	D118 L160 T161 Q162 K163	D118-S158 VanDerWaalsContact CG-OG 3.25Å; D118-S158 WeakPolarHBondContact OD1-CB 3.22Å; D118-S158 PolarHBondContact OD1-OG 2.89Å; S158-L160 PolarHBondContact O-N 3.25Å; S158-L160 PolarHBondContact OG-N 3.08Å; S158-T161 WeakPolarHBondContact CB-OG1 3.45Å; S158-T161 PolarHBondContact OG-N 3.26Å; S158-T161 PolarHBondContact OG-OG1 3.48Å; S158-Q162 CarbonylContact O-C 3.59Å; S158-Q162 WeakPolarHBondContact O-CA 3.31Å; S158-Q162 PolarHBondContact O-N 2.93Å; S158-K163 PolarHBondContact N-O 3.15Å; S158-K163 PolarHBondContact O-N 2.65Å
159	A	97.2	Very high	97.6	Very high	11 Å²	11	52 Å²	52	9%	0.091	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-34.2	172.8	0	0	0	0	0	111.2	C18 S22 F28	C18-A159 HydrophobicContact CB-CB 3.87Å; S22-A159 PolarHBondContact OG-O 3.01Å; F28-A159 HydrophobicContact CD2-CB 3.99Å; F28-A159 HydrophobicContact CE2-CB 3.92Å
160	L	95.7	Very high	97.5	Very high	97 Å²	97	53.1 Å²	53.1	51%	0.508	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-50.2	-179.1	178.8	62.9	0	0	0	112.3	F28 S158	F28-L160 HydrophobicContact CB-CD1 4.38Å; F28-L160 HydrophobicContact CD1-CD1 3.93Å; F28-L160 VanDerWaalsContact CD2-CA 3.44Å; F28-L160 HydrophobicContact CD2-CB 4.07Å; F28-L160 HydrophobicContact CD2-CD1 4.3Å; F28-L160 HydrophobicContact CE1-CD1 4.25Å; F28-L160 HydrophobicContact CE2-CB 4.06Å; F28-L160 HydrophobicContact CG-CD1 3.94Å; S158-L160 PolarHBondContact O-N 3.25Å; S158-L160 PolarHBondContact OG-N 3.08Å
161	T	96.5	Very high	97.5	Very high	83 Å²	83	46.2 Å²	46.2	51%	0.509	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-4.1	-178.9	65.4	0	0	0	0	112.9	D118 S158 K163	D118-T161 HydrophobicContact CB-CG2 4.03Å; S158-T161 WeakPolarHBondContact CB-OG1 3.45Å; S158-T161 PolarHBondContact OG-N 3.26Å; S158-T161 PolarHBondContact OG-OG1 3.48Å; T161-K163 PolarHBondContact O-N 3.31Å; T161-K163 WeakPolarHBondContact OG1-CB 3.41Å; T161-K163 PolarHBondContact OG1-N 3.42Å
162	Q	95.9	Very high	97.5	Very high	85 Å²	85	45.5 Å²	45.5	40%	0.397	23%	0.233	S	C	.	.			trans	59.5	6.8	-172.2	-57.5	178.9	-8.9	0	0	114.9	N26 S158 G164 L165	N26-Q162 PolarHBondContact O-NE2 2.89Å; S158-Q162 CarbonylContact O-C 3.59Å; S158-Q162 WeakPolarHBondContact O-CA 3.31Å; S158-Q162 PolarHBondContact O-N 2.93Å; Q162-G164 PolarHBondContact O-N 2.75Å; Q162-L165 HydrophobicContact CB-CD2 4.23Å; Q162-L165 HydrophobicContact CG-CD2 4.1Å; Q162-L165 VanDerWaalsContact O-CB 3.3Å; Q162-L165 WeakPolarHBondContact O-CB 3.14Å; Q162-L165 PolarHBondContact O-N 2.96Å
163	K	98.2	Very high	97.4	Very high	144 Å²	144	43.2 Å²	43.2	63%	0.626	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	126.5	175.7	-175.3	177.5	177.2	-177	0	110	I117 C157 S158 T161 L165	I117-K163 HydrophobicContact CD1-CB 4.43Å; I117-K163 HydrophobicContact CD1-CD 3.93Å; I117-K163 HydrophobicContact CD1-CG 4.11Å; C157-K163 CarbonylContact C-O 3.47Å; C157-K163 WeakPolarHBondContact CA-O 3.21Å; S158-K163 PolarHBondContact N-O 3.15Å; S158-K163 PolarHBondContact O-N 2.65Å; T161-K163 PolarHBondContact O-N 3.31Å; T161-K163 WeakPolarHBondContact OG1-CB 3.41Å; T161-K163 PolarHBondContact OG1-N 3.42Å; K163-L165 PolarHBondContact O-N 3.33Å; K163-L165 VanDerWaalsContact O-N 3.16Å
164	G	97.9	Very high	97.3	Very high	29 Å²	29	43.2 Å²	43.2	30%	0.299	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	-3.1	178.3	0	0	0	0	0	115.3	Q162 K166 N167 V168	Q162-G164 PolarHBondContact O-N 2.75Å; G164-K166 PolarHBondContact O-N 2.75Å; G164-N167 WeakPolarHBondContact O-CB 3.39Å; G164-N167 PolarHBondContact O-N 2.83Å; G164-V168 PolarHBondContact O-N 3.29Å
165	L	96.1	Very high	97.1	Very high	8 Å²	8	42 Å²	42	4%	0.042	22%	0.218	C	C	.	.	H	α-helix	trans	-59.9	-52.9	-172.2	-176.6	61.3	0	0	0	112.7	L19 Q162 K163 N167 V168 F169	L19-L165 HydrophobicContact CD1-CD1 3.37Å; L19-L165 HydrophobicContact CG-CD1 4.32Å; Q162-L165 HydrophobicContact CB-CD2 4.23Å; Q162-L165 HydrophobicContact CG-CD2 4.1Å; Q162-L165 VanDerWaalsContact O-CB 3.3Å; Q162-L165 WeakPolarHBondContact O-CB 3.14Å; Q162-L165 PolarHBondContact O-N 2.96Å; K163-L165 PolarHBondContact O-N 3.33Å; K163-L165 VanDerWaalsContact O-N 3.16Å; L165-N167 VanDerWaalsContact C-N 3.28Å; L165-N167 PolarHBondContact O-N 2.66Å; L165-V168 PolarHBondContact O-N 3.28Å; L165-F169 HydrophobicContact CD1-CE2 4.03Å; L165-F169 VanDerWaalsContact O-CD2 3.29Å; L165-F169 WeakPolarHBondContact O-CD2 3.31Å
166	K	95.3	Very high	97	Very high	128 Å²	128	42.7 Å²	42.7	56%	0.557	22%	0.224	S	C	*	.	H	α-helix	trans	-59	-40.4	177.3	-170.3	-170.2	-178.3	-58.2	0	112	G164 V168 F169 D170	G164-K166 PolarHBondContact O-N 2.75Å; K166-V168 VanDerWaalsContact C-N 3.29Å; K166-V168 PolarHBondContact O-N 3.03Å; K166-F169 PolarHBondContact O-N 2.97Å; K166-F169 VanDerWaalsContact O-N 3.15Å; K166-D170 IonicContact NZ-OD1 2.97Å; K166-D170 PolarHBondContact NZ-OD1 2.95Å; K166-D170 IonicContact NZ-OD2 2.74Å; K166-D170 PolarHBondContact NZ-OD2 3.46Å; K166-D170 PolarHBondContact O-N 2.74Å
167	N	97.6	Very high	96.7	Very high	67 Å²	67	44 Å²	44	36%	0.358	23%	0.232	S	C	.	.	H	α-helix	trans	-61.7	-35.6	-178.2	-174.4	76.4	0	0	0	112.3	G164 L165 F169 D170 E171	G164-N167 WeakPolarHBondContact O-CB 3.39Å; G164-N167 PolarHBondContact O-N 2.83Å; L165-N167 VanDerWaalsContact C-N 3.28Å; L165-N167 PolarHBondContact O-N 2.66Å; N167-F169 VanDerWaalsContact C-N 3.31Å; N167-F169 PolarHBondContact O-N 2.8Å; N167-D170 PolarHBondContact O-N 3.41Å; N167-E171 WeakPolarHBondContact O-CB 3.48Å; N167-E171 WeakPolarHBondContact O-CG 3.39Å; N167-E171 PolarHBondContact O-N 2.92Å
168	V	98.4	Very high	96.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-56.3	-47.3	175.1	175	0	0	0	0	111.1	L19 L79 V113 V155 C157 G164 L165 K166 A172	L19-V168 HydrophobicContact CD1-CG1 4.44Å; L19-V168 HydrophobicContact CD1-CG2 4.47Å; L19-V168 HydrophobicContact CD2-CG1 4.44Å; L79-V168 HydrophobicContact CD1-CG1 3.73Å; L79-V168 HydrophobicContact CD2-CG1 4.1Å; V113-V168 HydrophobicContact CG1-CG1 4.19Å; V113-V168 HydrophobicContact CG1-CG2 4.1Å; V113-V168 HydrophobicContact CG2-CG1 4.11Å; V155-V168 HydrophobicContact CB-CG2 4.34Å; V155-V168 HydrophobicContact CG2-CB 4.34Å; V155-V168 HydrophobicContact CG2-CG1 4.31Å; V155-V168 HydrophobicContact CG2-CG2 3.87Å; C157-V168 HydrophobicContact CB-CG2 3.78Å; G164-V168 PolarHBondContact O-N 3.29Å; L165-V168 PolarHBondContact O-N 3.28Å; K166-V168 VanDerWaalsContact C-N 3.29Å; K166-V168 PolarHBondContact O-N 3.03Å; V168-A172 WeakPolarHBondContact O-CB 2.93Å; V168-A172 PolarHBondContact O-N 2.98Å; V168-A172 VanDerWaalsContact O-N 3.1Å
169	F	97.3	Very high	95.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-79.3	-34.7	-176.5	-62.3	-81.2	0	0	0	112.8	L19 L20 Y23 L53 L55 L79 L165 K166 N167 E171 A172 I173	L19-F169 HydrophobicContact CD1-CE2 4.05Å; L19-F169 HydrophobicContact CD1-CZ 4.3Å; L19-F169 HydrophobicContact CD2-CZ 4.35Å; L19-F169 HydrophobicContact CG-CE2 4.17Å; L19-F169 HydrophobicContact CG-CZ 3.91Å; L20-F169 HydrophobicContact CD2-CE1 3.86Å; L20-F169 HydrophobicContact CD2-CZ 3.89Å; Y23-F169 HydrophobicContact CD1-CD1 4.02Å; Y23-F169 AromaticContact CD1-CD2 3.7Å; Y23-F169 HydrophobicContact CD1-CD2 3.7Å; Y23-F169 HydrophobicContact CD1-CE1 4Å; Y23-F169 AromaticContact CD1-CE2 3.71Å; Y23-F169 HydrophobicContact CD1-CE2 3.71Å; Y23-F169 AromaticContact CD1-CG 3.85Å; Y23-F169 HydrophobicContact CD1-CG 3.85Å; Y23-F169 AromaticContact CD1-CZ 3.83Å; Y23-F169 HydrophobicContact CD1-CZ 3.83Å; Y23-F169 HydrophobicContact CD2-CB 4.45Å; Y23-F169 AromaticContact CD2-CD2 3.27Å; Y23-F169 HydrophobicContact CD2-CD2 3.27Å; Y23-F169 AromaticContact CD2-CE2 3.65Å; Y23-F169 HydrophobicContact CD2-CE2 3.65Å; Y23-F169 AromaticContact CD2-CG 3.98Å; Y23-F169 HydrophobicContact CD2-CG 3.98Å; Y23-F169 HydrophobicContact CE1-CB 4.06Å; Y23-F169 AromaticContact CE1-CD1 3.96Å; Y23-F169 HydrophobicContact CE1-CD1 3.96Å; Y23-F169 AromaticContact CE1-CD2 3.95Å; Y23-F169 HydrophobicContact CE1-CD2 3.95Å; Y23-F169 HydrophobicContact CE1-CE1 4.38Å; Y23-F169 HydrophobicContact CE1-CE2 4.4Å; Y23-F169 AromaticContact CE1-CG 3.7Å; Y23-F169 HydrophobicContact CE1-CG 3.7Å; Y23-F169 HydrophobicContact CE2-CB 3.85Å; Y23-F169 AromaticContact CE2-CD2 3.56Å; Y23-F169 HydrophobicContact CE2-CD2 3.56Å; Y23-F169 HydrophobicContact CE2-CE2 4.36Å; Y23-F169 AromaticContact CE2-CG 3.84Å; Y23-F169 HydrophobicContact CE2-CG 3.84Å; Y23-F169 HydrophobicContact CG-CD1 4.49Å; Y23-F169 AromaticContact CG-CD2 3.34Å; Y23-F169 HydrophobicContact CG-CD2 3.34Å; Y23-F169 HydrophobicContact CG-CE1 4.41Å; Y23-F169 AromaticContact CG-CE2 3.27Å; Y23-F169 HydrophobicContact CG-CE2 3.27Å; Y23-F169 AromaticContact CG-CG 3.98Å; Y23-F169 HydrophobicContact CG-CG 3.98Å; Y23-F169 AromaticContact CG-CZ 3.82Å; Y23-F169 HydrophobicContact CG-CZ 3.82Å; Y23-F169 AromaticContact CZ-CD2 3.89Å; Y23-F169 AromaticContact CZ-CG 3.7Å; L53-F169 HydrophobicContact CD2-CB 4.34Å; L53-F169 HydrophobicContact CD2-CD1 4.04Å; L55-F169 HydrophobicContact CD1-CE1 4.26Å; L55-F169 HydrophobicContact CD2-CD1 3.9Å; L55-F169 HydrophobicContact CD2-CE1 3.61Å; L79-F169 HydrophobicContact CD1-CE1 4.16Å; L165-F169 HydrophobicContact CD1-CE2 4.03Å; L165-F169 VanDerWaalsContact O-CD2 3.29Å; L165-F169 WeakPolarHBondContact O-CD2 3.31Å; K166-F169 PolarHBondContact O-N 2.97Å; K166-F169 VanDerWaalsContact O-N 3.15Å; N167-F169 VanDerWaalsContact C-N 3.31Å; N167-F169 PolarHBondContact O-N 2.8Å; F169-E171 VanDerWaalsContact C-N 3.33Å; F169-E171 PolarHBondContact O-N 2.81Å; F169-A172 PolarHBondContact O-N 3.34Å; F169-I173 WeakPolarHBondContact O-CB 3.39Å; F169-I173 WeakPolarHBondContact O-CD1 3.42Å; F169-I173 WeakPolarHBondContact O-CG1 3.35Å; F169-I173 PolarHBondContact O-N 3.14Å
170	D	96.1	Very high	94.2	Very high	53 Å²	53	57.9 Å²	57.9	28%	0.283	31%	0.308	S	S	.	.	H	α-helix	trans	-58.4	-47.2	172.8	-69.1	-17.1	0	0	0	110.6	K166 N167 A172 I173 L174	K166-D170 IonicContact NZ-OD1 2.97Å; K166-D170 PolarHBondContact NZ-OD1 2.95Å; K166-D170 IonicContact NZ-OD2 2.74Å; K166-D170 PolarHBondContact NZ-OD2 3.46Å; K166-D170 PolarHBondContact O-N 2.74Å; N167-D170 PolarHBondContact O-N 3.41Å; D170-A172 VanDerWaalsContact C-N 3.33Å; D170-A172 PolarHBondContact O-N 3.38Å; D170-I173 PolarHBondContact O-N 3.35Å; D170-L174 VanDerWaalsContact O-CG 3.31Å; D170-L174 WeakPolarHBondContact O-CG 3.06Å; D170-L174 PolarHBondContact O-N 3.15Å
171	E	97.8	Very high	93	Very high	35 Å²	35	61.7 Å²	61.7	16%	0.164	32%	0.323	C	S	.	.	H	α-helix	trans	-68.2	-32.4	178.1	-63.7	-71	167.8	0	0	112.3	L111 K153 V155 N167 F169 L174 A175	L111-E171 HydrophobicContact CD1-CB 3.7Å; K153-E171 HydrophobicContact CD-CG 4.06Å; K153-E171 WeakPolarHBondContact CD-OE2 3.38Å; K153-E171 IonicContact NZ-OE1 2.67Å; K153-E171 PolarHBondContact NZ-OE1 2.88Å; K153-E171 IonicContact NZ-OE2 3.52Å; K153-E171 PolarHBondContact NZ-OE2 2.68Å; V155-E171 HydrophobicContact CG1-CB 4.32Å; V155-E171 HydrophobicContact CG1-CG 4.04Å; N167-E171 WeakPolarHBondContact O-CB 3.48Å; N167-E171 WeakPolarHBondContact O-CG 3.39Å; N167-E171 PolarHBondContact O-N 2.92Å; F169-E171 VanDerWaalsContact C-N 3.33Å; F169-E171 PolarHBondContact O-N 2.81Å; E171-L174 PolarHBondContact O-N 2.85Å; E171-A175 VanDerWaalsContact O-CB 3.31Å; E171-A175 WeakPolarHBondContact O-CB 3.37Å; E171-A175 PolarHBondContact O-N 3.3Å
172	A	97.6	Very high	91.4	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.008	34%	0.335	C	S	.	.	H	α-helix	trans	-68.6	-43.2	177.2	0	0	0	0	0	111.1	V77 L79 L111 V168 F169 D170 A175 A176	V77-A172 HydrophobicContact CG1-CB 4.13Å; V77-A172 HydrophobicContact CG2-CB 4.35Å; L79-A172 HydrophobicContact CD2-CB 3.91Å; L111-A172 HydrophobicContact CD1-CB 4.02Å; V168-A172 WeakPolarHBondContact O-CB 2.93Å; V168-A172 PolarHBondContact O-N 2.98Å; V168-A172 VanDerWaalsContact O-N 3.1Å; F169-A172 PolarHBondContact O-N 3.34Å; D170-A172 VanDerWaalsContact C-N 3.33Å; D170-A172 PolarHBondContact O-N 3.38Å; A172-A175 PolarHBondContact O-N 2.82Å; A172-A176 WeakPolarHBondContact O-CB 3.43Å; A172-A176 PolarHBondContact O-N 3.09Å
173	I	96.1	Very high	89.5	Confident	10 Å²	10	69.1 Å²	69.1	5%	0.051	36%	0.359	C	S	.	.	H	α-helix	trans	-59.7	-48	173.9	-73.4	163.7	0	0	0	110.2	I4 V44 I46 L53 F169 D170 A175 A176 L177	I4-I173 HydrophobicContact CD1-CB 4.47Å; I4-I173 HydrophobicContact CD1-CG1 4.31Å; I4-I173 HydrophobicContact CD1-CG2 3.98Å; V44-I173 HydrophobicContact CB-CD1 4.43Å; V44-I173 HydrophobicContact CG1-CD1 4.42Å; V44-I173 HydrophobicContact CG2-CD1 3.91Å; I46-I173 HydrophobicContact CD1-CG2 3.26Å; I46-I173 HydrophobicContact CG1-CG2 4.13Å; L53-I173 HydrophobicContact CD1-CG1 4.26Å; L53-I173 HydrophobicContact CD2-CD1 4.19Å; L53-I173 HydrophobicContact CD2-CG1 4.33Å; F169-I173 WeakPolarHBondContact O-CB 3.39Å; F169-I173 WeakPolarHBondContact O-CD1 3.42Å; F169-I173 WeakPolarHBondContact O-CG1 3.35Å; F169-I173 PolarHBondContact O-N 3.14Å; D170-I173 PolarHBondContact O-N 3.35Å; I173-A175 VanDerWaalsContact C-N 3.34Å; I173-A175 PolarHBondContact O-N 2.79Å; I173-A176 PolarHBondContact O-N 3.17Å; I173-L177 HydrophobicContact CG2-CD1 3.99Å; I173-L177 WeakPolarHBondContact O-CG 2.86Å; I173-L177 PolarHBondContact O-N 3.3Å
174	L	95.4	Very high	87.2	Confident	84 Å²	84	71.9 Å²	71.9	44%	0.44	37%	0.371	S	S	.	.	H	α-helix	trans	-60	-45	177.3	-71.7	172.5	0	0	0	111.3	D170 E171 A176 L177 E178	D170-L174 VanDerWaalsContact O-CG 3.31Å; D170-L174 WeakPolarHBondContact O-CG 3.06Å; D170-L174 PolarHBondContact O-N 3.15Å; E171-L174 PolarHBondContact O-N 2.85Å; L174-A176 VanDerWaalsContact C-N 3.27Å; L174-A176 PolarHBondContact O-N 2.97Å; L174-L177 PolarHBondContact O-N 3.2Å; L174-E178 PolarHBondContact O-N 3.36Å
175	A	96.1	Very high	85.2	Confident	3 Å²	3	80.1 Å²	80.1	3%	0.025	40%	0.399	C	S	.	.	H	α-helix	trans	-62.8	-32.4	177.5	0	0	0	0	0	113.2	V77 P109 L111 V152 E171 A172 I173 P179	V77-A175 HydrophobicContact CG2-CB 4.15Å; P109-A175 WeakPolarHBondContact CG-O 3.49Å; L111-A175 HydrophobicContact CD2-CB 4.32Å; V152-A175 HydrophobicContact CB-CB 4.25Å; V152-A175 HydrophobicContact CG1-CB 3.95Å; V152-A175 HydrophobicContact CG2-CB 4.23Å; E171-A175 VanDerWaalsContact O-CB 3.31Å; E171-A175 WeakPolarHBondContact O-CB 3.37Å; E171-A175 PolarHBondContact O-N 3.3Å; A172-A175 PolarHBondContact O-N 2.82Å; I173-A175 VanDerWaalsContact C-N 3.34Å; I173-A175 PolarHBondContact O-N 2.79Å; A175-P179 WeakPolarHBondContact O-CA 3.35Å
176	A	95.5	Very high	83.3	Confident	19 Å²	19	91.4 Å²	91.4	16%	0.157	44%	0.441	C	S	.	.	H	α-helix	trans	-73.4	-41.2	176.6	0	0	0	0	0	112.6	I4 D76 V77 A172 I173 L174	I4-A176 HydrophobicContact CG2-CB 3.65Å; D76-A176 HydrophobicContact CB-CB 3.97Å; V77-A176 HydrophobicContact CB-CB 4.12Å; V77-A176 HydrophobicContact CG1-CB 4.12Å; A172-A176 WeakPolarHBondContact O-CB 3.43Å; A172-A176 PolarHBondContact O-N 3.09Å; I173-A176 PolarHBondContact O-N 3.17Å; L174-A176 VanDerWaalsContact C-N 3.27Å; L174-A176 PolarHBondContact O-N 2.97Å
177	L	92.7	Very high	81.1	Confident	65 Å²	65	94.5 Å²	94.5	34%	0.34	45%	0.454	S	S	.	.	H	α-helix	trans	-80.6	-33.2	-177.7	-66.5	179.4	0	0	0	113	I4 I46 Y51 I173 L174 P179	I4-L177 HydrophobicContact CD1-CD1 4.37Å; I4-L177 HydrophobicContact CD1-CD2 4.03Å; I4-L177 HydrophobicContact CD1-CG 4.06Å; I4-L177 HydrophobicContact CG1-CD2 4.49Å; I46-L177 HydrophobicContact CD1-CD1 3.78Å; I46-L177 HydrophobicContact CG2-CD1 3.88Å; Y51-L177 HydrophobicContact CE1-CD2 3.95Å; I173-L177 HydrophobicContact CG2-CD1 3.99Å; I173-L177 WeakPolarHBondContact O-CG 2.86Å; I173-L177 PolarHBondContact O-N 3.3Å; L174-L177 PolarHBondContact O-N 3.2Å; L177-P179 VanDerWaalsContact C-CD 3.41Å; L177-P179 WeakPolarHBondContact O-CD 3.44Å
178	E	89.4	Confident	79.1	Confident	152 Å²	152	96.8 Å²	96.8	71%	0.71	47%	0.474	S	S	*	.	S	Bend	trans	-123.6	66.9	-179.2	-62.3	-177.4	-173.2	0	0	110.2	L174	L174-E178 PolarHBondContact O-N 3.36Å
179	P	78.4	Confident	77.2	Confident	74 Å²	74	102.3 Å²	102.3	48%	0.481	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-63.2	139.9	-177.6	25.3	-33.2	0	0	0	110.6	P109 A175 L177 E181	P109-P179 HydrophobicContact CG-CB 4.45Å; A175-P179 WeakPolarHBondContact O-CA 3.35Å; L177-P179 VanDerWaalsContact C-CD 3.41Å; L177-P179 WeakPolarHBondContact O-CD 3.44Å; P179-E181 PolarHBondContact O-N 2.68Å
180	P	74.3	Confident	75.2	Confident	78 Å²	78	110.1 Å²	110.1	51%	0.506	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-58.2	131.9	-179.1	-9.9	14.8	0	0	0	111.2	V152	V152-P180 HydrophobicContact CB-CG 4.5Å; V152-P180 HydrophobicContact CG1-CG 4.36Å; V152-P180 HydrophobicContact CG2-CG 3.6Å
181	E	71.1	Confident	73.2	Confident	177 Å²	177	118.7 Å²	118.7	83%	0.827	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-60.5	135.3	178	-73.1	-152	165.3	0	0	111.4	P179 K183	P179-E181 PolarHBondContact O-N 2.68Å; E181-K183 PolarHBondContact O-N 3.29Å
182	P	61.3	Low	71.9	Confident	119 Å²	119	122.9 Å²	122.9	77%	0.773	61%	0.614	S	S	*	*			trans	-63.4	112.9	174.5	23.8	-30.6	0	0	0	109.3	K184	P182-K184 PolarHBondContact O-N 3.5Å
183	K	56.7	Low	70.6	Confident	205 Å²	205	129.3 Å²	129.3	89%	0.891	65%	0.646	S	S	*	*			trans	-53.8	111.5	174.3	-70.6	-174.4	179.2	179.4	0	109.1	E181 K185	E181-K183 PolarHBondContact O-N 3.29Å; K183-K185 PolarHBondContact O-N 3.19Å; K183-K185 VanDerWaalsContact O-N 3.14Å
184	K	49.3	Very low	69.2	Low	203 Å²	203	135.9 Å²	135.9	88%	0.883	68%	0.679	S	S	*	*			trans	-52.9	121	175.7	-74.4	-180	-179.9	172.9	0	108.8	P182 R186	P182-K184 PolarHBondContact O-N 3.5Å; K184-R186 PolarHBondContact O-N 2.87Å
185	K	55.9	Low	67.6	Low	202 Å²	202	138.9 Å²	138.9	88%	0.878	69%	0.693	S	S	*	*			trans	-58	115.2	170	-72.5	-174.4	178.5	-178.8	0	107.3	K183 K187	K183-K185 PolarHBondContact O-N 3.19Å; K183-K185 VanDerWaalsContact O-N 3.14Å; K185-K187 PolarHBondContact O-N 2.88Å; K185-K187 VanDerWaalsContact O-N 3.09Å
186	R	56.1	Low	65.8	Low	244 Å²	244	147.4 Å²	147.4	92%	0.921	74%	0.735	S	S	*	*			trans	-59	115.9	166	-75.7	-176.2	167.7	-174.9	-3.7	106.2	K184 C188	K184-R186 PolarHBondContact O-N 2.87Å; R186-C188 PolarHBondContact O-N 2.85Å
187	K	50.2	Low	63.8	Low	194 Å²	194	156 Å²	156	84%	0.843	77%	0.774	S	S	*	*			trans	-58.6	113.1	170	-73.8	-174.7	176.9	-177.2	0	106.1	K185 V189	K185-K187 PolarHBondContact O-N 2.88Å; K185-K187 VanDerWaalsContact O-N 3.09Å; K187-V189 PolarHBondContact O-N 2.9Å; K187-V189 VanDerWaalsContact O-N 3.1Å
188	C	55.1	Low	61.8	Low	114 Å²	114	162.5 Å²	162.5	77%	0.77	81%	0.805	S	S	*	*			trans	-65.4	109	167.8	-150.2	0	0	0	0	105.6	R186 L190	R186-C188 PolarHBondContact O-N 2.85Å; C188-L190 PolarHBondContact O-N 2.92Å
189	V	59.4	Low	59.7	Low	117 Å²	117	163.3 Å²	163.3	71%	0.709	81%	0.812	S	S	*	*			trans	-78.9	101.1	168.5	-176.2	0	0	0	0	104.6	K187 L191	K187-V189 PolarHBondContact O-N 2.9Å; K187-V189 VanDerWaalsContact O-N 3.1Å; V189-L191 HydrophobicContact CG1-CG 4.41Å; V189-L191 PolarHBondContact O-N 2.9Å
190	L	55.4	Low	58.1	Low	163 Å²	163	170.8 Å²	170.8	85%	0.853	84%	0.84	S	S	*	*			trans	-68.8	109.8	163.3	-68.9	168.4	0	0	0	105.6	C188	C188-L190 PolarHBondContact O-N 2.92Å
191	L	52.5	Low	56.6	Low	233 Å²	233	179.2 Å²	179.2	100%	1.22	87%	0.87	S	S	*	*			trans	-81.6	0	166.3	-78.6	165.9	0	0	0	109.3	V189	V189-L191 HydrophobicContact CG1-CG 4.41Å; V189-L191 PolarHBondContact O-N 2.9Å

Retrieved 191 of 191 residues in 39.1 ms (Link to these results)

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