A0A096M9J5_POEFO 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 , UniProt , Accession A0A096M9J5, Species POEFO (Poecilia formosa, Amazon molly), Gene CDC42, 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	60.1	Low	93	Very high	149 Å²	149	37.9 Å²	37.9	73%	0.734	19%	0.193	S	C	*	.				0	115.3	0	-162.9	165.9	-171	0	0	107	T43 P50 T52	M1-T43 HydrophobicContact CE-CG2 3.77Å; M1-P50 HydrophobicContact CE-CB 4.46Å; M1-T52 VanDerWaalsContact CE-OG1 3.25Å; M1-T52 WeakPolarHBondContact CE-OG1 3.37Å; M1-T52 PolarHBondContact SD-OG1 3.43Å; M1-T52 VanDerWaalsContact SD-OG1 3.39Å
2	Q	86.1	Confident	93.2	Very high	119 Å²	119	37.4 Å²	37.4	56%	0.556	20%	0.204	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.3	138.6	178.6	-66	-176.4	32	0	0	108.3	Y51 T52	Q2-Y51 HydrophobicContact CB-CD1 3.55Å; Q2-Y51 HydrophobicContact CB-CE1 3.39Å; Q2-Y51 HydrophobicContact CB-CG 4.37Å; Q2-Y51 HydrophobicContact CG-CE1 4.09Å; Q2-Y51 PolarHBondContact NE2-OH 3.28Å; Q2-Y51 WeakPolarHBondContact O-CA 3.41Å; Q2-Y51 VanDerWaalsContact OE1-CZ 3.29Å; Q2-Y51 PolarHBondContact OE1-OH 2.98Å; Q2-T52 PolarHBondContact O-N 3.34Å
3	T	93.3	Very high	93.2	Very high	88 Å²	88	39.6 Å²	39.6	54%	0.54	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.5	-179.6	-57.6	0	0	0	0	108.4	T52	T3-T52 CarbonylContact C-O 3.59Å; T3-T52 VanDerWaalsContact CA-O 3.28Å; T3-T52 WeakPolarHBondContact CA-O 3.31Å; T3-T52 HydrophobicContact CG2-CG2 4.38Å
4	I	96.5	Very high	93.6	Very high	5 Å²	5	37 Å²	37	3%	0.026	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	120	171.5	-61.7	171.2	0	0	0	106.9	I46 Y51 T52 L53 G54 D76 V77 I173 A176 L177	I4-I46 HydrophobicContact CD1-CD1 4.19Å; I4-Y51 HydrophobicContact CD1-CD1 3.97Å; I4-Y51 HydrophobicContact CG1-CD1 4.18Å; I4-T52 PolarHBondContact N-O 2.99Å; I4-L53 HydrophobicContact CB-CD1 3.97Å; I4-L53 HydrophobicContact CG2-CD1 3.81Å; I4-G54 PolarHBondContact O-N 3.21Å; I4-D76 WeakPolarHBondContact CA-OD2 3.41Å; I4-D76 HydrophobicContact CG2-CB 4.17Å; I4-V77 HydrophobicContact CG2-CG1 4.49Å; I4-I173 HydrophobicContact CD1-CB 4.48Å; I4-I173 HydrophobicContact CD1-CG1 4.32Å; I4-I173 HydrophobicContact CD1-CG2 4.01Å; I4-A176 HydrophobicContact CG2-CB 3.64Å; I4-L177 HydrophobicContact CD1-CD1 4.43Å; I4-L177 HydrophobicContact CD1-CD2 4.06Å; I4-L177 HydrophobicContact CD1-CG 4.1Å
5	K	97.4	Very high	93.7	Very high	31 Å²	31	35.5 Å²	35.5	14%	0.135	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	112.8	174.4	177.4	167.6	175.5	-177.6	0	110.2	V7 F56 S71 P73 D76 V77	K5-V7 HydrophobicContact CG-CG2 4.34Å; K5-F56 HydrophobicContact CB-CE2 4.42Å; K5-F56 HydrophobicContact CD-CD2 4.3Å; K5-F56 HydrophobicContact CD-CE1 4.36Å; K5-F56 HydrophobicContact CD-CE2 3.85Å; K5-F56 HydrophobicContact CD-CZ 3.89Å; K5-F56 HydrophobicContact CG-CD2 3.8Å; K5-F56 HydrophobicContact CG-CE2 3.59Å; K5-F56 HydrophobicContact CG-CZ 4.17Å; K5-S71 WeakPolarHBondContact CE-O 3.31Å; K5-S71 PolarHBondContact NZ-O 3.09Å; K5-P73 PolarHBondContact NZ-O 3.37Å; K5-D76 PolarHBondContact N-OD2 2.93Å; K5-D76 PolarHBondContact O-N 2.94Å; K5-V77 PolarHBondContact O-N 3.34Å
6	C	98.1	Very high	93.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.8	175.8	-178.9	0	0	0	0	109.9	L53 G54 L55 F56 V77	C6-L53 HydrophobicContact CB-CD1 3.99Å; C6-G54 PolarHBondContact N-O 3.09Å; C6-L55 HydrophobicContact CB-CD2 4Å; C6-F56 PolarHBondContact O-N 2.97Å; C6-V77 WeakPolarHBondContact CA-O 3.34Å; C6-V77 HydrophobicContact CB-CG1 3.97Å
7	V	98.5	Very high	94	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	132	177	178.8	0	0	0	0	110.2	K5 V9 F56 T58 Y72 T75 V77 F78 L79	K5-V7 HydrophobicContact CG-CG2 4.34Å; V7-V9 HydrophobicContact CG1-CG1 4.17Å; V7-F56 HydrophobicContact CB-CB 4.33Å; V7-F56 HydrophobicContact CG1-CB 4.44Å; V7-F56 HydrophobicContact CG2-CB 3.84Å; V7-F56 HydrophobicContact CG2-CG 4.2Å; V7-T58 HydrophobicContact CG1-CG2 3.88Å; V7-Y72 HydrophobicContact CG1-CD1 4.06Å; V7-Y72 HydrophobicContact CG1-CE1 4.01Å; V7-T75 HydrophobicContact CB-CG2 4Å; V7-T75 HydrophobicContact CG2-CG2 3.75Å; V7-T75 WeakPolarHBondContact CG2-OG1 3.24Å; V7-V77 PolarHBondContact N-O 2.94Å; V7-V77 VanDerWaalsContact N-O 3.09Å; 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 4.38Å; V7-F78 CarbonylContact O-C 3.53Å; V7-F78 WeakPolarHBondContact O-CA 3.31Å; V7-L79 PolarHBondContact O-N 3.23Å
8	V	98.4	Very high	94.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.1	-179.1	-166.6	0	0	0	0	110.1	K16 L20 F56 T58 L79 C81	V8-K16 HydrophobicContact CG1-CB 3.87Å; V8-K16 HydrophobicContact CG1-CD 3.97Å; V8-K16 HydrophobicContact CG1-CG 3.9Å; V8-L20 HydrophobicContact CB-CD1 4.47Å; V8-L20 HydrophobicContact CG2-CD1 3.95Å; V8-L20 HydrophobicContact CG2-CD2 3.72Å; V8-L20 HydrophobicContact CG2-CG 4.15Å; V8-F56 PolarHBondContact N-O 2.77Å; V8-T58 PolarHBondContact O-OG1 3.21Å; V8-L79 HydrophobicContact CB-CB 4.46Å; V8-L79 HydrophobicContact CG1-CB 4.1Å; V8-L79 HydrophobicContact CG2-CB 4.23Å; V8-L79 HydrophobicContact CG2-CD1 4.05Å; V8-L79 HydrophobicContact CG2-CG 4.45Å; V8-C81 VanDerWaalsContact CG1-SG 3.57Å
9	V	98.6	Very high	94.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	165	178.9	-58.6	0	0	0	0	110.6	V7 K16 Y72 F78 L79 V80 C81 W97 I101	V7-V9 HydrophobicContact CG1-CG1 4.17Å; V9-K16 VanDerWaalsContact C-CD 3.49Å; V9-Y72 HydrophobicContact CG1-CE1 3.92Å; V9-F78 HydrophobicContact CG1-CD1 4.42Å; V9-L79 PolarHBondContact N-O 3.15Å; V9-V80 HydrophobicContact CG2-CB 4.39Å; V9-V80 HydrophobicContact CG2-CG1 4.44Å; V9-V80 HydrophobicContact CG2-CG2 3.93Å; V9-C81 PolarHBondContact O-N 2.97Å; V9-W97 HydrophobicContact CB-CE3 3.87Å; V9-W97 HydrophobicContact CB-CZ3 4.19Å; V9-W97 HydrophobicContact CG2-CE3 4.26Å; V9-I101 HydrophobicContact CG1-CG2 4.44Å; V9-I101 HydrophobicContact CG2-CG2 4.03Å
10	G	98.4	Very high	94.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139.5	167.6	-175.1	0	0	0	0	0	111.7	K16 G60 C81 W97	G10-K16 PolarHBondContact O-NZ 3.17Å; G10-G60 WeakPolarHBondContact O-CA 3.46Å; G10-C81 VanDerWaalsContact CA-O 3.32Å; G10-C81 WeakPolarHBondContact CA-O 3.14Å; G10-W97 VanDerWaalsContact CA-CE2 3.42Å; G10-W97 WeakPolarHBondContact O-CH2 3.3Å; G10-W97 VanDerWaalsContact O-CZ2 3.24Å; G10-W97 WeakPolarHBondContact O-CZ2 3.2Å
11	D	98.1	Very high	94.1	Very high	25 Å²	25	29.6 Å²	29.6	13%	0.134	18%	0.175	C	C	.	.			trans	-55.3	161.8	-176.5	-80.9	18.9	0	0	0	113.6	V14 K16 S89 N92 W97	D11-V14 HydrophobicContact CB-CG1 3.64Å; D11-V14 VanDerWaalsContact O-CG2 3.26Å; D11-V14 WeakPolarHBondContact O-CG2 3.48Å; D11-K16 PolarHBondContact O-NZ 3.07Å; D11-S89 VanDerWaalsContact OD2-CA 3.31Å; D11-S89 WeakPolarHBondContact OD2-CA 3.34Å; D11-N92 WeakPolarHBondContact OD1-CB 3.35Å; D11-N92 PolarHBondContact OD1-ND2 2.75Å; D11-N92 PolarHBondContact OD2-ND2 2.74Å; D11-W97 PolarHBondContact OD1-NE1 3.25Å
12	G	94.5	Very high	95.7	Very high	32 Å²	32	22.5 Å²	22.5	33%	0.33	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	147.4	167.1	0	0	0	0	0	111.5	V14	G12-V14 PolarHBondContact O-N 3.31Å
13	A	94.3	Very high	96.1	Very high	66 Å²	66	18.6 Å²	18.6	55%	0.545	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	7.4	175.1	0	0	0	0	0	117.6	G15	A13-G15 PolarHBondContact O-N 2.95Å; A13-G15 VanDerWaalsContact O-N 3.16Å
14	V	97.5	Very high	96	Very high	3 Å²	3	16.2 Å²	16.2	2%	0.018	11%	0.106	C	C	.	.	S	Bend	trans	-76.2	7.8	174.3	-53.9	0	0	0	0	113.9	D11 G12 K16 C81 T115	D11-V14 HydrophobicContact CB-CG1 3.64Å; D11-V14 VanDerWaalsContact O-CG2 3.26Å; D11-V14 WeakPolarHBondContact O-CG2 3.48Å; G12-V14 PolarHBondContact O-N 3.31Å; V14-K16 HydrophobicContact CG2-CD 4.43Å; V14-K16 HydrophobicContact CG2-CG 3.8Å; V14-C81 HydrophobicContact CG2-CB 4.03Å; V14-T115 VanDerWaalsContact O-CB 3.32Å; V14-T115 WeakPolarHBondContact O-CB 2.99Å; V14-T115 PolarHBondContact O-OG1 3.1Å
15	G	95.9	Very high	95.6	Very high	15 Å²	15	19.4 Å²	19.4	16%	0.155	13%	0.126	C	C	.	.	S	Bend	trans	83.6	21.8	173.8	0	0	0	0	0	116.5	A13 C18 L19	A13-G15 PolarHBondContact O-N 2.95Å; A13-G15 VanDerWaalsContact O-N 3.16Å; G15-C18 PolarHBondContact O-N 2.89Å; G15-L19 WeakPolarHBondContact O-CB 3.31Å; G15-L19 PolarHBondContact O-N 3.18Å
16	K	97.1	Very high	95.1	Very high	10 Å²	10	23.4 Å²	23.4	4%	0.043	15%	0.149	C	C	.	.	H	α-helix	trans	-55.7	-52.1	174	-58.5	-171.3	-57.9	-77.5	0	112.3	V8 V9 G10 D11 V14 C18 L19 L20 T58 C81	V8-K16 HydrophobicContact CG1-CB 3.87Å; V8-K16 HydrophobicContact CG1-CD 3.97Å; V8-K16 HydrophobicContact CG1-CG 3.9Å; V9-K16 VanDerWaalsContact C-CD 3.49Å; G10-K16 PolarHBondContact O-NZ 3.17Å; D11-K16 PolarHBondContact O-NZ 3.07Å; V14-K16 HydrophobicContact CG2-CD 4.43Å; V14-K16 HydrophobicContact CG2-CG 3.8Å; K16-C18 PolarHBondContact O-N 3.5Å; K16-L19 VanDerWaalsContact O-CB 3.31Å; K16-L19 WeakPolarHBondContact O-CB 3.24Å; K16-L19 PolarHBondContact O-N 2.85Å; K16-L20 WeakPolarHBondContact O-CG 3.46Å; K16-L20 PolarHBondContact O-N 2.96Å; K16-L20 VanDerWaalsContact O-N 3.09Å; K16-T58 WeakPolarHBondContact CE-O 3.37Å; K16-C81 HydrophobicContact CG-CB 3.97Å
17	T	95.1	Very high	94.5	Very high	23 Å²	23	30.7 Å²	30.7	14%	0.141	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-43.1	178.8	-43	0	0	0	0	111.7	L19 L20 I21 T35 D57	T17-L19 VanDerWaalsContact C-N 3.33Å; T17-L19 PolarHBondContact O-N 3.11Å; T17-L20 PolarHBondContact O-N 3.08Å; T17-I21 HydrophobicContact CG2-CD1 3.76Å; T17-I21 HydrophobicContact CG2-CG1 4.38Å; T17-I21 WeakPolarHBondContact O-CB 3.45Å; T17-I21 WeakPolarHBondContact O-CG1 3.33Å; T17-I21 PolarHBondContact O-N 3.31Å; T17-T35 WeakPolarHBondContact CG2-OG1 3.36Å; T17-T35 PolarHBondContact OG1-OG1 2.74Å; T17-D57 WeakPolarHBondContact CA-OD2 3.38Å; T17-D57 VanDerWaalsContact CB-OD2 3.25Å; T17-D57 WeakPolarHBondContact CB-OD2 3.26Å; T17-D57 WeakPolarHBondContact CG2-OD2 3.03Å; T17-D57 PolarHBondContact OG1-OD2 2.92Å
18	C	95.1	Very high	93.8	Very high	20 Å²	20	35 Å²	35	14%	0.135	20%	0.199	C	C	.	.	H	α-helix	trans	-62.8	-40	176.3	-56.2	0	0	0	0	111.8	G15 K16 S22 F28 P29 A159	G15-C18 PolarHBondContact O-N 2.89Å; K16-C18 PolarHBondContact O-N 3.5Å; C18-S22 WeakPolarHBondContact O-CB 3.12Å; C18-S22 PolarHBondContact O-N 2.78Å; C18-S22 PolarHBondContact O-OG 3.39Å; C18-S22 VanDerWaalsContact O-OG 3.14Å; C18-F28 HydrophobicContact CB-CD2 4.34Å; C18-F28 HydrophobicContact CB-CE2 3.69Å; C18-F28 HydrophobicContact CB-CZ 4.28Å; C18-P29 HydrophobicContact CB-CG 4.27Å; C18-A159 HydrophobicContact CB-CB 3.85Å
19	L	95.9	Very high	93.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-56.9	-50.3	174.3	171.6	78.4	0	0	0	110.7	G15 K16 T17 Y23 L79 C157 L165 V168 F169	G15-L19 WeakPolarHBondContact O-CB 3.31Å; G15-L19 PolarHBondContact O-N 3.18Å; K16-L19 VanDerWaalsContact O-CB 3.31Å; K16-L19 WeakPolarHBondContact O-CB 3.24Å; K16-L19 PolarHBondContact O-N 2.85Å; T17-L19 VanDerWaalsContact C-N 3.33Å; T17-L19 PolarHBondContact O-N 3.11Å; L19-Y23 WeakPolarHBondContact O-CB 3.44Å; L19-Y23 PolarHBondContact O-N 2.93Å; L19-Y23 VanDerWaalsContact O-N 3.13Å; L19-L79 HydrophobicContact CD2-CD1 4.11Å; L19-C157 WeakPolarHBondContact CD1-SG 3.17Å; L19-L165 HydrophobicContact CD1-CD1 3.36Å; L19-L165 HydrophobicContact CG-CD1 4.31Å; L19-V168 HydrophobicContact CD1-CG1 4.46Å; L19-V168 HydrophobicContact CD1-CG2 4.49Å; L19-V168 HydrophobicContact CD2-CG1 4.47Å; L19-F169 HydrophobicContact CD1-CE2 4.06Å; L19-F169 HydrophobicContact CD1-CZ 4.29Å; L19-F169 HydrophobicContact CD2-CZ 4.34Å; L19-F169 HydrophobicContact CG-CE2 4.17Å; L19-F169 HydrophobicContact CG-CZ 3.9Å
20	L	94.9	Very high	91.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67.7	-46.9	-178	-64.3	-179.5	0	0	0	112.6	V8 K16 T17 Y23 T24 Y40 L55 D57 F169	V8-L20 HydrophobicContact CB-CD1 4.47Å; V8-L20 HydrophobicContact CG2-CD1 3.95Å; V8-L20 HydrophobicContact CG2-CD2 3.72Å; V8-L20 HydrophobicContact CG2-CG 4.15Å; K16-L20 WeakPolarHBondContact O-CG 3.46Å; K16-L20 PolarHBondContact O-N 2.96Å; K16-L20 VanDerWaalsContact O-N 3.09Å; T17-L20 PolarHBondContact O-N 3.08Å; L20-Y23 PolarHBondContact O-N 3.29Å; L20-T24 WeakPolarHBondContact O-CG2 3.47Å; L20-T24 PolarHBondContact O-N 3.34Å; L20-T24 PolarHBondContact O-OG1 2.68Å; L20-Y40 HydrophobicContact CB-CD2 4.23Å; L20-Y40 HydrophobicContact CB-CE2 4.28Å; L20-Y40 HydrophobicContact CD1-CD2 4.31Å; L20-Y40 HydrophobicContact CD1-CE2 4.37Å; L20-L55 HydrophobicContact CD2-CB 3.89Å; L20-L55 HydrophobicContact CD2-CD1 4.01Å; L20-L55 HydrophobicContact CD2-CD2 4.15Å; L20-L55 HydrophobicContact CD2-CG 4.23Å; L20-D57 HydrophobicContact CD1-CB 3.44Å; L20-D57 VanDerWaalsContact CD1-CB 3.44Å; L20-F169 HydrophobicContact CD2-CE1 3.85Å; L20-F169 HydrophobicContact CD2-CZ 3.89Å
21	I	92.4	Very high	90.9	Very high	36 Å²	36	49.6 Å²	49.6	19%	0.185	28%	0.284	C	S	.	.	H	α-helix	trans	-65.3	-45.9	179.5	-66.8	175.7	0	0	0	110.8	T17 Y23 T24 T25 P29 Y40	T17-I21 HydrophobicContact CG2-CD1 3.76Å; T17-I21 HydrophobicContact CG2-CG1 4.38Å; T17-I21 WeakPolarHBondContact O-CB 3.45Å; T17-I21 WeakPolarHBondContact O-CG1 3.33Å; T17-I21 PolarHBondContact O-N 3.31Å; I21-Y23 PolarHBondContact O-N 3.29Å; I21-T24 PolarHBondContact O-N 2.87Å; I21-T24 PolarHBondContact O-OG1 2.84Å; I21-T25 HydrophobicContact CG2-CG2 4.26Å; I21-T25 WeakPolarHBondContact O-CB 3.36Å; I21-T25 PolarHBondContact O-N 2.87Å; I21-T25 PolarHBondContact O-OG1 2.82Å; I21-P29 HydrophobicContact CD1-CB 4.27Å; I21-P29 HydrophobicContact CD1-CG 4.42Å; I21-P29 HydrophobicContact CG2-CB 4.23Å; I21-P29 HydrophobicContact CG2-CG 4.38Å; I21-Y40 HydrophobicContact CG1-CE1 4.35Å
22	S	93.6	Very high	89.4	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.1	-38.2	178.1	-74.8	0	0	0	0	111.7	C18 N26 K27 F28 A159	C18-S22 WeakPolarHBondContact O-CB 3.12Å; C18-S22 PolarHBondContact O-N 2.78Å; C18-S22 PolarHBondContact O-OG 3.39Å; C18-S22 VanDerWaalsContact O-OG 3.14Å; S22-N26 WeakPolarHBondContact O-CA 3.38Å; S22-N26 PolarHBondContact O-N 2.83Å; S22-K27 VanDerWaalsContact CA-O 3.3Å; S22-K27 WeakPolarHBondContact CA-O 3.25Å; S22-K27 PolarHBondContact OG-O 3.32Å; S22-F28 WeakPolarHBondContact OG-CA 3.33Å; S22-A159 PolarHBondContact OG-O 2.8Å
23	Y	93.8	Very high	88.4	Confident	36 Å²	36	58.2 Å²	58.2	14%	0.141	32%	0.316	C	S	.	.	H	α-helix	trans	-71	-42.3	179.9	175.7	-112.3	0	0	0	112.4	L19 L20 I21 V42 L53 L55 F169	L19-Y23 WeakPolarHBondContact O-CB 3.44Å; L19-Y23 PolarHBondContact O-N 2.93Å; L19-Y23 VanDerWaalsContact O-N 3.13Å; L20-Y23 PolarHBondContact O-N 3.29Å; I21-Y23 PolarHBondContact O-N 3.29Å; Y23-V42 HydrophobicContact CE1-CG2 3.69Å; Y23-L53 HydrophobicContact CE1-CD2 4.04Å; Y23-L55 HydrophobicContact CD1-CD1 3.89Å; Y23-L55 HydrophobicContact CE1-CD1 4.23Å; Y23-F169 AromaticContact CD1-CD1 3.94Å; Y23-F169 HydrophobicContact CD1-CD1 3.94Å; Y23-F169 AromaticContact CD1-CD2 3.68Å; Y23-F169 HydrophobicContact CD1-CD2 3.68Å; Y23-F169 AromaticContact CD1-CE1 3.91Å; Y23-F169 HydrophobicContact CD1-CE1 3.91Å; Y23-F169 AromaticContact CD1-CE2 3.68Å; Y23-F169 HydrophobicContact CD1-CE2 3.68Å; Y23-F169 AromaticContact CD1-CG 3.81Å; Y23-F169 HydrophobicContact CD1-CG 3.81Å; Y23-F169 AromaticContact CD1-CZ 3.76Å; Y23-F169 HydrophobicContact CD1-CZ 3.76Å; 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 3.63Å; Y23-F169 HydrophobicContact CD2-CE2 3.63Å; Y23-F169 AromaticContact CD2-CG 3.96Å; Y23-F169 HydrophobicContact CD2-CG 3.96Å; Y23-F169 HydrophobicContact CE1-CB 4.04Å; Y23-F169 AromaticContact CE1-CD1 3.86Å; Y23-F169 HydrophobicContact CE1-CD1 3.86Å; Y23-F169 AromaticContact CE1-CD2 3.92Å; Y23-F169 HydrophobicContact CE1-CD2 3.92Å; Y23-F169 HydrophobicContact CE1-CE1 4.28Å; Y23-F169 HydrophobicContact CE1-CE2 4.36Å; Y23-F169 AromaticContact CE1-CG 3.65Å; Y23-F169 HydrophobicContact CE1-CG 3.65Å; Y23-F169 HydrophobicContact CE1-CZ 4.49Å; Y23-F169 HydrophobicContact CE2-CB 3.83Å; Y23-F169 AromaticContact CE2-CD2 3.55Å; Y23-F169 HydrophobicContact CE2-CD2 3.55Å; Y23-F169 HydrophobicContact CE2-CE2 4.33Å; Y23-F169 AromaticContact CE2-CG 3.81Å; Y23-F169 HydrophobicContact CE2-CG 3.81Å; Y23-F169 HydrophobicContact CG-CD1 4.43Å; Y23-F169 AromaticContact CG-CD2 3.34Å; Y23-F169 HydrophobicContact CG-CD2 3.34Å; Y23-F169 HydrophobicContact CG-CE1 4.34Å; Y23-F169 AromaticContact CG-CE2 3.25Å; Y23-F169 HydrophobicContact CG-CE2 3.25Å; Y23-F169 AromaticContact CG-CG 3.96Å; Y23-F169 HydrophobicContact CG-CG 3.96Å; Y23-F169 AromaticContact CG-CZ 3.76Å; Y23-F169 HydrophobicContact CG-CZ 3.76Å; Y23-F169 AromaticContact CZ-CD2 3.87Å; Y23-F169 AromaticContact CZ-CG 3.65Å
24	T	90.8	Very high	87.5	Confident	39 Å²	39	58.6 Å²	58.6	24%	0.239	31%	0.313	C	S	.	.	H	α-helix	trans	-77.1	-28.6	-177.7	55.1	0	0	0	0	113.6	L20 I21 V42 L55	L20-T24 WeakPolarHBondContact O-CG2 3.47Å; L20-T24 PolarHBondContact O-N 3.34Å; L20-T24 PolarHBondContact O-OG1 2.68Å; I21-T24 PolarHBondContact O-N 2.87Å; I21-T24 PolarHBondContact O-OG1 2.84Å; T24-V42 HydrophobicContact CG2-CG1 3.49Å; T24-V42 VanDerWaalsContact CG2-CG1 3.49Å; T24-L55 HydrophobicContact CG2-CD1 3.65Å
25	T	89	Confident	86.6	Confident	71 Å²	71	59 Å²	59	44%	0.436	32%	0.315	S	S	.	.	H	α-helix	trans	-113.5	-6.6	-173.1	69.8	0	0	0	0	114.5	I21 K27	I21-T25 HydrophobicContact CG2-CG2 4.26Å; I21-T25 WeakPolarHBondContact O-CB 3.36Å; I21-T25 PolarHBondContact O-N 2.87Å; I21-T25 PolarHBondContact O-OG1 2.82Å; T25-K27 PolarHBondContact O-N 2.82Å; T25-K27 PolarHBondContact OG1-N 3.47Å; T25-K27 PolarHBondContact OG1-O 2.84Å
26	N	87.1	Confident	85.4	Confident	116 Å²	116	62.2 Å²	62.2	62%	0.62	33%	0.332	S	S	*	.	S	Bend	trans	53.9	26.5	-169.2	-64.7	-54.8	0	0	0	113.5	S22 Q162	S22-N26 WeakPolarHBondContact O-CA 3.38Å; S22-N26 PolarHBondContact O-N 2.83Å; N26-Q162 VanDerWaalsContact C-NE2 3.33Å; N26-Q162 PolarHBondContact O-NE2 2.99Å
27	K	85.6	Confident	83.7	Confident	153 Å²	153	65.7 Å²	65.7	67%	0.665	35%	0.347	S	S	*	.	S	Bend	trans	-140.7	139.7	179.4	-67.2	-176.6	-178.2	-179.7	0	111.2	S22 T25	S22-K27 VanDerWaalsContact CA-O 3.3Å; S22-K27 WeakPolarHBondContact CA-O 3.25Å; S22-K27 PolarHBondContact OG-O 3.32Å; T25-K27 PolarHBondContact O-N 2.82Å; T25-K27 PolarHBondContact OG1-N 3.47Å; T25-K27 PolarHBondContact OG1-O 2.84Å
28	F	84.3	Confident	83	Confident	91 Å²	91	68.2 Å²	68.2	40%	0.399	36%	0.36	S	S	.	.			trans	-74.2	135.5	171	-169.5	-98.2	0	0	0	110.2	C18 S22 S30 A159 L160	C18-F28 HydrophobicContact CB-CD2 4.34Å; C18-F28 HydrophobicContact CB-CE2 3.69Å; C18-F28 HydrophobicContact CB-CZ 4.28Å; S22-F28 WeakPolarHBondContact OG-CA 3.33Å; F28-S30 PolarHBondContact O-N 2.64Å; F28-A159 HydrophobicContact CD2-CB 4.03Å; F28-A159 WeakPolarHBondContact CD2-O 3.36Å; F28-A159 HydrophobicContact CE2-CB 3.98Å; F28-L160 HydrophobicContact CB-CD1 4.44Å; F28-L160 HydrophobicContact CD1-CD1 3.96Å; F28-L160 VanDerWaalsContact CD2-CA 3.49Å; F28-L160 HydrophobicContact CD2-CB 4.1Å; F28-L160 HydrophobicContact CD2-CD1 4.32Å; F28-L160 HydrophobicContact CE1-CD1 4.27Å; F28-L160 HydrophobicContact CE2-CB 4.09Å; F28-L160 HydrophobicContact CG-CD1 3.98Å
29	P	82.4	Confident	82.5	Confident	29 Å²	29	71.4 Å²	71.4	19%	0.188	38%	0.376	C	S	.	.			trans	-65.6	133.4	179.3	25.6	-33	0	0	0	111.3	C18 I21	C18-P29 HydrophobicContact CB-CG 4.27Å; I21-P29 HydrophobicContact CD1-CB 4.27Å; I21-P29 HydrophobicContact CD1-CG 4.42Å; I21-P29 HydrophobicContact CG2-CB 4.23Å; I21-P29 HydrophobicContact CG2-CG 4.38Å
30	S	74.4	Confident	82.1	Confident	123 Å²	123	74.2 Å²	74.2	86%	0.86	39%	0.387	S	S	*	.	S	Bend	trans	-79.8	-20.4	179.9	52.1	0	0	0	0	113.8	F28	F28-S30 PolarHBondContact O-N 2.64Å
31	E	76.1	Confident	81.8	Confident	154 Å²	154	77.8 Å²	77.8	72%	0.72	42%	0.416	S	S	*	.	S	Bend	trans	-124	136.6	-179	-65.9	-177.5	-175.5	0	0	110.2
32	Y	67.9	Low	81.8	Confident	135 Å²	135	77.5 Å²	77.5	53%	0.529	42%	0.416	S	S	.	.			trans	-92.2	110.8	173.8	-179.1	-109.3	0	0	0	110	P34	Y32-P34 HydrophobicContact CE1-CG 3.94Å
33	V	74.1	Confident	81.8	Confident	102 Å²	102	82 Å²	82	62%	0.618	44%	0.444	S	S	*	.			trans	-110.8	121.3	169.6	-178.3	0	0	0	0	107.7	T35	V33-T35 PolarHBondContact O-N 2.97Å
34	P	74.6	Confident	81.6	Confident	74 Å²	74	81.3 Å²	81.3	48%	0.481	44%	0.443	S	S	.	.			trans	-60.4	123.8	177.1	-23.8	33.2	0	0	0	112.1	Y32	Y32-P34 HydrophobicContact CE1-CG 3.94Å
35	T	79.1	Confident	81.6	Confident	11 Å²	11	85.5 Å²	85.5	7%	0.067	46%	0.462	C	S	.	.			trans	-73.2	134.1	179.4	-53.2	0	0	0	0	112.1	T17 V33 D38 D57 A59	T17-T35 WeakPolarHBondContact CG2-OG1 3.36Å; T17-T35 PolarHBondContact OG1-OG1 2.74Å; V33-T35 PolarHBondContact O-N 2.97Å; T35-D38 HydrophobicContact CG2-CB 4.48Å; T35-D57 HydrophobicContact CG2-CB 4.04Å; T35-D57 WeakPolarHBondContact CG2-OD2 3.34Å; T35-D57 PolarHBondContact OG1-OD2 3.49Å; T35-A59 WeakPolarHBondContact O-CB 3.25Å
36	V	70.7	Confident	81.6	Confident	83 Å²	83	84.2 Å²	84.2	50%	0.503	45%	0.452	S	S	.	.	S	Bend	trans	-92.7	-58.5	162.5	177.9	0	0	0	0	109	A59 Y64	V36-A59 PolarHBondContact O-N 3.26Å; V36-Y64 HydrophobicContact CB-CE1 4.38Å; V36-Y64 HydrophobicContact CG1-CD1 4.19Å; V36-Y64 HydrophobicContact CG1-CE1 3.64Å; V36-Y64 HydrophobicContact CG2-CE1 4.21Å
37	F	60.4	Low	81.5	Confident	83 Å²	83	82.9 Å²	82.9	36%	0.364	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	134	173.2	-178.4	-104.8	0	0	0	109.5	N39 F56 D57 S71	F37-N39 WeakPolarHBondContact CE1-ND2 3.15Å; F37-N39 WeakPolarHBondContact CE1-OD1 2.9Å; F37-N39 WeakPolarHBondContact CZ-OD1 3.13Å; F37-F56 HydrophobicContact CE2-CD1 4.04Å; F37-F56 AromaticContact CZ-CD1 3.67Å; F37-F56 HydrophobicContact CZ-CD1 3.67Å; F37-F56 HydrophobicContact CZ-CE1 4.19Å; F37-D57 WeakPolarHBondContact CD2-O 3.36Å; F37-S71 WeakPolarHBondContact CD2-OG 3.28Å; F37-S71 WeakPolarHBondContact CE2-OG 3.46Å
38	D	80.9	Confident	81.6	Confident	76 Å²	76	78.2 Å²	78.2	41%	0.406	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	146.1	175.2	-84.2	-54.4	0	0	0	110.9	T35 Y40 D57	T35-D38 HydrophobicContact CG2-CB 4.48Å; D38-Y40 HydrophobicContact CB-CE2 3.82Å; D38-D57 HydrophobicContact CB-CB 4.26Å; D38-D57 PolarHBondContact N-O 2.97Å; D38-D57 PolarHBondContact O-N 3.39Å
39	N	83.5	Confident	81.9	Confident	88 Å²	88	79.8 Å²	79.8	47%	0.471	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.1	177	-68.1	-35.6	0	0	0	110.3	F37 L55 F56	F37-N39 WeakPolarHBondContact CE1-ND2 3.15Å; F37-N39 WeakPolarHBondContact CE1-OD1 2.9Å; F37-N39 WeakPolarHBondContact CZ-OD1 3.13Å; N39-L55 CarbonylContact C-O 3.5Å; N39-L55 WeakPolarHBondContact CA-O 3.44Å; N39-F56 WeakPolarHBondContact OD1-CD1 3.43Å; N39-F56 WeakPolarHBondContact OD1-CE1 3.47Å; N39-F56 WeakPolarHBondContact OD1-CG 3.47Å
40	Y	87.3	Confident	82.4	Confident	58 Å²	58	81 Å²	81	23%	0.227	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	154.3	172.1	-49.6	-91.4	0	0	0	109.6	L20 I21 D38 L55 D57	L20-Y40 HydrophobicContact CB-CD2 4.23Å; L20-Y40 HydrophobicContact CB-CE2 4.28Å; L20-Y40 HydrophobicContact CD1-CD2 4.31Å; L20-Y40 HydrophobicContact CD1-CE2 4.37Å; I21-Y40 HydrophobicContact CG1-CE1 4.35Å; D38-Y40 HydrophobicContact CB-CE2 3.82Å; Y40-L55 PolarHBondContact N-O 2.7Å; Y40-L55 PolarHBondContact O-N 3.04Å; Y40-D57 HydrophobicContact CE2-CB 4.34Å
41	A	90.1	Very high	83.4	Confident	75 Å²	75	76.5 Å²	76.5	62%	0.62	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	135	174.1	0	0	0	0	0	109.8	T52 L53	A41-T52 HydrophobicContact CB-CG2 4.21Å; A41-L53 WeakPolarHBondContact CA-O 3.1Å
42	V	92.1	Very high	84.3	Confident	30 Å²	30	70.6 Å²	70.6	18%	0.182	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	146.1	172.1	-63.2	0	0	0	0	110.2	Y23 T24 V44 L53	Y23-V42 HydrophobicContact CE1-CG2 3.69Å; T24-V42 HydrophobicContact CG2-CG1 3.49Å; T24-V42 VanDerWaalsContact CG2-CG1 3.49Å; V42-V44 HydrophobicContact CG2-CG1 4.18Å; V42-L53 HydrophobicContact CG2-CB 3.98Å; V42-L53 HydrophobicContact CG2-CD2 4.28Å; V42-L53 PolarHBondContact N-O 3.2Å; V42-L53 VanDerWaalsContact N-O 3.07Å; V42-L53 PolarHBondContact O-N 3.07Å
43	T	92.5	Very high	85.6	Confident	94 Å²	94	64.2 Å²	64.2	58%	0.577	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	126.4	172.7	-56.6	0	0	0	0	109.2	M1 P50 Y51	M1-T43 HydrophobicContact CE-CG2 3.77Å; T43-P50 HydrophobicContact CG2-CB 4.14Å; T43-Y51 CarbonylContact C-O 3.58Å; T43-Y51 WeakPolarHBondContact CA-O 3.37Å
44	V	91.5	Very high	86.7	Confident	23 Å²	23	59.7 Å²	59.7	14%	0.139	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.3	177.2	-62.3	0	0	0	0	110.1	V42 I46 Y51 I173	V42-V44 HydrophobicContact CG2-CG1 4.18Å; V44-I46 HydrophobicContact CG2-CD1 4.16Å; V44-I46 HydrophobicContact CG2-CG1 4.21Å; V44-Y51 PolarHBondContact N-O 2.81Å; V44-Y51 PolarHBondContact O-N 2.57Å; V44-I173 HydrophobicContact CB-CD1 4.46Å; V44-I173 HydrophobicContact CG1-CD1 4.43Å; V44-I173 HydrophobicContact CG2-CD1 3.9Å
45	M	90.7	Very high	87.7	Confident	127 Å²	127	56.2 Å²	56.2	63%	0.626	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.7	178	-62.6	-59.1	-65.7	0	0	109.7	G48 E49 P50	M45-G48 WeakPolarHBondContact CE-O 3.31Å; M45-E49 WeakPolarHBondContact CA-O 3.19Å; M45-P50 HydrophobicContact SD-CB 3.93Å
46	I	87.6	Confident	88.5	Confident	43 Å²	43	57.6 Å²	57.6	22%	0.221	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	116.4	-179.5	-52	174.6	0	0	0	107.9	I4 V44 G48 E49 Y51 I173 L177	I4-I46 HydrophobicContact CD1-CD1 4.19Å; V44-I46 HydrophobicContact CG2-CD1 4.16Å; V44-I46 HydrophobicContact CG2-CG1 4.21Å; I46-G48 PolarHBondContact O-N 2.97Å; I46-G48 VanDerWaalsContact O-N 3.11Å; I46-E49 PolarHBondContact N-O 2.89Å; I46-E49 PolarHBondContact O-N 2.96Å; I46-Y51 HydrophobicContact CB-CD2 3.79Å; I46-Y51 HydrophobicContact CB-CE2 3.89Å; I46-Y51 HydrophobicContact CD1-CD1 4.05Å; I46-Y51 HydrophobicContact CD1-CD2 3.69Å; I46-Y51 HydrophobicContact CD1-CE2 4.21Å; I46-Y51 HydrophobicContact CD1-CG 3.61Å; I46-Y51 HydrophobicContact CG1-CD2 3.9Å; I46-Y51 HydrophobicContact CG1-CE2 4.44Å; I46-Y51 HydrophobicContact CG1-CG 4.26Å; I46-I173 HydrophobicContact CD1-CG2 3.26Å; I46-I173 HydrophobicContact CG1-CG2 4.18Å; I46-L177 HydrophobicContact CD1-CD1 3.78Å; I46-L177 HydrophobicContact CG2-CD1 3.91Å
47	G	86.1	Confident	89.7	Confident	89 Å²	89	53.6 Å²	53.6	92%	0.918	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	23.4	-177.3	0	0	0	0	0	114.2	E49	G47-E49 VanDerWaalsContact C-N 3.34Å
48	G	88.3	Confident	91.3	Very high	55 Å²	55	49.8 Å²	49.8	57%	0.567	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	-5.4	-174.9	0	0	0	0	0	114.9	M45 I46	M45-G48 WeakPolarHBondContact CE-O 3.31Å; I46-G48 PolarHBondContact O-N 2.97Å; I46-G48 VanDerWaalsContact O-N 3.11Å
49	E	90.3	Very high	91.8	Very high	124 Å²	124	46.3 Å²	46.3	58%	0.579	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	140.9	178.1	-68.4	-62.5	140.6	0	0	111.6	M45 I46 G47 Y51	M45-E49 WeakPolarHBondContact CA-O 3.19Å; I46-E49 PolarHBondContact N-O 2.89Å; I46-E49 PolarHBondContact O-N 2.96Å; G47-E49 VanDerWaalsContact C-N 3.34Å; E49-Y51 HydrophobicContact CB-CD2 4.46Å; E49-Y51 HydrophobicContact CB-CE2 3.96Å; E49-Y51 WeakPolarHBondContact O-CD2 3.47Å
50	P	92.8	Very high	92	Very high	55 Å²	55	42.5 Å²	42.5	36%	0.357	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	127	178.3	31.7	-33.4	0	0	0	112.1	M1 T43 M45	M1-P50 HydrophobicContact CE-CB 4.46Å; T43-P50 HydrophobicContact CG2-CB 4.14Å; M45-P50 HydrophobicContact SD-CB 3.93Å
51	Y	93.9	Very high	92.2	Very high	27 Å²	27	42.4 Å²	42.4	11%	0.106	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	142.7	174.5	-77.2	-109.1	0	0	0	110.6	Q2 I4 T43 V44 I46 E49 L177	Q2-Y51 HydrophobicContact CB-CD1 3.55Å; Q2-Y51 HydrophobicContact CB-CE1 3.39Å; Q2-Y51 HydrophobicContact CB-CG 4.37Å; Q2-Y51 HydrophobicContact CG-CE1 4.09Å; Q2-Y51 PolarHBondContact NE2-OH 3.28Å; Q2-Y51 WeakPolarHBondContact O-CA 3.41Å; Q2-Y51 VanDerWaalsContact OE1-CZ 3.29Å; Q2-Y51 PolarHBondContact OE1-OH 2.98Å; I4-Y51 HydrophobicContact CD1-CD1 3.97Å; I4-Y51 HydrophobicContact CG1-CD1 4.18Å; T43-Y51 CarbonylContact C-O 3.58Å; T43-Y51 WeakPolarHBondContact CA-O 3.37Å; V44-Y51 PolarHBondContact N-O 2.81Å; V44-Y51 PolarHBondContact O-N 2.57Å; I46-Y51 HydrophobicContact CB-CD2 3.79Å; I46-Y51 HydrophobicContact CB-CE2 3.89Å; I46-Y51 HydrophobicContact CD1-CD1 4.05Å; I46-Y51 HydrophobicContact CD1-CD2 3.69Å; I46-Y51 HydrophobicContact CD1-CE2 4.21Å; I46-Y51 HydrophobicContact CD1-CG 3.61Å; I46-Y51 HydrophobicContact CG1-CD2 3.9Å; I46-Y51 HydrophobicContact CG1-CE2 4.44Å; I46-Y51 HydrophobicContact CG1-CG 4.26Å; E49-Y51 HydrophobicContact CB-CD2 4.46Å; E49-Y51 HydrophobicContact CB-CE2 3.96Å; E49-Y51 WeakPolarHBondContact O-CD2 3.47Å; Y51-L177 HydrophobicContact CE1-CD2 3.88Å
52	T	95.1	Very high	92.1	Very high	30 Å²	30	45.9 Å²	45.9	18%	0.184	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	116.9	167.7	-56.9	0	0	0	0	108.8	M1 Q2 T3 I4 A41	M1-T52 VanDerWaalsContact CE-OG1 3.25Å; M1-T52 WeakPolarHBondContact CE-OG1 3.37Å; M1-T52 PolarHBondContact SD-OG1 3.43Å; M1-T52 VanDerWaalsContact SD-OG1 3.39Å; Q2-T52 PolarHBondContact O-N 3.34Å; T3-T52 CarbonylContact C-O 3.59Å; T3-T52 VanDerWaalsContact CA-O 3.28Å; T3-T52 WeakPolarHBondContact CA-O 3.31Å; T3-T52 HydrophobicContact CG2-CG2 4.38Å; I4-T52 PolarHBondContact N-O 2.99Å; A41-T52 HydrophobicContact CB-CG2 4.21Å
53	L	95.5	Very high	92	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	106.3	168.5	-177.9	64.4	0	0	0	108.8	I4 C6 Y23 A41 V42 L55 F169 I173	I4-L53 HydrophobicContact CB-CD1 3.97Å; I4-L53 HydrophobicContact CG2-CD1 3.81Å; C6-L53 HydrophobicContact CB-CD1 3.99Å; Y23-L53 HydrophobicContact CE1-CD2 4.04Å; A41-L53 WeakPolarHBondContact CA-O 3.1Å; V42-L53 HydrophobicContact CG2-CB 3.98Å; V42-L53 HydrophobicContact CG2-CD2 4.28Å; V42-L53 PolarHBondContact N-O 3.2Å; V42-L53 VanDerWaalsContact N-O 3.07Å; V42-L53 PolarHBondContact O-N 3.07Å; L53-L55 HydrophobicContact CD1-CD2 4.31Å; L53-L55 HydrophobicContact CD2-CD2 3.77Å; L53-L55 HydrophobicContact CG-CD2 3.69Å; L53-L55 HydrophobicContact CG-CG 4.27Å; L53-F169 HydrophobicContact CD2-CB 4.35Å; L53-F169 HydrophobicContact CD2-CD1 4.05Å; L53-I173 HydrophobicContact CD1-CG1 4.26Å; L53-I173 HydrophobicContact CD2-CD1 4.19Å; L53-I173 HydrophobicContact CD2-CG1 4.32Å
54	G	96.8	Very high	92	Very high	8 Å²	8	50.2 Å²	50.2	8%	0.082	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	120.8	172.4	0	0	0	0	0	110.4	I4 C6	I4-G54 PolarHBondContact O-N 3.21Å; C6-G54 PolarHBondContact N-O 3.09Å
55	L	96.1	Very high	92	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	117.7	-176.2	-57.1	172.7	0	0	0	109.2	C6 L20 Y23 T24 N39 Y40 L53 F169	C6-L55 HydrophobicContact CB-CD2 4Å; L20-L55 HydrophobicContact CD2-CB 3.89Å; L20-L55 HydrophobicContact CD2-CD1 4.01Å; L20-L55 HydrophobicContact CD2-CD2 4.15Å; L20-L55 HydrophobicContact CD2-CG 4.23Å; Y23-L55 HydrophobicContact CD1-CD1 3.89Å; Y23-L55 HydrophobicContact CE1-CD1 4.23Å; T24-L55 HydrophobicContact CG2-CD1 3.65Å; N39-L55 CarbonylContact C-O 3.5Å; N39-L55 WeakPolarHBondContact CA-O 3.44Å; Y40-L55 PolarHBondContact N-O 2.7Å; Y40-L55 PolarHBondContact O-N 3.04Å; L53-L55 HydrophobicContact CD1-CD2 4.31Å; L53-L55 HydrophobicContact CD2-CD2 3.77Å; L53-L55 HydrophobicContact CG-CD2 3.69Å; L53-L55 HydrophobicContact CG-CG 4.27Å; L55-F169 HydrophobicContact CD1-CE1 4.22Å; L55-F169 HydrophobicContact CD2-CD1 3.91Å; L55-F169 HydrophobicContact CD2-CE1 3.64Å
56	F	96.3	Very high	92.1	Very high	40 Å²	40	56.7 Å²	56.7	18%	0.175	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	103.2	-175.6	-71.3	-114.4	0	0	0	108.5	K5 C6 V7 V8 F37 N39	K5-F56 HydrophobicContact CB-CE2 4.42Å; K5-F56 HydrophobicContact CD-CD2 4.3Å; K5-F56 HydrophobicContact CD-CE1 4.36Å; K5-F56 HydrophobicContact CD-CE2 3.85Å; K5-F56 HydrophobicContact CD-CZ 3.89Å; K5-F56 HydrophobicContact CG-CD2 3.8Å; K5-F56 HydrophobicContact CG-CE2 3.59Å; K5-F56 HydrophobicContact CG-CZ 4.17Å; C6-F56 PolarHBondContact O-N 2.97Å; V7-F56 HydrophobicContact CB-CB 4.33Å; V7-F56 HydrophobicContact CG1-CB 4.44Å; V7-F56 HydrophobicContact CG2-CB 3.84Å; V7-F56 HydrophobicContact CG2-CG 4.2Å; V8-F56 PolarHBondContact N-O 2.77Å; F37-F56 HydrophobicContact CE2-CD1 4.04Å; F37-F56 AromaticContact CZ-CD1 3.67Å; F37-F56 HydrophobicContact CZ-CD1 3.67Å; F37-F56 HydrophobicContact CZ-CE1 4.19Å; N39-F56 WeakPolarHBondContact OD1-CD1 3.43Å; N39-F56 WeakPolarHBondContact OD1-CE1 3.47Å; N39-F56 WeakPolarHBondContact OD1-CG 3.47Å
57	D	95.1	Very high	92.3	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	135.1	174.9	-160.8	12	0	0	0	110	T17 L20 T35 F37 D38 Y40	T17-D57 WeakPolarHBondContact CA-OD2 3.38Å; T17-D57 VanDerWaalsContact CB-OD2 3.25Å; T17-D57 WeakPolarHBondContact CB-OD2 3.26Å; T17-D57 WeakPolarHBondContact CG2-OD2 3.03Å; T17-D57 PolarHBondContact OG1-OD2 2.92Å; L20-D57 HydrophobicContact CD1-CB 3.44Å; L20-D57 VanDerWaalsContact CD1-CB 3.44Å; T35-D57 HydrophobicContact CG2-CB 4.04Å; T35-D57 WeakPolarHBondContact CG2-OD2 3.34Å; T35-D57 PolarHBondContact OG1-OD2 3.49Å; F37-D57 WeakPolarHBondContact CD2-O 3.36Å; D38-D57 HydrophobicContact CB-CB 4.26Å; D38-D57 PolarHBondContact N-O 2.97Å; D38-D57 PolarHBondContact O-N 3.39Å; Y40-D57 HydrophobicContact CE2-CB 4.34Å
58	T	94.8	Very high	92.8	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	146	-178.3	73.6	0	0	0	0	112.6	V7 V8 K16 G60 R68	V7-T58 HydrophobicContact CG1-CG2 3.88Å; V8-T58 PolarHBondContact O-OG1 3.21Å; K16-T58 WeakPolarHBondContact CE-O 3.37Å; T58-G60 PolarHBondContact O-N 3.26Å; T58-R68 HydrophobicContact CG2-CG 4.19Å
59	A	90.9	Very high	93.2	Very high	4 Å²	4	54 Å²	54	3%	0.033	26%	0.261	C	S	.	.			trans	-60.4	133	172	0	0	0	0	0	111.6	T35 V36 Y64 R68	T35-A59 WeakPolarHBondContact O-CB 3.25Å; V36-A59 PolarHBondContact O-N 3.26Å; A59-Y64 HydrophobicContact CB-CD1 4.23Å; A59-Y64 HydrophobicContact CB-CD2 3.45Å; A59-Y64 VanDerWaalsContact CB-CD2 3.45Å; A59-Y64 HydrophobicContact CB-CE2 4.16Å; A59-Y64 HydrophobicContact CB-CG 3.5Å; A59-Y64 VanDerWaalsContact CB-CG 3.5Å; A59-R68 PolarHBondContact O-NE 2.93Å; A59-R68 PolarHBondContact O-NH2 3.43Å
60	G	89.3	Confident	93.4	Very high	7 Å²	7	54.2 Å²	54.2	7%	0.072	27%	0.266	C	S	.	.			trans	-92.5	-6.6	178.4	0	0	0	0	0	114.4	G10 T58	G10-G60 WeakPolarHBondContact O-CA 3.46Å; T58-G60 PolarHBondContact O-N 3.26Å
61	Q	89.4	Confident	93.5	Very high	57 Å²	57	52.1 Å²	52.1	27%	0.266	25%	0.252	S	S	.	.	S	Bend	trans	-80.6	148.5	-178.5	-54.7	83.6	-15.1	0	0	110.9	D63 Y64 R68	Q61-D63 PolarHBondContact O-N 2.88Å; Q61-Y64 HydrophobicContact CB-CD2 4.13Å; Q61-Y64 PolarHBondContact O-N 3Å; Q61-R68 PolarHBondContact O-NH2 2.98Å
62	E	88.2	Confident	93.7	Very high	148 Å²	148	51 Å²	51	69%	0.692	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-62.6	-29.3	179.9	-65.7	-177.1	171.2	0	0	113	Y64 D65	E62-Y64 PolarHBondContact O-N 3.35Å; E62-D65 WeakPolarHBondContact O-CB 3.35Å; E62-D65 VanDerWaalsContact O-CG 3.28Å; E62-D65 PolarHBondContact O-N 2.84Å
63	D	91.7	Very high	93.7	Very high	146 Å²	146	53.2 Å²	53.2	78%	0.781	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-54.4	-23.8	175.9	-60.1	-41.6	0	0	0	112.9	Q61	Q61-D63 PolarHBondContact O-N 2.88Å
64	Y	91.3	Very high	93.7	Very high	69 Å²	69	61.6 Å²	61.6	27%	0.271	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-104.3	7.3	-178.8	-61.2	-83.1	0	0	0	113.9	V36 A59 Q61 E62 R66 L67 R68	V36-Y64 HydrophobicContact CB-CE1 4.38Å; V36-Y64 HydrophobicContact CG1-CD1 4.19Å; V36-Y64 HydrophobicContact CG1-CE1 3.64Å; V36-Y64 HydrophobicContact CG2-CE1 4.21Å; A59-Y64 HydrophobicContact CB-CD1 4.23Å; A59-Y64 HydrophobicContact CB-CD2 3.45Å; A59-Y64 VanDerWaalsContact CB-CD2 3.45Å; A59-Y64 HydrophobicContact CB-CE2 4.16Å; A59-Y64 HydrophobicContact CB-CG 3.5Å; A59-Y64 VanDerWaalsContact CB-CG 3.5Å; Q61-Y64 HydrophobicContact CB-CD2 4.13Å; Q61-Y64 PolarHBondContact O-N 3Å; E62-Y64 PolarHBondContact O-N 3.35Å; Y64-R66 PolarHBondContact O-N 2.84Å; Y64-R66 VanDerWaalsContact O-N 3.1Å; Y64-L67 HydrophobicContact CD1-CD1 3.97Å; Y64-L67 HydrophobicContact CE1-CD1 4.49Å; Y64-L67 PolarHBondContact O-N 3.21Å; Y64-R68 WeakPolarHBondContact O-CB 3.47Å; Y64-R68 PolarHBondContact O-N 3.07Å
65	D	92.2	Very high	93.8	Very high	54 Å²	54	61.6 Å²	61.6	29%	0.289	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-30.1	-176.7	-78.4	-7.1	0	0	0	113.3	E62 R68 P69 K96	E62-D65 WeakPolarHBondContact O-CB 3.35Å; E62-D65 VanDerWaalsContact O-CG 3.28Å; E62-D65 PolarHBondContact O-N 2.84Å; D65-R68 IonicContact OD1-CZ 3.28Å; D65-R68 VanDerWaalsContact OD1-CZ 3.25Å; D65-R68 IonicContact OD1-NH1 2.76Å; D65-R68 PolarHBondContact OD1-NH1 2.87Å; D65-R68 IonicContact OD1-NH2 2.7Å; D65-R68 PolarHBondContact OD1-NH2 2.84Å; D65-P69 WeakPolarHBondContact O-CD 3.33Å; D65-K96 VanDerWaalsContact CG-NZ 3.3Å; D65-K96 WeakPolarHBondContact OD1-CE 3.34Å; D65-K96 IonicContact OD1-NZ 3.47Å; D65-K96 PolarHBondContact OD1-NZ 2.93Å; D65-K96 IonicContact OD2-NZ 3.91Å; D65-K96 PolarHBondContact OD2-NZ 3.49Å
66	R	92.5	Very high	93.9	Very high	231 Å²	231	64.7 Å²	64.7	87%	0.872	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-23.6	176.5	-64.4	-175.3	-179.9	-177.9	1.1	114	Y64	Y64-R66 PolarHBondContact O-N 2.84Å; Y64-R66 VanDerWaalsContact O-N 3.1Å
67	L	92.5	Very high	94	Very high	100 Å²	100	62.8 Å²	62.8	52%	0.524	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-35.9	-177.2	-67.1	175.6	0	0	0	111.5	Y64 P69 L70	Y64-L67 HydrophobicContact CD1-CD1 3.97Å; Y64-L67 HydrophobicContact CE1-CD1 4.49Å; Y64-L67 PolarHBondContact O-N 3.21Å; L67-P69 VanDerWaalsContact C-CD 3.48Å; L67-L70 HydrophobicContact CD2-CD1 4.1Å; L67-L70 VanDerWaalsContact O-CB 3.24Å; L67-L70 WeakPolarHBondContact O-CB 3.35Å; L67-L70 VanDerWaalsContact O-CG 3.31Å; L67-L70 WeakPolarHBondContact O-CG 3.45Å; L67-L70 PolarHBondContact O-N 3.09Å; L67-L70 VanDerWaalsContact O-N 3.07Å
68	R	95.8	Very high	94.1	Very high	7 Å²	7	62.9 Å²	62.9	3%	0.026	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-51.7	-44.9	-179.1	-165.1	-174.3	-48.9	107.6	6.4	113.3	T58 A59 Q61 Y64 D65 L70 S71 Y72 W97 E100	T58-R68 HydrophobicContact CG2-CG 4.19Å; A59-R68 PolarHBondContact O-NE 2.93Å; A59-R68 PolarHBondContact O-NH2 3.43Å; Q61-R68 PolarHBondContact O-NH2 2.98Å; Y64-R68 WeakPolarHBondContact O-CB 3.47Å; Y64-R68 PolarHBondContact O-N 3.07Å; D65-R68 IonicContact OD1-CZ 3.28Å; D65-R68 VanDerWaalsContact OD1-CZ 3.25Å; D65-R68 IonicContact OD1-NH1 2.76Å; D65-R68 PolarHBondContact OD1-NH1 2.87Å; D65-R68 IonicContact OD1-NH2 2.7Å; D65-R68 PolarHBondContact OD1-NH2 2.84Å; R68-L70 PolarHBondContact O-N 2.79Å; R68-L70 VanDerWaalsContact O-N 3.08Å; R68-S71 VanDerWaalsContact O-CB 3.31Å; R68-S71 WeakPolarHBondContact O-CB 3.24Å; R68-S71 PolarHBondContact O-N 2.89Å; R68-S71 PolarHBondContact O-OG 2.7Å; R68-Y72 WeakPolarHBondContact CD-OH 3.31Å; R68-Y72 HydrophobicContact CG-CE1 4.1Å; R68-Y72 WeakPolarHBondContact CG-OH 3.49Å; R68-W97 VanDerWaalsContact CZ-CZ3 3.43Å; R68-E100 WeakPolarHBondContact CD-OE1 3.44Å; R68-E100 IonicContact CZ-OE1 2.81Å; R68-E100 IonicContact NH1-OE1 2.89Å; R68-E100 PolarHBondContact NH1-OE1 2.87Å; R68-E100 IonicContact NH1-OE2 3.25Å; R68-E100 PolarHBondContact NH1-OE2 3.48Å
69	P	96.3	Very high	94.3	Very high	23 Å²	23	62.8 Å²	62.8	15%	0.149	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-64.7	-16.9	-178	-24	36.5	0	0	0	114.9	D65 L67 S71 Y72	D65-P69 WeakPolarHBondContact O-CD 3.33Å; L67-P69 VanDerWaalsContact C-CD 3.48Å; P69-S71 PolarHBondContact O-N 2.89Å; P69-S71 VanDerWaalsContact O-N 3.15Å; P69-Y72 VanDerWaalsContact CA-CD2 3.48Å; P69-Y72 HydrophobicContact CB-CD2 3.85Å; P69-Y72 HydrophobicContact CB-CE2 3.97Å; P69-Y72 HydrophobicContact CG-CE2 4.12Å; P69-Y72 WeakPolarHBondContact O-CB 3.26Å; P69-Y72 PolarHBondContact O-N 2.78Å; P69-Y72 VanDerWaalsContact O-N 3.11Å
70	L	94.5	Very high	94.7	Very high	130 Å²	130	62.6 Å²	62.6	68%	0.681	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-62.6	-19	172.8	-56.7	177.9	0	0	0	112.1	L67 R68 P73	L67-L70 HydrophobicContact CD2-CD1 4.1Å; L67-L70 VanDerWaalsContact O-CB 3.24Å; L67-L70 WeakPolarHBondContact O-CB 3.35Å; L67-L70 VanDerWaalsContact O-CG 3.31Å; L67-L70 WeakPolarHBondContact O-CG 3.45Å; L67-L70 PolarHBondContact O-N 3.09Å; L67-L70 VanDerWaalsContact O-N 3.07Å; R68-L70 PolarHBondContact O-N 2.79Å; R68-L70 VanDerWaalsContact O-N 3.08Å; L70-P73 WeakPolarHBondContact O-CD 3.19Å
71	S	95.2	Very high	95.2	Very high	11 Å²	11	62.2 Å²	62.2	8%	0.077	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-85.3	-14.7	177.9	-48.7	0	0	0	0	113.5	K5 F37 R68 P69	K5-S71 WeakPolarHBondContact CE-O 3.31Å; K5-S71 PolarHBondContact NZ-O 3.09Å; F37-S71 WeakPolarHBondContact CD2-OG 3.28Å; F37-S71 WeakPolarHBondContact CE2-OG 3.46Å; R68-S71 VanDerWaalsContact O-CB 3.31Å; R68-S71 WeakPolarHBondContact O-CB 3.24Å; R68-S71 PolarHBondContact O-N 2.89Å; R68-S71 PolarHBondContact O-OG 2.7Å; P69-S71 PolarHBondContact O-N 2.89Å; P69-S71 VanDerWaalsContact O-N 3.15Å
72	Y	97.4	Very high	95.6	Very high	3 Å²	3	59.5 Å²	59.5	1%	0.012	29%	0.29	C	S	.	.			trans	-81.3	-24.2	-170.7	-60.4	-13	0	0	0	117.3	V7 V9 R68 P69 Q74 T75 F78 E100 H104 C105	V7-Y72 HydrophobicContact CG1-CD1 4.06Å; V7-Y72 HydrophobicContact CG1-CE1 4.01Å; V9-Y72 HydrophobicContact CG1-CE1 3.92Å; R68-Y72 WeakPolarHBondContact CD-OH 3.31Å; R68-Y72 HydrophobicContact CG-CE1 4.1Å; R68-Y72 WeakPolarHBondContact CG-OH 3.49Å; P69-Y72 VanDerWaalsContact CA-CD2 3.48Å; P69-Y72 HydrophobicContact CB-CD2 3.85Å; P69-Y72 HydrophobicContact CB-CE2 3.97Å; P69-Y72 HydrophobicContact CG-CE2 4.12Å; P69-Y72 WeakPolarHBondContact O-CB 3.26Å; P69-Y72 PolarHBondContact O-N 2.78Å; P69-Y72 VanDerWaalsContact O-N 3.11Å; Y72-Q74 PolarHBondContact O-N 3.38Å; Y72-T75 WeakPolarHBondContact O-CB 3.32Å; Y72-T75 PolarHBondContact O-N 2.84Å; Y72-T75 PolarHBondContact O-OG1 2.97Å; Y72-F78 AromaticContact CD1-CE1 3.6Å; Y72-F78 HydrophobicContact CD1-CE1 3.6Å; Y72-F78 AromaticContact CD1-CZ 3.98Å; Y72-F78 HydrophobicContact CD1-CZ 3.98Å; Y72-F78 AromaticContact CE1-CE1 3.83Å; Y72-F78 HydrophobicContact CE1-CE1 3.83Å; Y72-F78 HydrophobicContact CG-CE1 4.13Å; Y72-F78 HydrophobicContact CG-CZ 4.04Å; Y72-E100 HydrophobicContact CE2-CG 4.25Å; Y72-E100 PolarHBondContact OH-OE1 3.48Å; Y72-H104 HydrophobicContact CD2-CB 3.65Å; Y72-H104 AromaticContact CD2-CD2 3.94Å; Y72-H104 AromaticContact CD2-CG 3.87Å; Y72-H104 HydrophobicContact CE2-CB 4.39Å; Y72-H104 AromaticContact CE2-CD2 3.94Å; Y72-C105 PolarHBondContact O-SG 3.39Å
73	P	96.6	Very high	96.1	Very high	76 Å²	76	52.6 Å²	52.6	49%	0.494	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	134.1	178.7	-28.8	36.4	0	0	0	111.9	K5 L70 T75	K5-P73 PolarHBondContact NZ-O 3.37Å; L70-P73 WeakPolarHBondContact O-CD 3.19Å; P73-T75 PolarHBondContact O-N 3.42Å
74	Q	95.1	Very high	96.4	Very high	177 Å²	177	45.6 Å²	45.6	83%	0.827	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	24.5	178.5	-50.5	174.4	-60.3	0	0	114.7	Y72 D76	Y72-Q74 PolarHBondContact O-N 3.38Å; Q74-D76 PolarHBondContact O-N 2.87Å
75	T	97.9	Very high	96.8	Very high	8 Å²	8	43.3 Å²	43.3	5%	0.049	21%	0.214	C	C	.	.			trans	-68.7	128.9	171	-60.7	0	0	0	0	111	V7 Y72 P73 V77 F78 T108	V7-T75 HydrophobicContact CB-CG2 4Å; V7-T75 HydrophobicContact CG2-CG2 3.75Å; V7-T75 WeakPolarHBondContact CG2-OG1 3.24Å; Y72-T75 WeakPolarHBondContact O-CB 3.32Å; Y72-T75 PolarHBondContact O-N 2.84Å; Y72-T75 PolarHBondContact O-OG1 2.97Å; P73-T75 PolarHBondContact O-N 3.42Å; T75-V77 WeakPolarHBondContact CG2-O 3.35Å; T75-F78 HydrophobicContact CG2-CD1 4.15Å; T75-F78 HydrophobicContact CG2-CD2 3.85Å; T75-F78 HydrophobicContact CG2-CE1 3.97Å; T75-F78 HydrophobicContact CG2-CE2 3.64Å; T75-F78 HydrophobicContact CG2-CG 4.1Å; T75-F78 HydrophobicContact CG2-CZ 3.71Å; T75-T108 HydrophobicContact CG2-CG2 3.97Å; T75-T108 WeakPolarHBondContact O-CG2 3.48Å; T75-T108 PolarHBondContact O-OG1 3.04Å
76	D	97.8	Very high	97.1	Very high	66 Å²	66	42.4 Å²	42.4	35%	0.353	21%	0.212	S	C	.	.	S	Bend	trans	-87.3	-33.1	176.7	-59.8	-58	0	0	0	111.7	I4 K5 Q74 P109 A176	I4-D76 WeakPolarHBondContact CA-OD2 3.41Å; I4-D76 HydrophobicContact CG2-CB 4.17Å; K5-D76 PolarHBondContact N-OD2 2.93Å; K5-D76 PolarHBondContact O-N 2.94Å; Q74-D76 PolarHBondContact O-N 2.87Å; D76-P109 WeakPolarHBondContact O-CD 3.41Å; D76-P109 WeakPolarHBondContact O-CG 3.41Å; D76-A176 HydrophobicContact CB-CB 4Å
77	V	98.5	Very high	97.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	143.2	176.5	63.1	0	0	0	0	112	I4 K5 C6 V7 T75 P109 A172 A175 A176	I4-V77 HydrophobicContact CG2-CG1 4.49Å; K5-V77 PolarHBondContact O-N 3.34Å; C6-V77 WeakPolarHBondContact CA-O 3.34Å; C6-V77 HydrophobicContact CB-CG1 3.97Å; V7-V77 PolarHBondContact N-O 2.94Å; V7-V77 VanDerWaalsContact N-O 3.09Å; T75-V77 WeakPolarHBondContact CG2-O 3.35Å; V77-P109 WeakPolarHBondContact CA-O 3.32Å; V77-A172 HydrophobicContact CG1-CB 4.16Å; V77-A172 HydrophobicContact CG2-CB 4.38Å; V77-A175 HydrophobicContact CG2-CB 4.16Å; V77-A176 HydrophobicContact CB-CB 4.13Å; V77-A176 HydrophobicContact CG1-CB 4.1Å
78	F	98.8	Very high	97.6	Very high	1 Å²	1	30 Å²	30	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	143.5	170.2	-71.3	-85.3	0	0	0	112.4	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 4.38Å; V7-F78 CarbonylContact O-C 3.53Å; V7-F78 WeakPolarHBondContact O-CA 3.31Å; V9-F78 HydrophobicContact CG1-CD1 4.42Å; Y72-F78 AromaticContact CD1-CE1 3.6Å; Y72-F78 HydrophobicContact CD1-CE1 3.6Å; Y72-F78 AromaticContact CD1-CZ 3.98Å; Y72-F78 HydrophobicContact CD1-CZ 3.98Å; Y72-F78 AromaticContact CE1-CE1 3.83Å; Y72-F78 HydrophobicContact CE1-CE1 3.83Å; Y72-F78 HydrophobicContact CG-CE1 4.13Å; Y72-F78 HydrophobicContact CG-CZ 4.04Å; T75-F78 HydrophobicContact CG2-CD1 4.15Å; T75-F78 HydrophobicContact CG2-CD2 3.85Å; T75-F78 HydrophobicContact CG2-CE1 3.97Å; T75-F78 HydrophobicContact CG2-CE2 3.64Å; T75-F78 HydrophobicContact CG2-CG 4.1Å; T75-F78 HydrophobicContact CG2-CZ 3.71Å; F78-I101 HydrophobicContact CB-CD1 4.05Å; F78-I101 HydrophobicContact CD1-CB 4.46Å; F78-I101 HydrophobicContact CD1-CG2 3.88Å; F78-I101 HydrophobicContact CD2-CB 4.3Å; F78-I101 HydrophobicContact CD2-CD1 4.28Å; F78-I101 HydrophobicContact CE1-CB 4.43Å; F78-I101 HydrophobicContact CE1-CG2 3.92Å; F78-I101 HydrophobicContact CE2-CB 4.27Å; F78-I101 HydrophobicContact CG-CB 4.4Å; F78-I101 HydrophobicContact CG-CD1 4.15Å; F78-I101 HydrophobicContact CG-CG2 4.22Å; F78-I101 HydrophobicContact CZ-CB 4.34Å; F78-I101 HydrophobicContact CZ-CG2 4.31Å; F78-C105 HydrophobicContact CE2-CB 3.65Å; F78-C105 HydrophobicContact CZ-CB 4.08Å; F78-T108 HydrophobicContact CD2-CG2 3.5Å; F78-T108 VanDerWaalsContact CD2-CG2 3.5Å; F78-T108 HydrophobicContact CE2-CG2 3.56Å; F78-P109 PolarHBondContact N-O 3.45Å; F78-F110 HydrophobicContact CB-CB 3.73Å; F78-F110 CarbonylContact O-C 3.28Å; F78-F110 WeakPolarHBondContact O-CA 3.38Å; F78-L111 PolarHBondContact O-N 2.71Å
79	L	98.8	Very high	97.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	115.4	159.9	-60.2	-175.7	0	0	0	108.3	V7 V8 V9 L19 L111 V113 V168 F169 A172	V7-L79 PolarHBondContact O-N 3.23Å; V8-L79 HydrophobicContact CB-CB 4.46Å; V8-L79 HydrophobicContact CG1-CB 4.1Å; V8-L79 HydrophobicContact CG2-CB 4.23Å; V8-L79 HydrophobicContact CG2-CD1 4.05Å; V8-L79 HydrophobicContact CG2-CG 4.45Å; V9-L79 PolarHBondContact N-O 3.15Å; L19-L79 HydrophobicContact CD2-CD1 4.11Å; L79-L111 HydrophobicContact CD2-CB 3.89Å; L79-L111 HydrophobicContact CD2-CD1 3.89Å; L79-L111 HydrophobicContact CD2-CG 4.16Å; L79-V113 HydrophobicContact CB-CG2 4.09Å; L79-V113 HydrophobicContact CD2-CG2 3.94Å; L79-V113 HydrophobicContact CG-CG2 4.46Å; L79-V168 HydrophobicContact CD1-CG1 3.81Å; L79-V168 HydrophobicContact CD2-CG1 4.12Å; L79-F169 HydrophobicContact CD1-CE1 4.2Å; L79-A172 HydrophobicContact CD2-CB 3.92Å
80	V	98.8	Very high	97.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	102.2	174.3	-175.2	0	0	0	0	107.9	V9 V93 W97 V98 I101 F110 L111 V113	V9-V80 HydrophobicContact CG2-CB 4.39Å; V9-V80 HydrophobicContact CG2-CG1 4.44Å; V9-V80 HydrophobicContact CG2-CG2 3.93Å; V80-V93 HydrophobicContact CG1-CG1 3.97Å; V80-V93 HydrophobicContact CG1-CG2 4.32Å; V80-W97 HydrophobicContact CG1-CB 3.77Å; V80-V98 HydrophobicContact CG1-CG2 4.42Å; V80-I101 HydrophobicContact CG2-CD1 3.62Å; V80-F110 HydrophobicContact CB-CD2 4.32Å; 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 3.06Å; V80-V113 PolarHBondContact O-N 3.36Å
81	C	98.9	Very high	98.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	139.6	-173.7	-64.8	0	0	0	0	112.3	V8 V9 G10 V14 K16 V113 T115	V8-C81 VanDerWaalsContact CG1-SG 3.57Å; V9-C81 PolarHBondContact O-N 2.97Å; G10-C81 VanDerWaalsContact CA-O 3.32Å; G10-C81 WeakPolarHBondContact CA-O 3.14Å; V14-C81 HydrophobicContact CG2-CB 4.03Å; K16-C81 HydrophobicContact CG-CB 3.97Å; C81-V113 WeakPolarHBondContact CA-O 3.42Å; C81-T115 HydrophobicContact CB-CG2 4.23Å
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	-136.8	158.3	163.7	73.8	-83.8	0	0	0	109	V84 F90 V93 L112 V113 T115 I137 A142 Y154	F82-V84 HydrophobicContact CE2-CG1 4.02Å; F82-V84 HydrophobicContact CZ-CG1 4.4Å; F82-F90 HydrophobicContact CD1-CD2 4.05Å; F82-F90 HydrophobicContact CD2-CB 3.79Å; F82-F90 AromaticContact CD2-CD2 3.62Å; F82-F90 HydrophobicContact CD2-CD2 3.62Å; F82-F90 HydrophobicContact CD2-CG 4.17Å; F82-F90 AromaticContact CE1-CD2 3.86Å; F82-F90 HydrophobicContact CE1-CD2 3.86Å; F82-F90 HydrophobicContact CE1-CE2 4.15Å; F82-F90 HydrophobicContact CE2-CB 4.26Å; F82-F90 AromaticContact CE2-CD2 3.44Å; F82-F90 HydrophobicContact CE2-CD2 3.44Å; F82-F90 VanDerWaalsContact CE2-CD2 3.44Å; F82-F90 HydrophobicContact CE2-CE2 4.15Å; F82-F90 HydrophobicContact CE2-CG 4.22Å; F82-F90 HydrophobicContact CG-CB 4.29Å; F82-F90 AromaticContact CG-CD2 3.93Å; F82-F90 HydrophobicContact CG-CD2 3.93Å; F82-F90 AromaticContact CZ-CD2 3.57Å; F82-F90 HydrophobicContact CZ-CD2 3.57Å; F82-F90 AromaticContact CZ-CE2 3.87Å; F82-F90 HydrophobicContact CZ-CE2 3.87Å; F82-V93 HydrophobicContact CB-CG2 3.92Å; F82-V93 HydrophobicContact CD1-CG2 4.22Å; F82-V93 HydrophobicContact CG-CG2 4.35Å; F82-L112 HydrophobicContact CD1-CD1 3.76Å; F82-L112 HydrophobicContact CD1-CG 4.23Å; F82-L112 HydrophobicContact CE1-CD1 3.91Å; F82-L112 HydrophobicContact CE1-CD2 4.13Å; F82-L112 HydrophobicContact CE1-CG 3.85Å; F82-V113 WeakPolarHBondContact CD1-O 3.43Å; F82-V113 PolarHBondContact N-O 2.7Å; F82-T115 PolarHBondContact O-N 2.87Å; F82-T115 PolarHBondContact O-OG1 2.87Å; F82-I137 HydrophobicContact CE2-CB 4.07Å; F82-I137 HydrophobicContact CE2-CG1 4.15Å; F82-I137 HydrophobicContact CE2-CG2 3.96Å; F82-I137 HydrophobicContact CZ-CG2 4.31Å; F82-A142 HydrophobicContact CE1-CB 4.37Å; F82-A142 HydrophobicContact CZ-CB 3.76Å; F82-Y154 AromaticContact CE1-CE2 3.76Å; F82-Y154 HydrophobicContact CE1-CE2 3.76Å; F82-Y154 AromaticContact CZ-CE2 3.88Å; F82-Y154 HydrophobicContact CZ-CE2 3.88Å
83	S	98.8	Very high	98.3	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.014	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	132.5	173.4	164.9	0	0	0	0	110.5	V85 S86 S89 T115 Q116	S83-V85 PolarHBondContact O-N 3.25Å; S83-V85 VanDerWaalsContact O-N 3.07Å; S83-V85 VanDerWaalsContact OG-CG2 3.25Å; S83-V85 WeakPolarHBondContact OG-CG2 3.42Å; S83-V85 PolarHBondContact OG-N 3.09Å; S83-S86 PolarHBondContact O-N 2.98Å; S83-S89 PolarHBondContact N-OG 3.31Å; S83-T115 WeakPolarHBondContact CA-OG1 3.37Å; S83-Q116 PolarHBondContact OG-OE1 2.87Å
84	V	98.8	Very high	98.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-10.6	178.5	-53.2	0	0	0	0	113	F82 T115 I117 R120 P136 I137	F82-V84 HydrophobicContact CE2-CG1 4.02Å; F82-V84 HydrophobicContact CZ-CG1 4.4Å; V84-T115 PolarHBondContact N-O 2.9Å; V84-I117 HydrophobicContact CG1-CG2 3.99Å; V84-I117 HydrophobicContact CG2-CB 4.47Å; V84-I117 HydrophobicContact CG2-CG2 4.12Å; V84-R120 HydrophobicContact CG2-CB 4.22Å; V84-P136 CarbonylContact O-C 3.46Å; V84-P136 VanDerWaalsContact O-CA 3.24Å; V84-P136 WeakPolarHBondContact O-CA 3.06Å; V84-I137 PolarHBondContact O-N 3.2Å
85	V	98.5	Very high	98.5	Very high	20 Å²	20	31.4 Å²	31.4	12%	0.121	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	12.5	174.7	-62.2	0	0	0	0	113	S83 L119 T125 L129 P136	S83-V85 PolarHBondContact O-N 3.25Å; S83-V85 VanDerWaalsContact O-N 3.07Å; S83-V85 VanDerWaalsContact OG-CG2 3.25Å; S83-V85 WeakPolarHBondContact OG-CG2 3.42Å; S83-V85 PolarHBondContact OG-N 3.09Å; V85-L119 HydrophobicContact CB-CB 4.38Å; V85-L119 HydrophobicContact CG1-CB 3.66Å; V85-L119 WeakPolarHBondContact CG1-O 3.33Å; V85-L119 HydrophobicContact CG2-CB 3.9Å; V85-L119 HydrophobicContact CG2-CD1 3.83Å; V85-T125 HydrophobicContact CB-CG2 3.64Å; V85-T125 HydrophobicContact CG1-CG2 3.67Å; V85-T125 HydrophobicContact CG2-CG2 4.08Å; V85-L129 HydrophobicContact CB-CD1 4.18Å; V85-P136 HydrophobicContact CG1-CB 4.35Å; V85-P136 HydrophobicContact CG1-CG 4.45Å
86	S	98.4	Very high	98.6	Very high	35 Å²	35	32.8 Å²	32.8	25%	0.245	17%	0.167	C	C	.	.			trans	-125.6	89.7	172.9	-179.7	0	0	0	0	110.2	S83 S88 S89 F90	S83-S86 PolarHBondContact O-N 2.98Å; S86-S88 VanDerWaalsContact C-N 3.26Å; S86-S88 PolarHBondContact O-N 3.35Å; S86-S88 PolarHBondContact OG-OG 3.2Å; S86-S89 WeakPolarHBondContact CB-OG 3.47Å; S86-S89 PolarHBondContact O-N 3.5Å; S86-S89 PolarHBondContact O-OG 2.96Å; S86-F90 PolarHBondContact O-N 3.24Å
87	P	98.3	Very high	98.6	Very high	13 Å²	13	29.7 Å²	29.7	8%	0.084	15%	0.15	C	C	.	.	H	α-helix	trans	-58	-34.2	-178.8	-27.9	36.7	0	0	0	114.4	S89 F90 E91 L129 Q134 I137	P87-S89 VanDerWaalsContact C-N 3.33Å; P87-S89 PolarHBondContact O-N 3.45Å; P87-F90 WeakPolarHBondContact O-CB 3.37Å; P87-F90 PolarHBondContact O-N 2.7Å; P87-F90 VanDerWaalsContact O-N 3.15Å; P87-E91 PolarHBondContact O-N 3.31Å; P87-L129 HydrophobicContact CG-CD2 4.26Å; P87-Q134 HydrophobicContact CG-CB 4.11Å; P87-Q134 HydrophobicContact CG-CG 4.23Å; P87-I137 HydrophobicContact CB-CD1 4.2Å; P87-I137 HydrophobicContact CG-CD1 4.37Å
88	S	98.2	Very high	98.6	Very high	57 Å²	57	30.2 Å²	30.2	40%	0.399	15%	0.153	S	C	.	.	H	α-helix	trans	-62.9	-39.7	174.8	53.8	0	0	0	0	112	S86 F90 E91 N92	S86-S88 VanDerWaalsContact C-N 3.26Å; S86-S88 PolarHBondContact O-N 3.35Å; S86-S88 PolarHBondContact OG-OG 3.2Å; S88-F90 PolarHBondContact O-N 2.9Å; S88-E91 PolarHBondContact O-N 3.14Å; S88-N92 WeakPolarHBondContact O-CB 3.41Å; S88-N92 VanDerWaalsContact O-CG 3.28Å; S88-N92 PolarHBondContact O-N 3.39Å; S88-N92 PolarHBondContact O-ND2 3.11Å
89	S	98.7	Very high	98.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-29	176.4	75.4	0	0	0	0	112.8	D11 S83 S86 P87 V93	D11-S89 VanDerWaalsContact OD2-CA 3.31Å; D11-S89 WeakPolarHBondContact OD2-CA 3.34Å; S83-S89 PolarHBondContact N-OG 3.31Å; S86-S89 WeakPolarHBondContact CB-OG 3.47Å; S86-S89 PolarHBondContact O-N 3.5Å; S86-S89 PolarHBondContact O-OG 2.96Å; P87-S89 VanDerWaalsContact C-N 3.33Å; P87-S89 PolarHBondContact O-N 3.45Å; S89-V93 WeakPolarHBondContact O-CG2 3.45Å; S89-V93 PolarHBondContact O-N 3.19Å
90	F	98.8	Very high	98.6	Very high	24 Å²	24	34.5 Å²	34.5	11%	0.105	18%	0.179	C	C	.	.	H	α-helix	trans	-73.4	-40.3	175	-179.2	-107	0	0	0	112	F82 S86 P87 S88 V93 I137 T141 A142 L145	F82-F90 HydrophobicContact CD1-CD2 4.05Å; F82-F90 HydrophobicContact CD2-CB 3.79Å; F82-F90 AromaticContact CD2-CD2 3.62Å; F82-F90 HydrophobicContact CD2-CD2 3.62Å; F82-F90 HydrophobicContact CD2-CG 4.17Å; F82-F90 AromaticContact CE1-CD2 3.86Å; F82-F90 HydrophobicContact CE1-CD2 3.86Å; F82-F90 HydrophobicContact CE1-CE2 4.15Å; F82-F90 HydrophobicContact CE2-CB 4.26Å; F82-F90 AromaticContact CE2-CD2 3.44Å; F82-F90 HydrophobicContact CE2-CD2 3.44Å; F82-F90 VanDerWaalsContact CE2-CD2 3.44Å; F82-F90 HydrophobicContact CE2-CE2 4.15Å; F82-F90 HydrophobicContact CE2-CG 4.22Å; F82-F90 HydrophobicContact CG-CB 4.29Å; F82-F90 AromaticContact CG-CD2 3.93Å; F82-F90 HydrophobicContact CG-CD2 3.93Å; F82-F90 AromaticContact CZ-CD2 3.57Å; F82-F90 HydrophobicContact CZ-CD2 3.57Å; F82-F90 AromaticContact CZ-CE2 3.87Å; F82-F90 HydrophobicContact CZ-CE2 3.87Å; S86-F90 PolarHBondContact O-N 3.24Å; P87-F90 WeakPolarHBondContact O-CB 3.37Å; P87-F90 PolarHBondContact O-N 2.7Å; P87-F90 VanDerWaalsContact O-N 3.15Å; S88-F90 PolarHBondContact O-N 2.9Å; F90-V93 WeakPolarHBondContact O-CB 3.47Å; F90-V93 PolarHBondContact O-N 3.31Å; F90-I137 HydrophobicContact CB-CD1 4.15Å; F90-I137 HydrophobicContact CB-CG1 3.97Å; F90-I137 HydrophobicContact CD1-CD1 3.99Å; F90-I137 HydrophobicContact CD1-CG1 4.39Å; F90-I137 HydrophobicContact CD1-CG2 4.47Å; F90-I137 HydrophobicContact CD2-CG1 4.46Å; F90-I137 HydrophobicContact CD2-CG2 4.05Å; F90-I137 HydrophobicContact CE1-CG2 4.42Å; F90-I137 HydrophobicContact CE2-CG2 3.99Å; F90-I137 HydrophobicContact CG-CD1 4.11Å; F90-I137 HydrophobicContact CG-CG1 4.03Å; F90-I137 HydrophobicContact CG-CG2 4.27Å; F90-I137 HydrophobicContact CZ-CG2 4.17Å; F90-T141 HydrophobicContact CE1-CG2 3.83Å; F90-T141 HydrophobicContact CZ-CG2 3.92Å; F90-A142 HydrophobicContact CE2-CB 3.85Å; F90-A142 HydrophobicContact CZ-CB 4.38Å; F90-L145 HydrophobicContact CD1-CD2 4.44Å; F90-L145 HydrophobicContact CD2-CD2 3.9Å; F90-L145 HydrophobicContact CE1-CD2 3.96Å; F90-L145 HydrophobicContact CE2-CB 4.03Å; 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 3.4Å; F90-L145 VanDerWaalsContact CZ-CD2 3.4Å; F90-L145 HydrophobicContact CZ-CG 4.09Å
91	E	98.5	Very high	98.5	Very high	110 Å²	110	34.7 Å²	34.7	51%	0.514	18%	0.18	S	C	.	.	H	α-helix	trans	-62	-45.1	173.6	-69.6	169.7	175.2	0	0	111	P87 S88 V93 K94 E95	P87-E91 PolarHBondContact O-N 3.31Å; S88-E91 PolarHBondContact O-N 3.14Å; E91-V93 PolarHBondContact O-N 3.16Å; E91-V93 VanDerWaalsContact O-N 3.08Å; E91-K94 PolarHBondContact O-N 2.88Å; E91-E95 PolarHBondContact O-N 2.89Å
92	N	98.7	Very high	98.5	Very high	47 Å²	47	37.9 Å²	37.9	25%	0.251	20%	0.199	S	C	.	.	H	α-helix	trans	-60.3	-21.5	179	-73.8	-20.7	0	0	0	113.9	D11 S88 K94 E95 K96 W97	D11-N92 WeakPolarHBondContact OD1-CB 3.35Å; D11-N92 PolarHBondContact OD1-ND2 2.75Å; D11-N92 PolarHBondContact OD2-ND2 2.74Å; S88-N92 WeakPolarHBondContact O-CB 3.41Å; S88-N92 VanDerWaalsContact O-CG 3.28Å; S88-N92 PolarHBondContact O-N 3.39Å; S88-N92 PolarHBondContact O-ND2 3.11Å; N92-K94 VanDerWaalsContact C-N 3.3Å; N92-K94 PolarHBondContact O-N 3.46Å; N92-E95 PolarHBondContact O-N 3.13Å; N92-K96 WeakPolarHBondContact O-CA 3.27Å; N92-K96 WeakPolarHBondContact O-CB 3.22Å; N92-K96 PolarHBondContact O-N 2.88Å; N92-W97 VanDerWaalsContact O-CD1 3.29Å; N92-W97 PolarHBondContact O-N 2.95Å
93	V	98.8	Very high	98.4	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-55.3	-48.8	172	173.9	0	0	0	0	110.6	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 4.22Å; F82-V93 HydrophobicContact CG-CG2 4.35Å; S89-V93 WeakPolarHBondContact O-CG2 3.45Å; S89-V93 PolarHBondContact O-N 3.19Å; F90-V93 WeakPolarHBondContact O-CB 3.47Å; F90-V93 PolarHBondContact O-N 3.31Å; E91-V93 PolarHBondContact O-N 3.16Å; E91-V93 VanDerWaalsContact O-N 3.08Å; V93-V98 HydrophobicContact CG1-CG2 3.94Å; V93-V98 WeakPolarHBondContact O-CB 3.4Å; V93-V98 WeakPolarHBondContact O-CG2 3.2Å; V93-V98 PolarHBondContact O-N 2.54Å; V93-L112 HydrophobicContact CB-CD1 4.45Å; V93-L112 HydrophobicContact CG1-CD1 3.6Å; V93-L112 HydrophobicContact CG2-CD1 4Å; V93-L145 HydrophobicContact CB-CD2 4.17Å; V93-L145 HydrophobicContact CG1-CD2 4.1Å; V93-L149 HydrophobicContact CG1-CD1 3.6Å
94	K	98.4	Very high	98.4	Very high	135 Å²	135	49.1 Å²	49.1	59%	0.587	25%	0.251	S	S	*	.	I	π-helix	trans	-79.2	-36.6	-178.1	176.8	177.6	176.8	-170.5	0	112	E91 N92 P99 L145 L149	E91-K94 PolarHBondContact O-N 2.88Å; N92-K94 VanDerWaalsContact C-N 3.3Å; N92-K94 PolarHBondContact O-N 3.46Å; K94-P99 VanDerWaalsContact O-CD 3.27Å; K94-P99 WeakPolarHBondContact O-CD 3.16Å; K94-P99 WeakPolarHBondContact O-CG 3.07Å; K94-L145 HydrophobicContact CB-CD1 4.35Å; K94-L149 HydrophobicContact CB-CD1 4.36Å; K94-L149 HydrophobicContact CB-CD2 4.31Å; K94-L149 HydrophobicContact CG-CD2 4.1Å
95	E	98.1	Very high	98.3	Very high	141 Å²	141	49.9 Å²	49.9	66%	0.659	26%	0.257	S	S	*	.	I	π-helix	trans	-82.9	-30.6	-171.8	-62.5	-172.3	169.1	0	0	112.9	E91 N92	E91-E95 PolarHBondContact O-N 2.89Å; N92-E95 PolarHBondContact O-N 3.13Å
96	K	98.1	Very high	98.1	Very high	38 Å²	38	53.7 Å²	53.7	17%	0.165	28%	0.281	C	S	.	.	I	π-helix	trans	-125.3	-62.4	-174	178.4	174.1	179.5	158.8	0	113	D65 N92 P99 E100	D65-K96 VanDerWaalsContact CG-NZ 3.3Å; D65-K96 WeakPolarHBondContact OD1-CE 3.34Å; D65-K96 IonicContact OD1-NZ 3.47Å; D65-K96 PolarHBondContact OD1-NZ 2.93Å; D65-K96 IonicContact OD2-NZ 3.91Å; D65-K96 PolarHBondContact OD2-NZ 3.49Å; N92-K96 WeakPolarHBondContact O-CA 3.27Å; N92-K96 WeakPolarHBondContact O-CB 3.22Å; N92-K96 PolarHBondContact O-N 2.88Å; K96-P99 WeakPolarHBondContact O-CD 3.48Å; K96-E100 VanDerWaalsContact O-CB 3.31Å; K96-E100 WeakPolarHBondContact O-CB 3.35Å; K96-E100 PolarHBondContact O-N 2.89Å
97	W	98.6	Very high	97.8	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.311	C	S	.	.	I	π-helix	trans	-69.2	-47.8	-162.1	-62.4	111.9	0	0	0	113.9	V9 G10 D11 R68 V80 N92 E100 I101	V9-W97 HydrophobicContact CB-CE3 3.87Å; V9-W97 HydrophobicContact CB-CZ3 4.19Å; V9-W97 HydrophobicContact CG2-CE3 4.26Å; G10-W97 VanDerWaalsContact CA-CE2 3.42Å; G10-W97 WeakPolarHBondContact O-CH2 3.3Å; G10-W97 VanDerWaalsContact O-CZ2 3.24Å; G10-W97 WeakPolarHBondContact O-CZ2 3.2Å; D11-W97 PolarHBondContact OD1-NE1 3.25Å; R68-W97 VanDerWaalsContact CZ-CZ3 3.43Å; V80-W97 HydrophobicContact CG1-CB 3.77Å; N92-W97 VanDerWaalsContact O-CD1 3.29Å; N92-W97 PolarHBondContact O-N 2.95Å; W97-E100 PolarHBondContact O-N 2.91Å; W97-I101 PolarHBondContact O-N 3.46Å; W97-I101 VanDerWaalsContact O-N 3.07Å
98	V	98.6	Very high	97.8	Very high	11 Å²	11	62.6 Å²	62.6	7%	0.067	32%	0.317	C	S	.	.	H	α-helix	trans	-66.5	-45.1	177.5	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 3.94Å; V93-V98 WeakPolarHBondContact O-CB 3.4Å; V93-V98 WeakPolarHBondContact O-CG2 3.2Å; V93-V98 PolarHBondContact O-N 2.54Å; V98-E100 VanDerWaalsContact C-N 3.32Å; V98-E100 PolarHBondContact O-N 3.11Å; V98-I101 WeakPolarHBondContact O-CG1 3.46Å; V98-T102 VanDerWaalsContact O-CB 3.22Å; V98-T102 WeakPolarHBondContact O-CB 3.35Å; V98-T102 PolarHBondContact O-N 3.48Å; V98-T102 PolarHBondContact O-OG1 2.97Å; V98-F110 HydrophobicContact CG1-CE1 4.39Å; V98-F110 HydrophobicContact CG1-CZ 4.05Å; V98-F110 HydrophobicContact CG2-CD2 4.46Å; V98-F110 HydrophobicContact CG2-CE2 3.72Å; V98-F110 HydrophobicContact CG2-CZ 3.88Å; V98-L149 HydrophobicContact CB-CD1 4.42Å; V98-L149 HydrophobicContact CG1-CD2 4.49Å; V98-L149 HydrophobicContact CG2-CD1 3.88Å
99	P	98.5	Very high	97.8	Very high	63 Å²	63	60.6 Å²	60.6	41%	0.409	30%	0.303	S	S	.	.	H	α-helix	trans	-53.5	-44.5	170.6	-29.3	35.6	0	0	0	113.8	K94 K96 T102 H103	K94-P99 VanDerWaalsContact O-CD 3.27Å; K94-P99 WeakPolarHBondContact O-CD 3.16Å; K94-P99 WeakPolarHBondContact O-CG 3.07Å; K96-P99 WeakPolarHBondContact O-CD 3.48Å; P99-T102 PolarHBondContact O-N 2.99Å; P99-H103 WeakPolarHBondContact O-CB 3.49Å; P99-H103 PolarHBondContact O-N 3.45Å
100	E	98.5	Very high	97.8	Very high	28 Å²	28	61.4 Å²	61.4	13%	0.131	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-53.3	-179	-173	-179.2	120.2	0	0	112.2	R68 Y72 K96 W97 V98 T102 H103 H104	R68-E100 WeakPolarHBondContact CD-OE1 3.44Å; R68-E100 IonicContact CZ-OE1 2.81Å; R68-E100 IonicContact NH1-OE1 2.89Å; R68-E100 PolarHBondContact NH1-OE1 2.87Å; R68-E100 IonicContact NH1-OE2 3.25Å; R68-E100 PolarHBondContact NH1-OE2 3.48Å; Y72-E100 HydrophobicContact CE2-CG 4.25Å; Y72-E100 PolarHBondContact OH-OE1 3.48Å; K96-E100 VanDerWaalsContact O-CB 3.31Å; K96-E100 WeakPolarHBondContact O-CB 3.35Å; K96-E100 PolarHBondContact O-N 2.89Å; W97-E100 PolarHBondContact O-N 2.91Å; V98-E100 VanDerWaalsContact C-N 3.32Å; V98-E100 PolarHBondContact O-N 3.11Å; E100-T102 VanDerWaalsContact C-N 3.26Å; E100-T102 PolarHBondContact O-N 3.4Å; E100-H103 WeakPolarHBondContact O-CB 3.49Å; E100-H103 PolarHBondContact O-N 3.36Å; E100-H104 PolarHBondContact O-CD2 3.01Å; E100-H104 PolarHBondContact O-N 2.91Å
101	I	98.3	Very high	97.8	Very high	4 Å²	4	60.3 Å²	60.3	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-66.2	-31.8	179.7	68.2	175.2	0	0	0	111.6	V9 F78 V80 W97 V98 C105 F110	V9-I101 HydrophobicContact CG1-CG2 4.44Å; V9-I101 HydrophobicContact CG2-CG2 4.03Å; F78-I101 HydrophobicContact CB-CD1 4.05Å; F78-I101 HydrophobicContact CD1-CB 4.46Å; F78-I101 HydrophobicContact CD1-CG2 3.88Å; F78-I101 HydrophobicContact CD2-CB 4.3Å; F78-I101 HydrophobicContact CD2-CD1 4.28Å; F78-I101 HydrophobicContact CE1-CB 4.43Å; F78-I101 HydrophobicContact CE1-CG2 3.92Å; F78-I101 HydrophobicContact CE2-CB 4.27Å; F78-I101 HydrophobicContact CG-CB 4.4Å; F78-I101 HydrophobicContact CG-CD1 4.15Å; F78-I101 HydrophobicContact CG-CG2 4.22Å; F78-I101 HydrophobicContact CZ-CB 4.34Å; F78-I101 HydrophobicContact CZ-CG2 4.31Å; V80-I101 HydrophobicContact CG2-CD1 3.62Å; W97-I101 PolarHBondContact O-N 3.46Å; W97-I101 VanDerWaalsContact O-N 3.07Å; V98-I101 WeakPolarHBondContact O-CG1 3.46Å; I101-C105 CarbonylContact O-C 3.56Å; I101-C105 VanDerWaalsContact O-CA 3.31Å; I101-C105 WeakPolarHBondContact O-CA 3.27Å; I101-C105 WeakPolarHBondContact O-CB 3.4Å; I101-C105 PolarHBondContact O-N 3.29Å; I101-F110 HydrophobicContact CD1-CB 3.84Å; I101-F110 HydrophobicContact CD1-CD1 4.1Å; I101-F110 HydrophobicContact CD1-CD2 4.4Å; I101-F110 HydrophobicContact CD1-CG 3.87Å
102	T	97.6	Very high	97.8	Very high	68 Å²	68	55.1 Å²	55.1	42%	0.417	28%	0.278	S	S	.	.	H	α-helix	trans	-71.5	-34	177.8	-56.3	0	0	0	0	111.3	V98 P99 E100 P106	V98-T102 VanDerWaalsContact O-CB 3.22Å; V98-T102 WeakPolarHBondContact O-CB 3.35Å; V98-T102 PolarHBondContact O-N 3.48Å; V98-T102 PolarHBondContact O-OG1 2.97Å; P99-T102 PolarHBondContact O-N 2.99Å; E100-T102 VanDerWaalsContact C-N 3.26Å; E100-T102 PolarHBondContact O-N 3.4Å; T102-P106 VanDerWaalsContact O-CA 3.26Å; T102-P106 WeakPolarHBondContact O-CA 3.21Å; T102-P106 WeakPolarHBondContact O-CB 3.41Å
103	H	97.6	Very high	97.8	Very high	149 Å²	149	52.9 Å²	52.9	69%	0.69	27%	0.266	S	S	*	.	H	α-helix	trans	-64.3	-46.1	175.5	178.1	72.7	0	0	0	111.6	P99 E100	P99-H103 WeakPolarHBondContact O-CB 3.49Å; P99-H103 PolarHBondContact O-N 3.45Å; E100-H103 WeakPolarHBondContact O-CB 3.49Å; E100-H103 PolarHBondContact O-N 3.36Å
104	H	97.6	Very high	97.8	Very high	88 Å²	88	52.9 Å²	52.9	41%	0.407	27%	0.266	S	S	.	.	H	α-helix	trans	-85	-33.7	-176.9	-70.9	-71.8	0	0	0	113.8	Y72 E100	Y72-H104 HydrophobicContact CD2-CB 3.65Å; Y72-H104 AromaticContact CD2-CD2 3.94Å; Y72-H104 AromaticContact CD2-CG 3.87Å; Y72-H104 HydrophobicContact CE2-CB 4.39Å; Y72-H104 AromaticContact CE2-CD2 3.94Å; E100-H104 PolarHBondContact O-CD2 3.01Å; E100-H104 PolarHBondContact O-N 2.91Å
105	C	96.8	Very high	97.8	Very high	17 Å²	17	46.6 Å²	46.6	12%	0.115	24%	0.239	C	C	.	.			trans	-136.5	65.5	-172.1	-64.4	0	0	0	0	111.5	Y72 F78 I101 K107 T108	Y72-C105 PolarHBondContact O-SG 3.39Å; F78-C105 HydrophobicContact CE2-CB 3.65Å; F78-C105 HydrophobicContact CZ-CB 4.08Å; I101-C105 CarbonylContact O-C 3.56Å; I101-C105 VanDerWaalsContact O-CA 3.31Å; I101-C105 WeakPolarHBondContact O-CA 3.27Å; I101-C105 WeakPolarHBondContact O-CB 3.4Å; I101-C105 PolarHBondContact O-N 3.29Å; C105-K107 PolarHBondContact O-N 3.2Å; C105-T108 PolarHBondContact O-N 3.04Å; C105-T108 VanDerWaalsContact O-N 3.09Å
106	P	94.9	Very high	97.9	Very high	99 Å²	99	42.4 Å²	42.4	64%	0.643	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.1	-167.5	24.6	-36.2	0	0	0	115.9	T102	T102-P106 VanDerWaalsContact O-CA 3.26Å; T102-P106 WeakPolarHBondContact O-CA 3.21Å; T102-P106 WeakPolarHBondContact O-CB 3.41Å
107	K	93.4	Very high	97.9	Very high	201 Å²	201	41.5 Å²	41.5	87%	0.874	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-7.3	-179.2	-62.7	-176.8	-177.6	177.5	0	113.1	C105	C105-K107 PolarHBondContact O-N 3.2Å
108	T	97.4	Very high	97.8	Very high	34 Å²	34	43.8 Å²	43.8	21%	0.209	23%	0.228	C	C	.	.			trans	-78.3	127.2	-175.4	-59.3	0	0	0	0	109.1	T75 F78 C105	T75-T108 HydrophobicContact CG2-CG2 3.97Å; T75-T108 WeakPolarHBondContact O-CG2 3.48Å; T75-T108 PolarHBondContact O-OG1 3.04Å; F78-T108 HydrophobicContact CD2-CG2 3.5Å; F78-T108 VanDerWaalsContact CD2-CG2 3.5Å; F78-T108 HydrophobicContact CE2-CG2 3.56Å; C105-T108 PolarHBondContact O-N 3.04Å; C105-T108 VanDerWaalsContact O-N 3.09Å
109	P	98.1	Very high	97.8	Very high	16 Å²	16	45.6 Å²	45.6	10%	0.104	24%	0.237	C	C	.	.			trans	-65.9	156.6	177.1	27.4	-34.2	0	0	0	111.2	D76 V77 F78 V152 A175 P179	D76-P109 WeakPolarHBondContact O-CD 3.41Å; D76-P109 WeakPolarHBondContact O-CG 3.41Å; V77-P109 WeakPolarHBondContact CA-O 3.32Å; F78-P109 PolarHBondContact N-O 3.45Å; P109-V152 HydrophobicContact CB-CG2 3.55Å; P109-A175 WeakPolarHBondContact CG-O 3.31Å; P109-P179 HydrophobicContact CG-CB 4.43Å
110	F	98.7	Very high	97.8	Very high	17 Å²	17	44.5 Å²	44.5	8%	0.075	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	151	174	73.4	-84.2	0	0	0	112.1	F78 V80 V98 I101 L149 A151 V152	F78-F110 HydrophobicContact CB-CB 3.73Å; F78-F110 CarbonylContact O-C 3.28Å; F78-F110 WeakPolarHBondContact O-CA 3.38Å; V80-F110 HydrophobicContact CB-CD2 4.32Å; 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 4.39Å; V98-F110 HydrophobicContact CG1-CZ 4.05Å; V98-F110 HydrophobicContact CG2-CD2 4.46Å; V98-F110 HydrophobicContact CG2-CE2 3.72Å; V98-F110 HydrophobicContact CG2-CZ 3.88Å; I101-F110 HydrophobicContact CD1-CB 3.84Å; I101-F110 HydrophobicContact CD1-CD1 4.1Å; I101-F110 HydrophobicContact CD1-CD2 4.4Å; I101-F110 HydrophobicContact CD1-CG 3.87Å; F110-L149 HydrophobicContact CZ-CB 4.12Å; F110-L149 WeakPolarHBondContact CZ-O 3.38Å; F110-A151 HydrophobicContact CD2-CB 3.97Å; F110-A151 HydrophobicContact CE2-CB 3.47Å; F110-A151 VanDerWaalsContact CE2-CB 3.47Å; F110-A151 HydrophobicContact CZ-CB 3.84Å; F110-V152 PolarHBondContact O-N 3.42Å
111	L	98.8	Very high	97.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	142.9	167.1	-59.7	-172.8	0	0	0	110.1	F78 L79 V80 V113 V152 K153 V155 E171 A172 A175	F78-L111 PolarHBondContact O-N 2.71Å; L79-L111 HydrophobicContact CD2-CB 3.89Å; L79-L111 HydrophobicContact CD2-CD1 3.89Å; L79-L111 HydrophobicContact CD2-CG 4.16Å; V80-L111 PolarHBondContact N-O 3.06Å; L111-V113 HydrophobicContact CB-CG2 4.19Å; L111-V152 HydrophobicContact CD2-CB 3.9Å; L111-V152 HydrophobicContact CD2-CG1 4.41Å; L111-K153 HydrophobicContact CD2-CB 3.8Å; L111-V155 HydrophobicContact CD1-CG2 4.36Å; L111-E171 HydrophobicContact CD1-CB 3.74Å; L111-A172 HydrophobicContact CD1-CB 3.96Å; L111-A175 HydrophobicContact CD2-CB 4.46Å
112	L	98.9	Very high	97.6	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.3	163.6	-176.5	63.2	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 3.91Å; F82-L112 HydrophobicContact CE1-CD2 4.13Å; F82-L112 HydrophobicContact CE1-CG 3.85Å; V93-L112 HydrophobicContact CB-CD1 4.45Å; V93-L112 HydrophobicContact CG1-CD1 3.6Å; V93-L112 HydrophobicContact CG2-CD1 4Å; L112-A142 WeakPolarHBondContact CD2-O 3.21Å; L112-L145 HydrophobicContact CD2-CB 4.39Å; L112-L145 HydrophobicContact CD2-CD2 4.36Å; L112-L145 HydrophobicContact CD2-CG 4.47Å; L112-A146 HydrophobicContact CB-CB 4.12Å; L112-A146 HydrophobicContact CD2-CB 3.85Å; L112-A151 HydrophobicContact CB-CB 4.21Å; L112-K153 PolarHBondContact N-O 2.99Å; L112-Y154 HydrophobicContact CB-CD2 4.06Å; L112-Y154 HydrophobicContact CD2-CD2 3.96Å; L112-Y154 HydrophobicContact CD2-CE2 4.45Å; L112-Y154 HydrophobicContact CG-CD2 3.85Å; L112-Y154 HydrophobicContact CG-CE2 4.3Å; L112-Y154 WeakPolarHBondContact O-CA 3.09Å; L112-Y154 VanDerWaalsContact O-CD2 3.3Å; L112-Y154 WeakPolarHBondContact O-CD2 3.44Å; L112-V155 PolarHBondContact O-N 2.84Å
113	V	98.9	Very high	97.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	114.2	-174.5	-172.9	0	0	0	0	110.5	L79 V80 C81 F82 L111 T115 V155 V168	L79-V113 HydrophobicContact CB-CG2 4.09Å; L79-V113 HydrophobicContact CD2-CG2 3.94Å; L79-V113 HydrophobicContact CG-CG2 4.46Å; V80-V113 PolarHBondContact O-N 3.36Å; C81-V113 WeakPolarHBondContact CA-O 3.42Å; F82-V113 WeakPolarHBondContact CD1-O 3.43Å; F82-V113 PolarHBondContact N-O 2.7Å; L111-V113 HydrophobicContact CB-CG2 4.19Å; V113-T115 HydrophobicContact CG1-CG2 4.16Å; V113-V155 CarbonylContact C-O 3.55Å; V113-V155 WeakPolarHBondContact CA-O 3.33Å; V113-V155 HydrophobicContact CB-CG2 4.39Å; V113-V155 HydrophobicContact CG1-CG2 4.32Å; V113-V155 HydrophobicContact CG2-CG2 3.86Å; V113-V168 HydrophobicContact CG1-CG1 4.18Å; V113-V168 HydrophobicContact CG1-CG2 4.09Å; V113-V168 HydrophobicContact CG2-CG1 4.12Å
114	G	98.8	Very high	97.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	113.7	169.9	0	0	0	0	0	110.7	V155 E156 C157	G114-V155 PolarHBondContact N-O 3Å; G114-E156 CarbonylContact O-C 3.59Å; G114-E156 VanDerWaalsContact O-CA 3.3Å; G114-E156 WeakPolarHBondContact O-CA 3.32Å; G114-C157 PolarHBondContact O-N 2.88Å
115	T	98.8	Very high	97.6	Very high	4 Å²	4	45.7 Å²	45.7	3%	0.025	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	169.5	-179.6	66	0	0	0	0	111.5	V14 C81 F82 S83 V84 V113 I117 C157	V14-T115 VanDerWaalsContact O-CB 3.32Å; V14-T115 WeakPolarHBondContact O-CB 2.99Å; V14-T115 PolarHBondContact O-OG1 3.1Å; C81-T115 HydrophobicContact CB-CG2 4.23Å; F82-T115 PolarHBondContact O-N 2.87Å; F82-T115 PolarHBondContact O-OG1 2.87Å; S83-T115 WeakPolarHBondContact CA-OG1 3.37Å; V84-T115 PolarHBondContact N-O 2.9Å; V113-T115 HydrophobicContact CG1-CG2 4.16Å; T115-I117 VanDerWaalsContact C-N 3.32Å; T115-I117 PolarHBondContact O-N 2.95Å; T115-C157 CarbonylContact C-O 3.58Å; T115-C157 WeakPolarHBondContact CA-O 3.22Å
116	Q	98.4	Very high	97.6	Very high	53 Å²	53	47.7 Å²	47.7	25%	0.248	26%	0.26	C	S	.	.			trans	61.4	35.7	174.4	-57.4	176.5	-39.1	0	0	113.5	S83 D118 L119 C157	S83-Q116 PolarHBondContact OG-OE1 2.87Å; Q116-D118 PolarHBondContact O-N 3.05Å; Q116-D118 VanDerWaalsContact O-N 3.16Å; Q116-L119 HydrophobicContact CB-CD1 4.08Å; Q116-L119 HydrophobicContact CB-CG 4.39Å; Q116-L119 WeakPolarHBondContact O-CB 3.39Å; Q116-L119 PolarHBondContact O-N 3.34Å; Q116-C157 PolarHBondContact N-O 3.33Å; Q116-C157 VanDerWaalsContact N-O 3.13Å
117	I	98.6	Very high	97.8	Very high	18 Å²	18	48.1 Å²	48.1	9%	0.092	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-64.8	-18	-179	67.8	178.4	0	0	0	114.3	V84 T115 L119 R120 E156 C157 K163	V84-I117 HydrophobicContact CG1-CG2 3.99Å; V84-I117 HydrophobicContact CG2-CB 4.47Å; V84-I117 HydrophobicContact CG2-CG2 4.12Å; T115-I117 VanDerWaalsContact C-N 3.32Å; T115-I117 PolarHBondContact O-N 2.95Å; I117-L119 PolarHBondContact O-N 3.29Å; I117-R120 WeakPolarHBondContact O-CB 3.49Å; I117-R120 PolarHBondContact O-N 3.21Å; I117-E156 HydrophobicContact CD1-CB 4.34Å; I117-E156 HydrophobicContact CG2-CB 3.85Å; I117-E156 HydrophobicContact CG2-CG 4.13Å; I117-C157 PolarHBondContact N-O 3.35Å; I117-K163 HydrophobicContact CD1-CB 4.45Å; I117-K163 HydrophobicContact CD1-CD 3.89Å; I117-K163 HydrophobicContact CD1-CG 4.09Å
118	D	97.9	Very high	97.9	Very high	49 Å²	49	44.9 Å²	44.9	26%	0.262	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-62.1	-25	170.4	51.7	-75.1	0	0	0	112.9	Q116 S158 L160 T161	Q116-D118 PolarHBondContact O-N 3.05Å; Q116-D118 VanDerWaalsContact O-N 3.16Å; D118-S158 VanDerWaalsContact CG-OG 3.25Å; D118-S158 WeakPolarHBondContact OD1-CB 3.46Å; D118-S158 PolarHBondContact OD1-OG 3.16Å; D118-L160 WeakPolarHBondContact OD2-CD2 3.49Å; D118-T161 HydrophobicContact CB-CG2 4Å
119	L	98.1	Very high	97.9	Very high	49 Å²	49	43.9 Å²	43.9	26%	0.257	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-88.3	-9	179.8	-58.5	-178.4	0	0	0	113.5	V85 Q116 I117 D121 D122 T125	V85-L119 HydrophobicContact CB-CB 4.38Å; V85-L119 HydrophobicContact CG1-CB 3.66Å; V85-L119 WeakPolarHBondContact CG1-O 3.33Å; V85-L119 HydrophobicContact CG2-CB 3.9Å; 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 3.39Å; Q116-L119 PolarHBondContact O-N 3.34Å; I117-L119 PolarHBondContact O-N 3.29Å; L119-D121 VanDerWaalsContact C-N 3.29Å; L119-D121 PolarHBondContact O-N 3.15Å; L119-D122 HydrophobicContact CD2-CB 4.42Å; L119-D122 PolarHBondContact O-N 3.4Å; L119-T125 HydrophobicContact CB-CG2 4.3Å
120	R	97.9	Very high	97.9	Very high	40 Å²	40	46 Å²	46	15%	0.151	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-40.6	-175.2	179.4	177.9	-71.7	140.7	-5.6	112.4	V84 I117 V126 P136 I137 E156	V84-R120 HydrophobicContact CG2-CB 4.22Å; I117-R120 WeakPolarHBondContact O-CB 3.49Å; I117-R120 PolarHBondContact O-N 3.21Å; R120-V126 WeakPolarHBondContact O-CG2 3.43Å; R120-P136 HydrophobicContact CG-CB 3.94Å; R120-P136 WeakPolarHBondContact O-CG 3.41Å; R120-I137 PolarHBondContact NE-O 3.48Å; R120-I137 PolarHBondContact NH2-O 3.08Å; R120-E156 IonicContact CZ-OE1 2.62Å; R120-E156 IonicContact CZ-OE2 2.67Å; R120-E156 IonicContact NH1-OE1 2.73Å; R120-E156 IonicContact NH1-OE2 3.51Å; R120-E156 PolarHBondContact NH1-OE2 3.09Å; R120-E156 IonicContact NH2-OE1 2.75Å; R120-E156 PolarHBondContact NH2-OE1 2.91Å; R120-E156 IonicContact NH2-OE2 2.67Å; R120-E156 PolarHBondContact NH2-OE2 2.63Å
121	D	96	Very high	97.8	Very high	137 Å²	137	52 Å²	52	73%	0.733	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	7.1	-179.1	-56.6	-47.7	0	0	0	112.2	L119 P123	L119-D121 VanDerWaalsContact C-N 3.29Å; L119-D121 PolarHBondContact O-N 3.15Å; D121-P123 WeakPolarHBondContact O-CD 3.34Å
122	D	97.6	Very high	97.7	Very high	48 Å²	48	57.6 Å²	57.6	26%	0.257	31%	0.307	S	S	.	.			trans	-67.2	119.3	176.9	171.2	60.6	0	0	0	110.1	L119 S124 T125 V126	L119-D122 HydrophobicContact CD2-CB 4.42Å; L119-D122 PolarHBondContact O-N 3.4Å; D122-S124 PolarHBondContact O-N 3.09Å; D122-S124 WeakPolarHBondContact OD2-CB 3.42Å; D122-S124 PolarHBondContact OD2-N 3.24Å; D122-S124 PolarHBondContact OD2-OG 3.05Å; D122-T125 PolarHBondContact O-N 3.24Å; D122-T125 VanDerWaalsContact O-N 3.09Å; D122-T125 WeakPolarHBondContact OD2-CB 3.16Å; D122-T125 PolarHBondContact OD2-N 2.9Å; D122-T125 PolarHBondContact OD2-OG1 3.03Å; D122-V126 WeakPolarHBondContact O-CG2 3.48Å; D122-V126 PolarHBondContact O-N 3.39Å
123	P	97.6	Very high	97.6	Very high	101 Å²	101	67.2 Å²	67.2	66%	0.656	35%	0.349	S	S	*	.	H	α-helix	trans	-56.8	-38.6	-175	-27.4	35.3	0	0	0	113.3	D121 T125 E127	D121-P123 WeakPolarHBondContact O-CD 3.34Å; P123-T125 PolarHBondContact O-N 3.4Å; P123-E127 WeakPolarHBondContact O-CB 3.46Å; P123-E127 PolarHBondContact O-N 3.4Å
124	S	97.4	Very high	97.5	Very high	55 Å²	55	70.6 Å²	70.6	39%	0.385	37%	0.365	S	S	.	.	H	α-helix	trans	-67.8	-38.1	-178.3	88.8	0	0	0	0	111.8	D122 K128	D122-S124 PolarHBondContact O-N 3.09Å; D122-S124 WeakPolarHBondContact OD2-CB 3.42Å; D122-S124 PolarHBondContact OD2-N 3.24Å; D122-S124 PolarHBondContact OD2-OG 3.05Å; S124-K128 WeakPolarHBondContact O-CD 3.48Å; S124-K128 VanDerWaalsContact O-CG 3.22Å; S124-K128 WeakPolarHBondContact O-CG 3.25Å; S124-K128 PolarHBondContact O-N 3.13Å; S124-K128 VanDerWaalsContact O-N 3.11Å
125	T	96.9	Very high	97.5	Very high	20 Å²	20	78.8 Å²	78.8	12%	0.123	40%	0.4	C	S	.	.	H	α-helix	trans	-72.7	-44.5	179.1	-59	0	0	0	0	110.8	V85 L119 D122 P123 E127 K128 L129	V85-T125 HydrophobicContact CB-CG2 3.64Å; V85-T125 HydrophobicContact CG1-CG2 3.67Å; V85-T125 HydrophobicContact CG2-CG2 4.08Å; L119-T125 HydrophobicContact CB-CG2 4.3Å; D122-T125 PolarHBondContact O-N 3.24Å; D122-T125 VanDerWaalsContact O-N 3.09Å; D122-T125 WeakPolarHBondContact OD2-CB 3.16Å; D122-T125 PolarHBondContact OD2-N 2.9Å; D122-T125 PolarHBondContact OD2-OG1 3.03Å; P123-T125 PolarHBondContact O-N 3.4Å; T125-E127 VanDerWaalsContact C-N 3.34Å; T125-E127 PolarHBondContact O-N 3.45Å; T125-K128 PolarHBondContact O-N 2.85Å; T125-L129 HydrophobicContact CG2-CD1 4.27Å; T125-L129 PolarHBondContact O-N 2.88Å
126	V	97.1	Very high	97.4	Very high	59 Å²	59	79.7 Å²	79.7	36%	0.358	41%	0.406	S	S	.	.	H	α-helix	trans	-60.2	-43.9	175.6	174.2	0	0	0	0	111	R120 D122 L129 A130 P136	R120-V126 WeakPolarHBondContact O-CG2 3.43Å; D122-V126 WeakPolarHBondContact O-CG2 3.48Å; D122-V126 PolarHBondContact O-N 3.39Å; V126-L129 PolarHBondContact O-N 3.37Å; V126-A130 WeakPolarHBondContact O-CB 3.34Å; V126-A130 PolarHBondContact O-N 3.23Å; V126-P136 HydrophobicContact CG2-CG 4.22Å
127	E	97.7	Very high	97.5	Very high	109 Å²	109	78 Å²	78	51%	0.509	40%	0.399	S	S	.	.	H	α-helix	trans	-63.4	-43	177.6	-165.5	-160.7	144	0	0	112	P123 T125 A130 K131	P123-E127 WeakPolarHBondContact O-CB 3.46Å; P123-E127 PolarHBondContact O-N 3.4Å; T125-E127 VanDerWaalsContact C-N 3.34Å; T125-E127 PolarHBondContact O-N 3.45Å; E127-A130 PolarHBondContact O-N 2.62Å; E127-K131 WeakPolarHBondContact O-CG 3.18Å; E127-K131 PolarHBondContact O-N 2.75Å; E127-K131 VanDerWaalsContact O-N 3.1Å; E127-K131 WeakPolarHBondContact OE1-CE 3.41Å; E127-K131 IonicContact OE1-NZ 2.98Å; E127-K131 PolarHBondContact OE1-NZ 3.24Å
128	K	97.1	Very high	97.5	Very high	132 Å²	132	80 Å²	80	57%	0.574	41%	0.412	S	S	*	.	H	α-helix	trans	-61.1	-45.1	176.5	-75.7	168.8	-173.5	169.8	0	112	S124 T125 K131	S124-K128 WeakPolarHBondContact O-CD 3.48Å; S124-K128 VanDerWaalsContact O-CG 3.22Å; S124-K128 WeakPolarHBondContact O-CG 3.25Å; S124-K128 PolarHBondContact O-N 3.13Å; S124-K128 VanDerWaalsContact O-N 3.11Å; T125-K128 PolarHBondContact O-N 2.85Å; K128-K131 WeakPolarHBondContact O-CB 3.18Å; K128-K131 PolarHBondContact O-N 3.41Å
129	L	97	Very high	97.5	Very high	14 Å²	14	79.5 Å²	79.5	7%	0.073	41%	0.411	C	S	.	.	H	α-helix	trans	-64.4	-41.7	176.7	-74	169.9	0	0	0	111.5	V85 P87 T125 V126 K131 N132 K133 Q134 P136	V85-L129 HydrophobicContact CB-CD1 4.18Å; P87-L129 HydrophobicContact CG-CD2 4.26Å; T125-L129 HydrophobicContact CG2-CD1 4.27Å; T125-L129 PolarHBondContact O-N 2.88Å; V126-L129 PolarHBondContact O-N 3.37Å; L129-K131 VanDerWaalsContact C-N 3.28Å; L129-K131 PolarHBondContact O-N 3.33Å; L129-N132 CarbonylContact O-C 3.43Å; L129-N132 WeakPolarHBondContact O-CA 3.3Å; L129-N132 PolarHBondContact O-N 3.34Å; L129-K133 PolarHBondContact O-N 3.16Å; L129-Q134 CarbonylContact C-O 3.46Å; L129-Q134 VanDerWaalsContact C-O 3.28Å; L129-Q134 HydrophobicContact CB-CB 4.2Å; L129-Q134 HydrophobicContact CD2-CB 3.95Å; L129-Q134 PolarHBondContact O-N 3.2Å; L129-P136 HydrophobicContact CD1-CG 3.81Å
130	A	97.2	Very high	97.5	Very high	59 Å²	59	83 Å²	83	49%	0.488	43%	0.426	S	S	.	.	H	α-helix	trans	-60.7	-35.5	178.4	0	0	0	0	0	112.7	V126 E127 N132 K133 Q134	V126-A130 WeakPolarHBondContact O-CB 3.34Å; V126-A130 PolarHBondContact O-N 3.23Å; E127-A130 PolarHBondContact O-N 2.62Å; A130-N132 PolarHBondContact O-N 2.94Å; A130-K133 PolarHBondContact O-N 3.15Å; A130-Q134 PolarHBondContact N-O 3.03Å
131	K	97.2	Very high	97.5	Very high	143 Å²	143	84.5 Å²	84.5	62%	0.622	44%	0.44	S	S	*	.	H	α-helix	trans	-58.5	-31.1	173.4	-72.4	171.2	-174.7	167.5	0	112.6	E127 K128 L129	E127-K131 WeakPolarHBondContact O-CG 3.18Å; E127-K131 PolarHBondContact O-N 2.75Å; E127-K131 VanDerWaalsContact O-N 3.1Å; E127-K131 WeakPolarHBondContact OE1-CE 3.41Å; E127-K131 IonicContact OE1-NZ 2.98Å; E127-K131 PolarHBondContact OE1-NZ 3.24Å; K128-K131 WeakPolarHBondContact O-CB 3.18Å; K128-K131 PolarHBondContact O-N 3.41Å; L129-K131 VanDerWaalsContact C-N 3.28Å; L129-K131 PolarHBondContact O-N 3.33Å
132	N	95.8	Very high	97.6	Very high	119 Å²	119	78 Å²	78	64%	0.636	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	13.7	175.8	-63.8	-23.8	0	0	0	113.1	L129 A130 Q134	L129-N132 CarbonylContact O-C 3.43Å; L129-N132 WeakPolarHBondContact O-CA 3.3Å; L129-N132 PolarHBondContact O-N 3.34Å; A130-N132 PolarHBondContact O-N 2.94Å; N132-Q134 HydrophobicContact CB-CG 4.48Å; N132-Q134 PolarHBondContact O-N 2.56Å
133	K	97.2	Very high	97.7	Very high	202 Å²	202	79.8 Å²	79.8	88%	0.878	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	26.3	-175.2	-54.9	177.8	-179.2	176.7	0	113.7	L129 A130	L129-K133 PolarHBondContact O-N 3.16Å; A130-K133 PolarHBondContact O-N 3.15Å
134	Q	97.6	Very high	97.8	Very high	71 Å²	71	81 Å²	81	33%	0.332	41%	0.407	S	S	.	.			trans	-106	165.1	179.1	-75.7	177	-29.2	0	0	110.9	P87 L129 A130 N132	P87-Q134 HydrophobicContact CG-CB 4.11Å; P87-Q134 HydrophobicContact CG-CG 4.23Å; L129-Q134 CarbonylContact C-O 3.46Å; L129-Q134 VanDerWaalsContact C-O 3.28Å; L129-Q134 HydrophobicContact CB-CB 4.2Å; L129-Q134 HydrophobicContact CD2-CB 3.95Å; L129-Q134 PolarHBondContact O-N 3.2Å; A130-Q134 PolarHBondContact N-O 3.03Å; N132-Q134 HydrophobicContact CB-CG 4.48Å; N132-Q134 PolarHBondContact O-N 2.56Å
135	K	97.8	Very high	97.8	Very high	173 Å²	173	79.4 Å²	79.4	75%	0.752	39%	0.394	S	S	*	.			trans	-138	155.4	174.1	-66.1	-177	-179.7	-179	0	109.4
136	P	98.4	Very high	97.9	Very high	23 Å²	23	78.7 Å²	78.7	15%	0.149	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-54.4	147	168	-24.5	33.9	0	0	0	111.8	V84 V85 R120 V126 L129 T138	V84-P136 CarbonylContact O-C 3.46Å; V84-P136 VanDerWaalsContact O-CA 3.24Å; V84-P136 WeakPolarHBondContact O-CA 3.06Å; V85-P136 HydrophobicContact CG1-CB 4.35Å; V85-P136 HydrophobicContact CG1-CG 4.45Å; R120-P136 HydrophobicContact CG-CB 3.94Å; R120-P136 WeakPolarHBondContact O-CG 3.41Å; V126-P136 HydrophobicContact CG2-CG 4.22Å; L129-P136 HydrophobicContact CD1-CG 3.81Å; P136-T138 PolarHBondContact O-N 3.07Å
137	I	98.7	Very high	97.9	Very high	18 Å²	18	83.2 Å²	83.2	9%	0.092	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-70.8	127.1	175.7	-53.5	-52	0	0	0	109.3	F82 V84 P87 F90 R120 T141 A142	F82-I137 HydrophobicContact CE2-CB 4.07Å; F82-I137 HydrophobicContact CE2-CG1 4.15Å; F82-I137 HydrophobicContact CE2-CG2 3.96Å; F82-I137 HydrophobicContact CZ-CG2 4.31Å; V84-I137 PolarHBondContact O-N 3.2Å; P87-I137 HydrophobicContact CB-CD1 4.2Å; P87-I137 HydrophobicContact CG-CD1 4.37Å; F90-I137 HydrophobicContact CB-CD1 4.15Å; F90-I137 HydrophobicContact CB-CG1 3.97Å; F90-I137 HydrophobicContact CD1-CD1 3.99Å; F90-I137 HydrophobicContact CD1-CG1 4.39Å; F90-I137 HydrophobicContact CD1-CG2 4.47Å; F90-I137 HydrophobicContact CD2-CG1 4.46Å; F90-I137 HydrophobicContact CD2-CG2 4.05Å; F90-I137 HydrophobicContact CE1-CG2 4.42Å; F90-I137 HydrophobicContact CE2-CG2 3.99Å; F90-I137 HydrophobicContact CG-CD1 4.11Å; F90-I137 HydrophobicContact CG-CG1 4.03Å; F90-I137 HydrophobicContact CG-CG2 4.27Å; F90-I137 HydrophobicContact CZ-CG2 4.17Å; R120-I137 PolarHBondContact NE-O 3.48Å; R120-I137 PolarHBondContact NH2-O 3.08Å; I137-T141 HydrophobicContact CG2-CG2 4.42Å; I137-A142 HydrophobicContact CG2-CB 4.06Å
138	T	98.4	Very high	98	Very high	58 Å²	58	83.1 Å²	83.1	36%	0.356	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-83.5	152.6	176.8	82.8	0	0	0	0	111	P136 E140 T141 A142	P136-T138 PolarHBondContact O-N 3.07Å; T138-E140 WeakPolarHBondContact CB-OE2 3.31Å; T138-E140 PolarHBondContact O-N 3.01Å; T138-E140 PolarHBondContact OG1-OE2 3.05Å; T138-T141 PolarHBondContact O-N 2.85Å; T138-T141 PolarHBondContact OG1-N 3.07Å; T138-T141 PolarHBondContact OG1-OG1 3.27Å; T138-A142 PolarHBondContact O-N 2.96Å; T138-A142 VanDerWaalsContact O-N 3.15Å
139	P	98.4	Very high	98	Very high	39 Å²	39	78.4 Å²	78.4	25%	0.253	39%	0.385	S	S	.	.	H	α-helix	trans	-53.5	-42.3	176.1	-25.7	34.1	0	0	0	112.6	T141 A142 E143 E156	P139-T141 VanDerWaalsContact C-N 3.3Å; P139-T141 PolarHBondContact O-N 2.89Å; P139-A142 PolarHBondContact O-N 3.46Å; P139-E143 WeakPolarHBondContact O-CB 3.41Å; P139-E143 WeakPolarHBondContact O-CG 3.3Å; P139-E143 PolarHBondContact O-N 2.87Å; P139-E156 WeakPolarHBondContact CG-OE1 3.14Å
140	E	98.6	Very high	98	Very high	124 Å²	124	86.1 Å²	86.1	58%	0.579	42%	0.418	S	S	*	.	H	α-helix	trans	-64	-37.3	-176.6	-55.5	74.6	-159.7	0	0	112	T138 K144	T138-E140 WeakPolarHBondContact CB-OE2 3.31Å; T138-E140 PolarHBondContact O-N 3.01Å; T138-E140 PolarHBondContact OG1-OE2 3.05Å; E140-K144 WeakPolarHBondContact O-CB 3.39Å; E140-K144 PolarHBondContact O-N 3.46Å
141	T	98.4	Very high	98.1	Very high	70 Å²	70	84.1 Å²	84.1	43%	0.429	40%	0.401	S	S	.	.	H	α-helix	trans	-69.1	-43.9	178.4	-62.4	0	0	0	0	110.3	F90 I137 T138 P139 K144 L145	F90-T141 HydrophobicContact CE1-CG2 3.83Å; F90-T141 HydrophobicContact CZ-CG2 3.92Å; I137-T141 HydrophobicContact CG2-CG2 4.42Å; T138-T141 PolarHBondContact O-N 2.85Å; T138-T141 PolarHBondContact OG1-N 3.07Å; T138-T141 PolarHBondContact OG1-OG1 3.27Å; P139-T141 VanDerWaalsContact C-N 3.3Å; P139-T141 PolarHBondContact O-N 2.89Å; T141-K144 PolarHBondContact O-N 3.01Å; T141-L145 PolarHBondContact O-N 3.33Å; T141-L145 VanDerWaalsContact O-N 3.1Å
142	A	98.6	Very high	98.1	Very high	0 Å²	0	80.1 Å²	80.1	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-70.4	-38.9	178.7	0	0	0	0	0	113	F82 F90 L112 I137 T138 P139 K144 L145 A146 Y154	F82-A142 HydrophobicContact CE1-CB 4.37Å; F82-A142 HydrophobicContact CZ-CB 3.76Å; F90-A142 HydrophobicContact CE2-CB 3.85Å; F90-A142 HydrophobicContact CZ-CB 4.38Å; L112-A142 WeakPolarHBondContact CD2-O 3.21Å; I137-A142 HydrophobicContact CG2-CB 4.06Å; T138-A142 PolarHBondContact O-N 2.96Å; T138-A142 VanDerWaalsContact O-N 3.15Å; P139-A142 PolarHBondContact O-N 3.46Å; A142-K144 VanDerWaalsContact C-N 3.31Å; A142-K144 PolarHBondContact O-N 2.89Å; A142-L145 PolarHBondContact O-N 3.36Å; A142-A146 PolarHBondContact O-N 3.38Å; A142-Y154 HydrophobicContact CB-CD1 4.15Å; A142-Y154 HydrophobicContact CB-CD2 4.1Å; A142-Y154 HydrophobicContact CB-CE1 3.55Å; A142-Y154 HydrophobicContact CB-CE2 3.56Å; A142-Y154 HydrophobicContact CB-CG 4.37Å; A142-Y154 VanDerWaalsContact CB-OH 3.3Å; A142-Y154 WeakPolarHBondContact CB-OH 3.46Å
143	E	98.6	Very high	98.2	Very high	87 Å²	87	78.6 Å²	78.6	41%	0.407	38%	0.376	S	S	.	.	H	α-helix	trans	-60.7	-40.5	171.7	-77.1	-175.4	-172.9	0	0	112.2	P139 L145 A146 R147 Y154	P139-E143 WeakPolarHBondContact O-CB 3.41Å; P139-E143 WeakPolarHBondContact O-CG 3.3Å; P139-E143 PolarHBondContact O-N 2.87Å; E143-L145 VanDerWaalsContact C-N 3.35Å; E143-A146 PolarHBondContact O-N 3.19Å; E143-R147 WeakPolarHBondContact O-CG 3.36Å; E143-R147 PolarHBondContact O-N 2.88Å; E143-R147 IonicContact OE2-NH1 3.07Å; 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 4.35Å
144	K	98.7	Very high	98.3	Very high	126 Å²	126	70.3 Å²	70.3	55%	0.548	34%	0.339	S	S	.	.	H	α-helix	trans	-60.5	-47.3	175	-175.8	-175.9	174.4	-171.9	0	110.5	E140 T141 A142 A146 R147 D148	E140-K144 WeakPolarHBondContact O-CB 3.39Å; E140-K144 PolarHBondContact O-N 3.46Å; T141-K144 PolarHBondContact O-N 3.01Å; A142-K144 VanDerWaalsContact C-N 3.31Å; A142-K144 PolarHBondContact O-N 2.89Å; K144-A146 VanDerWaalsContact C-N 3.35Å; K144-A146 PolarHBondContact O-N 2.96Å; K144-R147 PolarHBondContact O-N 3.37Å; K144-D148 VanDerWaalsContact O-CG 3.28Å; K144-D148 PolarHBondContact O-N 3.12Å
145	L	98.6	Very high	98.3	Very high	21 Å²	21	67.1 Å²	67.1	11%	0.11	33%	0.325	C	S	.	.	H	α-helix	trans	-61.3	-42.9	177.1	-174.9	66.1	0	0	0	112	F90 V93 K94 L112 T141 A142 E143 R147 D148 L149	F90-L145 HydrophobicContact CD1-CD2 4.44Å; F90-L145 HydrophobicContact CD2-CD2 3.9Å; F90-L145 HydrophobicContact CE1-CD2 3.96Å; F90-L145 HydrophobicContact CE2-CB 4.03Å; 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 3.4Å; F90-L145 VanDerWaalsContact CZ-CD2 3.4Å; F90-L145 HydrophobicContact CZ-CG 4.09Å; V93-L145 HydrophobicContact CB-CD2 4.17Å; V93-L145 HydrophobicContact CG1-CD2 4.1Å; K94-L145 HydrophobicContact CB-CD1 4.35Å; L112-L145 HydrophobicContact CD2-CB 4.39Å; L112-L145 HydrophobicContact CD2-CD2 4.36Å; L112-L145 HydrophobicContact CD2-CG 4.47Å; T141-L145 PolarHBondContact O-N 3.33Å; T141-L145 VanDerWaalsContact O-N 3.1Å; A142-L145 PolarHBondContact O-N 3.36Å; E143-L145 VanDerWaalsContact C-N 3.35Å; L145-R147 VanDerWaalsContact C-N 3.3Å; L145-R147 PolarHBondContact O-N 3.25Å; L145-D148 PolarHBondContact O-N 3.02Å; L145-L149 HydrophobicContact CD1-CD1 3.75Å; L145-L149 HydrophobicContact CD1-CG 3.92Å; L145-L149 HydrophobicContact CD2-CD1 4.14Å; L145-L149 HydrophobicContact CG-CD1 3.67Å; L145-L149 HydrophobicContact CG-CG 4.15Å; L145-L149 WeakPolarHBondContact O-CB 3.46Å; L145-L149 WeakPolarHBondContact O-CG 3.5Å; L145-L149 PolarHBondContact O-N 2.9Å
146	A	98.6	Very high	98.4	Very high	6 Å²	6	60.8 Å²	60.8	5%	0.05	30%	0.298	C	S	.	.	H	α-helix	trans	-57.3	-43.5	176.7	0	0	0	0	0	112	L112 A142 E143 K144 K150 A151	L112-A146 HydrophobicContact CB-CB 4.12Å; L112-A146 HydrophobicContact CD2-CB 3.85Å; A142-A146 PolarHBondContact O-N 3.38Å; E143-A146 PolarHBondContact O-N 3.19Å; K144-A146 VanDerWaalsContact C-N 3.35Å; K144-A146 PolarHBondContact O-N 2.96Å; A146-K150 PolarHBondContact O-N 3.06Å; A146-A151 HydrophobicContact CB-CB 4.04Å; A146-A151 PolarHBondContact O-N 2.56Å
147	R	98.3	Very high	98.4	Very high	153 Å²	153	59.8 Å²	59.8	58%	0.577	29%	0.291	S	S	*	.	H	α-helix	trans	-63.9	-46.6	174.7	-72.1	-173.1	-67.5	-93.3	0.9	112	E143 K144 L145 L149 K150	E143-R147 WeakPolarHBondContact O-CG 3.36Å; E143-R147 PolarHBondContact O-N 2.88Å; E143-R147 IonicContact OE2-NH1 3.07Å; K144-R147 PolarHBondContact O-N 3.37Å; L145-R147 VanDerWaalsContact C-N 3.3Å; L145-R147 PolarHBondContact O-N 3.25Å; R147-L149 VanDerWaalsContact C-N 3.28Å; R147-L149 PolarHBondContact O-N 3.47Å; R147-K150 PolarHBondContact O-N 3.04Å; R147-K150 VanDerWaalsContact O-N 3.12Å
148	D	98.1	Very high	98.3	Very high	107 Å²	107	58.9 Å²	58.9	57%	0.572	29%	0.287	S	S	*	.	H	α-helix	trans	-61.9	-37.5	-179.1	-69.8	-13.9	0	0	0	111.7	K144 L145	K144-D148 VanDerWaalsContact O-CG 3.28Å; K144-D148 PolarHBondContact O-N 3.12Å; L145-D148 PolarHBondContact O-N 3.02Å
149	L	97.9	Very high	98.3	Very high	33 Å²	33	56.7 Å²	56.7	17%	0.173	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-3.1	178.4	-61	-179.6	0	0	0	113.8	V93 K94 V98 F110 L145 R147 A151	V93-L149 HydrophobicContact CG1-CD1 3.6Å; K94-L149 HydrophobicContact CB-CD1 4.36Å; K94-L149 HydrophobicContact CB-CD2 4.31Å; K94-L149 HydrophobicContact CG-CD2 4.1Å; V98-L149 HydrophobicContact CB-CD1 4.42Å; V98-L149 HydrophobicContact CG1-CD2 4.49Å; V98-L149 HydrophobicContact CG2-CD1 3.88Å; F110-L149 HydrophobicContact CZ-CB 4.12Å; F110-L149 WeakPolarHBondContact CZ-O 3.38Å; L145-L149 HydrophobicContact CD1-CD1 3.75Å; L145-L149 HydrophobicContact CD1-CG 3.92Å; L145-L149 HydrophobicContact CD2-CD1 4.14Å; L145-L149 HydrophobicContact CG-CD1 3.67Å; L145-L149 HydrophobicContact CG-CG 4.15Å; L145-L149 WeakPolarHBondContact O-CB 3.46Å; L145-L149 WeakPolarHBondContact O-CG 3.5Å; L145-L149 PolarHBondContact O-N 2.9Å; R147-L149 VanDerWaalsContact C-N 3.28Å; R147-L149 PolarHBondContact O-N 3.47Å; L149-A151 VanDerWaalsContact C-N 3.26Å; L149-A151 PolarHBondContact O-N 3.29Å
150	K	97.1	Very high	98.1	Very high	177 Å²	177	59.4 Å²	59.4	77%	0.77	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	35.7	-177.6	-49.9	172.1	-174.6	168.6	0	113.2	A146 R147	A146-K150 PolarHBondContact O-N 3.06Å; R147-K150 PolarHBondContact O-N 3.04Å; R147-K150 VanDerWaalsContact O-N 3.12Å
151	A	98.1	Very high	98	Very high	16 Å²	16	57.4 Å²	57.4	13%	0.132	28%	0.283	C	S	.	.			trans	-59.6	149	165.9	0	0	0	0	0	109.4	F110 L112 A146 L149 K153	F110-A151 HydrophobicContact CD2-CB 3.97Å; F110-A151 HydrophobicContact CE2-CB 3.47Å; F110-A151 VanDerWaalsContact CE2-CB 3.47Å; F110-A151 HydrophobicContact CZ-CB 3.84Å; L112-A151 HydrophobicContact CB-CB 4.21Å; A146-A151 HydrophobicContact CB-CB 4.04Å; A146-A151 PolarHBondContact O-N 2.56Å; L149-A151 VanDerWaalsContact C-N 3.26Å; L149-A151 PolarHBondContact O-N 3.29Å; A151-K153 VanDerWaalsContact C-N 3.29Å; A151-K153 PolarHBondContact O-N 3.24Å
152	V	97.8	Very high	97.8	Very high	59 Å²	59	58.2 Å²	58.2	36%	0.358	28%	0.282	S	S	.	.	S	Bend	trans	-62.9	-41.9	176.1	-179.7	0	0	0	0	110.1	P109 F110 L111 A175 P180	P109-V152 HydrophobicContact CB-CG2 3.55Å; F110-V152 PolarHBondContact O-N 3.42Å; L111-V152 HydrophobicContact CD2-CB 3.9Å; L111-V152 HydrophobicContact CD2-CG1 4.41Å; V152-A175 HydrophobicContact CB-CB 4.27Å; V152-A175 HydrophobicContact CG1-CB 3.97Å; V152-A175 HydrophobicContact CG2-CB 4.23Å; V152-P180 HydrophobicContact CG2-CG 3.93Å
153	K	98.1	Very high	97.8	Very high	87 Å²	87	65 Å²	65	38%	0.378	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	157.1	176.6	-156.4	170.7	-178.6	166.8	0	111.5	L111 L112 A151 V155 E171	L111-K153 HydrophobicContact CD2-CB 3.8Å; L112-K153 PolarHBondContact N-O 2.99Å; A151-K153 VanDerWaalsContact C-N 3.29Å; A151-K153 PolarHBondContact O-N 3.24Å; K153-V155 HydrophobicContact CD-CG1 4.35Å; K153-V155 HydrophobicContact CG-CG1 4.43Å; K153-E171 HydrophobicContact CD-CG 4.11Å; K153-E171 WeakPolarHBondContact CD-OE2 3.47Å; K153-E171 IonicContact NZ-OE1 3.51Å; K153-E171 PolarHBondContact NZ-OE1 3.48Å; K153-E171 IonicContact NZ-OE2 3.49Å; K153-E171 PolarHBondContact NZ-OE2 2.76Å; K153-E171 VanDerWaalsContact NZ-OE2 3.07Å
154	Y	98.8	Very high	97.7	Very high	28 Å²	28	62.2 Å²	62.2	11%	0.11	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.6	162	177	-122.5	0	0	0	109.8	F82 L112 A142 E143 E156	F82-Y154 AromaticContact CE1-CE2 3.76Å; F82-Y154 HydrophobicContact CE1-CE2 3.76Å; F82-Y154 AromaticContact CZ-CE2 3.88Å; F82-Y154 HydrophobicContact CZ-CE2 3.88Å; L112-Y154 HydrophobicContact CB-CD2 4.06Å; L112-Y154 HydrophobicContact CD2-CD2 3.96Å; L112-Y154 HydrophobicContact CD2-CE2 4.45Å; L112-Y154 HydrophobicContact CG-CD2 3.85Å; L112-Y154 HydrophobicContact CG-CE2 4.3Å; L112-Y154 WeakPolarHBondContact O-CA 3.09Å; L112-Y154 VanDerWaalsContact O-CD2 3.3Å; L112-Y154 WeakPolarHBondContact O-CD2 3.44Å; A142-Y154 HydrophobicContact CB-CD1 4.15Å; A142-Y154 HydrophobicContact CB-CD2 4.1Å; A142-Y154 HydrophobicContact CB-CE1 3.55Å; A142-Y154 HydrophobicContact CB-CE2 3.56Å; A142-Y154 HydrophobicContact CB-CG 4.37Å; A142-Y154 VanDerWaalsContact CB-OH 3.3Å; A142-Y154 WeakPolarHBondContact CB-OH 3.46Å; 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 4.35Å; Y154-E156 HydrophobicContact CE1-CG 3.63Å; Y154-E156 HydrophobicContact CE2-CG 4.27Å; Y154-E156 VanDerWaalsContact CZ-CG 3.41Å; Y154-E156 WeakPolarHBondContact OH-CG 3.45Å; Y154-E156 PolarHBondContact OH-OE1 3.5Å
155	V	98.7	Very high	97.6	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	-135.3	148.9	175.9	-68.3	0	0	0	0	110.7	L111 L112 V113 G114 K153 V168 E171	L111-V155 HydrophobicContact CD1-CG2 4.36Å; L112-V155 PolarHBondContact O-N 2.84Å; V113-V155 CarbonylContact C-O 3.55Å; V113-V155 WeakPolarHBondContact CA-O 3.33Å; V113-V155 HydrophobicContact CB-CG2 4.39Å; V113-V155 HydrophobicContact CG1-CG2 4.32Å; V113-V155 HydrophobicContact CG2-CG2 3.86Å; G114-V155 PolarHBondContact N-O 3Å; K153-V155 HydrophobicContact CD-CG1 4.35Å; K153-V155 HydrophobicContact CG-CG1 4.43Å; V155-V168 HydrophobicContact CB-CG2 4.32Å; V155-V168 HydrophobicContact CG2-CB 4.34Å; V155-V168 HydrophobicContact CG2-CG1 4.32Å; V155-V168 HydrophobicContact CG2-CG2 3.85Å; V155-E171 HydrophobicContact CG1-CB 4.35Å; V155-E171 HydrophobicContact CG1-CG 4.05Å
156	E	98.7	Very high	97.4	Very high	39 Å²	39	61.9 Å²	61.9	18%	0.182	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	144.3	179	-77	-169.7	177.8	0	0	111.6	G114 I117 R120 P139 Y154	G114-E156 CarbonylContact O-C 3.59Å; G114-E156 VanDerWaalsContact O-CA 3.3Å; G114-E156 WeakPolarHBondContact O-CA 3.32Å; I117-E156 HydrophobicContact CD1-CB 4.34Å; I117-E156 HydrophobicContact CG2-CB 3.85Å; I117-E156 HydrophobicContact CG2-CG 4.13Å; R120-E156 IonicContact CZ-OE1 2.62Å; R120-E156 IonicContact CZ-OE2 2.67Å; R120-E156 IonicContact NH1-OE1 2.73Å; R120-E156 IonicContact NH1-OE2 3.51Å; R120-E156 PolarHBondContact NH1-OE2 3.09Å; R120-E156 IonicContact NH2-OE1 2.75Å; R120-E156 PolarHBondContact NH2-OE1 2.91Å; R120-E156 IonicContact NH2-OE2 2.67Å; R120-E156 PolarHBondContact NH2-OE2 2.63Å; P139-E156 WeakPolarHBondContact CG-OE1 3.14Å; Y154-E156 HydrophobicContact CE1-CG 3.63Å; Y154-E156 HydrophobicContact CE2-CG 4.27Å; Y154-E156 VanDerWaalsContact CZ-CG 3.41Å; Y154-E156 WeakPolarHBondContact OH-CG 3.45Å; Y154-E156 PolarHBondContact OH-OE1 3.5Å
157	C	98.6	Very high	97.4	Very high	2 Å²	2	64.9 Å²	64.9	1%	0.014	32%	0.319	C	S	.	.			trans	-151.3	161.3	174.8	69.4	0	0	0	0	114.2	L19 G114 T115 Q116 I117 K163 V168	L19-C157 WeakPolarHBondContact CD1-SG 3.17Å; G114-C157 PolarHBondContact O-N 2.88Å; T115-C157 CarbonylContact C-O 3.58Å; T115-C157 WeakPolarHBondContact CA-O 3.22Å; Q116-C157 PolarHBondContact N-O 3.33Å; Q116-C157 VanDerWaalsContact N-O 3.13Å; I117-C157 PolarHBondContact N-O 3.35Å; C157-K163 CarbonylContact C-O 3.43Å; C157-K163 WeakPolarHBondContact CA-O 3.41Å; C157-K163 WeakPolarHBondContact CB-O 3.16Å; C157-V168 HydrophobicContact CB-CG2 3.8Å
158	S	98.3	Very high	97.4	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.291	C	S	.	.			trans	-124.4	114.6	165.4	166.7	0	0	0	0	107.7	D118 L160 T161 Q162 K163	D118-S158 VanDerWaalsContact CG-OG 3.25Å; D118-S158 WeakPolarHBondContact OD1-CB 3.46Å; D118-S158 PolarHBondContact OD1-OG 3.16Å; S158-L160 PolarHBondContact O-N 3.29Å; S158-L160 PolarHBondContact OG-N 3.38Å; S158-T161 WeakPolarHBondContact CB-OG1 3.45Å; S158-T161 PolarHBondContact OG-N 2.73Å; S158-T161 PolarHBondContact OG-OG1 3.32Å; S158-Q162 CarbonylContact O-C 3.38Å; S158-Q162 WeakPolarHBondContact O-CA 3.45Å; S158-Q162 PolarHBondContact O-N 3.34Å; S158-K163 PolarHBondContact N-O 2.7Å; S158-K163 PolarHBondContact O-N 2.98Å
159	A	96.8	Very high	97.3	Very high	11 Å²	11	52.5 Å²	52.5	9%	0.091	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-29	173.9	0	0	0	0	0	111.8	C18 S22 F28	C18-A159 HydrophobicContact CB-CB 3.85Å; S22-A159 PolarHBondContact OG-O 2.8Å; F28-A159 HydrophobicContact CD2-CB 4.03Å; F28-A159 WeakPolarHBondContact CD2-O 3.36Å; F28-A159 HydrophobicContact CE2-CB 3.98Å
160	L	95.3	Very high	97.2	Very high	96 Å²	96	53.4 Å²	53.4	50%	0.503	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-49.9	-179.8	178.7	63.4	0	0	0	111.9	F28 D118 S158	F28-L160 HydrophobicContact CB-CD1 4.44Å; F28-L160 HydrophobicContact CD1-CD1 3.96Å; F28-L160 VanDerWaalsContact CD2-CA 3.49Å; F28-L160 HydrophobicContact CD2-CB 4.1Å; F28-L160 HydrophobicContact CD2-CD1 4.32Å; F28-L160 HydrophobicContact CE1-CD1 4.27Å; F28-L160 HydrophobicContact CE2-CB 4.09Å; F28-L160 HydrophobicContact CG-CD1 3.98Å; D118-L160 WeakPolarHBondContact OD2-CD2 3.49Å; S158-L160 PolarHBondContact O-N 3.29Å; S158-L160 PolarHBondContact OG-N 3.38Å
161	T	96.1	Very high	97.2	Very high	82 Å²	82	46.7 Å²	46.7	50%	0.503	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-3.9	-178.3	65.2	0	0	0	0	113.1	D118 S158 K163	D118-T161 HydrophobicContact CB-CG2 4Å; S158-T161 WeakPolarHBondContact CB-OG1 3.45Å; S158-T161 PolarHBondContact OG-N 2.73Å; S158-T161 PolarHBondContact OG-OG1 3.32Å; T161-K163 PolarHBondContact O-N 3.1Å; T161-K163 WeakPolarHBondContact OG1-CB 3.13Å; T161-K163 PolarHBondContact OG1-N 3.29Å
162	Q	94.8	Very high	97.2	Very high	88 Å²	88	46 Å²	46	41%	0.411	23%	0.234	S	C	.	.			trans	60.9	4.4	-172.1	-55.8	-178.5	-5.3	0	0	115	N26 S158 G164 L165	N26-Q162 VanDerWaalsContact C-NE2 3.33Å; N26-Q162 PolarHBondContact O-NE2 2.99Å; S158-Q162 CarbonylContact O-C 3.38Å; S158-Q162 WeakPolarHBondContact O-CA 3.45Å; S158-Q162 PolarHBondContact O-N 3.34Å; Q162-G164 PolarHBondContact O-N 3.11Å; Q162-L165 HydrophobicContact CB-CD2 4.43Å; Q162-L165 HydrophobicContact CG-CD2 4.37Å; Q162-L165 WeakPolarHBondContact O-CB 3.45Å; Q162-L165 PolarHBondContact O-N 3.45Å
163	K	97.9	Very high	97.1	Very high	143 Å²	143	43.7 Å²	43.7	62%	0.622	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	127.1	176.5	-175.5	176.3	175.8	-177.6	0	110.1	I117 C157 S158 T161 L165	I117-K163 HydrophobicContact CD1-CB 4.45Å; I117-K163 HydrophobicContact CD1-CD 3.89Å; I117-K163 HydrophobicContact CD1-CG 4.09Å; C157-K163 CarbonylContact C-O 3.43Å; C157-K163 WeakPolarHBondContact CA-O 3.41Å; C157-K163 WeakPolarHBondContact CB-O 3.16Å; S158-K163 PolarHBondContact N-O 2.7Å; S158-K163 PolarHBondContact O-N 2.98Å; T161-K163 PolarHBondContact O-N 3.1Å; T161-K163 WeakPolarHBondContact OG1-CB 3.13Å; T161-K163 PolarHBondContact OG1-N 3.29Å; K163-L165 PolarHBondContact O-N 2.76Å; K163-L165 VanDerWaalsContact O-N 3.16Å
164	G	97.6	Very high	97	Very high	28 Å²	28	43.7 Å²	43.7	29%	0.289	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	-2.5	177.3	0	0	0	0	0	115.4	Q162 N167 V168	Q162-G164 PolarHBondContact O-N 3.11Å; G164-N167 WeakPolarHBondContact O-CB 3.5Å; G164-N167 PolarHBondContact O-N 3.32Å; G164-V168 PolarHBondContact O-N 3.28Å
165	L	95.6	Very high	96.8	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.042	22%	0.22	C	C	.	.	H	α-helix	trans	-61	-53.3	-171.6	-174	62.5	0	0	0	112.6	L19 Q162 K163 N167 V168 F169	L19-L165 HydrophobicContact CD1-CD1 3.36Å; L19-L165 HydrophobicContact CG-CD1 4.31Å; Q162-L165 HydrophobicContact CB-CD2 4.43Å; Q162-L165 HydrophobicContact CG-CD2 4.37Å; Q162-L165 WeakPolarHBondContact O-CB 3.45Å; Q162-L165 PolarHBondContact O-N 3.45Å; K163-L165 PolarHBondContact O-N 2.76Å; K163-L165 VanDerWaalsContact O-N 3.16Å; L165-N167 VanDerWaalsContact C-N 3.27Å; L165-N167 PolarHBondContact O-N 3.25Å; L165-V168 PolarHBondContact O-N 3.38Å; L165-F169 HydrophobicContact CD1-CE2 4.06Å; L165-F169 VanDerWaalsContact O-CD2 3.27Å; L165-F169 WeakPolarHBondContact O-CD2 3.3Å
166	K	94.9	Very high	96.7	Very high	131 Å²	131	43.3 Å²	43.3	57%	0.57	23%	0.227	S	C	*	.	H	α-helix	trans	-58.5	-40.6	177.3	-170.1	-170	-179	-58.1	0	111.9	V168 F169 D170	K166-V168 VanDerWaalsContact C-N 3.29Å; K166-V168 PolarHBondContact O-N 3.31Å; K166-F169 PolarHBondContact O-N 3.49Å; K166-F169 VanDerWaalsContact O-N 3.15Å; K166-D170 IonicContact NZ-OD1 2.96Å; K166-D170 PolarHBondContact NZ-OD1 3.19Å; K166-D170 IonicContact NZ-OD2 2.97Å; K166-D170 PolarHBondContact NZ-OD2 2.67Å; K166-D170 PolarHBondContact O-N 2.67Å
167	N	97.4	Very high	96.4	Very high	69 Å²	69	44.6 Å²	44.6	37%	0.369	24%	0.235	S	C	.	.	H	α-helix	trans	-61.3	-35.7	-178.6	-174.8	76.6	0	0	0	112.4	G164 L165 F169 E171	G164-N167 WeakPolarHBondContact O-CB 3.5Å; G164-N167 PolarHBondContact O-N 3.32Å; L165-N167 VanDerWaalsContact C-N 3.27Å; L165-N167 PolarHBondContact O-N 3.25Å; N167-F169 VanDerWaalsContact C-N 3.32Å; N167-F169 PolarHBondContact O-N 2.93Å; N167-E171 WeakPolarHBondContact O-CB 3.24Å; N167-E171 WeakPolarHBondContact O-CG 3.5Å; N167-E171 PolarHBondContact O-N 2.97Å
168	V	98.3	Very high	95.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57	-46.9	175.2	174.8	0	0	0	0	111.2	L19 L79 V113 V155 C157 G164 L165 K166 A172	L19-V168 HydrophobicContact CD1-CG1 4.46Å; L19-V168 HydrophobicContact CD1-CG2 4.49Å; L19-V168 HydrophobicContact CD2-CG1 4.47Å; L79-V168 HydrophobicContact CD1-CG1 3.81Å; L79-V168 HydrophobicContact CD2-CG1 4.12Å; V113-V168 HydrophobicContact CG1-CG1 4.18Å; V113-V168 HydrophobicContact CG1-CG2 4.09Å; V113-V168 HydrophobicContact CG2-CG1 4.12Å; V155-V168 HydrophobicContact CB-CG2 4.32Å; V155-V168 HydrophobicContact CG2-CB 4.34Å; V155-V168 HydrophobicContact CG2-CG1 4.32Å; V155-V168 HydrophobicContact CG2-CG2 3.85Å; C157-V168 HydrophobicContact CB-CG2 3.8Å; G164-V168 PolarHBondContact O-N 3.28Å; L165-V168 PolarHBondContact O-N 3.38Å; K166-V168 VanDerWaalsContact C-N 3.29Å; K166-V168 PolarHBondContact O-N 3.31Å; V168-A172 WeakPolarHBondContact O-CB 3.34Å; V168-A172 PolarHBondContact O-N 2.93Å; V168-A172 VanDerWaalsContact O-N 3.11Å
169	F	97.1	Very high	94.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-79.6	-34.4	-176.4	-62.3	-82.1	0	0	0	112.7	L19 L20 Y23 L53 L55 L79 L165 K166 N167 E171 A172 I173	L19-F169 HydrophobicContact CD1-CE2 4.06Å; L19-F169 HydrophobicContact CD1-CZ 4.29Å; L19-F169 HydrophobicContact CD2-CZ 4.34Å; L19-F169 HydrophobicContact CG-CE2 4.17Å; L19-F169 HydrophobicContact CG-CZ 3.9Å; L20-F169 HydrophobicContact CD2-CE1 3.85Å; L20-F169 HydrophobicContact CD2-CZ 3.89Å; Y23-F169 AromaticContact CD1-CD1 3.94Å; Y23-F169 HydrophobicContact CD1-CD1 3.94Å; Y23-F169 AromaticContact CD1-CD2 3.68Å; Y23-F169 HydrophobicContact CD1-CD2 3.68Å; Y23-F169 AromaticContact CD1-CE1 3.91Å; Y23-F169 HydrophobicContact CD1-CE1 3.91Å; Y23-F169 AromaticContact CD1-CE2 3.68Å; Y23-F169 HydrophobicContact CD1-CE2 3.68Å; Y23-F169 AromaticContact CD1-CG 3.81Å; Y23-F169 HydrophobicContact CD1-CG 3.81Å; Y23-F169 AromaticContact CD1-CZ 3.76Å; Y23-F169 HydrophobicContact CD1-CZ 3.76Å; 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 3.63Å; Y23-F169 HydrophobicContact CD2-CE2 3.63Å; Y23-F169 AromaticContact CD2-CG 3.96Å; Y23-F169 HydrophobicContact CD2-CG 3.96Å; Y23-F169 HydrophobicContact CE1-CB 4.04Å; Y23-F169 AromaticContact CE1-CD1 3.86Å; Y23-F169 HydrophobicContact CE1-CD1 3.86Å; Y23-F169 AromaticContact CE1-CD2 3.92Å; Y23-F169 HydrophobicContact CE1-CD2 3.92Å; Y23-F169 HydrophobicContact CE1-CE1 4.28Å; Y23-F169 HydrophobicContact CE1-CE2 4.36Å; Y23-F169 AromaticContact CE1-CG 3.65Å; Y23-F169 HydrophobicContact CE1-CG 3.65Å; Y23-F169 HydrophobicContact CE1-CZ 4.49Å; Y23-F169 HydrophobicContact CE2-CB 3.83Å; Y23-F169 AromaticContact CE2-CD2 3.55Å; Y23-F169 HydrophobicContact CE2-CD2 3.55Å; Y23-F169 HydrophobicContact CE2-CE2 4.33Å; Y23-F169 AromaticContact CE2-CG 3.81Å; Y23-F169 HydrophobicContact CE2-CG 3.81Å; Y23-F169 HydrophobicContact CG-CD1 4.43Å; Y23-F169 AromaticContact CG-CD2 3.34Å; Y23-F169 HydrophobicContact CG-CD2 3.34Å; Y23-F169 HydrophobicContact CG-CE1 4.34Å; Y23-F169 AromaticContact CG-CE2 3.25Å; Y23-F169 HydrophobicContact CG-CE2 3.25Å; Y23-F169 AromaticContact CG-CG 3.96Å; Y23-F169 HydrophobicContact CG-CG 3.96Å; Y23-F169 AromaticContact CG-CZ 3.76Å; Y23-F169 HydrophobicContact CG-CZ 3.76Å; Y23-F169 AromaticContact CZ-CD2 3.87Å; Y23-F169 AromaticContact CZ-CG 3.65Å; L53-F169 HydrophobicContact CD2-CB 4.35Å; L53-F169 HydrophobicContact CD2-CD1 4.05Å; L55-F169 HydrophobicContact CD1-CE1 4.22Å; L55-F169 HydrophobicContact CD2-CD1 3.91Å; L55-F169 HydrophobicContact CD2-CE1 3.64Å; L79-F169 HydrophobicContact CD1-CE1 4.2Å; L165-F169 HydrophobicContact CD1-CE2 4.06Å; L165-F169 VanDerWaalsContact O-CD2 3.27Å; L165-F169 WeakPolarHBondContact O-CD2 3.3Å; K166-F169 PolarHBondContact O-N 3.49Å; K166-F169 VanDerWaalsContact O-N 3.15Å; N167-F169 VanDerWaalsContact C-N 3.32Å; N167-F169 PolarHBondContact O-N 2.93Å; F169-E171 VanDerWaalsContact C-N 3.34Å; F169-E171 PolarHBondContact O-N 2.89Å; F169-A172 PolarHBondContact O-N 3.26Å; F169-I173 WeakPolarHBondContact O-CB 3.38Å; F169-I173 WeakPolarHBondContact O-CD1 3.37Å; F169-I173 WeakPolarHBondContact O-CG1 3.33Å; F169-I173 PolarHBondContact O-N 3.4Å
170	D	95.8	Very high	93.6	Very high	53 Å²	53	58.7 Å²	58.7	28%	0.283	31%	0.312	S	S	.	.	H	α-helix	trans	-58.5	-47.4	172.5	-68.8	-17.6	0	0	0	110.6	K166 A172 I173 L174	K166-D170 IonicContact NZ-OD1 2.96Å; K166-D170 PolarHBondContact NZ-OD1 3.19Å; K166-D170 IonicContact NZ-OD2 2.97Å; K166-D170 PolarHBondContact NZ-OD2 2.67Å; K166-D170 PolarHBondContact O-N 2.67Å; D170-A172 VanDerWaalsContact C-N 3.33Å; D170-A172 PolarHBondContact O-N 2.81Å; D170-I173 PolarHBondContact O-N 3.21Å; D170-L174 VanDerWaalsContact O-CG 3.31Å; D170-L174 WeakPolarHBondContact O-CG 3.33Å; D170-L174 PolarHBondContact O-N 3.1Å
171	E	97.7	Very high	92.3	Very high	36 Å²	36	62.8 Å²	62.8	17%	0.168	33%	0.328	C	S	.	.	H	α-helix	trans	-67.6	-32.9	178	-64.7	-70.9	167.4	0	0	112.3	L111 K153 V155 N167 F169 L174 A175	L111-E171 HydrophobicContact CD1-CB 3.74Å; K153-E171 HydrophobicContact CD-CG 4.11Å; K153-E171 WeakPolarHBondContact CD-OE2 3.47Å; K153-E171 IonicContact NZ-OE1 3.51Å; K153-E171 PolarHBondContact NZ-OE1 3.48Å; K153-E171 IonicContact NZ-OE2 3.49Å; K153-E171 PolarHBondContact NZ-OE2 2.76Å; K153-E171 VanDerWaalsContact NZ-OE2 3.07Å; V155-E171 HydrophobicContact CG1-CB 4.35Å; V155-E171 HydrophobicContact CG1-CG 4.05Å; N167-E171 WeakPolarHBondContact O-CB 3.24Å; N167-E171 WeakPolarHBondContact O-CG 3.5Å; N167-E171 PolarHBondContact O-N 2.97Å; F169-E171 VanDerWaalsContact C-N 3.34Å; F169-E171 PolarHBondContact O-N 2.89Å; E171-L174 PolarHBondContact O-N 3.39Å; E171-A175 VanDerWaalsContact O-CB 3.31Å; E171-A175 WeakPolarHBondContact O-CB 3.41Å; E171-A175 PolarHBondContact O-N 3.32Å
172	A	97.3	Very high	90.6	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-68.4	-42.7	177.2	0	0	0	0	0	111.3	V77 L79 L111 V168 F169 D170 A175 A176	V77-A172 HydrophobicContact CG1-CB 4.16Å; V77-A172 HydrophobicContact CG2-CB 4.38Å; L79-A172 HydrophobicContact CD2-CB 3.92Å; L111-A172 HydrophobicContact CD1-CB 3.96Å; V168-A172 WeakPolarHBondContact O-CB 3.34Å; V168-A172 PolarHBondContact O-N 2.93Å; V168-A172 VanDerWaalsContact O-N 3.11Å; F169-A172 PolarHBondContact O-N 3.26Å; D170-A172 VanDerWaalsContact C-N 3.33Å; D170-A172 PolarHBondContact O-N 2.81Å; A172-A175 PolarHBondContact O-N 2.81Å; A172-A176 WeakPolarHBondContact O-CB 3.35Å; A172-A176 PolarHBondContact O-N 3.21Å
173	I	95.9	Very high	88.7	Confident	11 Å²	11	70 Å²	70	6%	0.056	36%	0.364	C	S	.	.	H	α-helix	trans	-60.1	-48	174.1	-73.3	163	0	0	0	110.1	I4 V44 I46 L53 F169 D170 A175 A176 L177	I4-I173 HydrophobicContact CD1-CB 4.48Å; I4-I173 HydrophobicContact CD1-CG1 4.32Å; I4-I173 HydrophobicContact CD1-CG2 4.01Å; V44-I173 HydrophobicContact CB-CD1 4.46Å; V44-I173 HydrophobicContact CG1-CD1 4.43Å; V44-I173 HydrophobicContact CG2-CD1 3.9Å; I46-I173 HydrophobicContact CD1-CG2 3.26Å; I46-I173 HydrophobicContact CG1-CG2 4.18Å; L53-I173 HydrophobicContact CD1-CG1 4.26Å; L53-I173 HydrophobicContact CD2-CD1 4.19Å; L53-I173 HydrophobicContact CD2-CG1 4.32Å; F169-I173 WeakPolarHBondContact O-CB 3.38Å; F169-I173 WeakPolarHBondContact O-CD1 3.37Å; F169-I173 WeakPolarHBondContact O-CG1 3.33Å; F169-I173 PolarHBondContact O-N 3.4Å; D170-I173 PolarHBondContact O-N 3.21Å; I173-A175 VanDerWaalsContact C-N 3.35Å; I173-A175 PolarHBondContact O-N 3.19Å; I173-A176 PolarHBondContact O-N 3.15Å; I173-L177 HydrophobicContact CG2-CD1 3.97Å; I173-L177 WeakPolarHBondContact O-CG 3.15Å; I173-L177 PolarHBondContact O-N 3.44Å
174	L	95.2	Very high	86.2	Confident	88 Å²	88	73 Å²	73	46%	0.461	38%	0.377	S	S	.	.	H	α-helix	trans	-59.8	-45.5	177.3	-71.2	172.2	0	0	0	111.3	D170 E171 A176 L177 E178	D170-L174 VanDerWaalsContact O-CG 3.31Å; D170-L174 WeakPolarHBondContact O-CG 3.33Å; D170-L174 PolarHBondContact O-N 3.1Å; E171-L174 PolarHBondContact O-N 3.39Å; L174-A176 VanDerWaalsContact C-N 3.27Å; L174-A176 PolarHBondContact O-N 3.27Å; L174-L177 PolarHBondContact O-N 3.06Å; L174-E178 PolarHBondContact O-N 3.04Å
175	A	95.9	Very high	84.3	Confident	4 Å²	4	82.7 Å²	82.7	3%	0.033	41%	0.405	C	S	.	.	H	α-helix	trans	-62.5	-32.6	177.5	0	0	0	0	0	113.3	V77 P109 L111 V152 E171 A172 I173 P179	V77-A175 HydrophobicContact CG2-CB 4.16Å; P109-A175 WeakPolarHBondContact CG-O 3.31Å; L111-A175 HydrophobicContact CD2-CB 4.46Å; V152-A175 HydrophobicContact CB-CB 4.27Å; V152-A175 HydrophobicContact CG1-CB 3.97Å; V152-A175 HydrophobicContact CG2-CB 4.23Å; E171-A175 VanDerWaalsContact O-CB 3.31Å; E171-A175 WeakPolarHBondContact O-CB 3.41Å; E171-A175 PolarHBondContact O-N 3.32Å; A172-A175 PolarHBondContact O-N 2.81Å; I173-A175 VanDerWaalsContact C-N 3.35Å; I173-A175 PolarHBondContact O-N 3.19Å; A175-P179 WeakPolarHBondContact O-CA 3.41Å
176	A	95.1	Very high	82.4	Confident	20 Å²	20	88 Å²	88	17%	0.165	44%	0.44	C	S	.	.	H	α-helix	trans	-73.5	-39.6	176.6	0	0	0	0	0	112.7	I4 D76 V77 A172 I173 L174	I4-A176 HydrophobicContact CG2-CB 3.64Å; D76-A176 HydrophobicContact CB-CB 4Å; V77-A176 HydrophobicContact CB-CB 4.13Å; V77-A176 HydrophobicContact CG1-CB 4.1Å; A172-A176 WeakPolarHBondContact O-CB 3.35Å; A172-A176 PolarHBondContact O-N 3.21Å; I173-A176 PolarHBondContact O-N 3.15Å; L174-A176 VanDerWaalsContact C-N 3.27Å; L174-A176 PolarHBondContact O-N 3.27Å
177	L	92	Very high	80.2	Confident	66 Å²	66	91.2 Å²	91.2	35%	0.346	45%	0.454	S	S	.	.	H	α-helix	trans	-81.6	-33.2	-177.6	-66.7	178.7	0	0	0	113.1	I4 I46 Y51 I173 L174 P179	I4-L177 HydrophobicContact CD1-CD1 4.43Å; I4-L177 HydrophobicContact CD1-CD2 4.06Å; I4-L177 HydrophobicContact CD1-CG 4.1Å; I46-L177 HydrophobicContact CD1-CD1 3.78Å; I46-L177 HydrophobicContact CG2-CD1 3.91Å; Y51-L177 HydrophobicContact CE1-CD2 3.88Å; I173-L177 HydrophobicContact CG2-CD1 3.97Å; I173-L177 WeakPolarHBondContact O-CG 3.15Å; I173-L177 PolarHBondContact O-N 3.44Å; L174-L177 PolarHBondContact O-N 3.06Å; L177-P179 WeakPolarHBondContact O-CD 3.41Å
178	E	87.6	Confident	78	Confident	153 Å²	153	93.8 Å²	93.8	72%	0.715	48%	0.476	S	S	*	.	S	Bend	trans	-122.6	66.4	179.8	-63	-177.3	-173.5	0	0	110.2	L174	L174-E178 PolarHBondContact O-N 3.04Å
179	P	76.3	Confident	76.2	Confident	74 Å²	74	99.3 Å²	99.3	48%	0.481	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-63.6	136.2	-177.9	25.5	-33	0	0	0	110.2	P109 A175 L177 E181	P109-P179 HydrophobicContact CG-CB 4.43Å; A175-P179 WeakPolarHBondContact O-CA 3.41Å; L177-P179 WeakPolarHBondContact O-CD 3.41Å; P179-E181 PolarHBondContact O-N 3.23Å
180	P	72.1	Confident	74.2	Confident	83 Å²	83	107.2 Å²	107.2	54%	0.539	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-59.6	135.6	-179	19.1	-28.7	0	0	0	111.4	V152	V152-P180 HydrophobicContact CG2-CG 3.93Å
181	E	68.3	Low	72.2	Confident	181 Å²	181	115.7 Å²	115.7	85%	0.846	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-58.8	134.4	-178.3	-71.8	-160.7	168.6	0	0	111.6	P179 K183	P179-E181 PolarHBondContact O-N 3.23Å; E181-K183 PolarHBondContact O-N 3.18Å; E181-K183 VanDerWaalsContact O-N 3.09Å
182	P	59.2	Low	70.9	Confident	119 Å²	119	119.7 Å²	119.7	77%	0.773	62%	0.616	S	S	*	*			trans	-64.9	115.4	173.9	24.6	-30.7	0	0	0	109.6	K184	P182-K184 PolarHBondContact O-N 3.24Å
183	K	54.9	Low	69.6	Low	202 Å²	202	126 Å²	126	88%	0.878	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-55.2	117	173	-71	-173	178.8	-178.3	0	109.3	E181 R185	E181-K183 PolarHBondContact O-N 3.18Å; E181-K183 VanDerWaalsContact O-N 3.09Å; K183-R185 PolarHBondContact O-N 2.93Å
184	K	46.3	Very low	68.1	Low	206 Å²	206	132.4 Å²	132.4	90%	0.896	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-53.8	124.7	176.4	-71	178.2	-179.2	172.5	0	109.1	P182	P182-K184 PolarHBondContact O-N 3.24Å
185	R	57.8	Low	66.5	Low	232 Å²	232	135 Å²	135	88%	0.875	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-61.6	132.9	170.6	-67.3	-175.6	-178.4	-168.5	0.2	108	K183 K187	K183-R185 PolarHBondContact O-N 2.93Å; R185-K187 PolarHBondContact O-N 2.95Å
186	P	54.6	Low	64.7	Low	121 Å²	121	143.2 Å²	143.2	79%	0.786	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-58.6	129.7	168	24.6	-30.2	0	0	0	107.5	C188	P186-C188 PolarHBondContact O-N 3.18Å; P186-C188 VanDerWaalsContact O-N 3.09Å
187	K	49.2	Very low	62.6	Low	197 Å²	197	151.4 Å²	151.4	86%	0.857	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-59.9	116.4	173.4	-71.5	-177.1	176.5	-178	0	106.8	R185 V189	R185-K187 PolarHBondContact O-N 2.95Å; K187-V189 PolarHBondContact O-N 3.24Å
188	C	52.3	Low	60.5	Low	123 Å²	123	157.5 Å²	157.5	83%	0.831	80%	0.804	S	S	*	*			trans	-56.8	108.7	162	-94.2	0	0	0	0	107	P186 L190	P186-C188 PolarHBondContact O-N 3.18Å; P186-C188 VanDerWaalsContact O-N 3.09Å; C188-L190 PolarHBondContact O-N 2.77Å
189	V	60.5	Low	58.5	Low	116 Å²	116	157.8 Å²	157.8	70%	0.703	81%	0.811	S	S	*	*			trans	-80.3	103.2	161.9	-175.2	0	0	0	0	104.4	K187 L191	K187-V189 PolarHBondContact O-N 3.24Å; V189-L191 HydrophobicContact CG1-CG 4.36Å; V189-L191 PolarHBondContact O-N 3.39Å
190	L	55.3	Low	57	Low	166 Å²	166	164.8 Å²	164.8	87%	0.869	84%	0.839	S	S	*	*			trans	-66.5	112.3	163	-71.3	165.3	0	0	0	105.8	C188	C188-L190 PolarHBondContact O-N 2.77Å
191	L	53.3	Low	55.6	Low	232 Å²	232	172.3 Å²	172.3	100%	1.215	87%	0.866	S	S	*	*			trans	-90.9	0	165.5	-78.2	167.9	0	0	0	108.7	V189	V189-L191 HydrophobicContact CG1-CG 4.36Å; V189-L191 PolarHBondContact O-N 3.39Å

Retrieved 191 of 191 residues in 313.2 ms (Link to these results)

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