A0A060WDU0_ONCMY Loading...

hypoxia-inducible factor-proline dioxygenase

AlphaFold DB , UniProt , Accession A0A060WDU0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110497687, Length 248 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	40.5	Very low	59.6	Low	188 Å²	188	102.8 Å²	102.8	93%	0.926	55%	0.554	S	S	*	*				0	121.2	0	-73.9	-63.2	-174.3	0	0	108.6	L3 L4 Q5	M1-L3 VanDerWaalsContact C-N 3.27Å; M1-L3 PolarHBondContact O-N 3.24Å; M1-L4 HydrophobicContact CB-CD1 4.23Å; M1-L4 PolarHBondContact O-N 3.17Å; M1-Q5 PolarHBondContact O-N 3.45Å
2	P	50.9	Low	62	Low	111 Å²	111	95.3 Å²	95.3	72%	0.721	51%	0.513	S	S	*	.	H	α-helix	trans	-58.2	-32.1	-172.5	-24.6	33.2	0	0	0	115	Q5 H6	P2-Q5 PolarHBondContact O-N 2.83Å; P2-H6 PolarHBondContact O-N 2.9Å; P2-H6 VanDerWaalsContact O-N 3.07Å
3	L	37.9	Very low	64.3	Low	151 Å²	151	94.7 Å²	94.7	79%	0.791	51%	0.505	S	S	*	.	H	α-helix	trans	-69.8	-36.8	-179.5	-68.5	168.9	0	0	0	113.4	M1 Q5 H6 A7	M1-L3 VanDerWaalsContact C-N 3.27Å; M1-L3 PolarHBondContact O-N 3.24Å; L3-Q5 VanDerWaalsContact C-N 3.33Å; L3-H6 PolarHBondContact O-N 2.84Å; L3-A7 PolarHBondContact O-N 3.43Å; L3-A7 VanDerWaalsContact O-N 3.11Å
4	L	45.8	Very low	66.2	Low	132 Å²	132	99.9 Å²	99.9	69%	0.691	51%	0.514	S	S	*	.	H	α-helix	trans	-68.8	-34.8	175.1	-72.1	171.4	0	0	0	111.4	M1 L8	M1-L4 HydrophobicContact CB-CD1 4.23Å; M1-L4 PolarHBondContact O-N 3.17Å; L4-L8 WeakPolarHBondContact O-CB 3.46Å; L4-L8 PolarHBondContact O-N 3.46Å; L4-L8 VanDerWaalsContact O-N 3.13Å
5	Q	56.8	Low	68	Low	84 Å²	84	95.1 Å²	95.1	39%	0.393	49%	0.49	S	S	.	.	H	α-helix	trans	-67.4	-42.2	176.3	-170.4	59.2	56.3	0	0	111.5	M1 P2 L3 L8 D9	M1-Q5 PolarHBondContact O-N 3.45Å; P2-Q5 PolarHBondContact O-N 2.83Å; L3-Q5 VanDerWaalsContact C-N 3.33Å; Q5-L8 PolarHBondContact O-N 3.2Å; Q5-D9 PolarHBondContact NE2-OD1 3.24Å; Q5-D9 PolarHBondContact NE2-OD2 2.77Å; Q5-D9 WeakPolarHBondContact O-CB 3.34Å; Q5-D9 PolarHBondContact O-N 3.08Å
6	H	54.8	Low	69.5	Low	129 Å²	129	89.2 Å²	89.2	60%	0.597	46%	0.459	S	S	*	.	H	α-helix	trans	-65.8	-40.4	177.9	-171.9	-63.3	0	0	0	112.5	P2 L3 D9 T10	P2-H6 PolarHBondContact O-N 2.9Å; P2-H6 VanDerWaalsContact O-N 3.07Å; L3-H6 PolarHBondContact O-N 2.84Å; H6-D9 PolarHBondContact O-N 3.27Å; H6-T10 PolarHBondContact ND1-OG1 3.12Å; H6-T10 WeakPolarHBondContact O-CB 3.37Å; H6-T10 PolarHBondContact O-N 2.82Å; H6-T10 PolarHBondContact O-OG1 2.89Å
7	A	60.9	Low	70.9	Confident	48 Å²	48	87.2 Å²	87.2	40%	0.397	45%	0.45	S	S	.	.	H	α-helix	trans	-63.4	-47.6	176.5	0	0	0	0	0	111.3	L3 D9 T10 D11	L3-A7 PolarHBondContact O-N 3.43Å; L3-A7 VanDerWaalsContact O-N 3.11Å; A7-D9 PolarHBondContact O-N 3.24Å; A7-T10 PolarHBondContact O-N 3.47Å; A7-D11 PolarHBondContact O-N 3.39Å
8	L	72.1	Confident	72.1	Confident	79 Å²	79	87.8 Å²	87.8	41%	0.414	45%	0.454	S	S	.	.	H	α-helix	trans	-60.7	-42.9	176.5	-171.1	72.6	0	0	0	112.2	L4 Q5 T10 D11 L12 L100	L4-L8 WeakPolarHBondContact O-CB 3.46Å; L4-L8 PolarHBondContact O-N 3.46Å; L4-L8 VanDerWaalsContact O-N 3.13Å; Q5-L8 PolarHBondContact O-N 3.2Å; L8-T10 VanDerWaalsContact C-N 3.33Å; L8-T10 PolarHBondContact O-N 2.94Å; L8-D11 PolarHBondContact O-N 3.42Å; L8-L12 HydrophobicContact CG-CD1 4.39Å; L8-L12 VanDerWaalsContact O-CG 3.28Å; L8-L12 WeakPolarHBondContact O-CG 3.34Å; L8-L12 PolarHBondContact O-N 3.02Å; L8-L100 HydrophobicContact CD2-CD2 4.11Å
9	D	74.1	Confident	73.3	Confident	47 Å²	47	87.6 Å²	87.6	25%	0.251	45%	0.453	S	S	.	.	H	α-helix	trans	-66.8	-35.5	178.8	-71.5	-17	0	0	0	111.4	Q5 H6 A7 E13 K103	Q5-D9 PolarHBondContact NE2-OD1 3.24Å; Q5-D9 PolarHBondContact NE2-OD2 2.77Å; Q5-D9 WeakPolarHBondContact O-CB 3.34Å; Q5-D9 PolarHBondContact O-N 3.08Å; H6-D9 PolarHBondContact O-N 3.27Å; A7-D9 PolarHBondContact O-N 3.24Å; D9-E13 WeakPolarHBondContact O-CB 3.33Å; D9-E13 PolarHBondContact O-N 3.33Å; D9-K103 IonicContact OD1-NZ 3.37Å; D9-K103 PolarHBondContact OD1-NZ 2.94Å; D9-K103 IonicContact OD2-NZ 3.2Å
10	T	76.1	Confident	74.3	Confident	63 Å²	63	83.3 Å²	83.3	39%	0.387	43%	0.431	S	S	.	.	H	α-helix	trans	-68.1	-40.3	175.4	-52.4	0	0	0	0	111.6	H6 A7 L8 E13 R14	H6-T10 PolarHBondContact ND1-OG1 3.12Å; H6-T10 WeakPolarHBondContact O-CB 3.37Å; H6-T10 PolarHBondContact O-N 2.82Å; H6-T10 PolarHBondContact O-OG1 2.89Å; A7-T10 PolarHBondContact O-N 3.47Å; L8-T10 VanDerWaalsContact C-N 3.33Å; L8-T10 PolarHBondContact O-N 2.94Å; T10-E13 PolarHBondContact O-N 2.68Å; T10-R14 WeakPolarHBondContact O-CB 3.26Å; T10-R14 PolarHBondContact O-N 2.88Å
11	D	86.1	Confident	75.3	Confident	99 Å²	99	80 Å²	80	53%	0.529	41%	0.414	S	S	.	.	H	α-helix	trans	-66.8	-39.4	177.6	-71.1	-28.7	0	0	0	111.7	A7 L8 R14 L15	A7-D11 PolarHBondContact O-N 3.39Å; L8-D11 PolarHBondContact O-N 3.42Å; D11-R14 PolarHBondContact O-N 2.79Å; D11-L15 WeakPolarHBondContact O-CB 3.4Å; D11-L15 PolarHBondContact O-N 2.92Å
12	L	88.3	Confident	77.9	Confident	12 Å²	12	73.9 Å²	73.9	6%	0.063	39%	0.388	C	S	.	.	H	α-helix	trans	-66.3	-42.5	173.9	-70.3	173.1	0	0	0	111.9	L8 R14 L15 A16 F35 L100 K103 L104	L8-L12 HydrophobicContact CG-CD1 4.39Å; L8-L12 VanDerWaalsContact O-CG 3.28Å; L8-L12 WeakPolarHBondContact O-CG 3.34Å; L8-L12 PolarHBondContact O-N 3.02Å; L12-R14 VanDerWaalsContact C-N 3.33Å; L12-R14 PolarHBondContact O-N 2.77Å; L12-L15 PolarHBondContact O-N 3.32Å; L12-A16 WeakPolarHBondContact O-CB 3.44Å; L12-A16 PolarHBondContact O-N 2.8Å; L12-F35 HydrophobicContact CD2-CE2 3.96Å; L12-F35 HydrophobicContact CD2-CZ 4.42Å; L12-L100 HydrophobicContact CD1-CD2 4.06Å; L12-K103 HydrophobicContact CD1-CB 4.43Å; L12-L104 HydrophobicContact CB-CD1 4.14Å; L12-L104 HydrophobicContact CD2-CD1 3.93Å; L12-L104 VanDerWaalsContact O-CD1 3.25Å; L12-L104 WeakPolarHBondContact O-CD1 3.4Å
13	E	91.1	Very high	79.9	Confident	88 Å²	88	69.7 Å²	69.7	41%	0.411	36%	0.362	S	S	.	.	H	α-helix	trans	-59.5	-46.2	175.7	-179.3	172.6	-160.7	0	0	111.1	D9 T10 A16 L17	D9-E13 WeakPolarHBondContact O-CB 3.33Å; D9-E13 PolarHBondContact O-N 3.33Å; T10-E13 PolarHBondContact O-N 2.68Å; E13-A16 WeakPolarHBondContact O-CB 3.29Å; E13-A16 PolarHBondContact O-N 2.79Å; E13-L17 HydrophobicContact CG-CD1 3.74Å; E13-L17 HydrophobicContact CG-CG 4.29Å; E13-L17 WeakPolarHBondContact O-CB 3.29Å; E13-L17 WeakPolarHBondContact O-CG 3.26Å; E13-L17 PolarHBondContact O-N 2.91Å
14	R	92.2	Very high	82.6	Confident	167 Å²	167	62.6 Å²	62.6	63%	0.63	33%	0.325	S	S	*	.	H	α-helix	trans	-62.4	-45.7	177.2	-169.7	-176.8	148.3	-163.7	-10	111.8	T10 D11 L12 A16 L17 D18	T10-R14 WeakPolarHBondContact O-CB 3.26Å; T10-R14 PolarHBondContact O-N 2.88Å; D11-R14 PolarHBondContact O-N 2.79Å; L12-R14 VanDerWaalsContact C-N 3.33Å; L12-R14 PolarHBondContact O-N 2.77Å; R14-A16 VanDerWaalsContact C-N 3.3Å; R14-A16 PolarHBondContact O-N 2.81Å; R14-L17 PolarHBondContact O-N 3.37Å; R14-D18 HydrophobicContact CG-CB 4.49Å; R14-D18 WeakPolarHBondContact CG-OD2 3.22Å; R14-D18 IonicContact NE-OD2 2.89Å; R14-D18 WeakPolarHBondContact O-CB 3.33Å; R14-D18 PolarHBondContact O-N 3.16Å
15	L	92.3	Very high	84.8	Confident	29 Å²	29	61.3 Å²	61.3	15%	0.152	32%	0.318	C	S	.	.	I	π-helix	trans	-57.9	-43.5	175.4	176.8	61.7	0	0	0	111.5	D11 L12 L19 I20 F30 V32 L104	D11-L15 WeakPolarHBondContact O-CB 3.4Å; D11-L15 PolarHBondContact O-N 2.92Å; L12-L15 PolarHBondContact O-N 3.32Å; L15-L19 HydrophobicContact CD1-CB 4.27Å; L15-L19 HydrophobicContact CD1-CD1 3.78Å; L15-L19 WeakPolarHBondContact O-CB 3.07Å; L15-L19 PolarHBondContact O-N 2.97Å; L15-I20 HydrophobicContact CG-CD1 4.04Å; L15-I20 HydrophobicContact CG-CG1 4.43Å; L15-I20 WeakPolarHBondContact O-CG1 3.3Å; L15-I20 PolarHBondContact O-N 2.99Å; L15-F30 HydrophobicContact CD1-CE1 4.25Å; L15-F30 HydrophobicContact CD1-CZ 4.46Å; L15-V32 HydrophobicContact CD1-CG2 4.3Å; L15-V32 HydrophobicContact CD2-CG1 4.44Å; L15-V32 HydrophobicContact CD2-CG2 4.41Å; L15-L104 HydrophobicContact CB-CD1 4.26Å; L15-L104 HydrophobicContact CD2-CD1 4.01Å; L15-L104 HydrophobicContact CD2-CD2 4.42Å; L15-L104 HydrophobicContact CG-CD1 4.15Å
16	A	92.3	Very high	86.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.325	C	S	.	.	I	π-helix	trans	-63.5	-53.6	178	0	0	0	0	0	112.4	L12 E13 R14 I20 V21 L104 H107 C108	L12-A16 WeakPolarHBondContact O-CB 3.44Å; L12-A16 PolarHBondContact O-N 2.8Å; E13-A16 WeakPolarHBondContact O-CB 3.29Å; E13-A16 PolarHBondContact O-N 2.79Å; R14-A16 VanDerWaalsContact C-N 3.3Å; R14-A16 PolarHBondContact O-N 2.81Å; A16-I20 PolarHBondContact O-N 3.09Å; A16-V21 WeakPolarHBondContact O-CG2 3.15Å; A16-V21 PolarHBondContact O-N 3.04Å; A16-L104 HydrophobicContact CB-CD1 3.97Å; A16-L104 HydrophobicContact CB-CG 4.49Å; A16-H107 HydrophobicContact CB-CB 3.58Å; A16-C108 VanDerWaalsContact CB-SG 3.6Å
17	L	92.6	Very high	88.2	Confident	56 Å²	56	59.8 Å²	59.8	29%	0.293	32%	0.315	S	S	.	.	I	π-helix	trans	-79.5	-38.2	-170.5	-63.9	-179.1	0	0	0	113.4	E13 R14 P22 H107 R111	E13-L17 HydrophobicContact CG-CD1 3.74Å; E13-L17 HydrophobicContact CG-CG 4.29Å; E13-L17 WeakPolarHBondContact O-CB 3.29Å; E13-L17 WeakPolarHBondContact O-CG 3.26Å; E13-L17 PolarHBondContact O-N 2.91Å; R14-L17 PolarHBondContact O-N 3.37Å; L17-P22 WeakPolarHBondContact O-CD 3.38Å; L17-H107 WeakPolarHBondContact CD2-O 3.48Å; L17-R111 HydrophobicContact CD2-CG 4.07Å
18	D	93.8	Very high	89.7	Confident	98 Å²	98	58 Å²	58	52%	0.524	30%	0.301	S	S	.	.	I	π-helix	trans	-89.2	-27.4	-173.5	-63.6	-9.7	0	0	0	112.4	R14	R14-D18 HydrophobicContact CG-CB 4.49Å; R14-D18 WeakPolarHBondContact CG-OD2 3.22Å; R14-D18 IonicContact NE-OD2 2.89Å; R14-D18 WeakPolarHBondContact O-CB 3.33Å; R14-D18 PolarHBondContact O-N 3.16Å
19	L	94.4	Very high	90.8	Very high	84 Å²	84	55 Å²	55	44%	0.44	28%	0.284	S	S	.	.	I	π-helix	trans	-119.5	-56.4	-172.1	-59.1	176.2	0	0	0	112.8	L15 S23 F30	L15-L19 HydrophobicContact CD1-CB 4.27Å; L15-L19 HydrophobicContact CD1-CD1 3.78Å; L15-L19 WeakPolarHBondContact O-CB 3.07Å; L15-L19 PolarHBondContact O-N 2.97Å; L19-S23 WeakPolarHBondContact O-CB 3.45Å; L19-S23 PolarHBondContact O-N 2.84Å; L19-S23 VanDerWaalsContact O-N 3.12Å; L19-S23 PolarHBondContact O-OG 2.84Å; L19-F30 HydrophobicContact CB-CE1 4.36Å; L19-F30 HydrophobicContact CB-CE2 4.05Å; L19-F30 HydrophobicContact CB-CZ 3.72Å; L19-F30 HydrophobicContact CD1-CZ 4.39Å
20	I	93.9	Very high	91.9	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	28%	0.279	C	S	.	.	I	π-helix	trans	-66.2	-53.1	-173.3	-65.4	173.1	0	0	0	111.2	L15 A16 S23 L24 F30 L104 F190	L15-I20 HydrophobicContact CG-CD1 4.04Å; L15-I20 HydrophobicContact CG-CG1 4.43Å; L15-I20 WeakPolarHBondContact O-CG1 3.3Å; L15-I20 PolarHBondContact O-N 2.99Å; A16-I20 PolarHBondContact O-N 3.09Å; I20-S23 PolarHBondContact O-N 3.37Å; I20-L24 HydrophobicContact CG2-CD1 3.74Å; I20-L24 HydrophobicContact CG2-CG 4.22Å; I20-L24 WeakPolarHBondContact O-CB 3.49Å; I20-L24 WeakPolarHBondContact O-CG 3.29Å; I20-L24 PolarHBondContact O-N 2.94Å; I20-F30 HydrophobicContact CB-CD1 4.38Å; I20-F30 HydrophobicContact CG1-CD1 3.56Å; I20-F30 HydrophobicContact CG1-CE1 3.68Å; I20-F30 HydrophobicContact CG1-CG 4.47Å; I20-L104 HydrophobicContact CD1-CD1 3.95Å; I20-L104 HydrophobicContact CD1-CD2 3.31Å; I20-L104 HydrophobicContact CD1-CG 3.67Å; I20-F190 HydrophobicContact CD1-CD2 4.28Å; I20-F190 HydrophobicContact CD1-CE2 3.97Å
21	V	94.1	Very high	92.9	Very high	13 Å²	13	55.7 Å²	55.7	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-59.3	-52.6	-177.1	163.7	0	0	0	0	111.6	A16 S23 L24 L25 C108 R111 L112	A16-V21 WeakPolarHBondContact O-CG2 3.15Å; A16-V21 PolarHBondContact O-N 3.04Å; V21-S23 VanDerWaalsContact C-N 3.34Å; V21-S23 PolarHBondContact O-N 3.23Å; V21-L24 PolarHBondContact O-N 3.43Å; V21-L25 HydrophobicContact CG1-CD1 3.98Å; V21-L25 VanDerWaalsContact O-CG 3.29Å; V21-L25 WeakPolarHBondContact O-CG 3.48Å; V21-L25 PolarHBondContact O-N 3.36Å; V21-L25 VanDerWaalsContact O-N 3.08Å; V21-C108 HydrophobicContact CG2-CB 3.99Å; V21-R111 HydrophobicContact CB-CB 4.42Å; V21-R111 HydrophobicContact CG1-CB 3.72Å; V21-R111 HydrophobicContact CG2-CB 3.83Å; V21-L112 HydrophobicContact CB-CD2 4.47Å; V21-L112 HydrophobicContact CG2-CD2 3.95Å; V21-L112 HydrophobicContact CG2-CG 4.34Å
22	P	94.7	Very high	93.4	Very high	60 Å²	60	52.2 Å²	52.2	39%	0.39	26%	0.26	S	S	.	.	H	α-helix	trans	-62.2	-41.3	179.7	-25.1	36.8	0	0	0	112.6	L17 L25 D26	L17-P22 WeakPolarHBondContact O-CD 3.38Å; P22-L25 PolarHBondContact O-N 3.47Å; P22-D26 WeakPolarHBondContact O-CB 3.43Å; P22-D26 PolarHBondContact O-N 3.46Å
23	S	94.6	Very high	93.8	Very high	24 Å²	24	54.7 Å²	54.7	17%	0.168	27%	0.273	C	S	.	.	H	α-helix	trans	-67.8	-40	-178.7	-57.6	0	0	0	0	112.3	L19 I20 V21 L25 D26 Q27 G28 F30	L19-S23 WeakPolarHBondContact O-CB 3.45Å; L19-S23 PolarHBondContact O-N 2.84Å; L19-S23 VanDerWaalsContact O-N 3.12Å; L19-S23 PolarHBondContact O-OG 2.84Å; I20-S23 PolarHBondContact O-N 3.37Å; V21-S23 VanDerWaalsContact C-N 3.34Å; V21-S23 PolarHBondContact O-N 3.23Å; S23-L25 VanDerWaalsContact C-N 3.32Å; S23-L25 PolarHBondContact O-N 2.68Å; S23-D26 PolarHBondContact O-N 2.96Å; S23-Q27 WeakPolarHBondContact O-CA 3.4Å; S23-Q27 WeakPolarHBondContact O-CB 3.39Å; S23-Q27 PolarHBondContact O-N 3.45Å; S23-G28 PolarHBondContact O-N 2.79Å; S23-F30 VanDerWaalsContact CB-CD2 3.48Å; S23-F30 VanDerWaalsContact OG-CD2 3.29Å; S23-F30 WeakPolarHBondContact OG-CD2 3.46Å
24	L	93.3	Very high	94	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-63.5	-38.4	173.2	-76.6	-179.3	0	0	0	111.9	I20 V21 G28 L112 F190 W192	I20-L24 HydrophobicContact CG2-CD1 3.74Å; I20-L24 HydrophobicContact CG2-CG 4.22Å; I20-L24 WeakPolarHBondContact O-CB 3.49Å; I20-L24 WeakPolarHBondContact O-CG 3.29Å; I20-L24 PolarHBondContact O-N 2.94Å; V21-L24 PolarHBondContact O-N 3.43Å; L24-G28 VanDerWaalsContact O-CA 3.26Å; L24-G28 WeakPolarHBondContact O-CA 3.46Å; L24-G28 PolarHBondContact O-N 2.89Å; L24-L112 HydrophobicContact CB-CD2 4.17Å; L24-L112 HydrophobicContact CD1-CD1 4.44Å; L24-L112 HydrophobicContact CD1-CD2 3.69Å; L24-F190 HydrophobicContact CD1-CB 4.36Å; L24-F190 HydrophobicContact CD2-CB 4.16Å; L24-W192 HydrophobicContact CB-CZ2 3.88Å; L24-W192 PolarHBondContact O-NE1 3.02Å
25	L	92.3	Very high	94.1	Very high	105 Å²	105	50 Å²	50	55%	0.55	26%	0.263	S	S	.	.	H	α-helix	trans	-72.4	-35.3	179.3	-68.3	173.8	0	0	0	113.1	V21 P22 S23 W192	V21-L25 HydrophobicContact CG1-CD1 3.98Å; V21-L25 VanDerWaalsContact O-CG 3.29Å; V21-L25 WeakPolarHBondContact O-CG 3.48Å; V21-L25 PolarHBondContact O-N 3.36Å; V21-L25 VanDerWaalsContact O-N 3.08Å; P22-L25 PolarHBondContact O-N 3.47Å; S23-L25 VanDerWaalsContact C-N 3.32Å; S23-L25 PolarHBondContact O-N 2.68Å; L25-W192 HydrophobicContact CD2-CZ2 4.37Å
26	D	91.5	Very high	94.2	Very high	103 Å²	103	49.8 Å²	49.8	55%	0.551	26%	0.261	S	S	*	.	H	α-helix	trans	-88.5	-50.3	-178.3	179.8	47.7	0	0	0	113.4	P22 S23 K175	P22-D26 WeakPolarHBondContact O-CB 3.43Å; P22-D26 PolarHBondContact O-N 3.46Å; S23-D26 PolarHBondContact O-N 2.96Å; D26-K175 WeakPolarHBondContact O-CE 3.46Å; D26-K175 PolarHBondContact O-NZ 2.75Å
27	Q	91.4	Very high	94.2	Very high	79 Å²	79	51.1 Å²	51.1	37%	0.369	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-22.6	-171.3	-57.9	-173.4	-2.9	0	0	113.4	S23 F29	S23-Q27 WeakPolarHBondContact O-CA 3.4Å; S23-Q27 WeakPolarHBondContact O-CB 3.39Å; S23-Q27 PolarHBondContact O-N 3.45Å; Q27-F29 VanDerWaalsContact C-N 3.31Å; Q27-F29 HydrophobicContact CB-CD1 4.44Å; Q27-F29 HydrophobicContact CB-CE1 4.31Å
28	G	92.8	Very high	94.1	Very high	10 Å²	10	55.3 Å²	55.3	10%	0.103	29%	0.293	C	S	.	.	S	Bend	trans	87.5	-7.7	-179.2	0	0	0	0	0	115.1	S23 L24 F191 W192 N197	S23-G28 PolarHBondContact O-N 2.79Å; L24-G28 VanDerWaalsContact O-CA 3.26Å; L24-G28 WeakPolarHBondContact O-CA 3.46Å; L24-G28 PolarHBondContact O-N 2.89Å; G28-F191 WeakPolarHBondContact O-CA 3.41Å; G28-W192 PolarHBondContact O-N 3.2Å; G28-N197 PolarHBondContact O-ND2 3.27Å
29	F	96.2	Very high	94.1	Very high	17 Å²	17	56.5 Å²	56.5	8%	0.075	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	162.2	175.8	71.2	-81.8	0	0	0	110.6	Q27 I170 P172 Y177 A179 L189 F190 F191	Q27-F29 VanDerWaalsContact C-N 3.31Å; Q27-F29 HydrophobicContact CB-CD1 4.44Å; Q27-F29 HydrophobicContact CB-CE1 4.31Å; F29-I170 HydrophobicContact CB-CD1 4.26Å; F29-I170 HydrophobicContact CD2-CD1 4.46Å; F29-I170 HydrophobicContact CG-CD1 4.25Å; F29-P172 HydrophobicContact CD1-CG 4.25Å; F29-P172 HydrophobicContact CE1-CG 4.11Å; F29-Y177 HydrophobicContact CE1-CE2 4.08Å; F29-A179 HydrophobicContact CD1-CB 4.47Å; F29-A179 HydrophobicContact CE1-CB 3.61Å; F29-A179 HydrophobicContact CE2-CB 3.99Å; F29-A179 HydrophobicContact CZ-CB 3.32Å; F29-L189 HydrophobicContact CD2-CD1 4.39Å; F29-F190 CarbonylContact C-O 3.45Å; F29-F190 WeakPolarHBondContact CA-O 3.46Å; F29-F190 WeakPolarHBondContact CB-O 3.22Å; F29-F191 HydrophobicContact CB-CB 3.64Å
30	F	96.7	Very high	94.1	Very high	33 Å²	33	54.7 Å²	54.7	15%	0.145	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	141.5	173.9	178.5	-98.8	0	0	0	109.9	L15 L19 I20 S23 V32 L189 F190	L15-F30 HydrophobicContact CD1-CE1 4.25Å; L15-F30 HydrophobicContact CD1-CZ 4.46Å; L19-F30 HydrophobicContact CB-CE1 4.36Å; L19-F30 HydrophobicContact CB-CE2 4.05Å; L19-F30 HydrophobicContact CB-CZ 3.72Å; L19-F30 HydrophobicContact CD1-CZ 4.39Å; I20-F30 HydrophobicContact CB-CD1 4.38Å; I20-F30 HydrophobicContact CG1-CD1 3.56Å; I20-F30 HydrophobicContact CG1-CE1 3.68Å; I20-F30 HydrophobicContact CG1-CG 4.47Å; S23-F30 VanDerWaalsContact CB-CD2 3.48Å; S23-F30 VanDerWaalsContact OG-CD2 3.29Å; S23-F30 WeakPolarHBondContact OG-CD2 3.46Å; F30-V32 HydrophobicContact CE1-CB 4.09Å; F30-L189 CarbonylContact O-C 3.5Å; F30-F190 PolarHBondContact N-O 2.95Å; F30-F190 PolarHBondContact O-N 3.24Å
31	Y	97.1	Very high	94.1	Very high	91 Å²	91	54.7 Å²	54.7	36%	0.357	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	151.7	169.8	65.5	-97.1	0	0	0	111.9	V181 R187 L188	Y31-V181 HydrophobicContact CD1-CG1 4.36Å; Y31-V181 HydrophobicContact CD1-CG2 4.39Å; Y31-R187 HydrophobicContact CD2-CG 4.31Å; Y31-R187 HydrophobicContact CG-CG 4.48Å; Y31-L188 CarbonylContact C-O 3.53Å; Y31-L188 WeakPolarHBondContact CA-O 3.12Å; Y31-L188 WeakPolarHBondContact CB-O 3.4Å
32	V	96.3	Very high	94.3	Very high	26 Å²	26	57.5 Å²	57.5	16%	0.158	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.9	173.1	58.4	0	0	0	0	109.1	L15 F30 F35 R187 L188	L15-V32 HydrophobicContact CD1-CG2 4.3Å; L15-V32 HydrophobicContact CD2-CG1 4.44Å; L15-V32 HydrophobicContact CD2-CG2 4.41Å; F30-V32 HydrophobicContact CE1-CB 4.09Å; V32-F35 HydrophobicContact CG1-CB 4.32Å; V32-F35 HydrophobicContact CG1-CD2 4.12Å; V32-R187 CarbonylContact O-C 3.06Å; V32-R187 WeakPolarHBondContact O-CA 3.44Å; V32-L188 HydrophobicContact CG1-CB 3.78Å; V32-L188 HydrophobicContact CG1-CD2 4.38Å; V32-L188 PolarHBondContact N-O 2.98Å; V32-L188 PolarHBondContact O-N 2.89Å
33	D	96.5	Very high	94.4	Very high	63 Å²	63	60 Å²	60	34%	0.337	31%	0.308	S	S	.	.	S	Bend	trans	-93.6	153.5	174.4	-70.5	-40.5	0	0	0	110.6	R187	D33-R187 WeakPolarHBondContact OD1-CB 3.15Å; D33-R187 IonicContact OD1-CZ 3.66Å; D33-R187 VanDerWaalsContact OD1-CZ 3.29Å; D33-R187 IonicContact OD1-NE 3.9Å; D33-R187 PolarHBondContact OD1-NE 2.86Å; D33-R187 IonicContact OD1-NH2 2.79Å; D33-R187 PolarHBondContact OD1-NH2 2.82Å; D33-R187 VanDerWaalsContact OD1-NH2 3.08Å; D33-R187 IonicContact OD2-CZ 2.68Å; D33-R187 IonicContact OD2-NE 3.95Å; D33-R187 IonicContact OD2-NH2 2.96Å; D33-R187 PolarHBondContact OD2-NH2 2.92Å
34	N	94.6	Very high	94.5	Very high	128 Å²	128	58.9 Å²	58.9	68%	0.684	30%	0.3	S	S	*	.	S	Bend	trans	58.5	43.3	-179.5	-50.5	-67.7	0	0	0	113.1	D186	N34-D186 WeakPolarHBondContact CA-OD2 3.44Å; N34-D186 PolarHBondContact N-O 3.41Å
35	F	95.1	Very high	94.7	Very high	30 Å²	30	59.2 Å²	59.2	13%	0.132	30%	0.302	C	S	.	.	S	Bend	trans	-66.3	-50.1	-172.7	176.1	-115.8	0	0	0	113.6	L12 V32 L97 L100 I101 L104 Y153 D186 L188	L12-F35 HydrophobicContact CD2-CE2 3.96Å; L12-F35 HydrophobicContact CD2-CZ 4.42Å; V32-F35 HydrophobicContact CG1-CB 4.32Å; V32-F35 HydrophobicContact CG1-CD2 4.12Å; F35-L97 HydrophobicContact CD1-CD1 4.33Å; F35-L97 HydrophobicContact CE1-CD1 4.15Å; F35-L100 HydrophobicContact CE1-CB 4.12Å; F35-L100 HydrophobicContact CZ-CB 3.94Å; F35-I101 HydrophobicContact CE1-CG1 4.28Å; F35-L104 HydrophobicContact CE2-CD2 4.23Å; F35-Y153 HydrophobicContact CB-CE2 4.43Å; F35-Y153 HydrophobicContact CD1-CE2 4.33Å; F35-D186 VanDerWaalsContact N-CG 3.33Å; F35-D186 PolarHBondContact N-O 3.24Å; F35-D186 VanDerWaalsContact N-O 3.12Å; F35-D186 PolarHBondContact N-OD1 3.46Å; F35-D186 VanDerWaalsContact N-OD1 3.13Å; F35-D186 PolarHBondContact N-OD2 2.91Å; F35-L188 HydrophobicContact CB-CB 4.07Å; F35-L188 HydrophobicContact CD1-CB 4.26Å; F35-L188 HydrophobicContact CD1-CD2 3.75Å; F35-L188 HydrophobicContact CD1-CG 4.47Å; F35-L188 HydrophobicContact CD2-CD2 3.85Å; F35-L188 HydrophobicContact CE1-CD2 3.7Å; F35-L188 HydrophobicContact CE2-CD2 3.79Å; F35-L188 HydrophobicContact CG-CB 4.05Å; F35-L188 HydrophobicContact CG-CD2 3.83Å; F35-L188 HydrophobicContact CZ-CD2 3.72Å
36	L	93.1	Very high	94.9	Very high	24 Å²	24	57.3 Å²	57.3	13%	0.126	29%	0.292	C	S	.	.	S	Bend	trans	-93.7	-21.5	179.8	-59.8	-175.2	0	0	0	112.7	V40 V44 L97 L100 Y153 D186	L36-V40 HydrophobicContact CB-CB 3.94Å; L36-V40 HydrophobicContact CB-CG1 3.96Å; L36-V40 HydrophobicContact CD1-CG1 3.81Å; L36-V40 HydrophobicContact CG-CG1 4.36Å; L36-V44 HydrophobicContact CD1-CG2 3.89Å; L36-L97 HydrophobicContact CD1-CB 4.14Å; L36-L97 HydrophobicContact CD1-CD1 3.98Å; L36-L97 HydrophobicContact CD2-CD1 4.24Å; L36-L97 HydrophobicContact CG-CD1 4.34Å; L36-L100 HydrophobicContact CD2-CD1 3.44Å; L36-L100 VanDerWaalsContact CD2-CD1 3.44Å; L36-Y153 HydrophobicContact CD1-CE1 4.11Å; L36-Y153 HydrophobicContact CD1-CE2 4.21Å; L36-Y153 WeakPolarHBondContact CD1-OH 3.33Å; L36-Y153 HydrophobicContact CG-CE2 4.11Å; L36-D186 PolarHBondContact N-OD1 3.41Å; L36-D186 PolarHBondContact N-OD2 2.78Å
37	G	93	Very high	95.1	Very high	27 Å²	27	53.8 Å²	53.8	28%	0.278	27%	0.272	S	S	.	.			trans	84.7	162	-167.3	0	0	0	0	0	112.8	L39 V40 G41 D186	G37-L39 VanDerWaalsContact C-N 3.34Å; G37-L39 PolarHBondContact O-N 2.89Å; G37-V40 PolarHBondContact O-N 3.4Å; G37-G41 PolarHBondContact O-N 3.31Å; G37-D186 WeakPolarHBondContact CA-OD2 3.34Å; G37-D186 PolarHBondContact N-OD2 3.45Å
38	E	91.7	Very high	95.3	Very high	145 Å²	145	50 Å²	50	68%	0.678	26%	0.255	S	S	*	.	H	α-helix	trans	-57.6	-42.3	-170.3	-172.8	176.4	-175.4	0	0	113.9	H42	E38-H42 VanDerWaalsContact O-CB 3.25Å; E38-H42 WeakPolarHBondContact O-CB 3.37Å; E38-H42 PolarHBondContact O-N 3.27Å
39	L	93.1	Very high	95.5	Very high	122 Å²	122	54.1 Å²	54.1	64%	0.639	27%	0.27	S	S	*	.	H	α-helix	trans	-65.5	-52.3	-176.8	-177.7	65.4	0	0	0	111.7	G37 H42 F43	G37-L39 VanDerWaalsContact C-N 3.34Å; G37-L39 PolarHBondContact O-N 2.89Å; L39-H42 PolarHBondContact O-N 3.09Å; L39-F43 HydrophobicContact CD1-CE2 3.74Å; L39-F43 HydrophobicContact CD1-CZ 4.33Å; L39-F43 HydrophobicContact CG-CD2 4.38Å; L39-F43 HydrophobicContact CG-CE2 3.87Å; L39-F43 WeakPolarHBondContact O-CD2 3.37Å; L39-F43 PolarHBondContact O-N 3.48Å
40	V	93.3	Very high	95.4	Very high	47 Å²	47	59.2 Å²	59.2	29%	0.285	29%	0.294	S	S	.	.	H	α-helix	trans	-70.6	-42.5	-177.4	-179.8	0	0	0	0	110.1	L36 G37 H42 F43 V44 I96	L36-V40 HydrophobicContact CB-CB 3.94Å; L36-V40 HydrophobicContact CB-CG1 3.96Å; L36-V40 HydrophobicContact CD1-CG1 3.81Å; L36-V40 HydrophobicContact CG-CG1 4.36Å; G37-V40 PolarHBondContact O-N 3.4Å; V40-H42 PolarHBondContact O-N 3.42Å; V40-F43 PolarHBondContact O-N 2.98Å; V40-F43 VanDerWaalsContact O-N 3.15Å; V40-V44 WeakPolarHBondContact O-CG2 3.5Å; V40-V44 PolarHBondContact O-N 3.4Å; V40-V44 VanDerWaalsContact O-N 3.09Å; V40-I96 HydrophobicContact CG1-CG2 4.42Å
41	G	95.5	Very high	95.3	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-34.5	174.3	0	0	0	0	0	112.8	G37 V44 L45 Y153 F185	G37-G41 PolarHBondContact O-N 3.31Å; G41-V44 PolarHBondContact O-N 2.97Å; G41-L45 PolarHBondContact O-N 2.87Å; G41-Y153 WeakPolarHBondContact CA-OH 3.19Å; G41-F185 WeakPolarHBondContact O-CE2 3.45Å
42	H	97	Very high	95.1	Very high	72 Å²	72	56.9 Å²	56.9	33%	0.333	29%	0.287	S	S	.	.	H	α-helix	trans	-67.4	-42.6	176.8	-172.9	23.6	0	0	0	112.1	E38 L39 V40 V44 L45 D46	E38-H42 VanDerWaalsContact O-CB 3.25Å; E38-H42 WeakPolarHBondContact O-CB 3.37Å; E38-H42 PolarHBondContact O-N 3.27Å; L39-H42 PolarHBondContact O-N 3.09Å; V40-H42 PolarHBondContact O-N 3.42Å; H42-V44 VanDerWaalsContact C-N 3.33Å; H42-V44 PolarHBondContact O-N 2.99Å; H42-L45 WeakPolarHBondContact O-CB 3.43Å; H42-L45 PolarHBondContact O-N 3.35Å; H42-D46 IonicContact CE1-OD1 2.71Å; H42-D46 PolarHBondContact CE1-OD1 3.35Å; H42-D46 IonicContact CE1-OD2 3.61Å; H42-D46 PolarHBondContact CE1-OD2 3.48Å; H42-D46 IonicContact ND1-OD1 3.76Å; H42-D46 PolarHBondContact ND1-OD1 2.93Å; H42-D46 IonicContact ND1-OD2 2.66Å; H42-D46 IonicContact NE2-OD2 3.59Å; H42-D46 PolarHBondContact O-N 2.87Å
43	F	96.8	Very high	94.9	Very high	114 Å²	114	59.7 Å²	59.7	50%	0.5	31%	0.308	S	S	.	.	H	α-helix	trans	-62.6	-38.8	175	-72.1	-61.7	0	0	0	112.4	L39 V40 L45 D46 Q47 A93	L39-F43 HydrophobicContact CD1-CE2 3.74Å; L39-F43 HydrophobicContact CD1-CZ 4.33Å; L39-F43 HydrophobicContact CG-CD2 4.38Å; L39-F43 HydrophobicContact CG-CE2 3.87Å; L39-F43 WeakPolarHBondContact O-CD2 3.37Å; L39-F43 PolarHBondContact O-N 3.48Å; V40-F43 PolarHBondContact O-N 2.98Å; V40-F43 VanDerWaalsContact O-N 3.15Å; F43-L45 VanDerWaalsContact C-N 3.34Å; F43-D46 PolarHBondContact O-N 3.42Å; F43-Q47 WeakPolarHBondContact O-CG 3.14Å; F43-Q47 PolarHBondContact O-N 2.95Å; F43-Q47 VanDerWaalsContact O-N 3.07Å; F43-A93 HydrophobicContact CB-CB 3.76Å
44	V	97	Very high	94.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62.2	-44.6	173.8	-177.4	0	0	0	0	110.5	L36 V40 G41 H42 D46 Q47 V48 A93 I94 L97 Y153 L155	L36-V44 HydrophobicContact CD1-CG2 3.89Å; V40-V44 WeakPolarHBondContact O-CG2 3.5Å; V40-V44 PolarHBondContact O-N 3.4Å; V40-V44 VanDerWaalsContact O-N 3.09Å; G41-V44 PolarHBondContact O-N 2.97Å; H42-V44 VanDerWaalsContact C-N 3.33Å; H42-V44 PolarHBondContact O-N 2.99Å; V44-D46 VanDerWaalsContact C-N 3.34Å; V44-D46 PolarHBondContact O-N 3.2Å; V44-Q47 PolarHBondContact O-N 2.89Å; V44-V48 WeakPolarHBondContact O-CG2 3.33Å; V44-V48 PolarHBondContact O-N 2.82Å; V44-A93 HydrophobicContact CG2-CB 3.85Å; V44-I94 HydrophobicContact CG1-CG1 4.15Å; V44-L97 HydrophobicContact CG1-CD2 4.13Å; V44-L97 HydrophobicContact CG2-CB 4.4Å; V44-Y153 HydrophobicContact CB-CE1 4.47Å; V44-Y153 HydrophobicContact CG1-CE1 4.21Å; V44-L155 HydrophobicContact CB-CD2 4.02Å; V44-L155 HydrophobicContact CG1-CD1 4.32Å; V44-L155 HydrophobicContact CG1-CD2 3.77Å
45	L	97.7	Very high	94.5	Very high	7 Å²	7	56.6 Å²	56.6	4%	0.037	31%	0.31	C	S	.	.	H	α-helix	trans	-60.2	-42.6	177.1	174.3	59.6	0	0	0	111.9	G41 H42 F43 V48 K49 L155 K157 F185 Y209	G41-L45 PolarHBondContact O-N 2.87Å; H42-L45 WeakPolarHBondContact O-CB 3.43Å; H42-L45 PolarHBondContact O-N 3.35Å; F43-L45 VanDerWaalsContact C-N 3.34Å; L45-V48 PolarHBondContact O-N 2.88Å; L45-K49 HydrophobicContact CD1-CD 4.2Å; L45-K49 HydrophobicContact CD1-CG 4.11Å; L45-K49 HydrophobicContact CG-CD 4.19Å; L45-K49 WeakPolarHBondContact O-CB 3.49Å; L45-K49 WeakPolarHBondContact O-CG 3.46Å; L45-K49 PolarHBondContact O-N 3.4Å; L45-L155 HydrophobicContact CB-CD2 4.09Å; L45-L155 HydrophobicContact CD1-CB 4.08Å; L45-L155 WeakPolarHBondContact CD1-O 3.32Å; L45-K157 HydrophobicContact CD2-CD 4.24Å; L45-K157 HydrophobicContact CD2-CG 4.22Å; L45-F185 HydrophobicContact CB-CE2 4.45Å; L45-F185 HydrophobicContact CD2-CE2 4.38Å; L45-Y209 HydrophobicContact CD1-CD2 4.03Å
46	D	96.9	Very high	94.2	Very high	65 Å²	65	58.9 Å²	58.9	35%	0.348	33%	0.327	S	S	.	.	H	α-helix	trans	-65.7	-41.6	-179.6	-69.5	-12.9	0	0	0	111.4	H42 F43 V44 V48 K49 E50	H42-D46 IonicContact CE1-OD1 2.71Å; H42-D46 PolarHBondContact CE1-OD1 3.35Å; H42-D46 IonicContact CE1-OD2 3.61Å; H42-D46 PolarHBondContact CE1-OD2 3.48Å; H42-D46 IonicContact ND1-OD1 3.76Å; H42-D46 PolarHBondContact ND1-OD1 2.93Å; H42-D46 IonicContact ND1-OD2 2.66Å; H42-D46 IonicContact NE2-OD2 3.59Å; H42-D46 PolarHBondContact O-N 2.87Å; F43-D46 PolarHBondContact O-N 3.42Å; V44-D46 VanDerWaalsContact C-N 3.34Å; V44-D46 PolarHBondContact O-N 3.2Å; D46-V48 PolarHBondContact O-N 3.23Å; D46-K49 PolarHBondContact O-N 2.9Å; D46-E50 WeakPolarHBondContact O-CB 3.37Å; D46-E50 PolarHBondContact O-N 2.97Å
47	Q	95.7	Very high	94.1	Very high	30 Å²	30	58.3 Å²	58.3	14%	0.14	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-41.7	173.9	-69	-172	-15.3	0	0	112.2	F43 V44 E50 L51 G90 C91 E92 A93 I94	F43-Q47 WeakPolarHBondContact O-CG 3.14Å; F43-Q47 PolarHBondContact O-N 2.95Å; F43-Q47 VanDerWaalsContact O-N 3.07Å; V44-Q47 PolarHBondContact O-N 2.89Å; Q47-E50 PolarHBondContact O-N 2.9Å; Q47-L51 WeakPolarHBondContact O-CG 3.43Å; Q47-L51 PolarHBondContact O-N 3.32Å; Q47-G90 WeakPolarHBondContact CG-O 3.44Å; Q47-G90 PolarHBondContact NE2-O 3.24Å; Q47-G90 PolarHBondContact OE1-O 2.99Å; Q47-C91 VanDerWaalsContact OE1-CA 3.24Å; Q47-E92 VanDerWaalsContact NE2-N 3.19Å; Q47-E92 PolarHBondContact NE2-OE2 3.33Å; Q47-E92 VanDerWaalsContact NE2-OE2 3.08Å; Q47-A93 HydrophobicContact CG-CB 4.46Å; Q47-I94 HydrophobicContact CB-CD1 4.19Å; Q47-I94 HydrophobicContact CB-CG1 4.41Å; Q47-I94 VanDerWaalsContact OE1-N 3.08Å
48	V	96.3	Very high	93.9	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-39.2	176.3	167.5	0	0	0	0	111.8	V44 L45 D46 E50 L51 H52 I94 V125 L155 Y209 V211	V44-V48 WeakPolarHBondContact O-CG2 3.33Å; V44-V48 PolarHBondContact O-N 2.82Å; L45-V48 PolarHBondContact O-N 2.88Å; D46-V48 PolarHBondContact O-N 3.23Å; V48-E50 VanDerWaalsContact C-N 3.34Å; V48-L51 PolarHBondContact O-N 2.77Å; V48-H52 PolarHBondContact O-N 2.59Å; V48-I94 HydrophobicContact CG2-CD1 4.15Å; V48-V125 HydrophobicContact CB-CG1 4.26Å; V48-V125 HydrophobicContact CG1-CG1 3.63Å; V48-V125 HydrophobicContact CG2-CG1 3.85Å; V48-V125 HydrophobicContact CG2-CG2 4.48Å; V48-L155 HydrophobicContact CB-CD1 4.09Å; V48-L155 HydrophobicContact CG1-CD1 4.18Å; V48-L155 HydrophobicContact CG2-CD1 3.72Å; V48-Y209 HydrophobicContact CG1-CD1 3.57Å; V48-Y209 HydrophobicContact CG1-CE1 4.18Å; V48-Y209 HydrophobicContact CG1-CG 3.89Å; V48-V211 HydrophobicContact CG2-CG2 4.07Å
49	K	95.8	Very high	93.6	Very high	96 Å²	96	61.2 Å²	61.2	42%	0.417	33%	0.333	S	S	.	.	H	α-helix	trans	-64.3	-39.2	174.1	-77.8	176.2	174.8	175.7	0	111.9	L45 D46 H52 S53 Y209	L45-K49 HydrophobicContact CD1-CD 4.2Å; L45-K49 HydrophobicContact CD1-CG 4.11Å; L45-K49 HydrophobicContact CG-CD 4.19Å; L45-K49 WeakPolarHBondContact O-CB 3.49Å; L45-K49 WeakPolarHBondContact O-CG 3.46Å; L45-K49 PolarHBondContact O-N 3.4Å; D46-K49 PolarHBondContact O-N 2.9Å; K49-H52 WeakPolarHBondContact O-CB 3.45Å; K49-H52 PolarHBondContact O-N 3.35Å; K49-S53 PolarHBondContact O-N 2.74Å; K49-S53 PolarHBondContact O-OG 2.99Å; K49-Y209 HydrophobicContact CG-CE2 4.13Å
50	E	95.1	Very high	92.9	Very high	124 Å²	124	56 Å²	56	58%	0.579	31%	0.309	S	S	*	.	H	α-helix	trans	-65.8	-40.1	176.7	-172.7	59.2	-156.3	0	0	112	D46 Q47 V48 H52 S53 S54	D46-E50 WeakPolarHBondContact O-CB 3.37Å; D46-E50 PolarHBondContact O-N 2.97Å; Q47-E50 PolarHBondContact O-N 2.9Å; V48-E50 VanDerWaalsContact C-N 3.34Å; E50-H52 VanDerWaalsContact C-N 3.25Å; E50-H52 PolarHBondContact O-N 2.73Å; E50-S53 WeakPolarHBondContact CA-OG 3.36Å; E50-S53 PolarHBondContact O-N 3.06Å; E50-S53 PolarHBondContact O-OG 2.91Å; E50-S53 PolarHBondContact OE2-OG 3.43Å; E50-S54 VanDerWaalsContact O-CB 3.31Å; E50-S54 WeakPolarHBondContact O-CB 3.4Å; E50-S54 PolarHBondContact O-N 2.74Å; E50-S54 PolarHBondContact O-OG 2.76Å
51	L	93	Very high	92.1	Very high	27 Å²	27	60.4 Å²	60.4	14%	0.141	33%	0.326	C	S	.	.	H	α-helix	trans	-60.5	-37.9	171.6	-70.5	171.7	0	0	0	111.6	Q47 V48 S54 V56 L57 V84 I94 V125	Q47-L51 WeakPolarHBondContact O-CG 3.43Å; Q47-L51 PolarHBondContact O-N 3.32Å; V48-L51 PolarHBondContact O-N 2.77Å; L51-S54 WeakPolarHBondContact CA-OG 3.42Å; L51-S54 PolarHBondContact O-OG 2.86Å; L51-V56 PolarHBondContact O-N 2.64Å; L51-L57 VanDerWaalsContact C-CD1 3.41Å; L51-L57 HydrophobicContact CB-CD1 3.82Å; L51-L57 VanDerWaalsContact O-CD1 3.24Å; L51-L57 WeakPolarHBondContact O-CD1 3.25Å; L51-V84 HydrophobicContact CD1-CG2 3.86Å; L51-I94 HydrophobicContact CD1-CD1 4.01Å; L51-V125 HydrophobicContact CD1-CG2 4.25Å
52	H	93.4	Very high	90.8	Very high	48 Å²	48	64.9 Å²	64.9	22%	0.222	35%	0.35	C	S	.	.	H	α-helix	trans	-71	-46	176.8	-173.4	-157.5	0	0	0	112.8	V48 K49 E50 S54 G55 L57 C127 Y209	V48-H52 PolarHBondContact O-N 2.59Å; K49-H52 WeakPolarHBondContact O-CB 3.45Å; K49-H52 PolarHBondContact O-N 3.35Å; E50-H52 VanDerWaalsContact C-N 3.25Å; E50-H52 PolarHBondContact O-N 2.73Å; H52-S54 VanDerWaalsContact C-N 3.32Å; H52-S54 PolarHBondContact O-N 3.32Å; H52-G55 PolarHBondContact O-N 3.5Å; H52-G55 VanDerWaalsContact O-N 3.17Å; H52-L57 HydrophobicContact CB-CD1 4.42Å; H52-L57 HydrophobicContact CB-CD2 4.23Å; H52-C127 PolarHBondContact CE1-SG 3.12Å; H52-Y209 HydrophobicContact CB-CE1 4.15Å; H52-Y209 AromaticContact ND1-CE1 3.65Å; H52-Y209 AromaticContact ND1-CZ 3.65Å; H52-Y209 PolarHBondContact ND1-OH 2.79Å
53	S	93.3	Very high	88.8	Confident	85 Å²	85	66.1 Å²	66.1	59%	0.594	37%	0.373	S	S	*	.	H	α-helix	trans	-65.8	-33.6	-179.6	62.8	0	0	0	0	112.6	K49 E50 G55	K49-S53 PolarHBondContact O-N 2.74Å; K49-S53 PolarHBondContact O-OG 2.99Å; E50-S53 WeakPolarHBondContact CA-OG 3.36Å; E50-S53 PolarHBondContact O-N 3.06Å; E50-S53 PolarHBondContact O-OG 2.91Å; E50-S53 PolarHBondContact OE2-OG 3.43Å; S53-G55 PolarHBondContact O-N 3.47Å
54	S	92.3	Very high	86.5	Confident	67 Å²	67	63.5 Å²	63.5	47%	0.469	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-4.9	176	57.7	0	0	0	0	114.3	E50 L51 H52 V56	E50-S54 VanDerWaalsContact O-CB 3.31Å; E50-S54 WeakPolarHBondContact O-CB 3.4Å; E50-S54 PolarHBondContact O-N 2.74Å; E50-S54 PolarHBondContact O-OG 2.76Å; L51-S54 WeakPolarHBondContact CA-OG 3.42Å; L51-S54 PolarHBondContact O-OG 2.86Å; H52-S54 VanDerWaalsContact C-N 3.32Å; H52-S54 PolarHBondContact O-N 3.32Å; S54-V56 VanDerWaalsContact C-N 3.3Å; S54-V56 PolarHBondContact O-N 3.34Å; S54-V56 WeakPolarHBondContact OG-CG2 3.42Å
55	G	89.1	Confident	83.5	Confident	58 Å²	58	70 Å²	70	60%	0.598	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	16	175.8	0	0	0	0	0	114.5	H52 S53 L57	H52-G55 PolarHBondContact O-N 3.5Å; H52-G55 VanDerWaalsContact O-N 3.17Å; S53-G55 PolarHBondContact O-N 3.47Å; G55-L57 VanDerWaalsContact C-N 3.29Å; G55-L57 PolarHBondContact O-N 2.85Å
56	V	89.8	Confident	81	Confident	78 Å²	78	75.2 Å²	75.2	47%	0.473	45%	0.448	S	S	.	.			trans	-70.9	-26.8	179.9	176.6	0	0	0	0	111.9	L51 S54 Q58 A82	L51-V56 PolarHBondContact O-N 2.64Å; S54-V56 VanDerWaalsContact C-N 3.3Å; S54-V56 PolarHBondContact O-N 3.34Å; S54-V56 WeakPolarHBondContact OG-CG2 3.42Å; V56-Q58 PolarHBondContact O-N 3.08Å; V56-A82 HydrophobicContact CG1-CB 4.17Å
57	L	89.4	Confident	78.2	Confident	13 Å²	13	84.4 Å²	84.4	7%	0.068	48%	0.478	C	S	.	.			trans	-72.2	126	-179.8	-78.9	65.2	0	0	0	111.3	L51 H52 G55 K80 I81 A82 C127	L51-L57 VanDerWaalsContact C-CD1 3.41Å; L51-L57 HydrophobicContact CB-CD1 3.82Å; L51-L57 VanDerWaalsContact O-CD1 3.24Å; L51-L57 WeakPolarHBondContact O-CD1 3.25Å; H52-L57 HydrophobicContact CB-CD1 4.42Å; H52-L57 HydrophobicContact CB-CD2 4.23Å; G55-L57 VanDerWaalsContact C-N 3.29Å; G55-L57 PolarHBondContact O-N 2.85Å; L57-K80 HydrophobicContact CB-CB 3.78Å; L57-K80 HydrophobicContact CD2-CB 4.35Å; L57-I81 WeakPolarHBondContact CA-O 3.46Å; L57-A82 HydrophobicContact CD1-CB 3.94Å; L57-A82 HydrophobicContact CG-CB 4.08Å; L57-C127 HydrophobicContact CD2-CB 3.44Å; L57-C127 VanDerWaalsContact CD2-CB 3.44Å
58	Q	89.3	Confident	75.6	Confident	134 Å²	134	86.5 Å²	86.5	63%	0.626	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	157.2	179.9	-61.4	-175.8	-6.6	0	0	111.1	V56 G60 K80 I81	V56-Q58 PolarHBondContact O-N 3.08Å; Q58-G60 PolarHBondContact O-N 2.79Å; Q58-K80 CarbonylContact O-C 3.59Å; Q58-K80 WeakPolarHBondContact O-CA 3.22Å; Q58-I81 PolarHBondContact N-O 3.41Å; Q58-I81 PolarHBondContact O-N 2.67Å
59	D	86.8	Confident	72.8	Confident	99 Å²	99	92.4 Å²	92.4	53%	0.529	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	132.2	177.8	-68.9	-14.9	0	0	0	111.6	Q61	D59-Q61 PolarHBondContact O-N 2.84Å
60	G	78.5	Confident	70.2	Confident	13 Å²	13	91.9 Å²	91.9	13%	0.134	56%	0.558	C	S	.	*			trans	-57.6	133.4	-177.3	0	0	0	0	0	113.2	Q58 D79	Q58-G60 PolarHBondContact O-N 2.79Å; G60-D79 PolarHBondContact N-O 2.68Å
61	Q	76.1	Confident	67.8	Low	138 Å²	138	91.5 Å²	91.5	65%	0.645	56%	0.558	S	S	*	*			trans	-107.6	153.6	178.8	-60.5	-173.1	3.6	0	0	111.5	D59 R77	D59-Q61 PolarHBondContact O-N 2.84Å; Q61-R77 PolarHBondContact O-NH1 3.06Å
62	L	66.6	Low	65.7	Low	94 Å²	94	93.1 Å²	93.1	49%	0.492	57%	0.572	S	S	.	*			trans	-87.9	144.4	172.3	-65.1	171.6	0	0	0	110.1	I76	L62-I76 HydrophobicContact CD1-CD1 3.71Å; L62-I76 HydrophobicContact CD1-CG2 4.16Å; L62-I76 HydrophobicContact CD2-CG2 3.98Å
63	A	55.9	Low	64	Low	99 Å²	99	98.5 Å²	98.5	82%	0.818	60%	0.595	S	S	*	*	S	Bend	trans	-84.1	117.9	174.4	0	0	0	0	0	110.3
64	G	47.9	Very low	62.2	Low	59 Å²	59	103.7 Å²	103.7	61%	0.608	60%	0.601	S	S	*	*	S	Bend	trans	135	154.3	176.1	0	0	0	0	0	113.1	D66	G64-D66 PolarHBondContact O-N 2.76Å
65	P	34.8	Very low	60.8	Low	136 Å²	136	105.9 Å²	105.9	88%	0.883	61%	0.608	S	S	*	*			trans	-80.1	99	175.9	31.4	-28.6	0	0	0	109.4
66	D	44.4	Very low	60	Low	117 Å²	117	105.2 Å²	105.2	63%	0.626	59%	0.59	S	S	*	*			trans	-151.1	114.2	167	-139.4	6.3	0	0	0	106.1	G64 S68	G64-D66 PolarHBondContact O-N 2.76Å; D66-S68 WeakPolarHBondContact CB-OG 3.44Å; D66-S68 VanDerWaalsContact CG-CB 3.41Å; D66-S68 VanDerWaalsContact CG-N 3.33Å; D66-S68 PolarHBondContact OD1-N 2.85Å; D66-S68 WeakPolarHBondContact OD2-CB 3.47Å; D66-S68 PolarHBondContact OD2-OG 2.88Å
67	R	39.3	Very low	59.6	Low	257 Å²	257	102.6 Å²	102.6	97%	0.97	57%	0.572	S	S	*	*			cis	54.3	4.2	30.3	-63.4	-152.5	-167.2	-166	6.8	115.8	C69	R67-C69 PolarHBondContact O-N 3.04Å
68	S	39.6	Very low	59.3	Low	75 Å²	75	102.9 Å²	102.9	52%	0.524	58%	0.578	S	S	.	*			trans	-82	104.8	164.8	32.2	0	0	0	0	110.7	D66 G70	D66-S68 WeakPolarHBondContact CB-OG 3.44Å; D66-S68 VanDerWaalsContact CG-CB 3.41Å; D66-S68 VanDerWaalsContact CG-N 3.33Å; D66-S68 PolarHBondContact OD1-N 2.85Å; D66-S68 WeakPolarHBondContact OD2-CB 3.47Å; D66-S68 PolarHBondContact OD2-OG 2.88Å; S68-G70 PolarHBondContact O-N 3.48Å
69	C	38.4	Very low	59.3	Low	123 Å²	123	96.6 Å²	96.6	83%	0.831	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-6.8	112.5	152.2	-147.4	0	0	0	0	116.1	R67 I71	R67-C69 PolarHBondContact O-N 3.04Å; C69-I71 PolarHBondContact O-N 2.86Å
70	G	40.7	Very low	59.5	Low	85 Å²	85	95.3 Å²	95.3	88%	0.876	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	-13.8	144	0	0	0	0	0	120.1	S68 S72	S68-G70 PolarHBondContact O-N 3.48Å; G70-S72 PolarHBondContact O-N 3.18Å
71	I	44.6	Very low	60.3	Low	116 Å²	116	95.5 Å²	95.5	60%	0.595	54%	0.536	S	S	*	.			trans	-85.7	115.3	175.5	-56.2	175.2	0	0	0	108.7	C69 K73 N75 I76	C69-I71 PolarHBondContact O-N 2.86Å; I71-K73 PolarHBondContact O-N 3.28Å; I71-N75 HydrophobicContact CG2-CB 4.26Å; I71-I76 HydrophobicContact CG2-CD1 4.45Å; I71-I76 HydrophobicContact CG2-CG1 4.41Å
72	S	48.9	Very low	61.2	Low	62 Å²	62	89.3 Å²	89.3	43%	0.434	51%	0.508	S	S	.	.			trans	-53.7	125.3	175.1	178.9	0	0	0	0	109.8	G70 R74 N75	G70-S72 PolarHBondContact O-N 3.18Å; S72-R74 PolarHBondContact O-N 2.84Å; S72-N75 WeakPolarHBondContact O-CB 3.31Å; S72-N75 PolarHBondContact O-N 2.84Å
73	K	57.3	Low	62.5	Low	160 Å²	160	91.1 Å²	91.1	70%	0.696	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-52.8	-27.8	180	-66.1	-179.9	178.4	-179.6	0	112.9	I71 N75 I76 R77	I71-K73 PolarHBondContact O-N 3.28Å; K73-N75 PolarHBondContact O-N 3.13Å; K73-I76 PolarHBondContact O-N 3.32Å; K73-R77 PolarHBondContact O-N 2.98Å
74	R	57.2	Low	64.2	Low	195 Å²	195	86.7 Å²	86.7	74%	0.736	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-65.8	-19.6	175.2	-67	-176.3	177.7	170	0.1	114.2	S72 I76	S72-R74 PolarHBondContact O-N 2.84Å; R74-I76 VanDerWaalsContact C-N 3.35Å
75	N	62.5	Low	66.2	Low	112 Å²	112	85.5 Å²	85.5	60%	0.599	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-81.7	-16.9	178.7	-66.3	-1.2	0	0	0	112.4	I71 S72 K73 V136	I71-N75 HydrophobicContact CG2-CB 4.26Å; S72-N75 WeakPolarHBondContact O-CB 3.31Å; S72-N75 PolarHBondContact O-N 2.84Å; K73-N75 PolarHBondContact O-N 3.13Å; N75-V136 WeakPolarHBondContact O-CG1 3.12Å
76	I	72.1	Confident	68.6	Low	45 Å²	45	79.2 Å²	79.2	23%	0.231	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-47.9	-177.6	-59.2	174.2	0	0	0	110.1	L62 I71 K73 R74 Y135 V136	L62-I76 HydrophobicContact CD1-CD1 3.71Å; L62-I76 HydrophobicContact CD1-CG2 4.16Å; L62-I76 HydrophobicContact CD2-CG2 3.98Å; I71-I76 HydrophobicContact CG2-CD1 4.45Å; I71-I76 HydrophobicContact CG2-CG1 4.41Å; K73-I76 PolarHBondContact O-N 3.32Å; R74-I76 VanDerWaalsContact C-N 3.35Å; I76-Y135 HydrophobicContact CG2-CE2 4.14Å; I76-Y135 WeakPolarHBondContact O-CA 3.34Å; I76-Y135 WeakPolarHBondContact O-CD2 3.27Å; I76-V136 HydrophobicContact CB-CG2 4.46Å; I76-V136 HydrophobicContact CG2-CG2 3.76Å; I76-V136 PolarHBondContact O-N 3.17Å; I76-V136 VanDerWaalsContact O-N 3.1Å
77	R	80.4	Confident	70.5	Confident	23 Å²	23	79.5 Å²	79.5	9%	0.087	42%	0.42	C	S	.	.	B	Isolated β-bridge	trans	-144	138.4	175.3	65.4	-173.4	-66.5	178.5	6.1	110.6	Q61 K73 D79 G134 Y135	Q61-R77 PolarHBondContact O-NH1 3.06Å; K73-R77 PolarHBondContact O-N 2.98Å; R77-D79 WeakPolarHBondContact CB-OD1 3.32Å; R77-D79 IonicContact CZ-OD1 3.35Å; R77-D79 IonicContact CZ-OD2 2.67Å; R77-D79 IonicContact NE-OD1 3.4Å; R77-D79 PolarHBondContact NE-OD1 2.81Å; R77-D79 IonicContact NE-OD2 3.9Å; R77-D79 VanDerWaalsContact NH2-CG 3.31Å; R77-D79 IonicContact NH2-OD1 3.18Å; R77-D79 PolarHBondContact NH2-OD1 3.35Å; R77-D79 IonicContact NH2-OD2 3.66Å; R77-D79 PolarHBondContact NH2-OD2 2.99Å; R77-G134 WeakPolarHBondContact CA-O 3.32Å; R77-Y135 HydrophobicContact CB-CD1 3.91Å; R77-Y135 HydrophobicContact CB-CD2 4.13Å; R77-Y135 HydrophobicContact CB-CE1 4.11Å; R77-Y135 HydrophobicContact CB-CE2 4.29Å; R77-Y135 HydrophobicContact CB-CG 3.94Å
78	G	83.3	Confident	72.8	Confident	19 Å²	19	70.5 Å²	70.5	20%	0.196	39%	0.389	C	S	.	.			trans	-109.5	12.5	-178	0	0	0	0	0	114.6	P129 G134	G78-P129 WeakPolarHBondContact O-CD 3.31Å; G78-G134 PolarHBondContact N-O 2.79Å
79	D	89.1	Confident	75	Confident	2 Å²	2	78.6 Å²	78.6	1%	0.011	41%	0.408	C	S	.	.			trans	-93.1	157.2	-176.3	66.5	-44.9	0	0	0	113.5	G60 R77 I81 C127 Y128	G60-D79 PolarHBondContact N-O 2.68Å; R77-D79 WeakPolarHBondContact CB-OD1 3.32Å; R77-D79 IonicContact CZ-OD1 3.35Å; R77-D79 IonicContact CZ-OD2 2.67Å; R77-D79 IonicContact NE-OD1 3.4Å; R77-D79 PolarHBondContact NE-OD1 2.81Å; R77-D79 IonicContact NE-OD2 3.9Å; R77-D79 VanDerWaalsContact NH2-CG 3.31Å; R77-D79 IonicContact NH2-OD1 3.18Å; R77-D79 PolarHBondContact NH2-OD1 3.35Å; R77-D79 IonicContact NH2-OD2 3.66Å; R77-D79 PolarHBondContact NH2-OD2 2.99Å; D79-I81 WeakPolarHBondContact OD2-CG2 3.46Å; D79-C127 CarbonylContact C-O 3.54Å; D79-C127 WeakPolarHBondContact CA-O 3.47Å; D79-Y128 HydrophobicContact CB-CD1 3.86Å; D79-Y128 HydrophobicContact CB-CD2 3.77Å; D79-Y128 HydrophobicContact CB-CE1 3.72Å; D79-Y128 HydrophobicContact CB-CE2 3.61Å; D79-Y128 HydrophobicContact CB-CG 3.87Å
80	K	92.7	Very high	77.2	Confident	72 Å²	72	74.5 Å²	74.5	31%	0.313	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.4	169.1	-52.3	-177.6	176.8	-177.5	0	109.3	L57 Q58 A126 C127	L57-K80 HydrophobicContact CB-CB 3.78Å; L57-K80 HydrophobicContact CD2-CB 4.35Å; Q58-K80 CarbonylContact O-C 3.59Å; Q58-K80 WeakPolarHBondContact O-CA 3.22Å; K80-A126 CarbonylContact O-C 3.41Å; K80-A126 WeakPolarHBondContact O-CA 3.33Å; K80-C127 PolarHBondContact N-O 3.3Å; K80-C127 PolarHBondContact O-N 2.85Å
81	I	94.5	Very high	79.6	Confident	16 Å²	16	70.7 Å²	70.7	8%	0.082	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	152.8	-174.9	68.6	176.2	0	0	0	113.1	L57 Q58 D79 M124 V125 A126	L57-I81 WeakPolarHBondContact CA-O 3.46Å; Q58-I81 PolarHBondContact N-O 3.41Å; Q58-I81 PolarHBondContact O-N 2.67Å; D79-I81 WeakPolarHBondContact OD2-CG2 3.46Å; I81-M124 HydrophobicContact CB-CG 3.99Å; I81-M124 HydrophobicContact CB-SD 4.33Å; I81-M124 HydrophobicContact CD1-CG 4.35Å; I81-M124 HydrophobicContact CD1-SD 3.99Å; I81-M124 HydrophobicContact CG2-CE 4.5Å; I81-M124 HydrophobicContact CG2-CG 4.08Å; I81-M124 HydrophobicContact CG2-SD 3.93Å; I81-V125 CarbonylContact C-O 3.48Å; I81-V125 WeakPolarHBondContact CA-O 3.12Å; I81-A126 HydrophobicContact CG2-CB 4.02Å
82	A	94.4	Very high	81.9	Confident	8 Å²	8	70.2 Å²	70.2	7%	0.066	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	144.6	165.8	0	0	0	0	0	109.8	V56 L57 V125	V56-A82 HydrophobicContact CG1-CB 4.17Å; L57-A82 HydrophobicContact CD1-CB 3.94Å; L57-A82 HydrophobicContact CG-CB 4.08Å; A82-V125 PolarHBondContact N-O 3.38Å; A82-V125 PolarHBondContact O-N 2.76Å
83	W	93.8	Very high	84	Confident	132 Å²	132	67.6 Å²	67.6	50%	0.5	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	116.5	177.1	-67.5	94.6	0	0	0	110.2	K122 A123 M124 W214	W83-K122 HydrophobicContact CE3-CB 3.97Å; W83-K122 WeakPolarHBondContact CZ3-O 3.43Å; W83-A123 CarbonylContact C-O 3.58Å; W83-A123 WeakPolarHBondContact CA-O 3.48Å; W83-M124 HydrophobicContact CD2-CB 4.44Å; W83-M124 HydrophobicContact CE3-CB 4.02Å; W83-M124 HydrophobicContact CH2-CB 4.09Å; W83-M124 HydrophobicContact CH2-CG 4.46Å; W83-M124 HydrophobicContact CH2-SD 4.48Å; W83-M124 HydrophobicContact CZ2-CB 4.46Å; W83-M124 HydrophobicContact CZ2-CG 4.37Å; W83-M124 HydrophobicContact CZ2-SD 4.3Å; W83-M124 HydrophobicContact CZ3-CB 3.85Å; W83-W214 HydrophobicContact CH2-CE3 4.26Å; W83-W214 HydrophobicContact CH2-CH2 4.26Å; W83-W214 AromaticContact CH2-CZ3 3.51Å; W83-W214 HydrophobicContact CH2-CZ3 3.51Å; W83-W214 HydrophobicContact CZ3-CE3 4.35Å; W83-W214 AromaticContact CZ3-CZ3 3.76Å; W83-W214 HydrophobicContact CZ3-CZ3 3.76Å
84	V	92.9	Very high	85.8	Confident	6 Å²	6	60 Å²	60	4%	0.036	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131.4	-175.1	-178.7	0	0	0	0	109.3	L51 E88 C91 I94 K122 A123 V125	L51-V84 HydrophobicContact CD1-CG2 3.86Å; V84-E88 WeakPolarHBondContact CG1-OE2 3.47Å; V84-C91 HydrophobicContact CG1-CB 3.91Å; V84-I94 HydrophobicContact CG1-CD1 4.5Å; V84-I94 HydrophobicContact CG1-CG2 4.3Å; V84-K122 WeakPolarHBondContact O-CB 3.37Å; V84-A123 HydrophobicContact CB-CB 4.48Å; V84-A123 PolarHBondContact N-O 3.1Å; V84-A123 WeakPolarHBondContact O-CB 3.41Å; V84-A123 PolarHBondContact O-N 2.92Å; V84-V125 HydrophobicContact CB-CG2 4.39Å; V84-V125 HydrophobicContact CG2-CG2 3.78Å
85	S	89.5	Confident	87.6	Confident	35 Å²	35	53.4 Å²	53.4	25%	0.245	27%	0.27	C	S	.	.			trans	-87.5	-19.5	176.1	58.3	0	0	0	0	113.2	V87 E88	S85-V87 VanDerWaalsContact OG-CG2 3.3Å; S85-V87 WeakPolarHBondContact OG-CG2 3.19Å; S85-E88 WeakPolarHBondContact CB-OE1 3.49Å; S85-E88 PolarHBondContact N-OE1 3.43Å; S85-E88 PolarHBondContact N-OE2 3.23Å; S85-E88 VanDerWaalsContact N-OE2 3.15Å; S85-E88 PolarHBondContact OG-OE1 3.1Å; S85-E88 PolarHBondContact OG-OE2 2.95Å; S85-E88 VanDerWaalsContact OG-OE2 3.07Å
86	G	84.4	Confident	89.1	Confident	4 Å²	4	52.1 Å²	52.1	4%	0.041	26%	0.262	C	S	.	.	S	Bend	trans	88.2	4.3	-178.1	0	0	0	0	0	112.9	E88 N95	G86-E88 WeakPolarHBondContact CA-OE2 3.42Å; G86-E88 PolarHBondContact N-OE2 3.16Å; G86-N95 VanDerWaalsContact O-CB 3.23Å; G86-N95 WeakPolarHBondContact O-CB 3.1Å; G86-N95 PolarHBondContact O-ND2 3.13Å
87	V	86.1	Confident	90.2	Very high	123 Å²	123	50 Å²	50	75%	0.745	25%	0.251	S	S	*	.			trans	-105.8	-4.7	174.8	-60.7	0	0	0	0	112.3	S85	S85-V87 VanDerWaalsContact OG-CG2 3.3Å; S85-V87 WeakPolarHBondContact OG-CG2 3.19Å
88	E	87.3	Confident	91	Very high	68 Å²	68	48.9 Å²	48.9	32%	0.318	25%	0.247	S	C	.	.	S	Bend	trans	-66.7	146.5	174.9	-57.8	86.6	170.6	0	0	110.7	V84 S85 G86 G90 C91	V84-E88 WeakPolarHBondContact CG1-OE2 3.47Å; S85-E88 WeakPolarHBondContact CB-OE1 3.49Å; S85-E88 PolarHBondContact N-OE1 3.43Å; S85-E88 PolarHBondContact N-OE2 3.23Å; S85-E88 VanDerWaalsContact N-OE2 3.15Å; S85-E88 PolarHBondContact OG-OE1 3.1Å; S85-E88 PolarHBondContact OG-OE2 2.95Å; S85-E88 VanDerWaalsContact OG-OE2 3.07Å; G86-E88 WeakPolarHBondContact CA-OE2 3.42Å; G86-E88 PolarHBondContact N-OE2 3.16Å; E88-G90 PolarHBondContact O-N 3.42Å; E88-C91 HydrophobicContact CB-CB 4.3Å; E88-C91 WeakPolarHBondContact O-CB 3.14Å; E88-C91 PolarHBondContact O-N 3.37Å; E88-C91 VanDerWaalsContact O-N 3.16Å
89	R	84.8	Confident	91.5	Very high	244 Å²	244	50.9 Å²	50.9	92%	0.921	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	133.5	173.6	-81.4	-169.9	-101.5	-162.7	-5.3	109.9	C91	R89-C91 VanDerWaalsContact C-N 3.33Å
90	G	84.8	Confident	91.7	Very high	38 Å²	38	52.2 Å²	52.2	39%	0.392	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	10.4	-178.1	0	0	0	0	0	114.2	Q47 E88 E92	Q47-G90 WeakPolarHBondContact CG-O 3.44Å; Q47-G90 PolarHBondContact NE2-O 3.24Å; Q47-G90 PolarHBondContact OE1-O 2.99Å; E88-G90 PolarHBondContact O-N 3.42Å; G90-E92 WeakPolarHBondContact CA-OE2 3.38Å; G90-E92 PolarHBondContact N-OE1 2.87Å; G90-E92 PolarHBondContact N-OE2 2.96Å
91	C	91	Very high	91.8	Very high	4 Å²	4	49 Å²	49	3%	0.027	25%	0.249	C	C	.	.			trans	-115	20.7	175.4	-66.3	0	0	0	0	112.8	Q47 V84 E88 R89 A93 I94 N95	Q47-C91 VanDerWaalsContact OE1-CA 3.24Å; V84-C91 HydrophobicContact CG1-CB 3.91Å; E88-C91 HydrophobicContact CB-CB 4.3Å; E88-C91 WeakPolarHBondContact O-CB 3.14Å; E88-C91 PolarHBondContact O-N 3.37Å; E88-C91 VanDerWaalsContact O-N 3.16Å; R89-C91 VanDerWaalsContact C-N 3.33Å; C91-A93 PolarHBondContact O-N 3.41Å; C91-I94 HydrophobicContact CB-CB 4.48Å; C91-I94 HydrophobicContact CB-CD1 4.46Å; C91-I94 PolarHBondContact O-N 3.48Å; C91-N95 PolarHBondContact O-N 3.36Å
92	E	93.5	Very high	91.8	Very high	106 Å²	106	50.2 Å²	50.2	50%	0.495	26%	0.256	S	S	.	.	H	α-helix	trans	-63.8	-39.7	-175.8	-58.3	77.8	-170.7	0	0	112.9	Q47 G90 N95 I96	Q47-E92 VanDerWaalsContact NE2-N 3.19Å; Q47-E92 PolarHBondContact NE2-OE2 3.33Å; Q47-E92 VanDerWaalsContact NE2-OE2 3.08Å; G90-E92 WeakPolarHBondContact CA-OE2 3.38Å; G90-E92 PolarHBondContact N-OE1 2.87Å; G90-E92 PolarHBondContact N-OE2 2.96Å; E92-N95 VanDerWaalsContact O-CB 3.31Å; E92-N95 WeakPolarHBondContact O-CB 3.24Å; E92-N95 PolarHBondContact O-N 3.1Å; E92-I96 WeakPolarHBondContact O-CG1 3.45Å; E92-I96 PolarHBondContact O-N 3.24Å; E92-I96 VanDerWaalsContact O-N 3.07Å
93	A	93.7	Very high	91.7	Very high	8 Å²	8	52.7 Å²	52.7	7%	0.066	27%	0.265	C	S	.	.	H	α-helix	trans	-70.4	-38.2	176.5	0	0	0	0	0	111.2	F43 V44 Q47 C91 N95 I96 L97	F43-A93 HydrophobicContact CB-CB 3.76Å; V44-A93 HydrophobicContact CG2-CB 3.85Å; Q47-A93 HydrophobicContact CG-CB 4.46Å; C91-A93 PolarHBondContact O-N 3.41Å; A93-N95 VanDerWaalsContact C-N 3.27Å; A93-N95 PolarHBondContact O-N 2.96Å; A93-I96 PolarHBondContact O-N 3.43Å; A93-L97 PolarHBondContact O-N 3.21Å
94	I	94.6	Very high	91.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-40.5	171.1	-63.3	169.6	0	0	0	110	V44 Q47 V48 L51 V84 C91 I96 L97 L98 V125	V44-I94 HydrophobicContact CG1-CG1 4.15Å; Q47-I94 HydrophobicContact CB-CD1 4.19Å; Q47-I94 HydrophobicContact CB-CG1 4.41Å; Q47-I94 VanDerWaalsContact OE1-N 3.08Å; V48-I94 HydrophobicContact CG2-CD1 4.15Å; L51-I94 HydrophobicContact CD1-CD1 4.01Å; V84-I94 HydrophobicContact CG1-CD1 4.5Å; V84-I94 HydrophobicContact CG1-CG2 4.3Å; C91-I94 HydrophobicContact CB-CB 4.48Å; C91-I94 HydrophobicContact CB-CD1 4.46Å; C91-I94 PolarHBondContact O-N 3.48Å; I94-I96 PolarHBondContact O-N 2.74Å; I94-L97 WeakPolarHBondContact O-CB 3.49Å; I94-L97 PolarHBondContact O-N 2.98Å; I94-L98 HydrophobicContact CG2-CD1 4.08Å; I94-L98 HydrophobicContact CG2-CG 4.32Å; I94-L98 VanDerWaalsContact O-CG 3.24Å; I94-L98 WeakPolarHBondContact O-CG 3.42Å; I94-L98 PolarHBondContact O-N 2.79Å; I94-V125 HydrophobicContact CD1-CG2 4.44Å
95	N	95.1	Very high	91.6	Very high	56 Å²	56	46.4 Å²	46.4	30%	0.299	24%	0.241	S	C	.	.	H	α-helix	trans	-60.3	-43.5	175.5	-170.1	-87.7	0	0	0	112.8	G86 C91 E92 A93 L98 T99	G86-N95 VanDerWaalsContact O-CB 3.23Å; G86-N95 WeakPolarHBondContact O-CB 3.1Å; G86-N95 PolarHBondContact O-ND2 3.13Å; C91-N95 PolarHBondContact O-N 3.36Å; E92-N95 VanDerWaalsContact O-CB 3.31Å; E92-N95 WeakPolarHBondContact O-CB 3.24Å; E92-N95 PolarHBondContact O-N 3.1Å; A93-N95 VanDerWaalsContact C-N 3.27Å; A93-N95 PolarHBondContact O-N 2.96Å; N95-L98 PolarHBondContact O-N 2.83Å; N95-T99 WeakPolarHBondContact O-CB 3.31Å; N95-T99 PolarHBondContact O-N 2.92Å; N95-T99 PolarHBondContact O-OG1 2.97Å
96	I	94	Very high	91.7	Very high	85 Å²	85	49 Å²	49	44%	0.436	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-47.9	177.1	-68.4	166.5	0	0	0	110.1	V40 E92 A93 I94 L98 T99 L100	V40-I96 HydrophobicContact CG1-CG2 4.42Å; E92-I96 WeakPolarHBondContact O-CG1 3.45Å; E92-I96 PolarHBondContact O-N 3.24Å; E92-I96 VanDerWaalsContact O-N 3.07Å; A93-I96 PolarHBondContact O-N 3.43Å; I94-I96 PolarHBondContact O-N 2.74Å; I96-L98 PolarHBondContact O-N 3.25Å; I96-T99 PolarHBondContact O-N 2.96Å; I96-L100 HydrophobicContact CG2-CD1 4.03Å; I96-L100 WeakPolarHBondContact O-CG 3.25Å; I96-L100 PolarHBondContact O-N 2.86Å
97	L	95.4	Very high	92	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-53.6	-52.1	174.4	167.3	63.4	0	0	0	111	F35 L36 V44 A93 I94 T99 L100 I101 Y153 V211	F35-L97 HydrophobicContact CD1-CD1 4.33Å; F35-L97 HydrophobicContact CE1-CD1 4.15Å; L36-L97 HydrophobicContact CD1-CB 4.14Å; L36-L97 HydrophobicContact CD1-CD1 3.98Å; L36-L97 HydrophobicContact CD2-CD1 4.24Å; L36-L97 HydrophobicContact CG-CD1 4.34Å; V44-L97 HydrophobicContact CG1-CD2 4.13Å; V44-L97 HydrophobicContact CG2-CB 4.4Å; A93-L97 PolarHBondContact O-N 3.21Å; I94-L97 WeakPolarHBondContact O-CB 3.49Å; I94-L97 PolarHBondContact O-N 2.98Å; L97-T99 VanDerWaalsContact C-N 3.32Å; L97-T99 PolarHBondContact O-N 3.41Å; L97-L100 PolarHBondContact O-N 3.36Å; L97-I101 HydrophobicContact CD1-CD1 3.6Å; L97-I101 HydrophobicContact CD1-CG1 3.98Å; L97-I101 HydrophobicContact CG-CD1 3.89Å; L97-I101 WeakPolarHBondContact O-CG1 3.45Å; L97-I101 PolarHBondContact O-N 2.82Å; L97-Y153 HydrophobicContact CD1-CD1 4.09Å; L97-Y153 HydrophobicContact CD1-CD2 3.94Å; L97-Y153 HydrophobicContact CD1-CE1 4.43Å; L97-Y153 HydrophobicContact CD1-CE2 4.31Å; L97-Y153 HydrophobicContact CD1-CG 3.81Å; L97-Y153 HydrophobicContact CD2-CD1 3.45Å; L97-Y153 VanDerWaalsContact CD2-CD1 3.45Å; L97-Y153 HydrophobicContact CD2-CE1 4.06Å; L97-Y153 HydrophobicContact CD2-CG 3.81Å; L97-Y153 HydrophobicContact CG-CD1 4.42Å; L97-Y153 HydrophobicContact CG-CG 4.48Å; L97-V211 HydrophobicContact CD2-CB 4.37Å; L97-V211 HydrophobicContact CD2-CG1 4.34Å
98	L	95.6	Very high	92.1	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-41.7	-179.2	-67.5	175.3	0	0	0	112.3	I94 N95 I96 L100 I101 D102 A123 V213	I94-L98 HydrophobicContact CG2-CD1 4.08Å; I94-L98 HydrophobicContact CG2-CG 4.32Å; I94-L98 VanDerWaalsContact O-CG 3.24Å; I94-L98 WeakPolarHBondContact O-CG 3.42Å; I94-L98 PolarHBondContact O-N 2.79Å; N95-L98 PolarHBondContact O-N 2.83Å; I96-L98 PolarHBondContact O-N 3.25Å; L98-L100 VanDerWaalsContact C-N 3.32Å; L98-L100 PolarHBondContact O-N 2.88Å; L98-I101 PolarHBondContact O-N 2.89Å; L98-D102 WeakPolarHBondContact O-CB 3.36Å; L98-D102 PolarHBondContact O-N 2.62Å; L98-A123 HydrophobicContact CD1-CB 4.03Å; L98-A123 HydrophobicContact CD2-CB 3.92Å; L98-A123 HydrophobicContact CG-CB 4.47Å; L98-V213 HydrophobicContact CD2-CG1 3.44Å; L98-V213 VanDerWaalsContact CD2-CG1 3.44Å
99	T	94.5	Very high	92	Very high	61 Å²	61	46 Å²	46	37%	0.374	23%	0.234	S	C	.	.	H	α-helix	trans	-61.9	-40.7	177.7	-59.8	0	0	0	0	111.7	N95 I96 L97 D102 K103	N95-T99 WeakPolarHBondContact O-CB 3.31Å; N95-T99 PolarHBondContact O-N 2.92Å; N95-T99 PolarHBondContact O-OG1 2.97Å; I96-T99 PolarHBondContact O-N 2.96Å; L97-T99 VanDerWaalsContact C-N 3.32Å; L97-T99 PolarHBondContact O-N 3.41Å; T99-D102 PolarHBondContact O-N 2.67Å; T99-K103 WeakPolarHBondContact O-CG 3.35Å; T99-K103 PolarHBondContact O-N 2.93Å
100	L	94.1	Very high	91.8	Very high	29 Å²	29	37.1 Å²	37.1	15%	0.152	22%	0.218	C	C	.	.	H	α-helix	trans	-70.5	-40.8	178.7	-69.3	170.6	0	0	0	112.1	L8 L12 F35 L36 I96 L97 L98 D102 K103 L104	L8-L100 HydrophobicContact CD2-CD2 4.11Å; L12-L100 HydrophobicContact CD1-CD2 4.06Å; F35-L100 HydrophobicContact CE1-CB 4.12Å; F35-L100 HydrophobicContact CZ-CB 3.94Å; L36-L100 HydrophobicContact CD2-CD1 3.44Å; L36-L100 VanDerWaalsContact CD2-CD1 3.44Å; I96-L100 HydrophobicContact CG2-CD1 4.03Å; I96-L100 WeakPolarHBondContact O-CG 3.25Å; I96-L100 PolarHBondContact O-N 2.86Å; L97-L100 PolarHBondContact O-N 3.36Å; L98-L100 VanDerWaalsContact C-N 3.32Å; L98-L100 PolarHBondContact O-N 2.88Å; L100-D102 VanDerWaalsContact C-N 3.33Å; L100-K103 PolarHBondContact O-N 3.35Å; L100-L104 WeakPolarHBondContact O-CB 3.41Å; L100-L104 PolarHBondContact O-N 3.45Å
101	I	94.7	Very high	91.8	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-63.3	-42.1	173.5	-58	168	0	0	0	110	F35 L97 L98 K103 L104 V105 C151 L188 F190 V213 Y215	F35-I101 HydrophobicContact CE1-CG1 4.28Å; L97-I101 HydrophobicContact CD1-CD1 3.6Å; L97-I101 HydrophobicContact CD1-CG1 3.98Å; L97-I101 HydrophobicContact CG-CD1 3.89Å; L97-I101 WeakPolarHBondContact O-CG1 3.45Å; L97-I101 PolarHBondContact O-N 2.82Å; L98-I101 PolarHBondContact O-N 2.89Å; I101-K103 VanDerWaalsContact C-N 3.34Å; I101-K103 PolarHBondContact O-N 3.26Å; I101-L104 WeakPolarHBondContact O-CB 3.46Å; I101-L104 PolarHBondContact O-N 3.09Å; I101-V105 HydrophobicContact CG2-CG2 4.31Å; I101-V105 WeakPolarHBondContact O-CG2 3.32Å; I101-V105 PolarHBondContact O-N 3.03Å; I101-C151 HydrophobicContact CG2-CB 4.29Å; I101-C151 VanDerWaalsContact CG2-SG 3.58Å; I101-L188 HydrophobicContact CD1-CD1 3.84Å; I101-L188 HydrophobicContact CG1-CD1 4.04Å; I101-L188 HydrophobicContact CG1-CD2 4.21Å; I101-F190 HydrophobicContact CG2-CE1 4.24Å; I101-F190 HydrophobicContact CG2-CZ 4.23Å; I101-V213 HydrophobicContact CG2-CG2 4.43Å; I101-Y215 HydrophobicContact CG2-CE2 3.86Å; I101-Y215 WeakPolarHBondContact CG2-OH 3.48Å
102	D	94.1	Very high	91.4	Very high	43 Å²	43	43.3 Å²	43.3	23%	0.23	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-42.3	178	-73.6	-24	0	0	0	112.1	L98 T99 L100 T106 R120 Y215	L98-D102 WeakPolarHBondContact O-CB 3.36Å; L98-D102 PolarHBondContact O-N 2.62Å; T99-D102 PolarHBondContact O-N 2.67Å; L100-D102 VanDerWaalsContact C-N 3.33Å; D102-T106 WeakPolarHBondContact O-CB 3.44Å; D102-T106 PolarHBondContact O-N 3.45Å; D102-T106 PolarHBondContact O-OG1 3.12Å; D102-R120 WeakPolarHBondContact OD1-CD 3.4Å; D102-R120 IonicContact OD1-CZ 3.99Å; D102-R120 IonicContact OD1-NE 2.93Å; D102-R120 PolarHBondContact OD1-NE 2.89Å; D102-R120 IonicContact OD2-CZ 3.22Å; D102-R120 VanDerWaalsContact OD2-CZ 3.3Å; D102-R120 IonicContact OD2-NE 3.09Å; D102-R120 PolarHBondContact OD2-NE 2.86Å; D102-R120 IonicContact OD2-NH2 2.67Å; D102-R120 PolarHBondContact OD2-NH2 3.41Å; D102-Y215 PolarHBondContact N-OH 3.45Å; D102-Y215 WeakPolarHBondContact OD1-CE1 3.16Å; D102-Y215 PolarHBondContact OD1-OH 2.82Å
103	K	92.8	Very high	90.6	Very high	60 Å²	60	40.6 Å²	40.6	26%	0.261	23%	0.23	S	C	.	.	H	α-helix	trans	-60.6	-48.7	172.3	-76.6	-179.4	165.8	-155.8	0	111.7	D9 L12 T99 L100 I101 V105 T106 H107	D9-K103 IonicContact OD1-NZ 3.37Å; D9-K103 PolarHBondContact OD1-NZ 2.94Å; D9-K103 IonicContact OD2-NZ 3.2Å; L12-K103 HydrophobicContact CD1-CB 4.43Å; T99-K103 WeakPolarHBondContact O-CG 3.35Å; T99-K103 PolarHBondContact O-N 2.93Å; L100-K103 PolarHBondContact O-N 3.35Å; I101-K103 VanDerWaalsContact C-N 3.34Å; I101-K103 PolarHBondContact O-N 3.26Å; K103-V105 PolarHBondContact O-N 3.15Å; K103-T106 VanDerWaalsContact O-CB 3.3Å; K103-T106 WeakPolarHBondContact O-CB 3.41Å; K103-T106 PolarHBondContact O-N 3.29Å; K103-T106 VanDerWaalsContact O-N 3.1Å; K103-H107 PolarHBondContact O-CD2 2.79Å; K103-H107 PolarHBondContact O-N 2.89Å; K103-H107 VanDerWaalsContact O-N 3.13Å
104	L	92.4	Very high	89.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.5	-46.2	-179.2	-166.4	70.4	0	0	0	111.7	L12 L15 A16 I20 F35 L100 I101 T106 H107 C108 L188 F190	L12-L104 HydrophobicContact CB-CD1 4.14Å; L12-L104 HydrophobicContact CD2-CD1 3.93Å; L12-L104 VanDerWaalsContact O-CD1 3.25Å; L12-L104 WeakPolarHBondContact O-CD1 3.4Å; L15-L104 HydrophobicContact CB-CD1 4.26Å; L15-L104 HydrophobicContact CD2-CD1 4.01Å; L15-L104 HydrophobicContact CD2-CD2 4.42Å; L15-L104 HydrophobicContact CG-CD1 4.15Å; A16-L104 HydrophobicContact CB-CD1 3.97Å; A16-L104 HydrophobicContact CB-CG 4.49Å; I20-L104 HydrophobicContact CD1-CD1 3.95Å; I20-L104 HydrophobicContact CD1-CD2 3.31Å; I20-L104 HydrophobicContact CD1-CG 3.67Å; F35-L104 HydrophobicContact CE2-CD2 4.23Å; L100-L104 WeakPolarHBondContact O-CB 3.41Å; L100-L104 PolarHBondContact O-N 3.45Å; I101-L104 WeakPolarHBondContact O-CB 3.46Å; I101-L104 PolarHBondContact O-N 3.09Å; L104-T106 VanDerWaalsContact C-N 3.3Å; L104-T106 PolarHBondContact O-N 3.42Å; L104-H107 PolarHBondContact O-N 3.39Å; L104-C108 PolarHBondContact O-N 2.99Å; L104-C108 PolarHBondContact O-SG 2.99Å; L104-C108 VanDerWaalsContact O-SG 3.35Å; L104-L188 HydrophobicContact CD2-CD2 4.14Å; L104-F190 HydrophobicContact CD2-CE2 3.78Å; L104-F190 HydrophobicContact CD2-CZ 3.58Å
105	V	91.6	Very high	88.9	Confident	6 Å²	6	51.3 Å²	51.3	4%	0.036	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-35.2	176.4	174	0	0	0	0	111.4	I101 K103 H107 C108 I109 I117 F190 Y215	I101-V105 HydrophobicContact CG2-CG2 4.31Å; I101-V105 WeakPolarHBondContact O-CG2 3.32Å; I101-V105 PolarHBondContact O-N 3.03Å; K103-V105 PolarHBondContact O-N 3.15Å; V105-H107 VanDerWaalsContact C-N 3.29Å; V105-H107 PolarHBondContact O-N 3.14Å; V105-C108 WeakPolarHBondContact O-CA 3.22Å; V105-C108 WeakPolarHBondContact O-CB 3.49Å; V105-C108 PolarHBondContact O-N 3.47Å; V105-I109 WeakPolarHBondContact O-CG1 3.48Å; V105-I109 PolarHBondContact O-N 2.83Å; V105-I109 VanDerWaalsContact O-N 3.16Å; V105-I117 HydrophobicContact CG1-CD1 4Å; V105-I117 HydrophobicContact CG1-CG2 4.11Å; V105-F190 HydrophobicContact CG2-CE1 4Å; V105-Y215 HydrophobicContact CB-CD1 4.29Å; V105-Y215 HydrophobicContact CB-CE1 3.93Å; V105-Y215 HydrophobicContact CB-CE2 4.38Å; V105-Y215 HydrophobicContact CG1-CD1 3.72Å; V105-Y215 HydrophobicContact CG1-CD2 4.47Å; V105-Y215 HydrophobicContact CG1-CE1 3.85Å; V105-Y215 HydrophobicContact CG1-CG 4.06Å; V105-Y215 HydrophobicContact CG2-CD1 4.4Å; V105-Y215 HydrophobicContact CG2-CD2 3.99Å; V105-Y215 HydrophobicContact CG2-CE1 4.04Å; V105-Y215 HydrophobicContact CG2-CE2 3.58Å; V105-Y215 HydrophobicContact CG2-CG 4.39Å
106	T	91.2	Very high	88.4	Confident	88 Å²	88	51.7 Å²	51.7	54%	0.54	28%	0.28	S	S	.	.	H	α-helix	trans	-58.4	-40.8	175	-60.2	0	0	0	0	111.7	D102 K103 L104 C108 I109	D102-T106 WeakPolarHBondContact O-CB 3.44Å; D102-T106 PolarHBondContact O-N 3.45Å; D102-T106 PolarHBondContact O-OG1 3.12Å; K103-T106 VanDerWaalsContact O-CB 3.3Å; K103-T106 WeakPolarHBondContact O-CB 3.41Å; K103-T106 PolarHBondContact O-N 3.29Å; K103-T106 VanDerWaalsContact O-N 3.1Å; L104-T106 VanDerWaalsContact C-N 3.3Å; L104-T106 PolarHBondContact O-N 3.42Å; T106-C108 VanDerWaalsContact C-N 3.27Å; T106-C108 PolarHBondContact O-N 3.38Å; T106-I109 HydrophobicContact CG2-CD1 4.47Å; T106-I109 WeakPolarHBondContact O-CB 3.45Å; T106-I109 PolarHBondContact O-N 3.3Å
107	H	90.9	Very high	88.1	Confident	55 Å²	55	48.3 Å²	48.3	26%	0.255	26%	0.262	S	S	.	.	H	α-helix	trans	-67.3	-27.2	174.7	-66	-69	0	0	0	113.1	A16 L17 K103 L104 V105	A16-H107 HydrophobicContact CB-CB 3.58Å; L17-H107 WeakPolarHBondContact CD2-O 3.48Å; K103-H107 PolarHBondContact O-CD2 2.79Å; K103-H107 PolarHBondContact O-N 2.89Å; K103-H107 VanDerWaalsContact O-N 3.13Å; L104-H107 PolarHBondContact O-N 3.39Å; V105-H107 VanDerWaalsContact C-N 3.29Å; V105-H107 PolarHBondContact O-N 3.14Å
108	C	87.9	Confident	87.6	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.02	30%	0.3	C	S	.	.	H	α-helix	trans	-78.1	-16.2	175.5	-61	0	0	0	0	113.8	A16 V21 L104 V105 T106 G110 R111 L112	A16-C108 VanDerWaalsContact CB-SG 3.6Å; V21-C108 HydrophobicContact CG2-CB 3.99Å; L104-C108 PolarHBondContact O-N 2.99Å; L104-C108 PolarHBondContact O-SG 2.99Å; L104-C108 VanDerWaalsContact O-SG 3.35Å; V105-C108 WeakPolarHBondContact O-CA 3.22Å; V105-C108 WeakPolarHBondContact O-CB 3.49Å; V105-C108 PolarHBondContact O-N 3.47Å; T106-C108 VanDerWaalsContact C-N 3.27Å; T106-C108 PolarHBondContact O-N 3.38Å; C108-G110 PolarHBondContact O-N 3.35Å; C108-R111 PolarHBondContact O-N 3.45Å; C108-R111 VanDerWaalsContact O-N 3.09Å; C108-L112 HydrophobicContact CB-CD1 3.61Å; C108-L112 HydrophobicContact CB-CG 3.89Å; C108-L112 PolarHBondContact O-N 2.86Å
109	I	84.9	Confident	87.3	Confident	76 Å²	76	62 Å²	62	39%	0.39	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	134.8	-176.7	-67.6	175.1	0	0	0	110.4	V105 T106 R111 I117	V105-I109 WeakPolarHBondContact O-CG1 3.48Å; V105-I109 PolarHBondContact O-N 2.83Å; V105-I109 VanDerWaalsContact O-N 3.16Å; T106-I109 HydrophobicContact CG2-CD1 4.47Å; T106-I109 WeakPolarHBondContact O-CB 3.45Å; T106-I109 PolarHBondContact O-N 3.3Å; I109-R111 PolarHBondContact O-N 2.96Å; I109-I117 HydrophobicContact CG1-CB 4.39Å
110	G	81.3	Confident	87.3	Confident	56 Å²	56	62.3 Å²	62.3	58%	0.577	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	-4.7	-179.5	0	0	0	0	0	114.7	C108	C108-G110 PolarHBondContact O-N 3.35Å
111	R	85	Confident	87.3	Confident	164 Å²	164	61.7 Å²	61.7	62%	0.619	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-22.3	174.5	-56.3	-61.5	-173.2	157.4	2	113.1	L17 V21 C108 I109 G113	L17-R111 HydrophobicContact CD2-CG 4.07Å; V21-R111 HydrophobicContact CB-CB 4.42Å; V21-R111 HydrophobicContact CG1-CB 3.72Å; V21-R111 HydrophobicContact CG2-CB 3.83Å; C108-R111 PolarHBondContact O-N 3.45Å; C108-R111 VanDerWaalsContact O-N 3.09Å; I109-R111 PolarHBondContact O-N 2.96Å; R111-G113 PolarHBondContact O-N 2.86Å
112	L	82	Confident	87.3	Confident	9 Å²	9	66.9 Å²	66.9	5%	0.047	33%	0.333	C	S	.	.	S	Bend	trans	-78.9	36	175.5	-68.3	-178.7	0	0	0	113.4	V21 L24 C108 I117 V149 W192	V21-L112 HydrophobicContact CB-CD2 4.47Å; V21-L112 HydrophobicContact CG2-CD2 3.95Å; V21-L112 HydrophobicContact CG2-CG 4.34Å; L24-L112 HydrophobicContact CB-CD2 4.17Å; L24-L112 HydrophobicContact CD1-CD1 4.44Å; L24-L112 HydrophobicContact CD1-CD2 3.69Å; C108-L112 HydrophobicContact CB-CD1 3.61Å; C108-L112 HydrophobicContact CB-CG 3.89Å; C108-L112 PolarHBondContact O-N 2.86Å; L112-I117 HydrophobicContact CD1-CD1 4.33Å; L112-V149 HydrophobicContact CD1-CG2 4.28Å; L112-W192 HydrophobicContact CB-CH2 3.81Å; L112-W192 HydrophobicContact CB-CZ3 4.37Å; L112-W192 HydrophobicContact CD2-CH2 3.88Å; L112-W192 HydrophobicContact CD2-CZ2 4.31Å; L112-W192 HydrophobicContact CG-CH2 4.29Å
113	G	77.8	Confident	87.5	Confident	48 Å²	48	64.9 Å²	64.9	50%	0.495	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	-142.2	-176.7	0	0	0	0	0	113.3	R111 S115	R111-G113 PolarHBondContact O-N 2.86Å; G113-S115 VanDerWaalsContact C-N 3.28Å; G113-S115 PolarHBondContact O-N 2.88Å
114	K	73.3	Confident	87.7	Confident	204 Å²	204	62.8 Å²	62.8	89%	0.887	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-1.7	-176.3	-65.9	-176.6	-179.5	179.2	0	113.9	I116	K114-I116 PolarHBondContact O-N 2.82Å
115	S	77.4	Confident	87.9	Confident	29 Å²	29	62.8 Å²	62.8	20%	0.203	31%	0.313	C	S	.	.			trans	-71.3	129.4	-173.9	-60.6	0	0	0	0	112.1	G113 D217	G113-S115 VanDerWaalsContact C-N 3.28Å; G113-S115 PolarHBondContact O-N 2.88Å; S115-D217 WeakPolarHBondContact CA-OD2 3.37Å
116	I	84.6	Confident	88.1	Confident	65 Å²	65	62.6 Å²	62.6	33%	0.333	31%	0.312	S	S	.	.			trans	-104.7	95	176.5	-58.9	175.6	0	0	0	107.8	K114 R118 D217 S218	K114-I116 PolarHBondContact O-N 2.82Å; I116-R118 HydrophobicContact CG2-CG 4.17Å; I116-D217 PolarHBondContact N-OD2 3.28Å; I116-S218 VanDerWaalsContact O-CB 3.31Å; I116-S218 WeakPolarHBondContact O-CB 3.37Å; I116-S218 PolarHBondContact O-N 3.04Å; I116-S218 PolarHBondContact O-OG 2.88Å
117	I	88.7	Confident	88.4	Confident	13 Å²	13	58.4 Å²	58.4	7%	0.067	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	121.2	-178.5	-56.7	176.7	0	0	0	109.7	V105 I109 L112 V149 Y215 F216	V105-I117 HydrophobicContact CG1-CD1 4Å; V105-I117 HydrophobicContact CG1-CG2 4.11Å; I109-I117 HydrophobicContact CG1-CB 4.39Å; L112-I117 HydrophobicContact CD1-CD1 4.33Å; I117-V149 HydrophobicContact CD1-CG2 4.31Å; I117-Y215 HydrophobicContact CG2-CD1 3.67Å; I117-Y215 HydrophobicContact CG2-CG 4.15Å; I117-F216 WeakPolarHBondContact CA-O 3.4Å
118	R	85.1	Confident	88.6	Confident	208 Å²	208	56.4 Å²	56.4	79%	0.785	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.5	-27.9	178.9	-69.2	-177.5	-176.5	-139.8	-0.1	114.7	I116 S218	I116-R118 HydrophobicContact CG2-CG 4.17Å; R118-S218 WeakPolarHBondContact CB-OG 3.4Å; R118-S218 VanDerWaalsContact CD-OG 3.26Å; R118-S218 WeakPolarHBondContact CD-OG 3.48Å; R118-S218 WeakPolarHBondContact CG-OG 3.45Å
119	E	89.8	Confident	88.8	Confident	81 Å²	81	58.4 Å²	58.4	38%	0.379	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	155.2	179.6	65.1	-179.5	-163.8	0	0	110	F216 R221 K225	E119-F216 HydrophobicContact CG-CB 3.88Å; E119-F216 HydrophobicContact CG-CD2 3.88Å; E119-F216 HydrophobicContact CG-CG 4.2Å; E119-F216 PolarHBondContact O-N 2.83Å; E119-R221 VanDerWaalsContact OE1-CG 3.27Å; E119-R221 WeakPolarHBondContact OE1-CG 3.4Å; E119-R221 IonicContact OE1-NE 3.84Å; E119-K225 IonicContact OE1-NZ 3.71Å; E119-K225 PolarHBondContact OE1-NZ 2.9Å; E119-K225 IonicContact OE2-NZ 4Å
120	R	94.3	Very high	89.1	Confident	68 Å²	68	54.9 Å²	54.9	26%	0.257	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	166.3	169.5	63.3	154.1	171.8	81.8	4.3	110.8	D102 W214 Y215	D102-R120 WeakPolarHBondContact OD1-CD 3.4Å; D102-R120 IonicContact OD1-CZ 3.99Å; D102-R120 IonicContact OD1-NE 2.93Å; D102-R120 PolarHBondContact OD1-NE 2.89Å; D102-R120 IonicContact OD2-CZ 3.22Å; D102-R120 VanDerWaalsContact OD2-CZ 3.3Å; D102-R120 IonicContact OD2-NE 3.09Å; D102-R120 PolarHBondContact OD2-NE 2.86Å; D102-R120 IonicContact OD2-NH2 2.67Å; D102-R120 PolarHBondContact OD2-NH2 3.41Å; R120-W214 CarbonylContact C-O 3.59Å; R120-W214 WeakPolarHBondContact CA-O 3.34Å; R120-W214 WeakPolarHBondContact CB-O 3.38Å; R120-Y215 HydrophobicContact CB-CD1 3.67Å; R120-Y215 HydrophobicContact CB-CE1 3.73Å; R120-Y215 HydrophobicContact CB-CG 4.16Å; R120-Y215 HydrophobicContact CG-CD1 4.5Å; R120-Y215 HydrophobicContact CG-CE1 4.1Å
121	S	94.6	Very high	89.6	Confident	16 Å²	16	59.4 Å²	59.4	11%	0.112	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-69	168.3	173.7	69.8	0	0	0	0	111.7	W214	S121-W214 PolarHBondContact N-O 2.99Å; S121-W214 PolarHBondContact OG-N 3.01Å
122	K	94.7	Very high	89.9	Confident	113 Å²	113	52.9 Å²	52.9	49%	0.491	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-59.8	157.5	154.7	-70.7	-174	-179.9	-170.5	0	109.5	W83 V84 M124	W83-K122 HydrophobicContact CE3-CB 3.97Å; W83-K122 WeakPolarHBondContact CZ3-O 3.43Å; V84-K122 WeakPolarHBondContact O-CB 3.37Å; K122-M124 PolarHBondContact O-N 3.42Å
123	A	96.4	Very high	90.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	122.3	174.4	0	0	0	0	0	109.8	W83 V84 L98 V125 V211 V213	W83-A123 CarbonylContact C-O 3.58Å; W83-A123 WeakPolarHBondContact CA-O 3.48Å; V84-A123 HydrophobicContact CB-CB 4.48Å; V84-A123 PolarHBondContact N-O 3.1Å; V84-A123 WeakPolarHBondContact O-CB 3.41Å; V84-A123 PolarHBondContact O-N 2.92Å; L98-A123 HydrophobicContact CD1-CB 4.03Å; L98-A123 HydrophobicContact CD2-CB 3.92Å; L98-A123 HydrophobicContact CG-CB 4.47Å; A123-V125 PolarHBondContact O-N 2.79Å; A123-V211 HydrophobicContact CB-CG1 3.91Å; A123-V213 HydrophobicContact CB-CG1 4.1Å
124	M	97.1	Very high	91	Very high	16 Å²	16	52.5 Å²	52.5	8%	0.079	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	102.5	168.2	-172.9	-175.2	74.3	0	0	108.1	I81 W83 K122 A126 V211 T212 W214	I81-M124 HydrophobicContact CB-CG 3.99Å; I81-M124 HydrophobicContact CB-SD 4.33Å; I81-M124 HydrophobicContact CD1-CG 4.35Å; I81-M124 HydrophobicContact CD1-SD 3.99Å; I81-M124 HydrophobicContact CG2-CE 4.5Å; I81-M124 HydrophobicContact CG2-CG 4.08Å; I81-M124 HydrophobicContact CG2-SD 3.93Å; W83-M124 HydrophobicContact CD2-CB 4.44Å; W83-M124 HydrophobicContact CE3-CB 4.02Å; W83-M124 HydrophobicContact CH2-CB 4.09Å; W83-M124 HydrophobicContact CH2-CG 4.46Å; W83-M124 HydrophobicContact CH2-SD 4.48Å; W83-M124 HydrophobicContact CZ2-CB 4.46Å; W83-M124 HydrophobicContact CZ2-CG 4.37Å; W83-M124 HydrophobicContact CZ2-SD 4.3Å; W83-M124 HydrophobicContact CZ3-CB 3.85Å; K122-M124 PolarHBondContact O-N 3.42Å; M124-A126 HydrophobicContact CE-CB 4.39Å; M124-V211 WeakPolarHBondContact O-CA 3.31Å; M124-T212 PolarHBondContact N-O 3.32Å; M124-T212 PolarHBondContact O-N 3.4Å; M124-W214 HydrophobicContact CB-CH2 4.07Å; M124-W214 HydrophobicContact CB-CZ3 3.83Å; M124-W214 HydrophobicContact CE-CH2 3.61Å; M124-W214 HydrophobicContact CE-CZ2 4.33Å; M124-W214 HydrophobicContact SD-CH2 3.69Å; M124-W214 HydrophobicContact SD-CZ3 4.29Å
125	V	97.1	Very high	92	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	123.8	168.7	-179.9	0	0	0	0	107.2	V48 L51 I81 A82 V84 I94 A123 V211	V48-V125 HydrophobicContact CB-CG1 4.26Å; V48-V125 HydrophobicContact CG1-CG1 3.63Å; V48-V125 HydrophobicContact CG2-CG1 3.85Å; V48-V125 HydrophobicContact CG2-CG2 4.48Å; L51-V125 HydrophobicContact CD1-CG2 4.25Å; I81-V125 CarbonylContact C-O 3.48Å; I81-V125 WeakPolarHBondContact CA-O 3.12Å; A82-V125 PolarHBondContact N-O 3.38Å; A82-V125 PolarHBondContact O-N 2.76Å; V84-V125 HydrophobicContact CB-CG2 4.39Å; V84-V125 HydrophobicContact CG2-CG2 3.78Å; I94-V125 HydrophobicContact CD1-CG2 4.44Å; A123-V125 PolarHBondContact O-N 2.79Å; V125-V211 HydrophobicContact CG2-CG2 4.32Å
126	A	96.2	Very high	92.8	Very high	3 Å²	3	46.2 Å²	46.2	3%	0.025	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	141.9	-178.8	0	0	0	0	0	111.4	K80 I81 M124 Y209 A210	K80-A126 CarbonylContact O-C 3.41Å; K80-A126 WeakPolarHBondContact O-CA 3.33Å; I81-A126 HydrophobicContact CG2-CB 4.02Å; M124-A126 HydrophobicContact CE-CB 4.39Å; A126-Y209 WeakPolarHBondContact O-CA 2.96Å; A126-A210 PolarHBondContact N-O 3.18Å; A126-A210 PolarHBondContact O-N 3.13Å
127	C	96.6	Very high	93.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	115.7	174.2	176.7	0	0	0	0	109.1	H52 L57 D79 K80 R208 Y209	H52-C127 PolarHBondContact CE1-SG 3.12Å; L57-C127 HydrophobicContact CD2-CB 3.44Å; L57-C127 VanDerWaalsContact CD2-CB 3.44Å; D79-C127 CarbonylContact C-O 3.54Å; D79-C127 WeakPolarHBondContact CA-O 3.47Å; K80-C127 PolarHBondContact N-O 3.3Å; K80-C127 PolarHBondContact O-N 2.85Å; C127-R208 WeakPolarHBondContact CA-O 3.21Å; C127-Y209 HydrophobicContact CB-CD1 3.79Å; C127-Y209 HydrophobicContact CB-CE1 3.68Å; C127-Y209 WeakPolarHBondContact SG-CE1 3.35Å
128	Y	94.9	Very high	93.6	Very high	13 Å²	13	49.1 Å²	49.1	5%	0.051	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	113.3	164.9	-67.4	-106.2	0	0	0	106.7	D79 G130 V201 T207 R208	D79-Y128 HydrophobicContact CB-CD1 3.86Å; D79-Y128 HydrophobicContact CB-CD2 3.77Å; D79-Y128 HydrophobicContact CB-CE1 3.72Å; D79-Y128 HydrophobicContact CB-CE2 3.61Å; D79-Y128 HydrophobicContact CB-CG 3.87Å; Y128-G130 PolarHBondContact O-N 2.6Å; Y128-V201 HydrophobicContact CE1-CB 4.44Å; Y128-V201 HydrophobicContact CE1-CG1 4.12Å; Y128-T207 CarbonylContact O-C 3.59Å; Y128-T207 VanDerWaalsContact O-CA 3.31Å; Y128-T207 WeakPolarHBondContact O-CA 3.28Å; Y128-R208 PolarHBondContact N-O 2.86Å; Y128-R208 PolarHBondContact O-N 2.95Å
129	P	92.4	Very high	94.1	Very high	44 Å²	44	40.6 Å²	40.6	29%	0.286	21%	0.214	S	C	.	.			trans	-75.6	6	-169.9	31.6	-37.2	0	0	0	114.2	G78 T133	G78-P129 WeakPolarHBondContact O-CD 3.31Å; P129-T133 HydrophobicContact CG-CG2 4.33Å
130	G	91.6	Very high	94.4	Very high	2 Å²	2	37.6 Å²	37.6	2%	0.021	20%	0.201	C	C	.	.	S	Bend	trans	91	-149.4	-172.3	0	0	0	0	0	112.3	Y128 G132 T133 S204	Y128-G130 PolarHBondContact O-N 2.6Å; G130-G132 VanDerWaalsContact C-N 3.26Å; G130-G132 PolarHBondContact O-N 3.39Å; G130-T133 WeakPolarHBondContact O-CB 3.42Å; G130-T133 VanDerWaalsContact O-CG2 3.27Å; G130-T133 WeakPolarHBondContact O-CG2 3.3Å; G130-T133 PolarHBondContact O-N 3.37Å; G130-T133 VanDerWaalsContact O-N 3.11Å; G130-T133 PolarHBondContact O-OG1 3.38Å; G130-S204 CarbonylContact C-O 3.58Å; G130-S204 WeakPolarHBondContact CA-O 3.36Å
131	N	91.3	Very high	94.4	Very high	152 Å²	152	34.6 Å²	34.6	81%	0.813	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	30.5	178.3	-57.3	-37.9	0	0	0	115.2	T133 S204	N131-T133 VanDerWaalsContact C-N 3.25Å; N131-T133 PolarHBondContact O-N 2.98Å; N131-S204 PolarHBondContact N-O 3.4Å
132	G	91.6	Very high	94.2	Very high	27 Å²	27	36.2 Å²	36.2	28%	0.278	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	14.7	-178.7	0	0	0	0	0	113.7	G130 S204	G130-G132 VanDerWaalsContact C-N 3.26Å; G130-G132 PolarHBondContact O-N 3.39Å; G132-S204 WeakPolarHBondContact CA-O 3.4Å; G132-S204 PolarHBondContact N-O 2.79Å
133	T	91.4	Very high	94	Very high	30 Å²	30	36.5 Å²	36.5	18%	0.184	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	138.7	173.1	52.5	0	0	0	0	110.5	P129 G130 N131 S204	P129-T133 HydrophobicContact CG-CG2 4.33Å; G130-T133 WeakPolarHBondContact O-CB 3.42Å; G130-T133 VanDerWaalsContact O-CG2 3.27Å; G130-T133 WeakPolarHBondContact O-CG2 3.3Å; G130-T133 PolarHBondContact O-N 3.37Å; G130-T133 VanDerWaalsContact O-N 3.11Å; G130-T133 PolarHBondContact O-OG1 3.38Å; N131-T133 VanDerWaalsContact C-N 3.25Å; N131-T133 PolarHBondContact O-N 2.98Å; T133-S204 PolarHBondContact O-N 3.47Å
134	G	92.6	Very high	93.6	Very high	18 Å²	18	38.2 Å²	38.2	19%	0.186	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	-165.8	178.8	0	0	0	0	0	110.9	R77 G78 V201	R77-G134 WeakPolarHBondContact CA-O 3.32Å; G78-G134 PolarHBondContact N-O 2.79Å; G134-V201 WeakPolarHBondContact CA-O 3.42Å
135	Y	93	Very high	93.3	Very high	32 Å²	32	39.5 Å²	39.5	13%	0.125	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	118.5	172.7	-160	150.6	0	0	0	107.7	I76 R77 H138 E200 V201	I76-Y135 HydrophobicContact CG2-CE2 4.14Å; I76-Y135 WeakPolarHBondContact O-CA 3.34Å; I76-Y135 WeakPolarHBondContact O-CD2 3.27Å; R77-Y135 HydrophobicContact CB-CD1 3.91Å; R77-Y135 HydrophobicContact CB-CD2 4.13Å; R77-Y135 HydrophobicContact CB-CE1 4.11Å; R77-Y135 HydrophobicContact CB-CE2 4.29Å; R77-Y135 HydrophobicContact CB-CG 3.94Å; Y135-H138 AromaticContact CD1-CE1 3.7Å; Y135-H138 AromaticContact CD2-CE1 3.55Å; Y135-H138 AromaticContact CD2-ND1 3.4Å; Y135-H138 WeakPolarHBondContact CD2-ND1 3.42Å; Y135-H138 AromaticContact CE1-CE1 3.7Å; Y135-H138 AromaticContact CE1-NE2 3.76Å; Y135-H138 HydrophobicContact CE2-CB 4.37Å; Y135-H138 AromaticContact CE2-CE1 3.59Å; Y135-H138 AromaticContact CE2-CG 3.76Å; Y135-H138 AromaticContact CE2-ND1 3.4Å; Y135-H138 WeakPolarHBondContact CE2-ND1 3.48Å; Y135-H138 AromaticContact CE2-NE2 3.99Å; Y135-H138 AromaticContact CG-CE1 3.62Å; Y135-H138 AromaticContact CG-ND1 3.94Å; Y135-H138 AromaticContact CZ-CD2 3.97Å; Y135-H138 AromaticContact CZ-CE1 3.65Å; Y135-H138 AromaticContact CZ-ND1 3.89Å; Y135-H138 AromaticContact CZ-NE2 3.65Å; Y135-E200 WeakPolarHBondContact O-CA 3.16Å; Y135-E200 WeakPolarHBondContact O-CB 3.4Å; Y135-V201 PolarHBondContact N-O 3.14Å; Y135-V201 PolarHBondContact O-N 3.33Å
136	V	94.1	Very high	93.1	Very high	69 Å²	69	39.5 Å²	39.5	42%	0.418	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	155.6	175.1	-56.6	0	0	0	0	112.5	N75 I76 H138	N75-V136 WeakPolarHBondContact O-CG1 3.12Å; I76-V136 HydrophobicContact CB-CG2 4.46Å; I76-V136 HydrophobicContact CG2-CG2 3.76Å; I76-V136 PolarHBondContact O-N 3.17Å; I76-V136 VanDerWaalsContact O-N 3.1Å; V136-H138 PolarHBondContact O-N 3.04Å; V136-H138 PolarHBondContact O-ND1 3.43Å
137	K	95.7	Very high	93	Very high	105 Å²	105	41 Å²	41	46%	0.457	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	123.7	176.1	-170.9	172.2	179.4	165	0	112.5	F171 H199 E200	K137-F171 HydrophobicContact CD-CD2 3.9Å; K137-F171 HydrophobicContact CD-CE2 3.71Å; K137-F171 HydrophobicContact CD-CZ 4.28Å; K137-F171 HydrophobicContact CG-CD2 4.37Å; K137-F171 HydrophobicContact CG-CE2 4.21Å; K137-F171 VanDerWaalsContact NZ-CD2 3.35Å; K137-H199 CarbonylContact C-O 3.58Å; K137-H199 VanDerWaalsContact CA-O 3.31Å; K137-H199 WeakPolarHBondContact CA-O 3.36Å; K137-E200 HydrophobicContact CB-CB 4.01Å
138	H	95.4	Very high	92.9	Very high	34 Å²	34	41.3 Å²	41.3	16%	0.157	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	172.7	-179.4	64.5	-74.8	0	0	0	111.4	Y135 V136 D140 P198 H199	Y135-H138 AromaticContact CD1-CE1 3.7Å; Y135-H138 AromaticContact CD2-CE1 3.55Å; Y135-H138 AromaticContact CD2-ND1 3.4Å; Y135-H138 WeakPolarHBondContact CD2-ND1 3.42Å; Y135-H138 AromaticContact CE1-CE1 3.7Å; Y135-H138 AromaticContact CE1-NE2 3.76Å; Y135-H138 HydrophobicContact CE2-CB 4.37Å; Y135-H138 AromaticContact CE2-CE1 3.59Å; Y135-H138 AromaticContact CE2-CG 3.76Å; Y135-H138 AromaticContact CE2-ND1 3.4Å; Y135-H138 WeakPolarHBondContact CE2-ND1 3.48Å; Y135-H138 AromaticContact CE2-NE2 3.99Å; Y135-H138 AromaticContact CG-CE1 3.62Å; Y135-H138 AromaticContact CG-ND1 3.94Å; Y135-H138 AromaticContact CZ-CD2 3.97Å; Y135-H138 AromaticContact CZ-CE1 3.65Å; Y135-H138 AromaticContact CZ-ND1 3.89Å; Y135-H138 AromaticContact CZ-NE2 3.65Å; V136-H138 PolarHBondContact O-N 3.04Å; V136-H138 PolarHBondContact O-ND1 3.43Å; H138-D140 IonicContact NE2-OD1 2.92Å; H138-P198 CarbonylContact O-C 3.47Å; H138-P198 VanDerWaalsContact O-CA 3.27Å; H138-P198 WeakPolarHBondContact O-CA 3.47Å; H138-H199 AromaticContact CE1-CD2 3.77Å; H138-H199 AromaticContact CE1-NE2 3.56Å; H138-H199 PolarHBondContact N-O 3.07Å; H138-H199 PolarHBondContact ND1-O 2.86Å; H138-H199 AromaticContact NE2-CE1 4Å; H138-H199 AromaticContact NE2-NE2 3.33Å; H138-H199 PolarHBondContact NE2-NE2 2.83Å; H138-H199 PolarHBondContact O-N 3.05Å
139	V	96	Very high	92.9	Very high	30 Å²	30	40.8 Å²	40.8	18%	0.182	23%	0.233	C	C	.	.			trans	-115.8	135.7	168.8	173	0	0	0	0	106.1	P142 D194 R195 P198	V139-P142 HydrophobicContact CB-CB 4.33Å; V139-P142 HydrophobicContact CG1-CB 4.42Å; V139-P142 WeakPolarHBondContact O-CD 3.36Å; V139-D194 VanDerWaalsContact CG1-C 3.45Å; V139-D194 WeakPolarHBondContact CG1-O 3.34Å; V139-R195 HydrophobicContact CG1-CG 4.26Å; V139-P198 HydrophobicContact CG2-CB 4.01Å; V139-P198 HydrophobicContact CG2-CG 3.94Å
140	D	94.9	Very high	93.2	Very high	17 Å²	17	38.7 Å²	38.7	9%	0.091	22%	0.22	C	C	.	.	S	Bend	trans	-63.1	-51.2	-178.3	-98.5	-19.5	0	0	0	110.5	H138 P142 R147 T150 S193 H199 W214	H138-D140 IonicContact NE2-OD1 2.92Å; D140-P142 VanDerWaalsContact C-CD 3.5Å; D140-P142 VanDerWaalsContact O-CD 3.22Å; D140-P142 WeakPolarHBondContact O-CD 3.49Å; D140-R147 PolarHBondContact O-NH1 2.97Å; D140-R147 VanDerWaalsContact O-NH1 3.12Å; D140-R147 PolarHBondContact O-NH2 3.47Å; D140-R147 IonicContact OD1-NH1 3.59Å; D140-T150 WeakPolarHBondContact OD2-CB 2.97Å; D140-T150 VanDerWaalsContact OD2-CG2 3.28Å; D140-T150 WeakPolarHBondContact OD2-CG2 3.2Å; D140-T150 PolarHBondContact OD2-OG1 2.84Å; D140-S193 VanDerWaalsContact CB-O 3.32Å; D140-S193 WeakPolarHBondContact CB-O 3.48Å; D140-S193 PolarHBondContact N-O 2.76Å; D140-H199 IonicContact OD1-CE1 3.2Å; D140-H199 IonicContact OD2-CE1 3.64Å; D140-W214 PolarHBondContact OD2-NE1 3.38Å
141	N	93.9	Very high	93.5	Very high	5 Å²	5	38.6 Å²	38.6	3%	0.027	22%	0.219	C	C	.	.	S	Bend	trans	-115.8	78.4	179.9	-175.5	10.7	0	0	0	112	A144 D145 R147 S193 E220	N141-A144 WeakPolarHBondContact OD1-CA 3.4Å; N141-A144 PolarHBondContact OD1-N 3.44Å; N141-D145 PolarHBondContact OD1-N 2.7Å; N141-D145 PolarHBondContact OD1-OD1 2.87Å; N141-R147 HydrophobicContact CB-CB 4.1Å; N141-R147 WeakPolarHBondContact CB-O 3.47Å; N141-R147 PolarHBondContact ND2-N 3.01Å; N141-R147 PolarHBondContact ND2-O 3.11Å; N141-S193 PolarHBondContact N-O 2.92Å; N141-E220 PolarHBondContact ND2-OE1 3.43Å
142	P	91	Very high	93.8	Very high	51 Å²	51	32.2 Å²	32.2	33%	0.331	18%	0.184	S	C	.	.	S	Bend	trans	-77.8	-21.6	-177.5	30	-34	0	0	0	113.7	V139 D140 R195	V139-P142 HydrophobicContact CB-CB 4.33Å; V139-P142 HydrophobicContact CG1-CB 4.42Å; V139-P142 WeakPolarHBondContact O-CD 3.36Å; D140-P142 VanDerWaalsContact C-CD 3.5Å; D140-P142 VanDerWaalsContact O-CD 3.22Å; D140-P142 WeakPolarHBondContact O-CD 3.49Å; P142-R195 PolarHBondContact O-NE 3.25Å; P142-R195 PolarHBondContact O-NH2 2.88Å
143	N	89.9	Confident	94.2	Very high	118 Å²	118	31 Å²	31	63%	0.631	17%	0.171	S	C	*	.	S	Bend	trans	-123.2	19.1	-167.6	-63.5	-35.7	0	0	0	113.4	R227	N143-R227 PolarHBondContact O-NH1 3.06Å
144	A	89.8	Confident	94.5	Very high	36 Å²	36	29.5 Å²	29.5	30%	0.298	16%	0.162	S	C	.	.			trans	56.3	53.8	179.7	0	0	0	0	0	113.4	N141 G146 E220 R227	N141-A144 WeakPolarHBondContact OD1-CA 3.4Å; N141-A144 PolarHBondContact OD1-N 3.44Å; A144-G146 PolarHBondContact O-N 3.49Å; A144-E220 WeakPolarHBondContact CA-OE1 3.24Å; A144-E220 HydrophobicContact CB-CG 3.98Å; A144-R227 PolarHBondContact O-NH2 2.72Å
145	D	89.6	Confident	94.8	Very high	43 Å²	43	28.7 Å²	28.7	23%	0.23	15%	0.154	C	C	.	.			trans	-78.1	1.1	179.9	68.9	17.9	0	0	0	114.9	N141 R147 E220 R221 A224	N141-D145 PolarHBondContact OD1-N 2.7Å; N141-D145 PolarHBondContact OD1-OD1 2.87Å; D145-R147 WeakPolarHBondContact OD1-CB 3.37Å; D145-R147 VanDerWaalsContact OD1-CG 3.31Å; D145-R147 WeakPolarHBondContact OD1-CG 3.35Å; D145-R147 IonicContact OD1-CZ 3.29Å; D145-R147 PolarHBondContact OD1-N 3.13Å; D145-R147 IonicContact OD1-NE 3.83Å; D145-R147 PolarHBondContact OD1-NE 3.39Å; D145-R147 VanDerWaalsContact OD1-NE 3.09Å; D145-R147 IonicContact OD2-CZ 2.85Å; D145-R147 IonicContact OD2-NE 2.78Å; D145-R147 PolarHBondContact OD2-NE 3.49Å; D145-R147 IonicContact OD2-NH2 3.08Å; D145-R147 PolarHBondContact OD2-NH2 3.07Å; D145-E220 PolarHBondContact N-OE1 2.88Å; D145-R221 VanDerWaalsContact O-CD 3.3Å; D145-R221 WeakPolarHBondContact O-CD 3.42Å; D145-R221 PolarHBondContact O-NH1 2.93Å; D145-R221 VanDerWaalsContact O-NH1 3.15Å; D145-A224 WeakPolarHBondContact O-CB 3.43Å
146	G	92.5	Very high	95	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	107.8	-17.1	-179.3	0	0	0	0	0	114.1	A144 C148 F216 D217 E220	A144-G146 PolarHBondContact O-N 3.49Å; G146-C148 PolarHBondContact O-N 3.26Å; G146-F216 CarbonylContact O-C 3.56Å; G146-F216 WeakPolarHBondContact O-CA 3.49Å; G146-D217 PolarHBondContact O-N 3.45Å; G146-E220 WeakPolarHBondContact CA-OE1 3.42Å; G146-E220 PolarHBondContact N-OE1 3.26Å
147	R	94.6	Very high	95.2	Very high	36 Å²	36	27.7 Å²	27.7	14%	0.136	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	119.4	-178.3	-68.8	179.2	-77.7	159.7	-5.5	110	D140 N141 D145 S193 W214 F216	D140-R147 PolarHBondContact O-NH1 2.97Å; D140-R147 VanDerWaalsContact O-NH1 3.12Å; D140-R147 PolarHBondContact O-NH2 3.47Å; D140-R147 IonicContact OD1-NH1 3.59Å; N141-R147 HydrophobicContact CB-CB 4.1Å; N141-R147 WeakPolarHBondContact CB-O 3.47Å; N141-R147 PolarHBondContact ND2-N 3.01Å; N141-R147 PolarHBondContact ND2-O 3.11Å; D145-R147 WeakPolarHBondContact OD1-CB 3.37Å; D145-R147 VanDerWaalsContact OD1-CG 3.31Å; D145-R147 WeakPolarHBondContact OD1-CG 3.35Å; D145-R147 IonicContact OD1-CZ 3.29Å; D145-R147 PolarHBondContact OD1-N 3.13Å; D145-R147 IonicContact OD1-NE 3.83Å; D145-R147 PolarHBondContact OD1-NE 3.39Å; D145-R147 VanDerWaalsContact OD1-NE 3.09Å; D145-R147 IonicContact OD2-CZ 2.85Å; D145-R147 IonicContact OD2-NE 2.78Å; D145-R147 PolarHBondContact OD2-NE 3.49Å; D145-R147 IonicContact OD2-NH2 3.08Å; D145-R147 PolarHBondContact OD2-NH2 3.07Å; R147-S193 WeakPolarHBondContact O-CB 3.44Å; R147-W214 HydrophobicContact CB-CB 4.3Å; R147-W214 VanDerWaalsContact CD-CG 3.5Å; R147-W214 HydrophobicContact CG-CB 3.74Å; R147-W214 HydrophobicContact CG-CG 4.12Å; R147-F216 HydrophobicContact CB-CE1 4.47Å; R147-F216 HydrophobicContact CG-CD1 3.83Å; R147-F216 HydrophobicContact CG-CE1 3.35Å; R147-F216 HydrophobicContact CG-CZ 4.04Å
148	C	94.3	Very high	95.2	Very high	6 Å²	6	30.1 Å²	30.1	4%	0.041	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-40.5	-176.7	64	0	0	0	0	112.9	G146 W192 S193 Y215 D217	G146-C148 PolarHBondContact O-N 3.26Å; C148-W192 WeakPolarHBondContact O-CA 3.5Å; C148-S193 PolarHBondContact O-N 3Å; C148-Y215 PolarHBondContact N-O 3Å; C148-Y215 PolarHBondContact SG-O 3.47Å; C148-D217 HydrophobicContact CB-CB 4.11Å
149	V	95.9	Very high	95.4	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.012	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.2	179.8	179	0	0	0	0	109.4	L112 I117 F190 W192 S193 W214 Y215	L112-V149 HydrophobicContact CD1-CG2 4.28Å; I117-V149 HydrophobicContact CD1-CG2 4.31Å; V149-F190 HydrophobicContact CG1-CD1 4.02Å; V149-W192 HydrophobicContact CG2-CE3 3.94Å; V149-W192 HydrophobicContact CG2-CZ3 3.83Å; V149-S193 PolarHBondContact N-OG 3.01Å; V149-W214 WeakPolarHBondContact O-CA 3.18Å; V149-Y215 PolarHBondContact N-O 3.44Å; V149-Y215 PolarHBondContact O-N 3.32Å
150	T	97.8	Very high	95.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.7	170.5	-55.5	0	0	0	0	108.5	D140 I152 F190 F191 S193 T212 W214	D140-T150 WeakPolarHBondContact OD2-CB 2.97Å; D140-T150 VanDerWaalsContact OD2-CG2 3.28Å; D140-T150 WeakPolarHBondContact OD2-CG2 3.2Å; D140-T150 PolarHBondContact OD2-OG1 2.84Å; T150-I152 HydrophobicContact CG2-CD1 4.36Å; T150-I152 HydrophobicContact CG2-CG1 4Å; T150-F190 WeakPolarHBondContact O-CA 3.45Å; T150-F191 VanDerWaalsContact CB-CZ 3.47Å; T150-F191 HydrophobicContact CG2-CD1 4.49Å; T150-F191 HydrophobicContact CG2-CE1 3.65Å; T150-F191 HydrophobicContact CG2-CE2 4.1Å; T150-F191 HydrophobicContact CG2-CZ 3.41Å; T150-F191 VanDerWaalsContact CG2-CZ 3.41Å; T150-F191 PolarHBondContact N-O 3.43Å; T150-F191 PolarHBondContact O-N 3.3Å; T150-S193 PolarHBondContact N-OG 3.45Å; T150-S193 WeakPolarHBondContact OG1-CB 3.27Å; T150-S193 PolarHBondContact OG1-OG 3Å; T150-T212 HydrophobicContact CG2-CG2 3.86Å; T150-W214 PolarHBondContact OG1-NE1 3.21Å
151	C	98	Very high	95.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.8	174.7	-178.9	0	0	0	0	109.8	I101 L188 L189 F190 T212 V213 Y215	I101-C151 HydrophobicContact CG2-CB 4.29Å; I101-C151 VanDerWaalsContact CG2-SG 3.58Å; C151-L188 WeakPolarHBondContact SG-CD1 3.35Å; C151-L189 CarbonylContact C-O 3.48Å; C151-L189 VanDerWaalsContact CA-O 3.24Å; C151-L189 WeakPolarHBondContact CA-O 3.45Å; C151-F190 HydrophobicContact CB-CD1 4.02Å; C151-F190 HydrophobicContact CB-CE1 3.85Å; C151-F190 VanDerWaalsContact SG-CE1 3.52Å; C151-T212 CarbonylContact O-C 3.52Å; C151-T212 VanDerWaalsContact O-CA 3.31Å; C151-T212 WeakPolarHBondContact O-CA 3.44Å; C151-V213 HydrophobicContact CB-CG2 3.76Å; C151-V213 PolarHBondContact N-O 3.18Å; C151-V213 PolarHBondContact O-N 3.25Å; C151-Y215 HydrophobicContact CB-CE2 4.33Å
152	I	98.6	Very high	95.5	Very high	17 Å²	17	39.4 Å²	39.4	9%	0.087	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.5	-178.5	-52.2	-176.2	0	0	0	109.1	T150 Y154 L168 L188 L189 F191 A210 V211 T212	T150-I152 HydrophobicContact CG2-CD1 4.36Å; T150-I152 HydrophobicContact CG2-CG1 4Å; I152-Y154 HydrophobicContact CG2-CD1 4.07Å; I152-Y154 HydrophobicContact CG2-CE1 3.56Å; I152-Y154 HydrophobicContact CG2-CE2 4.23Å; I152-L168 HydrophobicContact CD1-CD2 4.45Å; I152-L188 CarbonylContact O-C 3.48Å; I152-L188 WeakPolarHBondContact O-CA 3.46Å; I152-L189 HydrophobicContact CB-CB 4.45Å; I152-L189 HydrophobicContact CD1-CD2 4.48Å; I152-L189 PolarHBondContact N-O 3.39Å; I152-L189 PolarHBondContact O-N 2.93Å; I152-F191 HydrophobicContact CD1-CE1 3.72Å; I152-F191 HydrophobicContact CD1-CZ 4.22Å; I152-F191 HydrophobicContact CG1-CE1 4.14Å; I152-A210 HydrophobicContact CG2-CB 3.94Å; I152-V211 CarbonylContact C-O 3.56Å; I152-V211 WeakPolarHBondContact CA-O 3.45Å; I152-T212 HydrophobicContact CG1-CG2 4.04Å
153	Y	98.7	Very high	95.8	Very high	1 Å²	1	43.3 Å²	43.3	0%	0.004	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	126.6	171.6	-177	-106.9	0	0	0	110.6	F35 L36 G41 V44 L97 L155 D186 R187 L188 A210 V211	F35-Y153 HydrophobicContact CB-CE2 4.43Å; F35-Y153 HydrophobicContact CD1-CE2 4.33Å; L36-Y153 HydrophobicContact CD1-CE1 4.11Å; L36-Y153 HydrophobicContact CD1-CE2 4.21Å; L36-Y153 WeakPolarHBondContact CD1-OH 3.33Å; L36-Y153 HydrophobicContact CG-CE2 4.11Å; G41-Y153 WeakPolarHBondContact CA-OH 3.19Å; V44-Y153 HydrophobicContact CB-CE1 4.47Å; V44-Y153 HydrophobicContact CG1-CE1 4.21Å; L97-Y153 HydrophobicContact CD1-CD1 4.09Å; L97-Y153 HydrophobicContact CD1-CD2 3.94Å; L97-Y153 HydrophobicContact CD1-CE1 4.43Å; L97-Y153 HydrophobicContact CD1-CE2 4.31Å; L97-Y153 HydrophobicContact CD1-CG 3.81Å; L97-Y153 HydrophobicContact CD2-CD1 3.45Å; L97-Y153 VanDerWaalsContact CD2-CD1 3.45Å; L97-Y153 HydrophobicContact CD2-CE1 4.06Å; L97-Y153 HydrophobicContact CD2-CG 3.81Å; L97-Y153 HydrophobicContact CG-CD1 4.42Å; L97-Y153 HydrophobicContact CG-CG 4.48Å; Y153-L155 HydrophobicContact CD1-CD2 3.94Å; Y153-L155 HydrophobicContact CD1-CG 4.09Å; Y153-L155 HydrophobicContact CE1-CD2 3.45Å; Y153-L155 VanDerWaalsContact CE1-CD2 3.45Å; Y153-L155 HydrophobicContact CE1-CG 4.09Å; Y153-D186 WeakPolarHBondContact CE2-OD1 3.44Å; Y153-D186 PolarHBondContact OH-OD1 2.97Å; Y153-R187 WeakPolarHBondContact CA-O 3.32Å; Y153-L188 HydrophobicContact CD2-CB 4.24Å; Y153-L188 HydrophobicContact CD2-CD1 4.04Å; Y153-L188 HydrophobicContact CG-CD1 4.45Å; Y153-A210 CarbonylContact O-C 3.58Å; Y153-A210 WeakPolarHBondContact O-CA 3.32Å; Y153-V211 PolarHBondContact N-O 2.68Å; Y153-V211 PolarHBondContact O-N 3.35Å
154	Y	98.7	Very high	96.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	148.1	-175.5	-64.9	-64.8	0	0	0	112.5	I152 L168 V181 P183 L184 D186 R187 L189 R208 A210	I152-Y154 HydrophobicContact CG2-CD1 4.07Å; I152-Y154 HydrophobicContact CG2-CE1 3.56Å; I152-Y154 HydrophobicContact CG2-CE2 4.23Å; Y154-L168 VanDerWaalsContact OH-CD2 3.32Å; Y154-L168 WeakPolarHBondContact OH-CD2 3.39Å; Y154-V181 HydrophobicContact CE2-CG1 4.2Å; Y154-P183 HydrophobicContact CD1-CB 3.49Å; Y154-P183 VanDerWaalsContact CD1-CB 3.49Å; Y154-P183 HydrophobicContact CE1-CB 3.76Å; Y154-P183 HydrophobicContact CG-CB 4Å; Y154-L184 CarbonylContact C-O 3.59Å; Y154-L184 WeakPolarHBondContact CB-O 3.2Å; Y154-D186 PolarHBondContact O-N 3.21Å; Y154-R187 HydrophobicContact CD2-CB 3.99Å; Y154-R187 HydrophobicContact CD2-CG 3.9Å; Y154-R187 HydrophobicContact CE2-CG 4.47Å; Y154-R187 PolarHBondContact N-O 2.99Å; Y154-L189 HydrophobicContact CE2-CB 4.1Å; Y154-L189 HydrophobicContact CE2-CD2 4.26Å; Y154-R208 VanDerWaalsContact CE1-NH2 3.32Å; Y154-A210 HydrophobicContact CD1-CB 4Å; Y154-A210 HydrophobicContact CE1-CB 4.21Å
155	L	98.4	Very high	96.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.			trans	-131	13.5	-163.8	-73.2	167.5	0	0	0	113.4	V44 L45 V48 Y153 K157 V211	V44-L155 HydrophobicContact CB-CD2 4.02Å; V44-L155 HydrophobicContact CG1-CD1 4.32Å; V44-L155 HydrophobicContact CG1-CD2 3.77Å; L45-L155 HydrophobicContact CB-CD2 4.09Å; L45-L155 HydrophobicContact CD1-CB 4.08Å; L45-L155 WeakPolarHBondContact CD1-O 3.32Å; V48-L155 HydrophobicContact CB-CD1 4.09Å; V48-L155 HydrophobicContact CG1-CD1 4.18Å; V48-L155 HydrophobicContact CG2-CD1 3.72Å; Y153-L155 HydrophobicContact CD1-CD2 3.94Å; Y153-L155 HydrophobicContact CD1-CG 4.09Å; Y153-L155 HydrophobicContact CE1-CD2 3.45Å; Y153-L155 VanDerWaalsContact CE1-CD2 3.45Å; Y153-L155 HydrophobicContact CE1-CG 4.09Å; L155-K157 PolarHBondContact O-N 3.26Å; L155-V211 HydrophobicContact CD1-CG2 3.86Å
156	N	98.3	Very high	96.9	Very high	7 Å²	7	37 Å²	37	4%	0.037	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-99.4	98.1	-165.2	-46.6	-69.5	0	0	0	111.6	W159 P183 F185 R208 Y209	N156-W159 HydrophobicContact CB-CB 4.3Å; N156-W159 HydrophobicContact CB-CD2 4.1Å; N156-W159 HydrophobicContact CB-CE3 3.51Å; N156-W159 HydrophobicContact CB-CG 4.47Å; N156-W159 HydrophobicContact CB-CZ3 4.14Å; N156-P183 WeakPolarHBondContact CB-O 3.47Å; N156-P183 PolarHBondContact ND2-O 2.97Å; N156-F185 WeakPolarHBondContact O-CB 3.2Å; N156-F185 PolarHBondContact O-N 3Å; N156-R208 VanDerWaalsContact OD1-CA 3.32Å; N156-R208 WeakPolarHBondContact OD1-CA 3.44Å; N156-Y209 PolarHBondContact ND2-O 2.86Å; N156-Y209 PolarHBondContact OD1-N 3.4Å; N156-Y209 PolarHBondContact OD1-O 3.4Å
157	K	97.1	Very high	97.2	Very high	74 Å²	74	38.5 Å²	38.5	32%	0.322	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	141.8	179.4	-67.6	-171	175.3	-168.7	0	110.5	L45 L155 W159 F185	L45-K157 HydrophobicContact CD2-CD 4.24Å; L45-K157 HydrophobicContact CD2-CG 4.22Å; L155-K157 PolarHBondContact O-N 3.26Å; K157-W159 PolarHBondContact O-N 3.41Å; K157-F185 HydrophobicContact CD-CD2 4.39Å; K157-F185 HydrophobicContact CD-CE2 4.38Å; K157-F185 VanDerWaalsContact CE-CE2 3.48Å; K157-F185 VanDerWaalsContact CE-CZ 3.47Å; K157-F185 HydrophobicContact CG-CB 4Å; K157-F185 HydrophobicContact CG-CD1 4.22Å; K157-F185 HydrophobicContact CG-CD2 3.52Å; K157-F185 HydrophobicContact CG-CE2 3.99Å; K157-F185 HydrophobicContact CG-CG 3.65Å
158	N	96.6	Very high	97.4	Very high	156 Å²	156	36.9 Å²	36.9	83%	0.834	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	39.5	176.7	-49	-38.7	0	0	0	112.8	N160	N158-N160 PolarHBondContact O-N 2.67Å
159	W	97.9	Very high	97.6	Very high	25 Å²	25	40 Å²	40	10%	0.095	20%	0.196	C	C	.	.			trans	-72.2	125.7	178.8	-165.7	-93	0	0	0	110.4	N156 K157 H164 G165 P183 L184 S204 A206 R208	N156-W159 HydrophobicContact CB-CB 4.3Å; N156-W159 HydrophobicContact CB-CD2 4.1Å; N156-W159 HydrophobicContact CB-CE3 3.51Å; N156-W159 HydrophobicContact CB-CG 4.47Å; N156-W159 HydrophobicContact CB-CZ3 4.14Å; K157-W159 PolarHBondContact O-N 3.41Å; W159-H164 HydrophobicContact CD2-CB 4.11Å; W159-H164 HydrophobicContact CE3-CB 4.34Å; W159-H164 AromaticContact CE3-ND1 3.98Å; W159-H164 HydrophobicContact CH2-CB 3.82Å; W159-H164 HydrophobicContact CZ2-CB 3.53Å; W159-H164 HydrophobicContact CZ3-CB 4.23Å; W159-G165 WeakPolarHBondContact CZ2-O 3.4Å; W159-G165 PolarHBondContact NE1-O 2.94Å; W159-P183 HydrophobicContact CD2-CG 4.01Å; W159-P183 HydrophobicContact CG-CG 4.16Å; W159-P183 HydrophobicContact CZ2-CG 4.1Å; W159-L184 HydrophobicContact CB-CD2 4.07Å; W159-S204 WeakPolarHBondContact CH2-OG 3.31Å; W159-A206 HydrophobicContact CH2-CB 3.91Å; W159-A206 HydrophobicContact CZ3-CB 3.84Å; W159-R208 HydrophobicContact CH2-CB 3.65Å; W159-R208 HydrophobicContact CH2-CG 4.24Å; W159-R208 HydrophobicContact CZ2-CB 4.4Å; W159-R208 HydrophobicContact CZ3-CB 4.04Å
160	N	97.2	Very high	97.7	Very high	51 Å²	51	40 Å²	40	27%	0.273	20%	0.195	S	C	.	.			trans	-111	111.5	169.1	179.6	-18.2	0	0	0	108	N158 E162 E163 H164	N158-N160 PolarHBondContact O-N 2.67Å; N160-E162 VanDerWaalsContact C-N 3.3Å; N160-E162 PolarHBondContact O-N 3.48Å; N160-E162 WeakPolarHBondContact OD1-CB 3.39Å; N160-E162 PolarHBondContact OD1-N 3.27Å; N160-E163 HydrophobicContact CB-CB 4.22Å; N160-E163 HydrophobicContact CB-CG 4.47Å; N160-E163 WeakPolarHBondContact ND2-CG 3.46Å; N160-E163 PolarHBondContact ND2-OE1 3.25Å; N160-E163 PolarHBondContact O-N 3.21Å; N160-E163 PolarHBondContact OD1-N 2.79Å; N160-H164 PolarHBondContact N-ND1 3.11Å; N160-H164 WeakPolarHBondContact O-CA 3.26Å; N160-H164 VanDerWaalsContact O-CB 3.22Å; N160-H164 WeakPolarHBondContact O-CB 3.2Å; N160-H164 PolarHBondContact O-N 3.2Å
161	A	95.4	Very high	97.6	Very high	15 Å²	15	42.3 Å²	42.3	12%	0.124	21%	0.206	C	C	.	.	H	α-helix	trans	-68.5	-26.1	-177	0	0	0	0	0	113.8	G165 I167 E182	A161-G165 VanDerWaalsContact O-CA 3.25Å; A161-G165 WeakPolarHBondContact O-CA 3.33Å; A161-G165 PolarHBondContact O-N 3.06Å; A161-I167 HydrophobicContact CB-CD1 4.03Å; A161-I167 HydrophobicContact CB-CG1 3.92Å; A161-E182 HydrophobicContact CB-CG 3.87Å
162	E	96.1	Very high	97.5	Very high	189 Å²	189	42.7 Å²	42.7	88%	0.883	21%	0.208	S	C	*	.	H	α-helix	trans	-69.5	-37.7	176.4	-60	-173.8	165.5	0	0	111.4	N160	N160-E162 VanDerWaalsContact C-N 3.3Å; N160-E162 PolarHBondContact O-N 3.48Å; N160-E162 WeakPolarHBondContact OD1-CB 3.39Å; N160-E162 PolarHBondContact OD1-N 3.27Å
163	E	96.3	Very high	97.2	Very high	134 Å²	134	48 Å²	48	63%	0.626	23%	0.233	S	C	*	.	H	α-helix	trans	-88.5	-44.5	-179.6	-68	175.2	-171.9	0	0	112.5	N160	N160-E163 HydrophobicContact CB-CB 4.22Å; N160-E163 HydrophobicContact CB-CG 4.47Å; N160-E163 WeakPolarHBondContact ND2-CG 3.46Å; N160-E163 PolarHBondContact ND2-OE1 3.25Å; N160-E163 PolarHBondContact O-N 3.21Å; N160-E163 PolarHBondContact OD1-N 2.79Å
164	H	97.9	Very high	96.7	Very high	52 Å²	52	52 Å²	52	24%	0.241	27%	0.274	C	S	.	.	H	α-helix	trans	-96.3	-14.8	-171.2	-56.1	152.5	0	0	0	113.7	W159 N160 Y205 A206	W159-H164 HydrophobicContact CD2-CB 4.11Å; W159-H164 HydrophobicContact CE3-CB 4.34Å; W159-H164 AromaticContact CE3-ND1 3.98Å; W159-H164 HydrophobicContact CH2-CB 3.82Å; W159-H164 HydrophobicContact CZ2-CB 3.53Å; W159-H164 HydrophobicContact CZ3-CB 4.23Å; N160-H164 PolarHBondContact N-ND1 3.11Å; N160-H164 WeakPolarHBondContact O-CA 3.26Å; N160-H164 VanDerWaalsContact O-CB 3.22Å; N160-H164 WeakPolarHBondContact O-CB 3.2Å; N160-H164 PolarHBondContact O-N 3.2Å; H164-Y205 PolarHBondContact O-N 2.71Å; H164-A206 HydrophobicContact CB-CB 3.9Å
165	G	97.6	Very high	96.3	Very high	13 Å²	13	56.1 Å²	56.1	13%	0.134	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	62.7	-133.8	-174.7	0	0	0	0	0	112.7	W159 A161 I167	W159-G165 WeakPolarHBondContact CZ2-O 3.4Å; W159-G165 PolarHBondContact NE1-O 2.94Å; A161-G165 VanDerWaalsContact O-CA 3.25Å; A161-G165 WeakPolarHBondContact O-CA 3.33Å; A161-G165 PolarHBondContact O-N 3.06Å; G165-I167 PolarHBondContact O-N 3.39Å
166	G	97	Very high	95.8	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.336	C	S	.	.			trans	68.9	15.1	170.8	0	0	0	0	0	116.2	L202 P203 R208	G166-L202 WeakPolarHBondContact CA-O 3.3Å; G166-P203 PolarHBondContact N-O 3.34Å; G166-R208 PolarHBondContact O-NE 2.72Å
167	I	98.4	Very high	95.5	Very high	30 Å²	30	66.3 Å²	66.3	15%	0.154	35%	0.351	C	S	.	.			trans	-61	134.6	176.7	-61.9	172.4	0	0	0	109.6	A161 G165 D180 L202	A161-I167 HydrophobicContact CB-CD1 4.03Å; A161-I167 HydrophobicContact CB-CG1 3.92Å; G165-I167 PolarHBondContact O-N 3.39Å; I167-D180 HydrophobicContact CG2-CB 3.65Å; I167-L202 HydrophobicContact CB-CB 4.49Å; I167-L202 HydrophobicContact CB-CD1 4.04Å; I167-L202 HydrophobicContact CB-CG 4.35Å; I167-L202 HydrophobicContact CD1-CD1 4.5Å; I167-L202 HydrophobicContact CG2-CD1 4.49Å; I167-L202 PolarHBondContact O-N 3.21Å
168	L	98.6	Very high	95.4	Very high	3 Å²	3	66.2 Å²	66.2	2%	0.016	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	116.9	163.9	176.2	75.1	0	0	0	108.2	I152 Y154 I170 V181 L189 H199 V201	I152-L168 HydrophobicContact CD1-CD2 4.45Å; Y154-L168 VanDerWaalsContact OH-CD2 3.32Å; Y154-L168 WeakPolarHBondContact OH-CD2 3.39Å; L168-I170 HydrophobicContact CD2-CD1 4.06Å; L168-I170 HydrophobicContact CD2-CG1 4.09Å; L168-I170 HydrophobicContact CG-CG1 4.13Å; L168-V181 HydrophobicContact CB-CB 4.35Å; L168-V181 PolarHBondContact N-O 3Å; L168-V181 PolarHBondContact O-N 3.18Å; L168-L189 HydrophobicContact CD2-CD2 3.3Å; L168-H199 HydrophobicContact CD1-CB 4.22Å; L168-V201 HydrophobicContact CD1-CG2 3.93Å
169	R	98.4	Very high	95.4	Very high	72 Å²	72	59.3 Å²	59.3	27%	0.272	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118.2	178.1	175.4	167.1	-72.8	165	0.7	110.2	F171 V178 A179 D180 H199 E200	R169-F171 HydrophobicContact CG-CD2 4.41Å; R169-F171 HydrophobicContact CG-CE1 4.22Å; R169-F171 HydrophobicContact CG-CE2 3.74Å; R169-F171 HydrophobicContact CG-CZ 3.64Å; R169-V178 HydrophobicContact CG-CG1 3.33Å; R169-A179 WeakPolarHBondContact CA-O 3.36Å; R169-D180 WeakPolarHBondContact CB-OD1 3.21Å; R169-D180 VanDerWaalsContact CG-OD1 3.3Å; R169-D180 WeakPolarHBondContact CG-OD1 3.27Å; R169-D180 IonicContact CZ-OD1 2.79Å; R169-D180 IonicContact CZ-OD2 3.85Å; R169-D180 IonicContact NE-OD1 2.76Å; R169-D180 PolarHBondContact NE-OD1 3.38Å; R169-D180 IonicContact NE-OD2 3.3Å; R169-D180 IonicContact NH2-OD1 3.81Å; R169-D180 IonicContact NH2-OD2 3.67Å; R169-D180 PolarHBondContact NH2-OD2 2.98Å; R169-H199 CarbonylContact O-C 3.56Å; R169-H199 WeakPolarHBondContact O-CA 3.44Å; R169-H199 WeakPolarHBondContact O-CB 3.28Å; R169-E200 HydrophobicContact CB-CG 3.92Å; R169-E200 HydrophobicContact CG-CG 4.42Å; R169-E200 PolarHBondContact N-O 3.48Å; R169-E200 PolarHBondContact O-N 2.87Å
170	I	98.2	Very high	95.4	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	139	179.8	-50.6	175	0	0	0	108.8	F29 L168 P172 V178 A179 V181 L189 N197 H199	F29-I170 HydrophobicContact CB-CD1 4.26Å; F29-I170 HydrophobicContact CD2-CD1 4.46Å; F29-I170 HydrophobicContact CG-CD1 4.25Å; L168-I170 HydrophobicContact CD2-CD1 4.06Å; L168-I170 HydrophobicContact CD2-CG1 4.09Å; L168-I170 HydrophobicContact CG-CG1 4.13Å; I170-P172 HydrophobicContact CG2-CG 4.21Å; I170-P172 WeakPolarHBondContact O-CD 3.33Å; I170-V178 WeakPolarHBondContact O-CG1 3.1Å; I170-A179 HydrophobicContact CB-CB 4.32Å; I170-A179 PolarHBondContact N-O 2.66Å; I170-A179 PolarHBondContact O-N 2.84Å; I170-V181 HydrophobicContact CD1-CG2 4.28Å; I170-L189 HydrophobicContact CD1-CD2 4.49Å; I170-N197 HydrophobicContact CG2-CB 3.92Å; I170-H199 HydrophobicContact CB-CB 4.38Å; I170-H199 HydrophobicContact CG1-CB 4.06Å; I170-H199 HydrophobicContact CG2-CB 4.5Å
171	F	97.1	Very high	95.5	Very high	50 Å²	50	59.3 Å²	59.3	22%	0.219	32%	0.322	C	S	.	.			trans	-116.8	75.5	179.3	-58.3	-93.1	0	0	0	110.3	K137 R169 E173 V178 P198 E200	K137-F171 HydrophobicContact CD-CD2 3.9Å; K137-F171 HydrophobicContact CD-CE2 3.71Å; K137-F171 HydrophobicContact CD-CZ 4.28Å; K137-F171 HydrophobicContact CG-CD2 4.37Å; K137-F171 HydrophobicContact CG-CE2 4.21Å; K137-F171 VanDerWaalsContact NZ-CD2 3.35Å; R169-F171 HydrophobicContact CG-CD2 4.41Å; R169-F171 HydrophobicContact CG-CE1 4.22Å; R169-F171 HydrophobicContact CG-CE2 3.74Å; R169-F171 HydrophobicContact CG-CZ 3.64Å; F171-E173 PolarHBondContact O-N 3Å; F171-V178 HydrophobicContact CD1-CG1 4.15Å; F171-V178 HydrophobicContact CD1-CG2 3.73Å; F171-V178 HydrophobicContact CE1-CG1 4.07Å; F171-V178 HydrophobicContact CE1-CG2 3.93Å; F171-P198 WeakPolarHBondContact CD2-O 3.37Å; F171-P198 PolarHBondContact N-O 2.95Å; F171-P198 WeakPolarHBondContact O-CD 3.44Å; F171-E200 HydrophobicContact CE2-CG 3.99Å; F171-E200 HydrophobicContact CZ-CG 4.48Å; F171-E200 WeakPolarHBondContact CZ-OE1 3.42Å
172	P	94.4	Very high	95.6	Very high	7 Å²	7	62.3 Å²	62.3	5%	0.045	33%	0.334	C	S	.	.			trans	-57.9	128.1	-173.8	-22.7	33.9	0	0	0	112.1	F29 I170 G174 K175 Y177 R196	F29-P172 HydrophobicContact CD1-CG 4.25Å; F29-P172 HydrophobicContact CE1-CG 4.11Å; I170-P172 HydrophobicContact CG2-CG 4.21Å; I170-P172 WeakPolarHBondContact O-CD 3.33Å; P172-G174 PolarHBondContact O-N 3.02Å; P172-K175 HydrophobicContact CB-CB 4.09Å; P172-K175 HydrophobicContact CB-CG 3.79Å; P172-K175 PolarHBondContact O-N 3.37Å; P172-Y177 HydrophobicContact CG-CE2 3.92Å; P172-R196 CarbonylContact C-O 3.58Å; P172-R196 WeakPolarHBondContact CA-O 3.5Å
173	E	92	Very high	95.7	Very high	130 Å²	130	53.3 Å²	53.3	61%	0.607	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	134.4	-177.2	-172.3	174.9	-151.4	0	0	110.9	F171 K175 R196	F171-E173 PolarHBondContact O-N 3Å; E173-K175 PolarHBondContact O-N 3.48Å; E173-R196 PolarHBondContact N-O 3.38Å
174	G	89.2	Confident	95.9	Very high	84 Å²	84	49.1 Å²	49.1	87%	0.866	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	3.5	-179.6	0	0	0	0	0	114.9	P172	P172-G174 PolarHBondContact O-N 3.02Å
175	K	89.6	Confident	95.9	Very high	86 Å²	86	48.4 Å²	48.4	37%	0.374	27%	0.27	S	S	.	.			trans	-102	147.5	171.9	-54.9	-64.6	-172.7	167.4	0	110.3	D26 P172 E173 Y177	D26-K175 WeakPolarHBondContact O-CE 3.46Å; D26-K175 PolarHBondContact O-NZ 2.75Å; P172-K175 HydrophobicContact CB-CB 4.09Å; P172-K175 HydrophobicContact CB-CG 3.79Å; P172-K175 PolarHBondContact O-N 3.37Å; E173-K175 PolarHBondContact O-N 3.48Å; K175-Y177 VanDerWaalsContact C-N 3.34Å; K175-Y177 HydrophobicContact CB-CD1 3.89Å; K175-Y177 HydrophobicContact CB-CE1 3.65Å; K175-Y177 HydrophobicContact CB-CG 4.5Å; K175-Y177 HydrophobicContact CD-CE1 3.99Å; K175-Y177 HydrophobicContact CG-CE1 3.83Å
176	S	89.6	Confident	95.9	Very high	133 Å²	133	47.8 Å²	47.8	93%	0.93	26%	0.263	S	S	*	.	S	Bend	trans	-83.7	-11.8	178.4	54.5	0	0	0	0	113.6
177	Y	91.6	Very high	96	Very high	89 Å²	89	48.5 Å²	48.5	35%	0.349	27%	0.266	S	S	.	.			trans	-99.6	159.6	-178.6	67	-97.3	0	0	0	111.7	F29 P172 K175 A179	F29-Y177 HydrophobicContact CE1-CE2 4.08Å; P172-Y177 HydrophobicContact CG-CE2 3.92Å; K175-Y177 VanDerWaalsContact C-N 3.34Å; K175-Y177 HydrophobicContact CB-CD1 3.89Å; K175-Y177 HydrophobicContact CB-CE1 3.65Å; K175-Y177 HydrophobicContact CB-CG 4.5Å; K175-Y177 HydrophobicContact CD-CE1 3.99Å; K175-Y177 HydrophobicContact CG-CE1 3.83Å; Y177-A179 HydrophobicContact CE2-CB 4.35Å
178	V	95.2	Very high	96	Very high	72 Å²	72	47.1 Å²	47.1	44%	0.436	26%	0.259	S	S	.	.			trans	-110.2	137.9	168.6	177.3	0	0	0	0	107	R169 I170 F171	R169-V178 HydrophobicContact CG-CG1 3.33Å; I170-V178 WeakPolarHBondContact O-CG1 3.1Å; F171-V178 HydrophobicContact CD1-CG1 4.15Å; F171-V178 HydrophobicContact CD1-CG2 3.73Å; F171-V178 HydrophobicContact CE1-CG1 4.07Å; F171-V178 HydrophobicContact CE1-CG2 3.93Å
179	A	96.7	Very high	96	Very high	10 Å²	10	47 Å²	47	8%	0.083	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.9	179.1	0	0	0	0	0	110.1	F29 R169 I170 Y177	F29-A179 HydrophobicContact CD1-CB 4.47Å; F29-A179 HydrophobicContact CE1-CB 3.61Å; F29-A179 HydrophobicContact CE2-CB 3.99Å; F29-A179 HydrophobicContact CZ-CB 3.32Å; R169-A179 WeakPolarHBondContact CA-O 3.36Å; I170-A179 HydrophobicContact CB-CB 4.32Å; I170-A179 PolarHBondContact N-O 2.66Å; I170-A179 PolarHBondContact O-N 2.84Å; Y177-A179 HydrophobicContact CE2-CB 4.35Å
180	D	98	Very high	95.9	Very high	76 Å²	76	43.7 Å²	43.7	41%	0.406	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	121.9	175.8	-79	-8.9	0	0	0	109.3	I167 R169	I167-D180 HydrophobicContact CG2-CB 3.65Å; R169-D180 WeakPolarHBondContact CB-OD1 3.21Å; R169-D180 VanDerWaalsContact CG-OD1 3.3Å; R169-D180 WeakPolarHBondContact CG-OD1 3.27Å; R169-D180 IonicContact CZ-OD1 2.79Å; R169-D180 IonicContact CZ-OD2 3.85Å; R169-D180 IonicContact NE-OD1 2.76Å; R169-D180 PolarHBondContact NE-OD1 3.38Å; R169-D180 IonicContact NE-OD2 3.3Å; R169-D180 IonicContact NH2-OD1 3.81Å; R169-D180 IonicContact NH2-OD2 3.67Å; R169-D180 PolarHBondContact NH2-OD2 2.98Å
181	V	98.2	Very high	95.9	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	112.2	-179.6	-175.8	0	0	0	0	109.1	Y31 Y154 L168 I170 L189	Y31-V181 HydrophobicContact CD1-CG1 4.36Å; Y31-V181 HydrophobicContact CD1-CG2 4.39Å; Y154-V181 HydrophobicContact CE2-CG1 4.2Å; L168-V181 HydrophobicContact CB-CB 4.35Å; L168-V181 PolarHBondContact N-O 3Å; L168-V181 PolarHBondContact O-N 3.18Å; I170-V181 HydrophobicContact CD1-CG2 4.28Å; V181-L189 HydrophobicContact CG1-CD2 4.36Å; V181-L189 HydrophobicContact CG2-CD1 4.38Å
182	E	98.4	Very high	95.9	Very high	77 Å²	77	41.7 Å²	41.7	36%	0.36	24%	0.237	S	C	.	.			trans	-69.2	138	172.7	-65	-173.6	-132.1	0	0	110.9	A161 L184 R187	A161-E182 HydrophobicContact CB-CG 3.87Å; E182-L184 HydrophobicContact CB-CD2 3.76Å; E182-L184 HydrophobicContact CB-CG 3.83Å; E182-L184 PolarHBondContact O-N 3.46Å; E182-R187 WeakPolarHBondContact O-CD 3.36Å; E182-R187 PolarHBondContact O-NH1 2.85Å
183	P	98.3	Very high	96	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.235	C	C	.	.			trans	-81.8	52.9	-176.7	37.7	-39.8	0	0	0	111.7	Y154 N156 W159 R208	Y154-P183 HydrophobicContact CD1-CB 3.49Å; Y154-P183 VanDerWaalsContact CD1-CB 3.49Å; Y154-P183 HydrophobicContact CE1-CB 3.76Å; Y154-P183 HydrophobicContact CG-CB 4Å; N156-P183 WeakPolarHBondContact CB-O 3.47Å; N156-P183 PolarHBondContact ND2-O 2.97Å; W159-P183 HydrophobicContact CD2-CG 4.01Å; W159-P183 HydrophobicContact CG-CG 4.16Å; W159-P183 HydrophobicContact CZ2-CG 4.1Å; P183-R208 HydrophobicContact CB-CG 4.27Å; P183-R208 HydrophobicContact CG-CG 4.28Å
184	L	98.6	Very high	96.1	Very high	47 Å²	47	37.2 Å²	37.2	25%	0.246	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-66.2	149.4	-173.5	-56.1	-173.6	0	0	0	112.5	Y154 W159 E182 D186 R187	Y154-L184 CarbonylContact C-O 3.59Å; Y154-L184 WeakPolarHBondContact CB-O 3.2Å; W159-L184 HydrophobicContact CB-CD2 4.07Å; E182-L184 HydrophobicContact CB-CD2 3.76Å; E182-L184 HydrophobicContact CB-CG 3.83Å; E182-L184 PolarHBondContact O-N 3.46Å; L184-D186 PolarHBondContact O-N 2.98Å; L184-R187 HydrophobicContact CB-CB 4.4Å; L184-R187 WeakPolarHBondContact O-CB 3.42Å; L184-R187 PolarHBondContact O-N 3.05Å
185	F	98.6	Very high	96.4	Very high	36 Å²	36	40.1 Å²	40.1	16%	0.158	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	136.6	173.3	176.9	-100	0	0	0	112.2	G41 L45 N156 K157 R187	G41-F185 WeakPolarHBondContact O-CE2 3.45Å; L45-F185 HydrophobicContact CB-CE2 4.45Å; L45-F185 HydrophobicContact CD2-CE2 4.38Å; N156-F185 WeakPolarHBondContact O-CB 3.2Å; N156-F185 PolarHBondContact O-N 3Å; K157-F185 HydrophobicContact CD-CD2 4.39Å; K157-F185 HydrophobicContact CD-CE2 4.38Å; K157-F185 VanDerWaalsContact CE-CE2 3.48Å; K157-F185 VanDerWaalsContact CE-CZ 3.47Å; K157-F185 HydrophobicContact CG-CB 4Å; K157-F185 HydrophobicContact CG-CD1 4.22Å; K157-F185 HydrophobicContact CG-CD2 3.52Å; K157-F185 HydrophobicContact CG-CE2 3.99Å; K157-F185 HydrophobicContact CG-CG 3.65Å; F185-R187 PolarHBondContact O-N 3.46Å
186	D	97.8	Very high	96.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	25.7	177.7	-162	19.7	0	0	0	114.3	N34 F35 L36 G37 Y153 Y154 L184	N34-D186 WeakPolarHBondContact CA-OD2 3.44Å; N34-D186 PolarHBondContact N-O 3.41Å; F35-D186 VanDerWaalsContact N-CG 3.33Å; F35-D186 PolarHBondContact N-O 3.24Å; F35-D186 VanDerWaalsContact N-O 3.12Å; F35-D186 PolarHBondContact N-OD1 3.46Å; F35-D186 VanDerWaalsContact N-OD1 3.13Å; F35-D186 PolarHBondContact N-OD2 2.91Å; L36-D186 PolarHBondContact N-OD1 3.41Å; L36-D186 PolarHBondContact N-OD2 2.78Å; G37-D186 WeakPolarHBondContact CA-OD2 3.34Å; G37-D186 PolarHBondContact N-OD2 3.45Å; Y153-D186 WeakPolarHBondContact CE2-OD1 3.44Å; Y153-D186 PolarHBondContact OH-OD1 2.97Å; Y154-D186 PolarHBondContact O-N 3.21Å; L184-D186 PolarHBondContact O-N 2.98Å
187	R	98.5	Very high	97	Very high	16 Å²	16	34 Å²	34	6%	0.06	16%	0.156	C	C	.	.			trans	-92.5	128.3	168.8	176.3	173.6	-73.7	-176.9	-10.4	110.6	Y31 V32 D33 Y153 Y154 E182 L184 F185	Y31-R187 HydrophobicContact CD2-CG 4.31Å; Y31-R187 HydrophobicContact CG-CG 4.48Å; V32-R187 CarbonylContact O-C 3.06Å; V32-R187 WeakPolarHBondContact O-CA 3.44Å; D33-R187 WeakPolarHBondContact OD1-CB 3.15Å; D33-R187 IonicContact OD1-CZ 3.66Å; D33-R187 VanDerWaalsContact OD1-CZ 3.29Å; D33-R187 IonicContact OD1-NE 3.9Å; D33-R187 PolarHBondContact OD1-NE 2.86Å; D33-R187 IonicContact OD1-NH2 2.79Å; D33-R187 PolarHBondContact OD1-NH2 2.82Å; D33-R187 VanDerWaalsContact OD1-NH2 3.08Å; D33-R187 IonicContact OD2-CZ 2.68Å; D33-R187 IonicContact OD2-NE 3.95Å; D33-R187 IonicContact OD2-NH2 2.96Å; D33-R187 PolarHBondContact OD2-NH2 2.92Å; Y153-R187 WeakPolarHBondContact CA-O 3.32Å; Y154-R187 HydrophobicContact CD2-CB 3.99Å; Y154-R187 HydrophobicContact CD2-CG 3.9Å; Y154-R187 HydrophobicContact CE2-CG 4.47Å; Y154-R187 PolarHBondContact N-O 2.99Å; E182-R187 WeakPolarHBondContact O-CD 3.36Å; E182-R187 PolarHBondContact O-NH1 2.85Å; L184-R187 HydrophobicContact CB-CB 4.4Å; L184-R187 WeakPolarHBondContact O-CB 3.42Å; L184-R187 PolarHBondContact O-N 3.05Å; F185-R187 PolarHBondContact O-N 3.46Å
188	L	98.4	Very high	97.3	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.6	171.1	-173.2	69.2	0	0	0	109.7	Y31 V32 F35 I101 L104 C151 I152 Y153 F190	Y31-L188 CarbonylContact C-O 3.53Å; Y31-L188 WeakPolarHBondContact CA-O 3.12Å; Y31-L188 WeakPolarHBondContact CB-O 3.4Å; V32-L188 HydrophobicContact CG1-CB 3.78Å; V32-L188 HydrophobicContact CG1-CD2 4.38Å; V32-L188 PolarHBondContact N-O 2.98Å; V32-L188 PolarHBondContact O-N 2.89Å; F35-L188 HydrophobicContact CB-CB 4.07Å; F35-L188 HydrophobicContact CD1-CB 4.26Å; F35-L188 HydrophobicContact CD1-CD2 3.75Å; F35-L188 HydrophobicContact CD1-CG 4.47Å; F35-L188 HydrophobicContact CD2-CD2 3.85Å; F35-L188 HydrophobicContact CE1-CD2 3.7Å; F35-L188 HydrophobicContact CE2-CD2 3.79Å; F35-L188 HydrophobicContact CG-CB 4.05Å; F35-L188 HydrophobicContact CG-CD2 3.83Å; F35-L188 HydrophobicContact CZ-CD2 3.72Å; I101-L188 HydrophobicContact CD1-CD1 3.84Å; I101-L188 HydrophobicContact CG1-CD1 4.04Å; I101-L188 HydrophobicContact CG1-CD2 4.21Å; L104-L188 HydrophobicContact CD2-CD2 4.14Å; C151-L188 WeakPolarHBondContact SG-CD1 3.35Å; I152-L188 CarbonylContact O-C 3.48Å; I152-L188 WeakPolarHBondContact O-CA 3.46Å; Y153-L188 HydrophobicContact CD2-CB 4.24Å; Y153-L188 HydrophobicContact CD2-CD1 4.04Å; Y153-L188 HydrophobicContact CG-CD1 4.45Å; L188-F190 HydrophobicContact CD2-CE2 3.43Å; L188-F190 VanDerWaalsContact CD2-CE2 3.43Å; L188-F190 HydrophobicContact CD2-CZ 3.61Å; L188-F190 HydrophobicContact CG-CD2 4.42Å; L188-F190 HydrophobicContact CG-CE2 3.6Å; L188-F190 HydrophobicContact CG-CZ 4Å
189	L	98.4	Very high	97.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136.8	-178.9	171.1	71.9	0	0	0	110.4	F29 F30 C151 I152 Y154 L168 I170 V181 F191	F29-L189 HydrophobicContact CD2-CD1 4.39Å; F30-L189 CarbonylContact O-C 3.5Å; C151-L189 CarbonylContact C-O 3.48Å; C151-L189 VanDerWaalsContact CA-O 3.24Å; C151-L189 WeakPolarHBondContact CA-O 3.45Å; I152-L189 HydrophobicContact CB-CB 4.45Å; I152-L189 HydrophobicContact CD1-CD2 4.48Å; I152-L189 PolarHBondContact N-O 3.39Å; I152-L189 PolarHBondContact O-N 2.93Å; Y154-L189 HydrophobicContact CE2-CB 4.1Å; Y154-L189 HydrophobicContact CE2-CD2 4.26Å; L168-L189 HydrophobicContact CD2-CD2 3.3Å; I170-L189 HydrophobicContact CD1-CD2 4.49Å; V181-L189 HydrophobicContact CG1-CD2 4.36Å; V181-L189 HydrophobicContact CG2-CD1 4.38Å; L189-F191 HydrophobicContact CD2-CD1 3.94Å; L189-F191 HydrophobicContact CD2-CE1 4.07Å; L189-F191 HydrophobicContact CG-CD1 4.04Å
190	F	97.6	Very high	97.5	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.018	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	140	170.4	-65.6	-91.2	0	0	0	110.2	I20 L24 F29 F30 I101 L104 V105 V149 T150 C151 L188	I20-F190 HydrophobicContact CD1-CD2 4.28Å; I20-F190 HydrophobicContact CD1-CE2 3.97Å; L24-F190 HydrophobicContact CD1-CB 4.36Å; L24-F190 HydrophobicContact CD2-CB 4.16Å; F29-F190 CarbonylContact C-O 3.45Å; F29-F190 WeakPolarHBondContact CA-O 3.46Å; F29-F190 WeakPolarHBondContact CB-O 3.22Å; F30-F190 PolarHBondContact N-O 2.95Å; F30-F190 PolarHBondContact O-N 3.24Å; I101-F190 HydrophobicContact CG2-CE1 4.24Å; I101-F190 HydrophobicContact CG2-CZ 4.23Å; L104-F190 HydrophobicContact CD2-CE2 3.78Å; L104-F190 HydrophobicContact CD2-CZ 3.58Å; V105-F190 HydrophobicContact CG2-CE1 4Å; V149-F190 HydrophobicContact CG1-CD1 4.02Å; T150-F190 WeakPolarHBondContact O-CA 3.45Å; C151-F190 HydrophobicContact CB-CD1 4.02Å; C151-F190 HydrophobicContact CB-CE1 3.85Å; C151-F190 VanDerWaalsContact SG-CE1 3.52Å; L188-F190 HydrophobicContact CD2-CE2 3.43Å; L188-F190 VanDerWaalsContact CD2-CE2 3.43Å; L188-F190 HydrophobicContact CD2-CZ 3.61Å; L188-F190 HydrophobicContact CG-CD2 4.42Å; L188-F190 HydrophobicContact CG-CE2 3.6Å; L188-F190 HydrophobicContact CG-CZ 4Å
191	F	97.4	Very high	97.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	157.7	167.1	61.4	-86.8	0	0	0	111.1	G28 F29 T150 I152 L189 S193 N197 H199	G28-F191 WeakPolarHBondContact O-CA 3.41Å; F29-F191 HydrophobicContact CB-CB 3.64Å; T150-F191 VanDerWaalsContact CB-CZ 3.47Å; T150-F191 HydrophobicContact CG2-CD1 4.49Å; T150-F191 HydrophobicContact CG2-CE1 3.65Å; T150-F191 HydrophobicContact CG2-CE2 4.1Å; T150-F191 HydrophobicContact CG2-CZ 3.41Å; T150-F191 VanDerWaalsContact CG2-CZ 3.41Å; T150-F191 PolarHBondContact N-O 3.43Å; T150-F191 PolarHBondContact O-N 3.3Å; I152-F191 HydrophobicContact CD1-CE1 3.72Å; I152-F191 HydrophobicContact CD1-CZ 4.22Å; I152-F191 HydrophobicContact CG1-CE1 4.14Å; L189-F191 HydrophobicContact CD2-CD1 3.94Å; L189-F191 HydrophobicContact CD2-CE1 4.07Å; L189-F191 HydrophobicContact CG-CD1 4.04Å; F191-S193 PolarHBondContact O-N 2.79Å; F191-N197 HydrophobicContact CD2-CB 3.92Å; F191-H199 AromaticContact CE2-CE1 3.47Å; F191-H199 VanDerWaalsContact CE2-CE1 3.47Å; F191-H199 WeakPolarHBondContact CE2-CE1 3.45Å; F191-H199 AromaticContact CE2-ND1 3.65Å; F191-H199 AromaticContact CZ-CE1 3.7Å; F191-H199 AromaticContact CZ-NE2 3.91Å
192	W	96.7	Very high	97.4	Very high	8 Å²	8	28.4 Å²	28.4	3%	0.03	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	129.9	173.5	-56.8	113.8	0	0	0	111.1	L24 L25 G28 L112 C148 V149 D194 R196 N197	L24-W192 HydrophobicContact CB-CZ2 3.88Å; L24-W192 PolarHBondContact O-NE1 3.02Å; L25-W192 HydrophobicContact CD2-CZ2 4.37Å; G28-W192 PolarHBondContact O-N 3.2Å; L112-W192 HydrophobicContact CB-CH2 3.81Å; L112-W192 HydrophobicContact CB-CZ3 4.37Å; L112-W192 HydrophobicContact CD2-CH2 3.88Å; L112-W192 HydrophobicContact CD2-CZ2 4.31Å; L112-W192 HydrophobicContact CG-CH2 4.29Å; C148-W192 WeakPolarHBondContact O-CA 3.5Å; V149-W192 HydrophobicContact CG2-CE3 3.94Å; V149-W192 HydrophobicContact CG2-CZ3 3.83Å; W192-D194 VanDerWaalsContact C-N 3.27Å; W192-D194 PolarHBondContact O-N 3.38Å; W192-R196 HydrophobicContact CB-CB 4.36Å; W192-R196 VanDerWaalsContact CD2-CZ 3.42Å; W192-N197 WeakPolarHBondContact CB-ND2 3.48Å; W192-N197 PolarHBondContact N-ND2 3.36Å; W192-N197 WeakPolarHBondContact O-CB 3.42Å; W192-N197 PolarHBondContact O-ND2 3.12Å; W192-N197 VanDerWaalsContact O-ND2 3.09Å
193	S	96.6	Very high	97.3	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.007	13%	0.128	C	C	.	.	S	Bend	trans	-72.8	-18.2	-177.9	-53.4	0	0	0	0	113.8	D140 N141 R147 C148 V149 T150 F191	D140-S193 VanDerWaalsContact CB-O 3.32Å; D140-S193 WeakPolarHBondContact CB-O 3.48Å; D140-S193 PolarHBondContact N-O 2.76Å; N141-S193 PolarHBondContact N-O 2.92Å; R147-S193 WeakPolarHBondContact O-CB 3.44Å; C148-S193 PolarHBondContact O-N 3Å; V149-S193 PolarHBondContact N-OG 3.01Å; T150-S193 PolarHBondContact N-OG 3.45Å; T150-S193 WeakPolarHBondContact OG1-CB 3.27Å; T150-S193 PolarHBondContact OG1-OG 3Å; F191-S193 PolarHBondContact O-N 2.79Å
194	D	95	Very high	97.1	Very high	42 Å²	42	27.4 Å²	27.4	23%	0.225	13%	0.128	C	C	.	.	S	Bend	trans	-82	-167.4	-175.2	69.1	20.9	0	0	0	113.1	V139 W192 R196 N197	V139-D194 VanDerWaalsContact CG1-C 3.45Å; V139-D194 WeakPolarHBondContact CG1-O 3.34Å; W192-D194 VanDerWaalsContact C-N 3.27Å; W192-D194 PolarHBondContact O-N 3.38Å; D194-R196 VanDerWaalsContact CG-NE 3.27Å; D194-R196 PolarHBondContact O-N 2.78Å; D194-R196 VanDerWaalsContact OD1-CB 3.22Å; D194-R196 WeakPolarHBondContact OD1-CB 3.31Å; D194-R196 VanDerWaalsContact OD1-CG 3.26Å; D194-R196 WeakPolarHBondContact OD1-CG 3.4Å; D194-R196 IonicContact OD1-CZ 3.61Å; D194-R196 PolarHBondContact OD1-N 3.46Å; D194-R196 IonicContact OD1-NE 2.77Å; D194-R196 PolarHBondContact OD1-NE 3.23Å; D194-R196 IonicContact OD1-NH2 3.52Å; D194-R196 IonicContact OD2-CZ 2.79Å; D194-R196 IonicContact OD2-NE 3.58Å; D194-R196 PolarHBondContact OD2-NE 2.96Å; D194-R196 IonicContact OD2-NH2 3.56Å; D194-R196 PolarHBondContact OD2-NH2 3.4Å; D194-N197 PolarHBondContact O-N 2.93Å; D194-N197 VanDerWaalsContact O-N 3.16Å
195	R	95.1	Very high	97	Very high	145 Å²	145	32.3 Å²	32.3	55%	0.547	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-9.3	-175.6	-65.7	-179.9	179.7	-108.3	-3.3	114.6	V139 P142 N197 P198	V139-R195 HydrophobicContact CG1-CG 4.26Å; P142-R195 PolarHBondContact O-NE 3.25Å; P142-R195 PolarHBondContact O-NH2 2.88Å; R195-N197 PolarHBondContact O-N 3.44Å; R195-P198 VanDerWaalsContact O-CD 3.29Å; R195-P198 WeakPolarHBondContact O-CD 3.25Å
196	R	94.9	Very high	96.9	Very high	90 Å²	90	31.8 Å²	31.8	34%	0.34	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-27.8	173.2	-69.8	174.3	-78.2	174.7	-4.3	112.6	P172 E173 W192 D194	P172-R196 CarbonylContact C-O 3.58Å; P172-R196 WeakPolarHBondContact CA-O 3.5Å; E173-R196 PolarHBondContact N-O 3.38Å; W192-R196 HydrophobicContact CB-CB 4.36Å; W192-R196 VanDerWaalsContact CD2-CZ 3.42Å; D194-R196 VanDerWaalsContact CG-NE 3.27Å; D194-R196 PolarHBondContact O-N 2.78Å; D194-R196 VanDerWaalsContact OD1-CB 3.22Å; D194-R196 WeakPolarHBondContact OD1-CB 3.31Å; D194-R196 VanDerWaalsContact OD1-CG 3.26Å; D194-R196 WeakPolarHBondContact OD1-CG 3.4Å; D194-R196 IonicContact OD1-CZ 3.61Å; D194-R196 PolarHBondContact OD1-N 3.46Å; D194-R196 IonicContact OD1-NE 2.77Å; D194-R196 PolarHBondContact OD1-NE 3.23Å; D194-R196 IonicContact OD1-NH2 3.52Å; D194-R196 IonicContact OD2-CZ 2.79Å; D194-R196 IonicContact OD2-NE 3.58Å; D194-R196 PolarHBondContact OD2-NE 2.96Å; D194-R196 IonicContact OD2-NH2 3.56Å; D194-R196 PolarHBondContact OD2-NH2 3.4Å
197	N	96.7	Very high	96.9	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	17%	0.166	C	C	.	.			trans	-131.9	69.4	-177	-63.4	-56.5	0	0	0	113.8	G28 I170 F191 W192 D194 R195 H199	G28-N197 PolarHBondContact O-ND2 3.27Å; I170-N197 HydrophobicContact CG2-CB 3.92Å; F191-N197 HydrophobicContact CD2-CB 3.92Å; W192-N197 WeakPolarHBondContact CB-ND2 3.48Å; W192-N197 PolarHBondContact N-ND2 3.36Å; W192-N197 WeakPolarHBondContact O-CB 3.42Å; W192-N197 PolarHBondContact O-ND2 3.12Å; W192-N197 VanDerWaalsContact O-ND2 3.09Å; D194-N197 PolarHBondContact O-N 2.93Å; D194-N197 VanDerWaalsContact O-N 3.16Å; R195-N197 PolarHBondContact O-N 3.44Å; N197-H199 PolarHBondContact O-N 3.13Å; N197-H199 PolarHBondContact O-ND1 2.92Å
198	P	97.6	Very high	96.9	Very high	25 Å²	25	34.4 Å²	34.4	16%	0.162	16%	0.164	C	C	.	.			trans	-56.4	134.9	161.5	-17.8	31.5	0	0	0	109.6	H138 V139 F171 R195	H138-P198 CarbonylContact O-C 3.47Å; H138-P198 VanDerWaalsContact O-CA 3.27Å; H138-P198 WeakPolarHBondContact O-CA 3.47Å; V139-P198 HydrophobicContact CG2-CB 4.01Å; V139-P198 HydrophobicContact CG2-CG 3.94Å; F171-P198 WeakPolarHBondContact CD2-O 3.37Å; F171-P198 PolarHBondContact N-O 2.95Å; F171-P198 WeakPolarHBondContact O-CD 3.44Å; R195-P198 VanDerWaalsContact O-CD 3.29Å; R195-P198 WeakPolarHBondContact O-CD 3.25Å
199	H	98.2	Very high	96.9	Very high	7 Å²	7	35.6 Å²	35.6	3%	0.032	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	157.7	-176.1	59.6	-85.8	0	0	0	112.1	K137 H138 D140 L168 R169 I170 F191 N197	K137-H199 CarbonylContact C-O 3.58Å; K137-H199 VanDerWaalsContact CA-O 3.31Å; K137-H199 WeakPolarHBondContact CA-O 3.36Å; H138-H199 AromaticContact CE1-CD2 3.77Å; H138-H199 AromaticContact CE1-NE2 3.56Å; H138-H199 PolarHBondContact N-O 3.07Å; H138-H199 PolarHBondContact ND1-O 2.86Å; H138-H199 AromaticContact NE2-CE1 4Å; H138-H199 AromaticContact NE2-NE2 3.33Å; H138-H199 PolarHBondContact NE2-NE2 2.83Å; H138-H199 PolarHBondContact O-N 3.05Å; D140-H199 IonicContact OD1-CE1 3.2Å; D140-H199 IonicContact OD2-CE1 3.64Å; L168-H199 HydrophobicContact CD1-CB 4.22Å; R169-H199 CarbonylContact O-C 3.56Å; R169-H199 WeakPolarHBondContact O-CA 3.44Å; R169-H199 WeakPolarHBondContact O-CB 3.28Å; I170-H199 HydrophobicContact CB-CB 4.38Å; I170-H199 HydrophobicContact CG1-CB 4.06Å; I170-H199 HydrophobicContact CG2-CB 4.5Å; F191-H199 AromaticContact CE2-CE1 3.47Å; F191-H199 VanDerWaalsContact CE2-CE1 3.47Å; F191-H199 WeakPolarHBondContact CE2-CE1 3.45Å; F191-H199 AromaticContact CE2-ND1 3.65Å; F191-H199 AromaticContact CZ-CE1 3.7Å; F191-H199 AromaticContact CZ-NE2 3.91Å; N197-H199 PolarHBondContact O-N 3.13Å; N197-H199 PolarHBondContact O-ND1 2.92Å
200	E	97.5	Very high	96.9	Very high	45 Å²	45	35.7 Å²	35.7	21%	0.21	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	152.2	177.1	69	-170.6	169	0	0	110.7	Y135 K137 R169 F171 L202	Y135-E200 WeakPolarHBondContact O-CA 3.16Å; Y135-E200 WeakPolarHBondContact O-CB 3.4Å; K137-E200 HydrophobicContact CB-CB 4.01Å; R169-E200 HydrophobicContact CB-CG 3.92Å; R169-E200 HydrophobicContact CG-CG 4.42Å; R169-E200 PolarHBondContact N-O 3.48Å; R169-E200 PolarHBondContact O-N 2.87Å; F171-E200 HydrophobicContact CE2-CG 3.99Å; F171-E200 HydrophobicContact CZ-CG 4.48Å; F171-E200 WeakPolarHBondContact CZ-OE1 3.42Å; E200-L202 HydrophobicContact CG-CD2 4.04Å
201	V	97.6	Very high	96.9	Very high	13 Å²	13	35.7 Å²	35.7	8%	0.079	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	112	169.7	-179	0	0	0	0	107.1	Y128 G134 Y135 L168	Y128-V201 HydrophobicContact CE1-CB 4.44Å; Y128-V201 HydrophobicContact CE1-CG1 4.12Å; G134-V201 WeakPolarHBondContact CA-O 3.42Å; Y135-V201 PolarHBondContact N-O 3.14Å; Y135-V201 PolarHBondContact O-N 3.33Å; L168-V201 HydrophobicContact CD1-CG2 3.93Å
202	L	97.2	Very high	97	Very high	39 Å²	39	36.2 Å²	36.2	20%	0.204	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	156	176.6	-61	-170.1	0	0	0	110.7	G166 I167 E200 S204	G166-L202 WeakPolarHBondContact CA-O 3.3Å; I167-L202 HydrophobicContact CB-CB 4.49Å; I167-L202 HydrophobicContact CB-CD1 4.04Å; I167-L202 HydrophobicContact CB-CG 4.35Å; I167-L202 HydrophobicContact CD1-CD1 4.5Å; I167-L202 HydrophobicContact CG2-CD1 4.49Å; I167-L202 PolarHBondContact O-N 3.21Å; E200-L202 HydrophobicContact CG-CD2 4.04Å; L202-S204 PolarHBondContact O-N 3.04Å
203	P	96.1	Very high	97	Very high	56 Å²	56	35.9 Å²	35.9	36%	0.364	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-48.4	127.4	178.7	-30.7	37.4	0	0	0	112.7	G166 Y205	G166-P203 PolarHBondContact N-O 3.34Å; P203-Y205 HydrophobicContact CB-CE2 4.05Å
204	S	95.5	Very high	97.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.2	175.6	-166.8	0	0	0	0	109.5	G130 N131 G132 T133 W159 L202 A206	G130-S204 CarbonylContact C-O 3.58Å; G130-S204 WeakPolarHBondContact CA-O 3.36Å; N131-S204 PolarHBondContact N-O 3.4Å; G132-S204 WeakPolarHBondContact CA-O 3.4Å; G132-S204 PolarHBondContact N-O 2.79Å; T133-S204 PolarHBondContact O-N 3.47Å; W159-S204 WeakPolarHBondContact CH2-OG 3.31Å; L202-S204 PolarHBondContact O-N 3.04Å; S204-A206 PolarHBondContact OG-O 3.04Å
205	Y	96.3	Very high	97.1	Very high	150 Å²	150	35.1 Å²	35.1	59%	0.588	17%	0.166	S	C	*	.	S	Bend	trans	-106.8	-8.3	178.6	-61.1	-78.5	0	0	0	113	H164 P203	H164-Y205 PolarHBondContact O-N 2.71Å; P203-Y205 HydrophobicContact CB-CE2 4.05Å
206	A	96.8	Very high	97.1	Very high	26 Å²	26	29.2 Å²	29.2	22%	0.215	14%	0.144	C	C	.	.	S	Bend	trans	-117.1	165.5	166.8	0	0	0	0	0	111.1	W159 H164 S204 R208	W159-A206 HydrophobicContact CH2-CB 3.91Å; W159-A206 HydrophobicContact CZ3-CB 3.84Å; H164-A206 HydrophobicContact CB-CB 3.9Å; S204-A206 PolarHBondContact OG-O 3.04Å; A206-R208 PolarHBondContact O-N 3.48Å
207	T	97.2	Very high	97	Very high	64 Å²	64	25.6 Å²	25.6	39%	0.393	13%	0.131	S	C	.	.			trans	-65.4	118	174.7	-57.1	0	0	0	0	110.1	Y128 Y209	Y128-T207 CarbonylContact O-C 3.59Å; Y128-T207 VanDerWaalsContact O-CA 3.31Å; Y128-T207 WeakPolarHBondContact O-CA 3.28Å; T207-Y209 HydrophobicContact CG2-CD2 4.3Å; T207-Y209 HydrophobicContact CG2-CE1 4.08Å; T207-Y209 HydrophobicContact CG2-CE2 3.61Å; T207-Y209 VanDerWaalsContact CG2-CZ 3.47Å
208	R	98	Very high	96.7	Very high	6 Å²	6	27 Å²	27	2%	0.023	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	118.5	-177.1	174.6	-170	-178.2	-78.1	7	110.9	C127 Y128 Y154 N156 W159 G166 P183 A206	C127-R208 WeakPolarHBondContact CA-O 3.21Å; Y128-R208 PolarHBondContact N-O 2.86Å; Y128-R208 PolarHBondContact O-N 2.95Å; Y154-R208 VanDerWaalsContact CE1-NH2 3.32Å; N156-R208 VanDerWaalsContact OD1-CA 3.32Å; N156-R208 WeakPolarHBondContact OD1-CA 3.44Å; W159-R208 HydrophobicContact CH2-CB 3.65Å; W159-R208 HydrophobicContact CH2-CG 4.24Å; W159-R208 HydrophobicContact CZ2-CB 4.4Å; W159-R208 HydrophobicContact CZ3-CB 4.04Å; G166-R208 PolarHBondContact O-NE 2.72Å; P183-R208 HydrophobicContact CB-CG 4.27Å; P183-R208 HydrophobicContact CG-CG 4.28Å; A206-R208 PolarHBondContact O-N 3.48Å
209	Y	98.4	Very high	96.4	Very high	25 Å²	25	31.6 Å²	31.6	10%	0.098	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	144	175.7	-61.3	-69.4	0	0	0	111.9	L45 V48 K49 H52 A126 C127 N156 T207	L45-Y209 HydrophobicContact CD1-CD2 4.03Å; V48-Y209 HydrophobicContact CG1-CD1 3.57Å; V48-Y209 HydrophobicContact CG1-CE1 4.18Å; V48-Y209 HydrophobicContact CG1-CG 3.89Å; K49-Y209 HydrophobicContact CG-CE2 4.13Å; H52-Y209 HydrophobicContact CB-CE1 4.15Å; H52-Y209 AromaticContact ND1-CE1 3.65Å; H52-Y209 AromaticContact ND1-CZ 3.65Å; H52-Y209 PolarHBondContact ND1-OH 2.79Å; A126-Y209 WeakPolarHBondContact O-CA 2.96Å; C127-Y209 HydrophobicContact CB-CD1 3.79Å; C127-Y209 HydrophobicContact CB-CE1 3.68Å; C127-Y209 WeakPolarHBondContact SG-CE1 3.35Å; N156-Y209 PolarHBondContact ND2-O 2.86Å; N156-Y209 PolarHBondContact OD1-N 3.4Å; N156-Y209 PolarHBondContact OD1-O 3.4Å; T207-Y209 HydrophobicContact CG2-CD2 4.3Å; T207-Y209 HydrophobicContact CG2-CE1 4.08Å; T207-Y209 HydrophobicContact CG2-CE2 3.61Å; T207-Y209 VanDerWaalsContact CG2-CZ 3.47Å
210	A	98.3	Very high	96.1	Very high	3 Å²	3	33.6 Å²	33.6	3%	0.025	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	152.3	170.5	0	0	0	0	0	110.5	A126 I152 Y153 Y154	A126-A210 PolarHBondContact N-O 3.18Å; A126-A210 PolarHBondContact O-N 3.13Å; I152-A210 HydrophobicContact CG2-CB 3.94Å; Y153-A210 CarbonylContact O-C 3.58Å; Y153-A210 WeakPolarHBondContact O-CA 3.32Å; Y154-A210 HydrophobicContact CD1-CB 4Å; Y154-A210 HydrophobicContact CE1-CB 4.21Å
211	V	98.3	Very high	95.8	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.024	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	120.9	171.5	-179.2	0	0	0	0	107.9	V48 L97 A123 M124 V125 I152 Y153 L155	V48-V211 HydrophobicContact CG2-CG2 4.07Å; L97-V211 HydrophobicContact CD2-CB 4.37Å; L97-V211 HydrophobicContact CD2-CG1 4.34Å; A123-V211 HydrophobicContact CB-CG1 3.91Å; M124-V211 WeakPolarHBondContact O-CA 3.31Å; V125-V211 HydrophobicContact CG2-CG2 4.32Å; I152-V211 CarbonylContact C-O 3.56Å; I152-V211 WeakPolarHBondContact CA-O 3.45Å; Y153-V211 PolarHBondContact N-O 2.68Å; Y153-V211 PolarHBondContact O-N 3.35Å; L155-V211 HydrophobicContact CD1-CG2 3.86Å
212	T	98.3	Very high	95.4	Very high	10 Å²	10	36.1 Å²	36.1	6%	0.061	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	137.2	-178	-52.8	0	0	0	0	111.2	M124 T150 C151 I152 W214	M124-T212 PolarHBondContact N-O 3.32Å; M124-T212 PolarHBondContact O-N 3.4Å; T150-T212 HydrophobicContact CG2-CG2 3.86Å; C151-T212 CarbonylContact O-C 3.52Å; C151-T212 VanDerWaalsContact O-CA 3.31Å; C151-T212 WeakPolarHBondContact O-CA 3.44Å; I152-T212 HydrophobicContact CG1-CG2 4.04Å; T212-W214 HydrophobicContact CG2-CD2 4.14Å; T212-W214 HydrophobicContact CG2-CE3 4.3Å; T212-W214 HydrophobicContact CG2-CH2 3.69Å; T212-W214 HydrophobicContact CG2-CZ2 3.49Å; T212-W214 VanDerWaalsContact CG2-CZ2 3.49Å; T212-W214 HydrophobicContact CG2-CZ3 4.07Å
213	V	97.8	Very high	95.1	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	146	166.9	-67.6	0	0	0	0	110.2	L98 I101 A123 C151 Y215	L98-V213 HydrophobicContact CD2-CG1 3.44Å; L98-V213 VanDerWaalsContact CD2-CG1 3.44Å; I101-V213 HydrophobicContact CG2-CG2 4.43Å; A123-V213 HydrophobicContact CB-CG1 4.1Å; C151-V213 HydrophobicContact CB-CG2 3.76Å; C151-V213 PolarHBondContact N-O 3.18Å; C151-V213 PolarHBondContact O-N 3.25Å; V213-Y215 HydrophobicContact CG2-CE2 3.81Å
214	W	97.5	Very high	94.8	Very high	19 Å²	19	36.9 Å²	36.9	7%	0.072	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.9	173.6	-62.2	-88.9	0	0	0	110.2	W83 R120 S121 M124 D140 R147 V149 T150 T212	W83-W214 HydrophobicContact CH2-CE3 4.26Å; W83-W214 HydrophobicContact CH2-CH2 4.26Å; W83-W214 AromaticContact CH2-CZ3 3.51Å; W83-W214 HydrophobicContact CH2-CZ3 3.51Å; W83-W214 HydrophobicContact CZ3-CE3 4.35Å; W83-W214 AromaticContact CZ3-CZ3 3.76Å; W83-W214 HydrophobicContact CZ3-CZ3 3.76Å; R120-W214 CarbonylContact C-O 3.59Å; R120-W214 WeakPolarHBondContact CA-O 3.34Å; R120-W214 WeakPolarHBondContact CB-O 3.38Å; S121-W214 PolarHBondContact N-O 2.99Å; S121-W214 PolarHBondContact OG-N 3.01Å; M124-W214 HydrophobicContact CB-CH2 4.07Å; M124-W214 HydrophobicContact CB-CZ3 3.83Å; M124-W214 HydrophobicContact CE-CH2 3.61Å; M124-W214 HydrophobicContact CE-CZ2 4.33Å; M124-W214 HydrophobicContact SD-CH2 3.69Å; M124-W214 HydrophobicContact SD-CZ3 4.29Å; D140-W214 PolarHBondContact OD2-NE1 3.38Å; R147-W214 HydrophobicContact CB-CB 4.3Å; R147-W214 VanDerWaalsContact CD-CG 3.5Å; R147-W214 HydrophobicContact CG-CB 3.74Å; R147-W214 HydrophobicContact CG-CG 4.12Å; V149-W214 WeakPolarHBondContact O-CA 3.18Å; T150-W214 PolarHBondContact OG1-NE1 3.21Å; T212-W214 HydrophobicContact CG2-CD2 4.14Å; T212-W214 HydrophobicContact CG2-CE3 4.3Å; T212-W214 HydrophobicContact CG2-CH2 3.69Å; T212-W214 HydrophobicContact CG2-CZ2 3.49Å; T212-W214 VanDerWaalsContact CG2-CZ2 3.49Å; T212-W214 HydrophobicContact CG2-CZ3 4.07Å
215	Y	96.1	Very high	94.5	Very high	7 Å²	7	40.6 Å²	40.6	3%	0.027	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.6	173.1	-72.4	-87.9	0	0	0	110.1	I101 D102 V105 I117 R120 C148 V149 C151 V213	I101-Y215 HydrophobicContact CG2-CE2 3.86Å; I101-Y215 WeakPolarHBondContact CG2-OH 3.48Å; D102-Y215 PolarHBondContact N-OH 3.45Å; D102-Y215 WeakPolarHBondContact OD1-CE1 3.16Å; D102-Y215 PolarHBondContact OD1-OH 2.82Å; V105-Y215 HydrophobicContact CB-CD1 4.29Å; V105-Y215 HydrophobicContact CB-CE1 3.93Å; V105-Y215 HydrophobicContact CB-CE2 4.38Å; V105-Y215 HydrophobicContact CG1-CD1 3.72Å; V105-Y215 HydrophobicContact CG1-CD2 4.47Å; V105-Y215 HydrophobicContact CG1-CE1 3.85Å; V105-Y215 HydrophobicContact CG1-CG 4.06Å; V105-Y215 HydrophobicContact CG2-CD1 4.4Å; V105-Y215 HydrophobicContact CG2-CD2 3.99Å; V105-Y215 HydrophobicContact CG2-CE1 4.04Å; V105-Y215 HydrophobicContact CG2-CE2 3.58Å; V105-Y215 HydrophobicContact CG2-CG 4.39Å; I117-Y215 HydrophobicContact CG2-CD1 3.67Å; I117-Y215 HydrophobicContact CG2-CG 4.15Å; R120-Y215 HydrophobicContact CB-CD1 3.67Å; R120-Y215 HydrophobicContact CB-CE1 3.73Å; R120-Y215 HydrophobicContact CB-CG 4.16Å; R120-Y215 HydrophobicContact CG-CD1 4.5Å; R120-Y215 HydrophobicContact CG-CE1 4.1Å; C148-Y215 PolarHBondContact N-O 3Å; C148-Y215 PolarHBondContact SG-O 3.47Å; V149-Y215 PolarHBondContact N-O 3.44Å; V149-Y215 PolarHBondContact O-N 3.32Å; C151-Y215 HydrophobicContact CB-CE2 4.33Å; V213-Y215 HydrophobicContact CG2-CE2 3.81Å
216	F	94.4	Very high	94.2	Very high	22 Å²	22	39.8 Å²	39.8	10%	0.096	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	132.6	-174.9	-63.4	-82.5	0	0	0	111.9	I117 E119 G146 R147 R221	I117-F216 WeakPolarHBondContact CA-O 3.4Å; E119-F216 HydrophobicContact CG-CB 3.88Å; E119-F216 HydrophobicContact CG-CD2 3.88Å; E119-F216 HydrophobicContact CG-CG 4.2Å; E119-F216 PolarHBondContact O-N 2.83Å; G146-F216 CarbonylContact O-C 3.56Å; G146-F216 WeakPolarHBondContact O-CA 3.49Å; R147-F216 HydrophobicContact CB-CE1 4.47Å; R147-F216 HydrophobicContact CG-CD1 3.83Å; R147-F216 HydrophobicContact CG-CE1 3.35Å; R147-F216 HydrophobicContact CG-CZ 4.04Å; F216-R221 HydrophobicContact CB-CB 4.29Å; F216-R221 HydrophobicContact CB-CG 4.26Å; F216-R221 HydrophobicContact CD1-CG 4.29Å; F216-R221 HydrophobicContact CG-CG 4.42Å
217	D	93.6	Very high	93.8	Very high	13 Å²	13	43.7 Å²	43.7	7%	0.07	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	127.7	162.1	177.3	-97.2	0	0	0	109.7	S115 I116 G146 C148 E219 E220 R221	S115-D217 WeakPolarHBondContact CA-OD2 3.37Å; I116-D217 PolarHBondContact N-OD2 3.28Å; G146-D217 PolarHBondContact O-N 3.45Å; C148-D217 HydrophobicContact CB-CB 4.11Å; D217-E219 PolarHBondContact O-N 3.42Å; D217-E219 PolarHBondContact OD1-N 3.15Å; D217-E220 HydrophobicContact CB-CB 4.15Å; D217-E220 WeakPolarHBondContact OD1-CB 3.16Å; D217-E220 PolarHBondContact OD1-N 3.24Å; D217-R221 WeakPolarHBondContact O-CB 3.43Å; D217-R221 PolarHBondContact O-N 3.09Å
218	S	90.9	Very high	93.1	Very high	31 Å²	31	47.2 Å²	47.2	22%	0.217	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-37	-171.4	-60.6	0	0	0	0	113	I116 R118 A222	I116-S218 VanDerWaalsContact O-CB 3.31Å; I116-S218 WeakPolarHBondContact O-CB 3.37Å; I116-S218 PolarHBondContact O-N 3.04Å; I116-S218 PolarHBondContact O-OG 2.88Å; R118-S218 WeakPolarHBondContact CB-OG 3.4Å; R118-S218 VanDerWaalsContact CD-OG 3.26Å; R118-S218 WeakPolarHBondContact CD-OG 3.48Å; R118-S218 WeakPolarHBondContact CG-OG 3.45Å; S218-A222 WeakPolarHBondContact O-CB 3.49Å; S218-A222 PolarHBondContact O-N 3.46Å; S218-A222 VanDerWaalsContact O-N 3.1Å
219	E	90.9	Very high	92.4	Very high	122 Å²	122	54.2 Å²	54.2	57%	0.57	24%	0.243	S	C	*	.	H	α-helix	trans	-75.5	-51.6	-176.8	-65.3	-173.2	173.3	0	0	110.2	D217 R221 A222 E223	D217-E219 PolarHBondContact O-N 3.42Å; D217-E219 PolarHBondContact OD1-N 3.15Å; E219-R221 VanDerWaalsContact C-N 3.27Å; E219-R221 PolarHBondContact O-N 3.25Å; E219-A222 WeakPolarHBondContact O-CB 3.47Å; E219-A222 PolarHBondContact O-N 3.32Å; E219-A222 VanDerWaalsContact O-N 3.13Å; E219-E223 PolarHBondContact O-N 3.3Å
220	E	91.1	Very high	91.7	Very high	49 Å²	49	58.3 Å²	58.3	23%	0.229	27%	0.266	C	S	.	.	H	α-helix	trans	-60	-40.2	177.7	-170.9	-174.5	120.8	0	0	110.9	N141 A144 D145 G146 D217 E223 A224	N141-E220 PolarHBondContact ND2-OE1 3.43Å; A144-E220 WeakPolarHBondContact CA-OE1 3.24Å; A144-E220 HydrophobicContact CB-CG 3.98Å; D145-E220 PolarHBondContact N-OE1 2.88Å; G146-E220 WeakPolarHBondContact CA-OE1 3.42Å; G146-E220 PolarHBondContact N-OE1 3.26Å; D217-E220 HydrophobicContact CB-CB 4.15Å; D217-E220 WeakPolarHBondContact OD1-CB 3.16Å; D217-E220 PolarHBondContact OD1-N 3.24Å; E220-E223 WeakPolarHBondContact O-CB 3.44Å; E220-E223 PolarHBondContact O-N 3.03Å; E220-A224 WeakPolarHBondContact O-CB 3.36Å; E220-A224 PolarHBondContact O-N 3.33Å
221	R	91.2	Very high	90.8	Very high	72 Å²	72	63.3 Å²	63.3	27%	0.272	29%	0.292	S	S	.	.	H	α-helix	trans	-66.1	-39.4	177.3	-174.8	57.4	175.2	154.2	3.5	112.4	E119 D145 F216 D217 E219 E223 A224 K225	E119-R221 VanDerWaalsContact OE1-CG 3.27Å; E119-R221 WeakPolarHBondContact OE1-CG 3.4Å; E119-R221 IonicContact OE1-NE 3.84Å; D145-R221 VanDerWaalsContact O-CD 3.3Å; D145-R221 WeakPolarHBondContact O-CD 3.42Å; D145-R221 PolarHBondContact O-NH1 2.93Å; D145-R221 VanDerWaalsContact O-NH1 3.15Å; F216-R221 HydrophobicContact CB-CB 4.29Å; F216-R221 HydrophobicContact CB-CG 4.26Å; F216-R221 HydrophobicContact CD1-CG 4.29Å; F216-R221 HydrophobicContact CG-CG 4.42Å; D217-R221 WeakPolarHBondContact O-CB 3.43Å; D217-R221 PolarHBondContact O-N 3.09Å; E219-R221 VanDerWaalsContact C-N 3.27Å; E219-R221 PolarHBondContact O-N 3.25Å; R221-E223 VanDerWaalsContact C-N 3.33Å; R221-A224 PolarHBondContact O-N 2.86Å; R221-K225 WeakPolarHBondContact O-CG 3.31Å; R221-K225 PolarHBondContact O-N 3.07Å
222	A	90.4	Very high	89.6	Confident	39 Å²	39	65.8 Å²	65.8	32%	0.322	31%	0.307	S	S	.	.	H	α-helix	trans	-64	-41.3	175.1	0	0	0	0	0	111.1	S218 E219 K225 R226	S218-A222 WeakPolarHBondContact O-CB 3.49Å; S218-A222 PolarHBondContact O-N 3.46Å; S218-A222 VanDerWaalsContact O-N 3.1Å; E219-A222 WeakPolarHBondContact O-CB 3.47Å; E219-A222 PolarHBondContact O-N 3.32Å; E219-A222 VanDerWaalsContact O-N 3.13Å; A222-K225 PolarHBondContact O-N 3.23Å; A222-R226 WeakPolarHBondContact O-CG 3.48Å; A222-R226 PolarHBondContact O-N 2.96Å
223	E	90.9	Very high	88.4	Confident	97 Å²	97	67.7 Å²	67.7	45%	0.453	32%	0.324	S	S	.	.	H	α-helix	trans	-64.2	-43.4	174.5	-74.9	179.3	-177.4	0	0	113.1	E219 E220 R221 K225 R226 R227	E219-E223 PolarHBondContact O-N 3.3Å; E220-E223 WeakPolarHBondContact O-CB 3.44Å; E220-E223 PolarHBondContact O-N 3.03Å; R221-E223 VanDerWaalsContact C-N 3.33Å; E223-K225 VanDerWaalsContact C-N 3.34Å; E223-K225 PolarHBondContact O-N 3.43Å; E223-R226 WeakPolarHBondContact O-CB 3.46Å; E223-R226 PolarHBondContact O-N 3.22Å; E223-R226 VanDerWaalsContact O-N 3.14Å; E223-R226 IonicContact OE1-NH2 3.78Å; E223-R227 PolarHBondContact O-N 3.21Å
224	A	89.3	Confident	86.9	Confident	14 Å²	14	70.2 Å²	70.2	12%	0.116	34%	0.341	C	S	.	.	H	α-helix	trans	-60	-43.9	174.4	0	0	0	0	0	111.6	D145 E220 R221 R226 R227 F228	D145-A224 WeakPolarHBondContact O-CB 3.43Å; E220-A224 WeakPolarHBondContact O-CB 3.36Å; E220-A224 PolarHBondContact O-N 3.33Å; R221-A224 PolarHBondContact O-N 2.86Å; A224-R226 VanDerWaalsContact C-N 3.29Å; A224-R226 PolarHBondContact O-N 3.47Å; A224-R227 PolarHBondContact O-N 3.38Å; A224-F228 WeakPolarHBondContact O-CB 3.48Å; A224-F228 PolarHBondContact O-N 2.82Å
225	K	88.6	Confident	85.5	Confident	78 Å²	78	72.6 Å²	72.6	34%	0.339	36%	0.358	S	S	.	.	H	α-helix	trans	-63.9	-30.9	174.8	-72.1	174.1	-173.6	166.9	0	112.4	E119 R221 A222 E223 R229	E119-K225 IonicContact OE1-NZ 3.71Å; E119-K225 PolarHBondContact OE1-NZ 2.9Å; E119-K225 IonicContact OE2-NZ 4Å; R221-K225 WeakPolarHBondContact O-CG 3.31Å; R221-K225 PolarHBondContact O-N 3.07Å; A222-K225 PolarHBondContact O-N 3.23Å; E223-K225 VanDerWaalsContact C-N 3.34Å; E223-K225 PolarHBondContact O-N 3.43Å; K225-R229 WeakPolarHBondContact O-CG 3.46Å; K225-R229 PolarHBondContact O-N 2.91Å; K225-R229 PolarHBondContact O-NE 3.17Å
226	R	90.1	Very high	83.8	Confident	133 Å²	133	78.1 Å²	78.1	50%	0.502	38%	0.384	S	S	.	.	H	α-helix	trans	-70.7	-54	173.4	-75.2	-171.7	-71.6	-130	3.1	111	A222 E223 A224 F228 R229 D230	A222-R226 WeakPolarHBondContact O-CG 3.48Å; A222-R226 PolarHBondContact O-N 2.96Å; E223-R226 WeakPolarHBondContact O-CB 3.46Å; E223-R226 PolarHBondContact O-N 3.22Å; E223-R226 VanDerWaalsContact O-N 3.14Å; E223-R226 IonicContact OE1-NH2 3.78Å; A224-R226 VanDerWaalsContact C-N 3.29Å; A224-R226 PolarHBondContact O-N 3.47Å; R226-F228 VanDerWaalsContact C-N 3.27Å; R226-F228 PolarHBondContact O-N 2.88Å; R226-R229 WeakPolarHBondContact O-CA 3.39Å; R226-R229 WeakPolarHBondContact O-CB 3.37Å; R226-R229 PolarHBondContact O-N 3.3Å; R226-D230 PolarHBondContact O-N 3.3Å
227	R	88.6	Confident	82.1	Confident	107 Å²	107	81.4 Å²	81.4	40%	0.404	40%	0.403	S	S	.	.	H	α-helix	trans	-52	-44.3	177	-75.8	-178	-76.4	155	-3.6	112.5	N143 A144 E223 A224 D230 L231	N143-R227 PolarHBondContact O-NH1 3.06Å; A144-R227 PolarHBondContact O-NH2 2.72Å; E223-R227 PolarHBondContact O-N 3.21Å; A224-R227 PolarHBondContact O-N 3.38Å; R227-D230 PolarHBondContact O-N 3.45Å; R227-L231 WeakPolarHBondContact O-CB 3.39Å; R227-L231 WeakPolarHBondContact O-CD1 3.44Å; R227-L231 WeakPolarHBondContact O-CG 3.15Å; R227-L231 PolarHBondContact O-N 3.38Å
228	F	83.4	Confident	80.3	Confident	139 Å²	139	87 Å²	87	61%	0.61	43%	0.428	S	S	*	.	H	α-helix	trans	-63.2	-42.6	177.8	-173.5	-95.2	0	0	0	112.5	A224 R226 L231 T232	A224-F228 WeakPolarHBondContact O-CB 3.48Å; A224-F228 PolarHBondContact O-N 2.82Å; R226-F228 VanDerWaalsContact C-N 3.27Å; R226-F228 PolarHBondContact O-N 2.88Å; F228-L231 PolarHBondContact O-N 2.91Å; F228-T232 HydrophobicContact CD1-CG2 4.17Å; F228-T232 HydrophobicContact CE1-CG2 3.75Å; F228-T232 HydrophobicContact CZ-CG2 3.96Å; F228-T232 WeakPolarHBondContact O-CG2 3.24Å; F228-T232 PolarHBondContact O-N 3.46Å; F228-T232 PolarHBondContact O-OG1 3.48Å
229	R	83.3	Confident	78.6	Confident	153 Å²	153	90.2 Å²	90.2	58%	0.577	44%	0.444	S	S	*	.	H	α-helix	trans	-62.1	-46.3	176.5	-80.9	178.9	-87.1	180	-6.3	111.3	K225 R226 L231 T232 A233	K225-R229 WeakPolarHBondContact O-CG 3.46Å; K225-R229 PolarHBondContact O-N 2.91Å; K225-R229 PolarHBondContact O-NE 3.17Å; R226-R229 WeakPolarHBondContact O-CA 3.39Å; R226-R229 WeakPolarHBondContact O-CB 3.37Å; R226-R229 PolarHBondContact O-N 3.3Å; R229-L231 PolarHBondContact O-N 3.06Å; R229-T232 WeakPolarHBondContact CA-OG1 3.47Å; R229-T232 PolarHBondContact O-N 3.49Å; R229-T232 PolarHBondContact O-OG1 3.32Å; R229-A233 WeakPolarHBondContact O-CB 3.45Å; R229-A233 PolarHBondContact O-N 2.83Å
230	D	83.1	Confident	76.9	Confident	110 Å²	110	92.8 Å²	92.8	59%	0.588	45%	0.448	S	S	*	.	H	α-helix	trans	-63.3	-41.9	-179.7	-59.8	-23.8	0	0	0	111.6	R226 R227 A233 S234	R226-D230 PolarHBondContact O-N 3.3Å; R227-D230 PolarHBondContact O-N 3.45Å; D230-A233 PolarHBondContact O-N 2.87Å; D230-S234 WeakPolarHBondContact O-CB 3.3Å; D230-S234 PolarHBondContact O-N 3.36Å; D230-S234 PolarHBondContact O-OG 2.85Å
231	L	78.5	Confident	75.3	Confident	109 Å²	109	99.1 Å²	99.1	57%	0.571	47%	0.47	S	S	*	.	H	α-helix	trans	-58.6	-51.6	172.8	-78.6	159.7	0	0	0	111.2	R227 F228 R229 A233 S234 T235	R227-L231 WeakPolarHBondContact O-CB 3.39Å; R227-L231 WeakPolarHBondContact O-CD1 3.44Å; R227-L231 WeakPolarHBondContact O-CG 3.15Å; R227-L231 PolarHBondContact O-N 3.38Å; F228-L231 PolarHBondContact O-N 2.91Å; R229-L231 PolarHBondContact O-N 3.06Å; L231-A233 VanDerWaalsContact C-N 3.32Å; L231-A233 PolarHBondContact O-N 3.37Å; L231-S234 PolarHBondContact O-N 2.91Å; L231-S234 PolarHBondContact O-OG 2.62Å; L231-T235 PolarHBondContact O-N 3.41Å; L231-T235 PolarHBondContact O-OG1 3.07Å
232	T	74.3	Confident	73.6	Confident	55 Å²	55	99.7 Å²	99.7	34%	0.337	48%	0.482	S	S	.	.	H	α-helix	trans	-62.8	-36.7	-179.9	54.2	0	0	0	0	113.3	F228 R229 Q236	F228-T232 HydrophobicContact CD1-CG2 4.17Å; F228-T232 HydrophobicContact CE1-CG2 3.75Å; F228-T232 HydrophobicContact CZ-CG2 3.96Å; F228-T232 WeakPolarHBondContact O-CG2 3.24Å; F228-T232 PolarHBondContact O-N 3.46Å; F228-T232 PolarHBondContact O-OG1 3.48Å; R229-T232 WeakPolarHBondContact CA-OG1 3.47Å; R229-T232 PolarHBondContact O-N 3.49Å; R229-T232 PolarHBondContact O-OG1 3.32Å; T232-Q236 WeakPolarHBondContact O-CG 3.49Å; T232-Q236 PolarHBondContact O-N 3.08Å; T232-Q236 VanDerWaalsContact O-N 3.14Å
233	A	72.2	Confident	71.9	Confident	50 Å²	50	104.8 Å²	104.8	41%	0.413	50%	0.5	S	S	.	.	H	α-helix	trans	-66.8	-42.9	175.8	0	0	0	0	0	111.3	R229 D230 L231 T235 Q236 D237	R229-A233 WeakPolarHBondContact O-CB 3.45Å; R229-A233 PolarHBondContact O-N 2.83Å; D230-A233 PolarHBondContact O-N 2.87Å; L231-A233 VanDerWaalsContact C-N 3.32Å; L231-A233 PolarHBondContact O-N 3.37Å; A233-T235 PolarHBondContact O-N 3.15Å; A233-Q236 PolarHBondContact O-N 3.16Å; A233-D237 PolarHBondContact O-N 2.76Å
234	S	67.2	Low	70.3	Confident	55 Å²	55	107.8 Å²	107.8	39%	0.385	51%	0.512	S	S	.	.	H	α-helix	trans	-64.5	-37.4	177.8	73.1	0	0	0	0	113.2	D230 L231 D237 Q238	D230-S234 WeakPolarHBondContact O-CB 3.3Å; D230-S234 PolarHBondContact O-N 3.36Å; D230-S234 PolarHBondContact O-OG 2.85Å; L231-S234 PolarHBondContact O-N 2.91Å; L231-S234 PolarHBondContact O-OG 2.62Å; S234-D237 PolarHBondContact O-N 3.32Å; S234-Q238 WeakPolarHBondContact O-CG 3.44Å; S234-Q238 PolarHBondContact O-N 2.82Å
235	T	67.1	Low	68.6	Low	70 Å²	70	113 Å²	113	43%	0.429	54%	0.538	S	S	.	.	H	α-helix	trans	-67.6	-42	175.8	-48.3	0	0	0	0	111.4	L231 A233 D237 Q238 D239	L231-T235 PolarHBondContact O-N 3.41Å; L231-T235 PolarHBondContact O-OG1 3.07Å; A233-T235 PolarHBondContact O-N 3.15Å; T235-D237 VanDerWaalsContact C-N 3.34Å; T235-D237 PolarHBondContact O-N 3.49Å; T235-Q238 PolarHBondContact O-N 3.41Å; T235-D239 PolarHBondContact O-N 3.18Å
236	Q	61	Low	66.8	Low	122 Å²	122	114 Å²	114	57%	0.57	55%	0.554	S	S	*	*	H	α-helix	trans	-64.5	-36.6	176.7	-72.9	177.8	5.5	0	0	112.8	T232 A233 R240	T232-Q236 WeakPolarHBondContact O-CG 3.49Å; T232-Q236 PolarHBondContact O-N 3.08Å; T232-Q236 VanDerWaalsContact O-N 3.14Å; A233-Q236 PolarHBondContact O-N 3.16Å; Q236-R240 WeakPolarHBondContact O-CB 3.31Å; Q236-R240 VanDerWaalsContact O-CG 3.31Å; Q236-R240 WeakPolarHBondContact O-CG 3.23Å; Q236-R240 PolarHBondContact O-N 3.44Å
237	D	58.6	Low	64.8	Low	91 Å²	91	114.4 Å²	114.4	49%	0.487	57%	0.566	S	S	.	*	H	α-helix	trans	-70.6	-35.1	175.2	-93	-5	0	0	0	112.7	A233 S234 T235 R241	A233-D237 PolarHBondContact O-N 2.76Å; S234-D237 PolarHBondContact O-N 3.32Å; T235-D237 VanDerWaalsContact C-N 3.34Å; T235-D237 PolarHBondContact O-N 3.49Å; D237-R241 WeakPolarHBondContact O-CG 3.37Å; D237-R241 PolarHBondContact O-N 3.07Å; D237-R241 VanDerWaalsContact O-N 3.13Å
238	Q	55.7	Low	62.6	Low	130 Å²	130	119.5 Å²	119.5	61%	0.607	60%	0.6	S	S	*	*	H	α-helix	trans	-67.1	-47.2	172.7	-77.1	-176.7	-9.8	0	0	111.6	S234 T235 R240 R241 T242	S234-Q238 WeakPolarHBondContact O-CG 3.44Å; S234-Q238 PolarHBondContact O-N 2.82Å; T235-Q238 PolarHBondContact O-N 3.41Å; Q238-R240 VanDerWaalsContact C-N 3.3Å; Q238-R240 PolarHBondContact O-N 3.3Å; Q238-R241 PolarHBondContact O-N 3.17Å; Q238-R241 VanDerWaalsContact O-N 3.12Å; Q238-T242 PolarHBondContact O-N 3.42Å; Q238-T242 PolarHBondContact O-OG1 3.03Å
239	D	55.3	Low	61.6	Low	100 Å²	100	118.5 Å²	118.5	54%	0.535	60%	0.599	S	S	.	*	H	α-helix	trans	-61.3	-38.5	178.1	-73.4	-21	0	0	0	112	T235 T242 M243	T235-D239 PolarHBondContact O-N 3.18Å; D239-T242 PolarHBondContact O-N 3.38Å; D239-M243 PolarHBondContact O-N 2.75Å
240	R	55.8	Low	60.4	Low	175 Å²	175	116.7 Å²	116.7	66%	0.66	60%	0.6	S	S	*	*	H	α-helix	trans	-66	-35.2	174.4	-79.7	178.3	175.8	-169.5	0.1	113.5	Q236 Q238 K244	Q236-R240 WeakPolarHBondContact O-CB 3.31Å; Q236-R240 VanDerWaalsContact O-CG 3.31Å; Q236-R240 WeakPolarHBondContact O-CG 3.23Å; Q236-R240 PolarHBondContact O-N 3.44Å; Q238-R240 VanDerWaalsContact C-N 3.3Å; Q238-R240 PolarHBondContact O-N 3.3Å; R240-K244 WeakPolarHBondContact O-CG 3.11Å; R240-K244 PolarHBondContact O-N 2.99Å
241	R	55.9	Low	59.2	Low	183 Å²	183	117.1 Å²	117.1	69%	0.691	60%	0.601	S	S	*	*	H	α-helix	trans	-73.1	-37.8	175.2	-76.6	178.3	-175.6	179.3	3.6	111.6	D237 Q238 K244 N245	D237-R241 WeakPolarHBondContact O-CG 3.37Å; D237-R241 PolarHBondContact O-N 3.07Å; D237-R241 VanDerWaalsContact O-N 3.13Å; Q238-R241 PolarHBondContact O-N 3.17Å; Q238-R241 VanDerWaalsContact O-N 3.12Å; R241-K244 PolarHBondContact O-N 3.41Å; R241-N245 PolarHBondContact O-N 2.98Å
242	T	57.1	Low	58	Low	84 Å²	84	117.5 Å²	117.5	52%	0.515	60%	0.603	S	S	.	*	H	α-helix	trans	-68.8	-40.3	177.9	-50.4	0	0	0	0	111.8	Q238 D239 K244 N245 C246	Q238-T242 PolarHBondContact O-N 3.42Å; Q238-T242 PolarHBondContact O-OG1 3.03Å; D239-T242 PolarHBondContact O-N 3.38Å; T242-K244 PolarHBondContact O-N 3.47Å; T242-N245 PolarHBondContact O-N 3Å; T242-C246 PolarHBondContact O-N 3.41Å
243	M	54.9	Low	57	Low	145 Å²	145	121.4 Å²	121.4	71%	0.714	62%	0.619	S	S	*	*	H	α-helix	trans	-61.1	-41.9	173.6	-86.7	-177.9	169.9	0	0	112.6	D239 N245 C246	D239-M243 PolarHBondContact O-N 2.75Å; M243-N245 PolarHBondContact O-N 3.28Å; M243-C246 PolarHBondContact O-N 2.96Å
244	K	56.8	Low	56	Low	160 Å²	160	126.2 Å²	126.2	70%	0.696	63%	0.633	S	S	*	*	H	α-helix	trans	-64.8	-20.9	177.7	-77.4	-175.2	177.7	-173.4	0	114.5	R240 R241 T242	R240-K244 WeakPolarHBondContact O-CG 3.11Å; R240-K244 PolarHBondContact O-N 2.99Å; R241-K244 PolarHBondContact O-N 3.41Å; T242-K244 PolarHBondContact O-N 3.47Å
245	N	53.2	Low	55.2	Low	123 Å²	123	131.3 Å²	131.3	66%	0.658	65%	0.651	S	S	*	*	H	α-helix	trans	-93.1	-8.1	179.6	-75.4	-7.4	0	0	0	113.6	R241 T242 M243	R241-N245 PolarHBondContact O-N 2.98Å; T242-N245 PolarHBondContact O-N 3Å; M243-N245 PolarHBondContact O-N 3.28Å
246	C	50.9	Low	54.3	Low	101 Å²	101	136 Å²	136	68%	0.682	67%	0.668	S	S	*	*	H	α-helix	trans	-96	-7.1	174.3	-76.3	0	0	0	0	113.5	T242 M243 L248	T242-C246 PolarHBondContact O-N 3.41Å; M243-C246 PolarHBondContact O-N 2.96Å; C246-L248 VanDerWaalsContact C-N 3.34Å
247	D	49	Very low	53.7	Low	141 Å²	141	137.2 Å²	137.2	75%	0.754	68%	0.676	S	S	*	*			trans	-95	20.7	177.9	-68	-30.5	0	0	0	112.9
248	L	41.7	Very low	53.3	Low	213 Å²	213	141.4 Å²	141.4	100%	1.115	69%	0.693	S	S	*	*			trans	-124.1	0	173.7	-81.7	164.9	0	0	0	110.1	C246	C246-L248 VanDerWaalsContact C-N 3.34Å

Retrieved 248 of 248 residues in 1484.6 ms (Link to these results)

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