A0A087Y766_POEFO Loading...

protein-tyrosine-phosphatase

AlphaFold DB , UniProt , Accession A0A087Y766, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 582 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	40.9	Very low	70	Confident	145 Å²	145	41.9 Å²	41.9	71%	0.714	22%	0.216	S	C	*	.				0	97.7	0	-178.2	-168	-89.7	0	0	105.7	W4 H114	M1-W4 PolarHBondContact O-NE1 3.28Å; M1-W4 VanDerWaalsContact O-NE1 3.08Å; M1-H114 PolarHBondContact N-NE2 2.99Å
2	V	50.2	Low	71.5	Confident	10 Å²	10	49.5 Å²	49.5	6%	0.061	26%	0.256	C	S	.	.			trans	-140.7	82.3	-170.3	-176.9	0	0	0	0	112.4	W4 F5 S73 H114	V2-W4 HydrophobicContact CB-CD2 4.48Å; V2-W4 HydrophobicContact CB-CZ2 3.84Å; V2-W4 HydrophobicContact CG1-CD2 3.64Å; V2-W4 HydrophobicContact CG1-CE3 4.02Å; V2-W4 HydrophobicContact CG1-CG 4.28Å; V2-W4 HydrophobicContact CG1-CH2 3.63Å; V2-W4 HydrophobicContact CG1-CZ2 3.21Å; V2-W4 HydrophobicContact CG1-CZ3 4.01Å; V2-W4 HydrophobicContact CG2-CH2 4.46Å; V2-W4 HydrophobicContact CG2-CZ2 3.45Å; V2-W4 VanDerWaalsContact CG2-CZ2 3.45Å; V2-F5 HydrophobicContact CG1-CB 4.3Å; V2-S73 WeakPolarHBondContact CG2-OG 3.19Å; V2-H114 WeakPolarHBondContact CB-CE1 3.45Å; V2-H114 VanDerWaalsContact CB-ND1 3.29Å; V2-H114 WeakPolarHBondContact CB-ND1 3.39Å; V2-H114 WeakPolarHBondContact CG2-CE1 3.26Å; V2-H114 PolarHBondContact N-CD2 3.3Å; V2-H114 PolarHBondContact N-NE2 3.4Å; V2-H114 VanDerWaalsContact O-CB 3.31Å; V2-H114 WeakPolarHBondContact O-CB 3.48Å
3	R	64.1	Low	72.5	Confident	10 Å²	10	52.2 Å²	52.2	4%	0.038	27%	0.267	C	S	.	.			trans	-107.6	-0.8	161.3	-79.2	176.6	164.7	-161.3	-21.5	112.2	F5 N101 S102 D104 D483	R3-F5 PolarHBondContact O-N 2.85Å; R3-N101 HydrophobicContact CB-CB 3.85Å; R3-N101 VanDerWaalsContact CB-CG 3.43Å; R3-N101 WeakPolarHBondContact CB-OD1 3.42Å; R3-N101 CarbonylContact O-C 3.57Å; R3-N101 VanDerWaalsContact O-CA 3.29Å; R3-N101 WeakPolarHBondContact O-CA 3.47Å; R3-S102 PolarHBondContact O-N 3.34Å; R3-D104 IonicContact CZ-OD1 2.82Å; R3-D104 IonicContact CZ-OD2 2.93Å; R3-D104 IonicContact NE-OD1 3Å; R3-D104 IonicContact NH1-OD2 3.29Å; R3-D104 VanDerWaalsContact NH2-CG 3.31Å; R3-D104 IonicContact NH2-OD1 2.94Å; R3-D104 PolarHBondContact NH2-OD1 3.19Å; R3-D104 IonicContact NH2-OD2 3.78Å; R3-D104 PolarHBondContact NH2-OD2 3.07Å; R3-D483 VanDerWaalsContact CD-OD1 3.3Å; R3-D483 WeakPolarHBondContact CD-OD1 3.39Å; R3-D483 IonicContact CZ-OD1 3.46Å; R3-D483 IonicContact NE-OD1 2.76Å; R3-D483 IonicContact NH1-OD1 3.5Å; R3-D483 PolarHBondContact NH1-OD1 2.93Å
4	W	75.9	Confident	73.5	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.015	25%	0.248	C	C	.	.			trans	-70.8	-2.3	176.9	48.2	-105.3	0	0	0	114.2	M1 V2 H6 F27 L28 A29 L72 V76 P99	M1-W4 PolarHBondContact O-NE1 3.28Å; M1-W4 VanDerWaalsContact O-NE1 3.08Å; V2-W4 HydrophobicContact CB-CD2 4.48Å; V2-W4 HydrophobicContact CB-CZ2 3.84Å; V2-W4 HydrophobicContact CG1-CD2 3.64Å; V2-W4 HydrophobicContact CG1-CE3 4.02Å; V2-W4 HydrophobicContact CG1-CG 4.28Å; V2-W4 HydrophobicContact CG1-CH2 3.63Å; V2-W4 HydrophobicContact CG1-CZ2 3.21Å; V2-W4 HydrophobicContact CG1-CZ3 4.01Å; V2-W4 HydrophobicContact CG2-CH2 4.46Å; V2-W4 HydrophobicContact CG2-CZ2 3.45Å; V2-W4 VanDerWaalsContact CG2-CZ2 3.45Å; W4-H6 PolarHBondContact O-CD2 3.3Å; W4-F27 HydrophobicContact CB-CD2 4.37Å; W4-F27 HydrophobicContact CB-CE2 3.95Å; W4-F27 AromaticContact CD1-CE2 3.83Å; W4-F27 HydrophobicContact CD2-CE2 4.17Å; W4-F27 AromaticContact CG-CE2 3.72Å; W4-F27 HydrophobicContact CG-CE2 3.72Å; W4-F27 HydrophobicContact CG-CZ 4.44Å; W4-L28 CarbonylContact O-C 3.53Å; W4-L28 WeakPolarHBondContact O-CA 3.12Å; W4-L28 WeakPolarHBondContact O-CB 3.27Å; W4-A29 HydrophobicContact CE3-CB 3.38Å; W4-A29 HydrophobicContact CZ3-CB 3.32Å; W4-A29 PolarHBondContact O-N 3.46Å; W4-L72 HydrophobicContact CH2-CB 3.95Å; W4-L72 WeakPolarHBondContact CH2-O 3.19Å; W4-V76 HydrophobicContact CD2-CG1 4.43Å; W4-V76 HydrophobicContact CD2-CG2 4.19Å; W4-V76 HydrophobicContact CE3-CG2 4.25Å; W4-V76 HydrophobicContact CH2-CB 4.01Å; W4-V76 HydrophobicContact CH2-CG2 3.37Å; W4-V76 HydrophobicContact CZ2-CB 3.38Å; W4-V76 HydrophobicContact CZ2-CG1 3.86Å; W4-V76 HydrophobicContact CZ2-CG2 3.24Å; W4-V76 HydrophobicContact CZ3-CG2 3.88Å; W4-P99 HydrophobicContact CB-CB 3.81Å; W4-P99 HydrophobicContact CG-CB 4.27Å
5	F	76.7	Confident	74.6	Confident	23 Å²	23	48.7 Å²	48.7	10%	0.101	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-92.3	114	-179	-172.8	-96.1	0	0	0	111.3	V2 R3 R7 A29 P31 F39 L72 P142	V2-F5 HydrophobicContact CG1-CB 4.3Å; R3-F5 PolarHBondContact O-N 2.85Å; F5-R7 HydrophobicContact CD1-CG 4.21Å; F5-R7 HydrophobicContact CE1-CG 4.09Å; F5-A29 CarbonylContact C-O 3.54Å; F5-A29 WeakPolarHBondContact CA-O 3.48Å; F5-A29 HydrophobicContact CD2-CB 4.12Å; F5-P31 HydrophobicContact CZ-CG 3.89Å; F5-F39 AromaticContact CE2-CD1 3.56Å; F5-F39 HydrophobicContact CE2-CD1 3.56Å; F5-F39 AromaticContact CE2-CE1 3.75Å; F5-F39 HydrophobicContact CE2-CE1 3.75Å; F5-F39 AromaticContact CZ-CD1 3.88Å; F5-F39 HydrophobicContact CZ-CD1 3.88Å; F5-F39 AromaticContact CZ-CE1 3.67Å; F5-F39 HydrophobicContact CZ-CE1 3.67Å; F5-L72 HydrophobicContact CD2-CD1 4.24Å; F5-L72 HydrophobicContact CE2-CD1 3.96Å; F5-P142 HydrophobicContact CD1-CB 4.48Å; F5-P142 HydrophobicContact CE1-CB 4.06Å; F5-P142 HydrophobicContact CE2-CB 4.33Å; F5-P142 HydrophobicContact CZ-CB 3.98Å
6	H	76.7	Confident	75.4	Confident	9 Å²	9	54.1 Å²	54.1	4%	0.042	27%	0.271	C	S	.	.			trans	-103.1	122.6	179.3	-67.6	-112.9	0	0	0	110.2	W4 I9 A29 R30 P31 V100 N101 S102	W4-H6 PolarHBondContact O-CD2 3.3Å; H6-I9 HydrophobicContact CB-CB 4.49Å; H6-I9 HydrophobicContact CB-CD1 3.34Å; H6-I9 HydrophobicContact CB-CG1 3.54Å; H6-I9 HydrophobicContact CB-CG2 4.22Å; H6-A29 PolarHBondContact N-O 3.41Å; H6-R30 WeakPolarHBondContact O-CA 3.13Å; H6-R30 WeakPolarHBondContact O-CB 3.42Å; H6-P31 WeakPolarHBondContact O-CD 3.36Å; H6-V100 PolarHBondContact NE2-O 2.8Å; H6-N101 PolarHBondContact CE1-O 3.1Å; H6-S102 WeakPolarHBondContact CE1-CA 3.27Å; H6-S102 PolarHBondContact ND1-OG 2.99Å; H6-S102 PolarHBondContact NE2-N 3.29Å
7	R	69.5	Low	75.8	Confident	69 Å²	69	52.9 Å²	52.9	26%	0.26	27%	0.265	S	S	.	.	S	Bend	trans	-75.7	-45.8	-169.4	-56.5	-178.7	72.1	-153.5	-5.8	112.9	F5 P31 G143 C169	F5-R7 HydrophobicContact CD1-CG 4.21Å; F5-R7 HydrophobicContact CE1-CG 4.09Å; R7-P31 WeakPolarHBondContact O-CD 3.41Å; R7-P31 WeakPolarHBondContact O-CG 3.31Å; R7-G143 PolarHBondContact NE-O 3.06Å; R7-G143 PolarHBondContact NH1-O 2.95Å; R7-G143 PolarHBondContact NH2-O 2.87Å; R7-C169 PolarHBondContact NH1-SG 3.32Å; R7-C169 VanDerWaalsContact NH1-SG 3.4Å; R7-C169 PolarHBondContact NH2-SG 3.04Å
8	D	69.9	Low	76.3	Confident	107 Å²	107	49.9 Å²	49.9	57%	0.572	25%	0.251	S	S	*	.	S	Bend	trans	-126.1	45.1	-170	-81.1	-56	0	0	0	114.7
9	I	75.8	Confident	76.8	Confident	23 Å²	23	52.3 Å²	52.3	12%	0.118	26%	0.259	C	S	.	.			trans	-110.7	141.8	173.2	69.6	172.5	0	0	0	112	H6 Q13 A14 I17 L28 R30	H6-I9 HydrophobicContact CB-CB 4.49Å; H6-I9 HydrophobicContact CB-CD1 3.34Å; H6-I9 HydrophobicContact CB-CG1 3.54Å; H6-I9 HydrophobicContact CB-CG2 4.22Å; I9-Q13 HydrophobicContact CB-CB 4.17Å; I9-A14 HydrophobicContact CD1-CB 3.84Å; I9-I17 HydrophobicContact CD1-CD1 4.12Å; I9-I17 HydrophobicContact CG2-CD1 4.29Å; I9-L28 HydrophobicContact CD1-CD1 3.75Å; I9-L28 HydrophobicContact CD1-CD2 4.09Å; I9-R30 HydrophobicContact CD1-CB 4.49Å; I9-R30 HydrophobicContact CG1-CB 3.97Å; I9-R30 HydrophobicContact CG1-CG 4.47Å
10	T	84.9	Confident	76.8	Confident	42 Å²	42	52 Å²	52	26%	0.258	26%	0.262	S	S	.	.			trans	-77.4	168.8	171	62.2	0	0	0	0	111.1	L12 Q13 A14 K33	T10-L12 VanDerWaalsContact C-N 3.31Å; T10-L12 PolarHBondContact O-N 3.06Å; T10-Q13 PolarHBondContact O-N 3.49Å; T10-Q13 WeakPolarHBondContact OG1-CB 3.31Å; T10-Q13 VanDerWaalsContact OG1-CG 3.32Å; T10-Q13 WeakPolarHBondContact OG1-CG 3.4Å; T10-Q13 PolarHBondContact OG1-N 3.2Å; T10-Q13 VanDerWaalsContact OG1-N 3.17Å; T10-Q13 PolarHBondContact OG1-OE1 3.09Å; T10-A14 WeakPolarHBondContact O-CB 3.5Å; T10-A14 PolarHBondContact O-N 2.84Å; T10-K33 HydrophobicContact CG2-CD 4.01Å
11	G	85.8	Confident	76.8	Confident	19 Å²	19	54.6 Å²	54.6	20%	0.196	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-43	171.5	0	0	0	0	0	112.8	A14 E15 R30 H51	G11-A14 WeakPolarHBondContact O-CB 3.32Å; G11-A14 PolarHBondContact O-N 2.67Å; G11-E15 WeakPolarHBondContact O-CG 3.24Å; G11-E15 PolarHBondContact O-N 3.17Å; G11-R30 VanDerWaalsContact CA-CZ 3.45Å; G11-R30 VanDerWaalsContact CA-NH2 3.27Å; G11-H51 PolarHBondContact O-CE1 3.45Å
12	L	87.4	Confident	78.5	Confident	133 Å²	133	48 Å²	48	70%	0.696	24%	0.239	S	C	*	.	H	α-helix	trans	-64	-43.7	178.6	-65.4	172.3	0	0	0	112.2	T10 A14 E15 E16	T10-L12 VanDerWaalsContact C-N 3.31Å; T10-L12 PolarHBondContact O-N 3.06Å; L12-A14 VanDerWaalsContact C-N 3.33Å; L12-A14 PolarHBondContact O-N 3.31Å; L12-E15 WeakPolarHBondContact O-CB 3.39Å; L12-E15 PolarHBondContact O-N 3.3Å; L12-E16 PolarHBondContact O-N 3.28Å
13	Q	85.1	Confident	79.9	Confident	85 Å²	85	51.2 Å²	51.2	40%	0.397	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-38.5	174.9	-73.5	165.9	-47.5	0	0	111.6	I9 T10 E15 E16 I17	I9-Q13 HydrophobicContact CB-CB 4.17Å; T10-Q13 PolarHBondContact O-N 3.49Å; T10-Q13 WeakPolarHBondContact OG1-CB 3.31Å; T10-Q13 VanDerWaalsContact OG1-CG 3.32Å; T10-Q13 WeakPolarHBondContact OG1-CG 3.4Å; T10-Q13 PolarHBondContact OG1-N 3.2Å; T10-Q13 VanDerWaalsContact OG1-N 3.17Å; T10-Q13 PolarHBondContact OG1-OE1 3.09Å; Q13-E15 VanDerWaalsContact C-N 3.34Å; Q13-E16 PolarHBondContact O-N 3.42Å; Q13-I17 WeakPolarHBondContact O-CB 3.41Å; Q13-I17 WeakPolarHBondContact O-CD1 3.41Å; Q13-I17 WeakPolarHBondContact O-CG1 3.48Å; Q13-I17 PolarHBondContact O-N 2.97Å
14	A	86.4	Confident	80.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.1	-41.4	173.6	0	0	0	0	0	112	I9 T10 G11 L12 L18 L28	I9-A14 HydrophobicContact CD1-CB 3.84Å; T10-A14 WeakPolarHBondContact O-CB 3.5Å; T10-A14 PolarHBondContact O-N 2.84Å; G11-A14 WeakPolarHBondContact O-CB 3.32Å; G11-A14 PolarHBondContact O-N 2.67Å; L12-A14 VanDerWaalsContact C-N 3.33Å; L12-A14 PolarHBondContact O-N 3.31Å; A14-L18 WeakPolarHBondContact O-CB 3.38Å; A14-L18 WeakPolarHBondContact O-CG 3.48Å; A14-L18 PolarHBondContact O-N 3.49Å; A14-L28 HydrophobicContact CB-CD1 3.89Å; A14-L28 HydrophobicContact CB-CD2 4.47Å
15	E	90.2	Very high	81.3	Confident	52 Å²	52	54.4 Å²	54.4	24%	0.243	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-46	173.8	-68	-167.5	-151.9	0	0	111.9	G11 L12 Q13 L18 K19 V49 H51	G11-E15 WeakPolarHBondContact O-CG 3.24Å; G11-E15 PolarHBondContact O-N 3.17Å; L12-E15 WeakPolarHBondContact O-CB 3.39Å; L12-E15 PolarHBondContact O-N 3.3Å; Q13-E15 VanDerWaalsContact C-N 3.34Å; E15-L18 PolarHBondContact O-N 2.92Å; E15-K19 VanDerWaalsContact O-CB 3.25Å; E15-K19 WeakPolarHBondContact O-CB 3.42Å; E15-K19 VanDerWaalsContact O-CG 3.28Å; E15-K19 WeakPolarHBondContact O-CG 3.41Å; E15-K19 PolarHBondContact O-N 3.27Å; E15-K19 IonicContact OE2-NZ 2.66Å; E15-K19 PolarHBondContact OE2-NZ 3.1Å; E15-V49 HydrophobicContact CB-CB 4.37Å; E15-V49 HydrophobicContact CB-CG1 4.48Å; E15-V49 HydrophobicContact CB-CG2 4.47Å; E15-V49 HydrophobicContact CG-CB 3.91Å; E15-V49 HydrophobicContact CG-CG1 3.89Å; E15-H51 VanDerWaalsContact CG-NE2 3.32Å; E15-H51 WeakPolarHBondContact CG-NE2 3.38Å; E15-H51 IonicContact OE1-NE2 3.46Å; E15-H51 PolarHBondContact OE1-NE2 2.79Å
16	E	86.4	Confident	81.8	Confident	134 Å²	134	53.5 Å²	53.5	63%	0.626	27%	0.267	S	S	*	.	H	α-helix	trans	-61.3	-46.1	179.5	-172.3	177	-173.4	0	0	111.1	L12 Q13 K19 S20	L12-E16 PolarHBondContact O-N 3.28Å; Q13-E16 PolarHBondContact O-N 3.42Å; E16-K19 PolarHBondContact O-N 2.79Å; E16-S20 WeakPolarHBondContact O-CB 3.06Å; E16-S20 PolarHBondContact O-N 3.28Å; E16-S20 PolarHBondContact O-OG 3.38Å
17	I	82	Confident	82.4	Confident	34 Å²	34	53.1 Å²	53.1	17%	0.174	27%	0.265	C	S	.	.	H	α-helix	trans	-59.5	-50	176.2	-70.1	164.4	0	0	0	110.5	I9 Q13 K19 S20 R21 L28 V100	I9-I17 HydrophobicContact CD1-CD1 4.12Å; I9-I17 HydrophobicContact CG2-CD1 4.29Å; Q13-I17 WeakPolarHBondContact O-CB 3.41Å; Q13-I17 WeakPolarHBondContact O-CD1 3.41Å; Q13-I17 WeakPolarHBondContact O-CG1 3.48Å; Q13-I17 PolarHBondContact O-N 2.97Å; I17-K19 PolarHBondContact O-N 3.21Å; I17-S20 PolarHBondContact O-N 3.03Å; I17-S20 PolarHBondContact O-OG 3.08Å; I17-R21 WeakPolarHBondContact O-CB 3.37Å; I17-R21 PolarHBondContact O-N 3.47Å; I17-L28 HydrophobicContact CG2-CD2 4.06Å; I17-V100 HydrophobicContact CG2-CG1 3.74Å
18	L	85.2	Confident	83.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.9	-40	-178.5	-75.9	167.6	0	0	0	112.4	A14 E15 G22 L28 R44 V49 V100	A14-L18 WeakPolarHBondContact O-CB 3.38Å; A14-L18 WeakPolarHBondContact O-CG 3.48Å; A14-L18 PolarHBondContact O-N 3.49Å; E15-L18 PolarHBondContact O-N 2.92Å; L18-G22 CarbonylContact O-C 3.5Å; L18-G22 VanDerWaalsContact O-CA 3.25Å; L18-G22 WeakPolarHBondContact O-CA 3.37Å; L18-G22 PolarHBondContact O-N 2.8Å; L18-L28 HydrophobicContact CD1-CD2 4.36Å; L18-L28 HydrophobicContact CD1-CG 4.21Å; L18-L28 HydrophobicContact CD2-CD2 4.31Å; L18-L28 HydrophobicContact CD2-CG 4.45Å; L18-L28 HydrophobicContact CG-CD2 4Å; L18-L28 HydrophobicContact CG-CG 4.31Å; L18-R44 HydrophobicContact CB-CB 4.39Å; L18-R44 WeakPolarHBondContact O-CD 3.25Å; L18-R44 PolarHBondContact O-NH1 2.72Å; L18-R44 VanDerWaalsContact O-NH1 3.08Å; L18-V49 HydrophobicContact CB-CG2 3.83Å; L18-V49 HydrophobicContact CD1-CG1 3.63Å; L18-V49 HydrophobicContact CD1-CG2 4.29Å; L18-V100 HydrophobicContact CD2-CB 4.37Å; L18-V100 HydrophobicContact CD2-CG2 3.74Å
19	K	85.4	Confident	84.1	Confident	94 Å²	94	44.8 Å²	44.8	41%	0.409	23%	0.226	S	C	.	.	H	α-helix	trans	-70.5	-37.7	177.8	-75.3	169.5	176.4	163.3	0	112.3	E15 E16 I17 R44 V49	E15-K19 VanDerWaalsContact O-CB 3.25Å; E15-K19 WeakPolarHBondContact O-CB 3.42Å; E15-K19 VanDerWaalsContact O-CG 3.28Å; E15-K19 WeakPolarHBondContact O-CG 3.41Å; E15-K19 PolarHBondContact O-N 3.27Å; E15-K19 IonicContact OE2-NZ 2.66Å; E15-K19 PolarHBondContact OE2-NZ 3.1Å; E16-K19 PolarHBondContact O-N 2.79Å; I17-K19 PolarHBondContact O-N 3.21Å; K19-R44 PolarHBondContact O-NH1 3.49Å; K19-V49 HydrophobicContact CG-CG2 3.97Å
20	S	78.3	Confident	84.5	Confident	47 Å²	47	44.5 Å²	44.5	33%	0.329	22%	0.223	S	C	.	.	H	α-helix	trans	-88.5	-23	-174.6	65.4	0	0	0	0	114.5	E16 I17	E16-S20 WeakPolarHBondContact O-CB 3.06Å; E16-S20 PolarHBondContact O-N 3.28Å; E16-S20 PolarHBondContact O-OG 3.38Å; I17-S20 PolarHBondContact O-N 3.03Å; I17-S20 PolarHBondContact O-OG 3.08Å
21	R	75.9	Confident	84.3	Confident	106 Å²	106	44.6 Å²	44.6	40%	0.4	22%	0.224	S	C	.	.	H	α-helix	trans	-130	-20.2	-172.9	-47.8	178.3	92.3	-152.6	1.5	114.5	I17 D481	I17-R21 WeakPolarHBondContact O-CB 3.37Å; I17-R21 PolarHBondContact O-N 3.47Å; R21-D481 IonicContact CZ-OD1 3.29Å; R21-D481 IonicContact CZ-OD2 3.16Å; R21-D481 IonicContact NE-OD1 3.89Å; R21-D481 IonicContact NE-OD2 3.58Å; R21-D481 PolarHBondContact NE-OD2 3.48Å; R21-D481 VanDerWaalsContact NH1-CG 3.29Å; R21-D481 IonicContact NH1-OD1 2.9Å; R21-D481 PolarHBondContact NH1-OD1 2.89Å; R21-D481 IonicContact NH1-OD2 3.27Å; R21-D481 PolarHBondContact NH1-OD2 2.61Å; R21-D481 IonicContact NH2-OD1 3.94Å; R21-D481 PolarHBondContact NH2-OD1 3.32Å; R21-D481 IonicContact NH2-OD2 3.84Å
22	G	76.5	Confident	84.1	Confident	8 Å²	8	44.7 Å²	44.7	8%	0.082	22%	0.222	C	C	.	.			trans	-96	163.3	-178.7	0	0	0	0	0	113.4	L18 R44	L18-G22 CarbonylContact O-C 3.5Å; L18-G22 VanDerWaalsContact O-CA 3.25Å; L18-G22 WeakPolarHBondContact O-CA 3.37Å; L18-G22 PolarHBondContact O-N 2.8Å; G22-R44 PolarHBondContact O-NH1 3.02Å
23	I	80.6	Confident	83.7	Confident	76 Å²	76	44.8 Å²	44.8	39%	0.39	22%	0.217	S	C	.	.			trans	-110.1	174.8	169.6	57.7	173.8	0	0	0	111.2	G25 S26 Y98 T477	I23-G25 PolarHBondContact O-N 2.89Å; I23-S26 PolarHBondContact N-OG 2.63Å; I23-S26 WeakPolarHBondContact O-CB 3.41Å; I23-S26 PolarHBondContact O-N 3.4Å; I23-S26 PolarHBondContact O-OG 3.22Å; I23-Y98 HydrophobicContact CD1-CD2 3.57Å; I23-Y98 HydrophobicContact CD1-CE1 4.42Å; I23-Y98 HydrophobicContact CD1-CE2 3.45Å; I23-Y98 VanDerWaalsContact CD1-CE2 3.45Å; I23-Y98 HydrophobicContact CD1-CG 4.1Å; I23-Y98 HydrophobicContact CG1-CD2 3.54Å; I23-Y98 HydrophobicContact CG1-CE2 3.85Å; I23-Y98 HydrophobicContact CG1-CG 4.19Å; I23-T477 WeakPolarHBondContact CD1-O 3.37Å
24	H	84.4	Confident	83.4	Confident	80 Å²	80	50 Å²	50	37%	0.37	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	132.4	173.6	174.5	97.9	0	0	0	110.9	S26 S46 Y98	H24-S26 VanDerWaalsContact C-N 3.3Å; H24-S46 WeakPolarHBondContact ND1-CA 3.48Å; H24-S46 PolarHBondContact ND1-N 2.87Å; H24-S46 PolarHBondContact ND1-OG 2.81Å; H24-Y98 WeakPolarHBondContact O-CD2 3.34Å; H24-Y98 VanDerWaalsContact O-CE2 3.32Å; H24-Y98 WeakPolarHBondContact O-CE2 3.47Å
25	G	84.3	Confident	83	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.01	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	3.4	-174.2	0	0	0	0	0	114.2	I23 R44 E95 K97 Y98	I23-G25 PolarHBondContact O-N 2.89Å; G25-R44 PolarHBondContact N-O 3.35Å; G25-E95 WeakPolarHBondContact CA-O 3.18Å; G25-K97 PolarHBondContact O-N 3.19Å; G25-Y98 PolarHBondContact O-N 3.36Å
26	S	86.9	Confident	82.2	Confident	4 Å²	4	57.5 Å²	57.5	3%	0.028	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	139.9	173.5	-66.1	0	0	0	0	111.6	I23 H24 V43 R44 Y98	I23-S26 PolarHBondContact N-OG 2.63Å; I23-S26 WeakPolarHBondContact O-CB 3.41Å; I23-S26 PolarHBondContact O-N 3.4Å; I23-S26 PolarHBondContact O-OG 3.22Å; H24-S26 VanDerWaalsContact C-N 3.3Å; S26-V43 CarbonylContact O-C 3.58Å; S26-V43 WeakPolarHBondContact O-CA 3.41Å; S26-R44 PolarHBondContact O-N 3.35Å; S26-Y98 CarbonylContact C-O 3.58Å; S26-Y98 WeakPolarHBondContact CA-O 3.47Å
27	F	90.3	Very high	81.5	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.009	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	156.4	-177	73.3	-88	0	0	0	113.5	W4 L41 S42 V43 V76 L96 Y98 P99 V100	W4-F27 HydrophobicContact CB-CD2 4.37Å; W4-F27 HydrophobicContact CB-CE2 3.95Å; W4-F27 AromaticContact CD1-CE2 3.83Å; W4-F27 HydrophobicContact CD2-CE2 4.17Å; W4-F27 AromaticContact CG-CE2 3.72Å; W4-F27 HydrophobicContact CG-CE2 3.72Å; W4-F27 HydrophobicContact CG-CZ 4.44Å; F27-L41 HydrophobicContact CD2-CD1 3.95Å; F27-S42 CarbonylContact C-O 3.47Å; F27-S42 VanDerWaalsContact CA-O 3.27Å; F27-S42 WeakPolarHBondContact CA-O 3.23Å; F27-V43 HydrophobicContact CB-CB 4.41Å; F27-V43 HydrophobicContact CB-CG1 4.2Å; F27-V43 HydrophobicContact CB-CG2 4.04Å; F27-V76 HydrophobicContact CE2-CG1 3.5Å; F27-V76 HydrophobicContact CE2-CG2 4.43Å; F27-V76 HydrophobicContact CZ-CG1 3.6Å; F27-L96 HydrophobicContact CB-CD2 3.59Å; F27-L96 HydrophobicContact CD1-CB 3.8Å; F27-L96 HydrophobicContact CD1-CD2 4Å; F27-L96 HydrophobicContact CD1-CG 4.46Å; F27-L96 HydrophobicContact CD2-CD2 4.19Å; F27-L96 HydrophobicContact CE1-CB 3.89Å; F27-L96 HydrophobicContact CG-CB 4.31Å; F27-L96 HydrophobicContact CG-CD2 3.67Å; F27-L96 HydrophobicContact CG-CG 4.48Å; F27-L96 HydrophobicContact CZ-CB 4.47Å; F27-Y98 PolarHBondContact N-O 3.08Å; F27-P99 HydrophobicContact CE1-CB 4.06Å; F27-P99 HydrophobicContact CE2-CB 4.27Å; F27-P99 HydrophobicContact CZ-CB 3.8Å; F27-V100 PolarHBondContact O-N 3.45Å
28	L	86.9	Confident	81.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	155.4	169.2	63.4	79.4	0	0	0	110.2	W4 I9 A14 I17 L18 R30 S42 V100	W4-L28 CarbonylContact O-C 3.53Å; W4-L28 WeakPolarHBondContact O-CA 3.12Å; W4-L28 WeakPolarHBondContact O-CB 3.27Å; I9-L28 HydrophobicContact CD1-CD1 3.75Å; I9-L28 HydrophobicContact CD1-CD2 4.09Å; A14-L28 HydrophobicContact CB-CD1 3.89Å; A14-L28 HydrophobicContact CB-CD2 4.47Å; I17-L28 HydrophobicContact CG2-CD2 4.06Å; L18-L28 HydrophobicContact CD1-CD2 4.36Å; L18-L28 HydrophobicContact CD1-CG 4.21Å; L18-L28 HydrophobicContact CD2-CD2 4.31Å; L18-L28 HydrophobicContact CD2-CG 4.45Å; L18-L28 HydrophobicContact CG-CD2 4Å; L18-L28 HydrophobicContact CG-CG 4.31Å; L28-R30 HydrophobicContact CD1-CG 4.44Å; L28-S42 PolarHBondContact N-O 3.07Å; L28-S42 PolarHBondContact O-N 3.22Å; L28-V100 HydrophobicContact CB-CB 4.47Å; L28-V100 HydrophobicContact CD2-CB 4.48Å
29	A	86.4	Confident	81.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	153.9	170.9	0	0	0	0	0	110.8	W4 F5 H6 S40 L41	W4-A29 HydrophobicContact CE3-CB 3.38Å; W4-A29 HydrophobicContact CZ3-CB 3.32Å; W4-A29 PolarHBondContact O-N 3.46Å; F5-A29 CarbonylContact C-O 3.54Å; F5-A29 WeakPolarHBondContact CA-O 3.48Å; F5-A29 HydrophobicContact CD2-CB 4.12Å; H6-A29 PolarHBondContact N-O 3.41Å; A29-S40 CarbonylContact C-O 3.59Å; A29-S40 WeakPolarHBondContact CA-O 3.44Å; A29-L41 HydrophobicContact CB-CD1 4.17Å
30	R	85.3	Confident	81.7	Confident	18 Å²	18	49.6 Å²	49.6	7%	0.068	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	159.7	-177.7	56.5	177.4	-179.9	72	5.5	111.2	H6 I9 G11 L28 F39 S40 S42 H51	H6-R30 WeakPolarHBondContact O-CA 3.13Å; H6-R30 WeakPolarHBondContact O-CB 3.42Å; I9-R30 HydrophobicContact CD1-CB 4.49Å; I9-R30 HydrophobicContact CG1-CB 3.97Å; I9-R30 HydrophobicContact CG1-CG 4.47Å; G11-R30 VanDerWaalsContact CA-CZ 3.45Å; G11-R30 VanDerWaalsContact CA-NH2 3.27Å; L28-R30 HydrophobicContact CD1-CG 4.44Å; R30-F39 CarbonylContact O-C 3.59Å; R30-F39 WeakPolarHBondContact O-CA 3.09Å; R30-S40 PolarHBondContact N-O 3.06Å; R30-S40 PolarHBondContact NH2-OG 2.96Å; R30-S40 PolarHBondContact O-N 3.1Å; R30-S42 PolarHBondContact NE-OG 3.09Å; R30-H51 PolarHBondContact NH2-ND1 3.23Å
31	P	80.6	Confident	82.3	Confident	44 Å²	44	47.3 Å²	47.3	29%	0.286	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	146.7	166.9	-24.8	35.9	0	0	0	112.5	F5 H6 R7	F5-P31 HydrophobicContact CZ-CG 3.89Å; H6-P31 WeakPolarHBondContact O-CD 3.36Å; R7-P31 WeakPolarHBondContact O-CD 3.41Å; R7-P31 WeakPolarHBondContact O-CG 3.31Å
32	S	82.3	Confident	83	Confident	20 Å²	20	42.3 Å²	42.3	14%	0.14	23%	0.228	C	C	.	.			trans	-82.2	116.7	174.1	-178.6	0	0	0	0	110.4	K34 N35 D38	S32-K34 VanDerWaalsContact C-N 3.27Å; S32-K34 PolarHBondContact O-N 3.48Å; S32-K34 PolarHBondContact OG-N 2.95Å; S32-N35 WeakPolarHBondContact CB-O 3.5Å; S32-N35 PolarHBondContact OG-N 3.46Å; S32-D38 VanDerWaalsContact CB-O 3.27Å; S32-D38 WeakPolarHBondContact CB-O 3.33Å; S32-D38 PolarHBondContact N-O 2.8Å
33	K	78.6	Confident	83.7	Confident	136 Å²	136	42 Å²	42	59%	0.591	23%	0.225	S	C	*	.	S	Bend	trans	-73.9	-17.5	171.1	-62.4	-141.5	-179	-172.1	0	113.5	T10	T10-K33 HydrophobicContact CG2-CD 4.01Å
34	K	78.6	Confident	84.2	Confident	193 Å²	193	39.7 Å²	39.7	84%	0.839	21%	0.211	S	C	*	.	S	Bend	trans	-83.3	-38	178.7	-72.7	-174	179.3	179.2	0	112.2	S32	S32-K34 VanDerWaalsContact C-N 3.27Å; S32-K34 PolarHBondContact O-N 3.48Å; S32-K34 PolarHBondContact OG-N 2.95Å
35	N	77.8	Confident	84.3	Confident	61 Å²	61	36.9 Å²	36.9	33%	0.326	20%	0.2	S	C	.	.	S	Bend	trans	-128.1	104.9	-178.4	-60.4	-47.4	0	0	0	108.9	S32 G37 D38 R53	S32-N35 WeakPolarHBondContact CB-O 3.5Å; S32-N35 PolarHBondContact OG-N 3.46Å; N35-G37 PolarHBondContact O-N 3.18Å; N35-D38 HydrophobicContact CB-CB 4.11Å; N35-D38 PolarHBondContact O-N 3.38Å; N35-R53 PolarHBondContact ND2-NE 2.82Å; N35-R53 PolarHBondContact ND2-NH1 2.82Å; N35-R53 PolarHBondContact ND2-NH2 2.78Å
36	V	73.9	Confident	84.3	Confident	150 Å²	150	40 Å²	40	91%	0.909	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	128.1	-179.3	-178.8	0	0	0	0	109.6
37	G	70.3	Confident	84.1	Confident	49 Å²	49	46.5 Å²	46.5	51%	0.505	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.6	-22.1	-177.3	0	0	0	0	0	114.5	N35 N56	N35-G37 PolarHBondContact O-N 3.18Å; G37-N56 WeakPolarHBondContact O-CB 3.38Å
38	D	83.8	Confident	84	Confident	13 Å²	13	53.4 Å²	53.4	7%	0.07	28%	0.283	C	S	.	.			trans	-89.7	166.3	175.8	-75.4	-12.6	0	0	0	112.5	S32 N35 R53 I54 Q55 N56	S32-D38 VanDerWaalsContact CB-O 3.27Å; S32-D38 WeakPolarHBondContact CB-O 3.33Å; S32-D38 PolarHBondContact N-O 2.8Å; N35-D38 HydrophobicContact CB-CB 4.11Å; N35-D38 PolarHBondContact O-N 3.38Å; D38-R53 IonicContact OD2-CZ 2.98Å; D38-R53 IonicContact OD2-NE 3.38Å; D38-R53 PolarHBondContact OD2-NE 3.44Å; D38-R53 IonicContact OD2-NH2 3.07Å; D38-R53 PolarHBondContact OD2-NH2 2.83Å; D38-I54 WeakPolarHBondContact CB-O 3.41Å; D38-Q55 WeakPolarHBondContact OD1-CA 3.31Å; D38-N56 PolarHBondContact OD1-N 2.73Å; D38-N56 VanDerWaalsContact OD1-N 3.16Å
39	F	86.1	Confident	84.1	Confident	23 Å²	23	54.2 Å²	54.2	10%	0.101	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	167.7	175.3	-56.8	-88.8	0	0	0	111	F5 R30 I54 N56 Y61 L72	F5-F39 AromaticContact CE2-CD1 3.56Å; F5-F39 HydrophobicContact CE2-CD1 3.56Å; F5-F39 AromaticContact CE2-CE1 3.75Å; F5-F39 HydrophobicContact CE2-CE1 3.75Å; F5-F39 AromaticContact CZ-CD1 3.88Å; F5-F39 HydrophobicContact CZ-CD1 3.88Å; F5-F39 AromaticContact CZ-CE1 3.67Å; F5-F39 HydrophobicContact CZ-CE1 3.67Å; R30-F39 CarbonylContact O-C 3.59Å; R30-F39 WeakPolarHBondContact O-CA 3.09Å; F39-I54 HydrophobicContact CB-CB 4.04Å; F39-I54 HydrophobicContact CB-CG2 4.5Å; F39-I54 PolarHBondContact N-O 3.46Å; F39-I54 PolarHBondContact O-N 2.86Å; F39-I54 VanDerWaalsContact O-O 3.14Å; F39-N56 HydrophobicContact CD2-CB 4.25Å; F39-N56 HydrophobicContact CE2-CB 4.03Å; F39-Y61 HydrophobicContact CD2-CD1 4.26Å; F39-Y61 AromaticContact CD2-CE1 3.9Å; F39-Y61 HydrophobicContact CD2-CE1 3.9Å; F39-Y61 HydrophobicContact CE2-CD1 4.38Å; F39-Y61 AromaticContact CE2-CE1 3.6Å; F39-Y61 HydrophobicContact CE2-CE1 3.6Å; F39-Y61 HydrophobicContact CZ-CE1 4.45Å; F39-L72 HydrophobicContact CB-CD2 4.44Å; F39-L72 HydrophobicContact CD1-CD1 3.83Å; F39-L72 HydrophobicContact CD2-CD1 4.05Å; F39-L72 HydrophobicContact CD2-CD2 4.33Å; F39-L72 HydrophobicContact CE1-CD1 3.96Å; F39-L72 HydrophobicContact CE2-CD1 4.22Å; F39-L72 HydrophobicContact CG-CD1 3.85Å; F39-L72 HydrophobicContact CG-CD2 4.37Å; F39-L72 HydrophobicContact CZ-CD1 4.16Å
40	S	88.8	Confident	84.2	Confident	10 Å²	10	55.4 Å²	55.4	7%	0.07	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	128.7	174.3	-171.3	0	0	0	0	110	A29 R30 I52	A29-S40 CarbonylContact C-O 3.59Å; A29-S40 WeakPolarHBondContact CA-O 3.44Å; R30-S40 PolarHBondContact N-O 3.06Å; R30-S40 PolarHBondContact NH2-OG 2.96Å; R30-S40 PolarHBondContact O-N 3.1Å; S40-I52 CarbonylContact C-O 3.54Å; S40-I52 WeakPolarHBondContact CA-O 3.3Å; S40-I52 PolarHBondContact OG-O 2.93Å
41	L	89.9	Confident	84.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	119.1	171.2	-175.9	66.6	0	0	0	108.2	F27 A29 V43 H51 I52 I54 L63 L86 L96	F27-L41 HydrophobicContact CD2-CD1 3.95Å; A29-L41 HydrophobicContact CB-CD1 4.17Å; L41-V43 HydrophobicContact CD2-CG2 4.32Å; L41-V43 HydrophobicContact CG-CG2 3.96Å; L41-H51 WeakPolarHBondContact O-CA 3.13Å; L41-I52 HydrophobicContact CB-CB 4.31Å; L41-I52 PolarHBondContact N-O 2.96Å; L41-I52 PolarHBondContact O-N 2.86Å; L41-I54 HydrophobicContact CB-CD1 3.92Å; L41-I54 HydrophobicContact CB-CG1 4.49Å; L41-L63 HydrophobicContact CD2-CD1 3.98Å; L41-L86 HydrophobicContact CD2-CD1 4.3Å; L41-L96 HydrophobicContact CD2-CD1 3.95Å; L41-L96 HydrophobicContact CD2-CD2 3.99Å; L41-L96 HydrophobicContact CG-CD2 4.44Å
42	S	91.2	Very high	84.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.6	179.1	-49.6	0	0	0	0	108.2	F27 L28 R30 T50 H51	F27-S42 CarbonylContact C-O 3.47Å; F27-S42 VanDerWaalsContact CA-O 3.27Å; F27-S42 WeakPolarHBondContact CA-O 3.23Å; L28-S42 PolarHBondContact N-O 3.07Å; L28-S42 PolarHBondContact O-N 3.22Å; R30-S42 PolarHBondContact NE-OG 3.09Å; S42-T50 CarbonylContact C-O 3.54Å; S42-T50 WeakPolarHBondContact CA-O 3.35Å; S42-H51 WeakPolarHBondContact CB-ND1 3.46Å; S42-H51 PolarHBondContact OG-CE1 3Å; S42-H51 PolarHBondContact OG-ND1 3.11Å
43	V	91.1	Very high	85	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	132.6	-173.5	-168.5	0	0	0	0	109.9	S26 F27 L41 V45 V49 T50 I52 I94 L96	S26-V43 CarbonylContact O-C 3.58Å; S26-V43 WeakPolarHBondContact O-CA 3.41Å; F27-V43 HydrophobicContact CB-CB 4.41Å; F27-V43 HydrophobicContact CB-CG1 4.2Å; F27-V43 HydrophobicContact CB-CG2 4.04Å; L41-V43 HydrophobicContact CD2-CG2 4.32Å; L41-V43 HydrophobicContact CG-CG2 3.96Å; V43-V45 HydrophobicContact CG1-CG2 4.39Å; V43-V45 PolarHBondContact O-N 3.5Å; V43-V49 CarbonylContact O-C 3.53Å; V43-V49 WeakPolarHBondContact O-CA 3.38Å; V43-T50 PolarHBondContact N-O 3.02Å; V43-T50 PolarHBondContact O-N 3Å; V43-I52 HydrophobicContact CG2-CD1 4.42Å; V43-I94 HydrophobicContact CB-CG2 3.84Å; V43-I94 HydrophobicContact CG1-CG2 3.59Å; V43-I94 HydrophobicContact CG2-CG2 3.94Å; V43-L96 HydrophobicContact CB-CD2 4.43Å; V43-L96 HydrophobicContact CG1-CD2 4.03Å; V43-L96 HydrophobicContact CG2-CD2 3.49Å; V43-L96 VanDerWaalsContact CG2-CD2 3.49Å
44	R	90.4	Very high	85.3	Confident	29 Å²	29	53.9 Å²	53.9	11%	0.109	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	110.3	172.8	-176.2	171	-179.9	160.4	7.1	109.7	L18 K19 G22 G25 S26 S46 E47 Q48 V49	L18-R44 HydrophobicContact CB-CB 4.39Å; L18-R44 WeakPolarHBondContact O-CD 3.25Å; L18-R44 PolarHBondContact O-NH1 2.72Å; L18-R44 VanDerWaalsContact O-NH1 3.08Å; K19-R44 PolarHBondContact O-NH1 3.49Å; G22-R44 PolarHBondContact O-NH1 3.02Å; G25-R44 PolarHBondContact N-O 3.35Å; S26-R44 PolarHBondContact O-N 3.35Å; R44-S46 WeakPolarHBondContact CG-O 3.23Å; R44-S46 PolarHBondContact NE-O 2.95Å; R44-E47 IonicContact NH2-OE1 3.28Å; R44-E47 IonicContact NH2-OE2 3.28Å; R44-E47 PolarHBondContact NH2-OE2 3.21Å; R44-Q48 CarbonylContact C-O 3.56Å; R44-Q48 WeakPolarHBondContact CA-O 3.32Å; R44-V49 HydrophobicContact CB-CG2 4.48Å
45	V	87.3	Confident	85.6	Confident	21 Å²	21	49.1 Å²	49.1	13%	0.127	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	99.1	173.7	-173.1	0	0	0	0	107.5	V43 E47 Q48 T92 I94	V43-V45 HydrophobicContact CG1-CG2 4.39Å; V43-V45 PolarHBondContact O-N 3.5Å; V45-E47 PolarHBondContact O-N 3.33Å; V45-Q48 CarbonylContact C-O 3.55Å; V45-Q48 PolarHBondContact N-O 3.22Å; V45-Q48 PolarHBondContact O-N 2.81Å; V45-Q48 VanDerWaalsContact O-N 3.07Å; V45-T92 HydrophobicContact CG1-CG2 4.06Å; V45-I94 HydrophobicContact CG2-CG1 4.23Å; V45-I94 HydrophobicContact CG2-CG2 4.15Å
46	S	84.3	Confident	85.7	Confident	66 Å²	66	48.5 Å²	48.5	46%	0.462	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	-115.1	-174.9	-53.9	0	0	0	0	110.8	H24 R44	H24-S46 WeakPolarHBondContact ND1-CA 3.48Å; H24-S46 PolarHBondContact ND1-N 2.87Å; H24-S46 PolarHBondContact ND1-OG 2.81Å; R44-S46 WeakPolarHBondContact CG-O 3.23Å; R44-S46 PolarHBondContact NE-O 2.95Å
47	E	82.9	Confident	85.8	Confident	141 Å²	141	44.2 Å²	44.2	66%	0.659	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-1.1	177.9	-62.2	-51	140.8	0	0	113.9	R44 V45	R44-E47 IonicContact NH2-OE1 3.28Å; R44-E47 IonicContact NH2-OE2 3.28Å; R44-E47 PolarHBondContact NH2-OE2 3.21Å; V45-E47 PolarHBondContact O-N 3.33Å
48	Q	87	Confident	85.7	Confident	146 Å²	146	45 Å²	45	68%	0.682	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	157.9	-179	-61	-170.7	19.4	0	0	111.2	R44 V45	R44-Q48 CarbonylContact C-O 3.56Å; R44-Q48 WeakPolarHBondContact CA-O 3.32Å; V45-Q48 CarbonylContact C-O 3.55Å; V45-Q48 PolarHBondContact N-O 3.22Å; V45-Q48 PolarHBondContact O-N 2.81Å; V45-Q48 VanDerWaalsContact O-N 3.07Å
49	V	90.1	Very high	85.1	Confident	17 Å²	17	51.1 Å²	51.1	10%	0.103	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.9	174.5	174.8	0	0	0	0	107.9	E15 L18 K19 V43 R44	E15-V49 HydrophobicContact CB-CB 4.37Å; E15-V49 HydrophobicContact CB-CG1 4.48Å; E15-V49 HydrophobicContact CB-CG2 4.47Å; E15-V49 HydrophobicContact CG-CB 3.91Å; E15-V49 HydrophobicContact CG-CG1 3.89Å; L18-V49 HydrophobicContact CB-CG2 3.83Å; L18-V49 HydrophobicContact CD1-CG1 3.63Å; L18-V49 HydrophobicContact CD1-CG2 4.29Å; K19-V49 HydrophobicContact CG-CG2 3.97Å; V43-V49 CarbonylContact O-C 3.53Å; V43-V49 WeakPolarHBondContact O-CA 3.38Å; R44-V49 HydrophobicContact CB-CG2 4.48Å
50	T	88.7	Confident	84.7	Confident	25 Å²	25	53.4 Å²	53.4	15%	0.153	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	138.2	177.6	-59.4	0	0	0	0	109.3	S42 V43 I52 D88 I94	S42-T50 CarbonylContact C-O 3.54Å; S42-T50 WeakPolarHBondContact CA-O 3.35Å; V43-T50 PolarHBondContact N-O 3.02Å; V43-T50 PolarHBondContact O-N 3Å; T50-I52 HydrophobicContact CG2-CG1 4.31Å; T50-D88 WeakPolarHBondContact CG2-OD2 3.35Å; T50-I94 HydrophobicContact CG2-CD1 4.05Å
51	H	88.8	Confident	84	Confident	67 Å²	67	54 Å²	54	31%	0.31	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	116.8	176.7	-61	-71.6	0	0	0	110.9	G11 E15 R30 L41 S42	G11-H51 PolarHBondContact O-CE1 3.45Å; E15-H51 VanDerWaalsContact CG-NE2 3.32Å; E15-H51 WeakPolarHBondContact CG-NE2 3.38Å; E15-H51 IonicContact OE1-NE2 3.46Å; E15-H51 PolarHBondContact OE1-NE2 2.79Å; R30-H51 PolarHBondContact NH2-ND1 3.23Å; L41-H51 WeakPolarHBondContact O-CA 3.13Å; S42-H51 WeakPolarHBondContact CB-ND1 3.46Å; S42-H51 PolarHBondContact OG-CE1 3Å; S42-H51 PolarHBondContact OG-ND1 3.11Å
52	I	87.6	Confident	83.6	Confident	19 Å²	19	55.2 Å²	55.2	10%	0.097	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.4	-179.1	-45	-179.4	0	0	0	107.9	S40 L41 V43 T50 L63 L86 I94	S40-I52 CarbonylContact C-O 3.54Å; S40-I52 WeakPolarHBondContact CA-O 3.3Å; S40-I52 PolarHBondContact OG-O 2.93Å; L41-I52 HydrophobicContact CB-CB 4.31Å; L41-I52 PolarHBondContact N-O 2.96Å; L41-I52 PolarHBondContact O-N 2.86Å; V43-I52 HydrophobicContact CG2-CD1 4.42Å; T50-I52 HydrophobicContact CG2-CG1 4.31Å; I52-L63 HydrophobicContact CG2-CD1 3.91Å; I52-L63 HydrophobicContact CG2-CD2 3.97Å; I52-L63 HydrophobicContact CG2-CG 3.78Å; I52-L86 HydrophobicContact CD1-CD2 3.38Å; I52-I94 HydrophobicContact CD1-CD1 3.63Å; I52-I94 HydrophobicContact CD1-CG2 4.38Å; I52-I94 HydrophobicContact CG1-CD1 4.37Å
53	R	86.9	Confident	83	Confident	100 Å²	100	55.7 Å²	55.7	38%	0.377	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	134	178.2	-176.9	-179.3	178.9	-175.1	-3.2	109.5	N35 D38 Y64	N35-R53 PolarHBondContact ND2-NE 2.82Å; N35-R53 PolarHBondContact ND2-NH1 2.82Å; N35-R53 PolarHBondContact ND2-NH2 2.78Å; D38-R53 IonicContact OD2-CZ 2.98Å; D38-R53 IonicContact OD2-NE 3.38Å; D38-R53 PolarHBondContact OD2-NE 3.44Å; D38-R53 IonicContact OD2-NH2 3.07Å; D38-R53 PolarHBondContact OD2-NH2 2.83Å; R53-Y64 HydrophobicContact CB-CD2 4.49Å
54	I	85.8	Confident	81.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.7	168.9	-61	165.4	0	0	0	107.3	D38 F39 L41 Y61 D62 L63 L72 L75	D38-I54 WeakPolarHBondContact CB-O 3.41Å; F39-I54 HydrophobicContact CB-CB 4.04Å; F39-I54 HydrophobicContact CB-CG2 4.5Å; F39-I54 PolarHBondContact N-O 3.46Å; F39-I54 PolarHBondContact O-N 2.86Å; F39-I54 VanDerWaalsContact O-O 3.14Å; L41-I54 HydrophobicContact CB-CD1 3.92Å; L41-I54 HydrophobicContact CB-CG1 4.49Å; I54-Y61 HydrophobicContact CG2-CD1 4.16Å; I54-D62 CarbonylContact C-O 3.58Å; I54-D62 WeakPolarHBondContact CA-O 3.48Å; I54-L63 HydrophobicContact CD1-CD1 4.42Å; I54-L63 HydrophobicContact CG1-CD1 3.91Å; I54-L72 HydrophobicContact CD1-CD2 3.95Å; I54-L72 HydrophobicContact CG2-CD2 3.83Å; I54-L75 HydrophobicContact CD1-CD1 4.26Å; I54-L75 HydrophobicContact CD1-CD2 4.25Å; I54-L75 HydrophobicContact CG1-CD1 4.33Å; I54-L75 HydrophobicContact CG2-CD1 3.99Å
55	Q	85.8	Confident	80.2	Confident	92 Å²	92	64.8 Å²	64.8	43%	0.43	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	133.5	176.3	-171.7	170.9	-6.3	0	0	109.7	D38 T57 Y61 D62	D38-Q55 WeakPolarHBondContact OD1-CA 3.31Å; Q55-T57 HydrophobicContact CG-CG2 4.36Å; Q55-Y61 WeakPolarHBondContact O-CA 3.49Å; Q55-D62 PolarHBondContact N-O 3.46Å; Q55-D62 PolarHBondContact O-N 3.31Å
56	N	79.3	Confident	79.3	Confident	48 Å²	48	65.6 Å²	65.6	26%	0.257	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	111.2	171.9	-179.6	8.3	0	0	0	108.9	G37 D38 F39 G58 Y61	G37-N56 WeakPolarHBondContact O-CB 3.38Å; D38-N56 PolarHBondContact OD1-N 2.73Å; D38-N56 VanDerWaalsContact OD1-N 3.16Å; F39-N56 HydrophobicContact CD2-CB 4.25Å; F39-N56 HydrophobicContact CE2-CB 4.03Å; N56-G58 VanDerWaalsContact C-N 3.34Å; N56-G58 PolarHBondContact OD1-N 2.65Å; N56-Y61 HydrophobicContact CB-CD1 4.09Å; N56-Y61 HydrophobicContact CB-CE1 3.98Å
57	T	76.6	Confident	78.9	Confident	61 Å²	61	67.9 Å²	67.9	37%	0.374	37%	0.366	S	S	.	.			trans	-87.3	-6.3	-179.4	57.2	0	0	0	0	113.1	Q55 D59 Y60	Q55-T57 HydrophobicContact CG-CG2 4.36Å; T57-D59 VanDerWaalsContact C-N 3.3Å; T57-D59 PolarHBondContact OG1-N 3.29Å; T57-Y60 HydrophobicContact CG2-CE2 4.17Å; T57-Y60 PolarHBondContact N-O 2.95Å; T57-Y60 PolarHBondContact OG1-N 2.88Å; T57-Y60 PolarHBondContact OG1-O 3.41Å
58	G	67.4	Low	78.8	Confident	65 Å²	65	66.8 Å²	66.8	67%	0.67	36%	0.359	S	S	*	.	S	Bend	trans	92.9	-22.5	-168.8	0	0	0	0	0	113.4	N56	N56-G58 VanDerWaalsContact C-N 3.34Å; N56-G58 PolarHBondContact OD1-N 2.65Å
59	D	70.5	Confident	78.5	Confident	141 Å²	141	60.9 Å²	60.9	75%	0.754	33%	0.33	S	S	*	.	S	Bend	trans	-101.9	-31.9	178	-63	-39.2	0	0	0	112.7	T57	T57-D59 VanDerWaalsContact C-N 3.3Å; T57-D59 PolarHBondContact OG1-N 3.29Å
60	Y	77.4	Confident	77.8	Confident	72 Å²	72	63.2 Å²	63.2	28%	0.282	35%	0.352	S	S	.	.			trans	-159.9	164.6	-178.3	53.2	-96.6	0	0	0	111.9	T57 D62 K68 F69	T57-Y60 HydrophobicContact CG2-CE2 4.17Å; T57-Y60 PolarHBondContact N-O 2.95Å; T57-Y60 PolarHBondContact OG1-N 2.88Å; T57-Y60 PolarHBondContact OG1-O 3.41Å; Y60-D62 HydrophobicContact CD2-CB 4.14Å; Y60-D62 HydrophobicContact CE2-CB 4.08Å; Y60-K68 HydrophobicContact CD1-CD 4.45Å; Y60-K68 HydrophobicContact CD2-CB 4.13Å; Y60-K68 HydrophobicContact CD2-CD 3.79Å; Y60-K68 HydrophobicContact CD2-CG 3.9Å; Y60-K68 HydrophobicContact CE1-CD 4.34Å; Y60-K68 HydrophobicContact CE2-CD 3.66Å; Y60-K68 HydrophobicContact CE2-CG 4.09Å; Y60-K68 HydrophobicContact CG-CB 4.36Å; Y60-K68 HydrophobicContact CG-CD 4.19Å; Y60-K68 PolarHBondContact OH-NZ 3.37Å; Y60-F69 WeakPolarHBondContact CA-O 3.36Å
61	Y	75.4	Confident	77.1	Confident	23 Å²	23	63.6 Å²	63.6	9%	0.09	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.4	171.6	-63.4	-88.8	0	0	0	109.8	F39 I54 Q55 N56 K68 F69 A70 L72	F39-Y61 HydrophobicContact CD2-CD1 4.26Å; F39-Y61 AromaticContact CD2-CE1 3.9Å; F39-Y61 HydrophobicContact CD2-CE1 3.9Å; F39-Y61 HydrophobicContact CE2-CD1 4.38Å; F39-Y61 AromaticContact CE2-CE1 3.6Å; F39-Y61 HydrophobicContact CE2-CE1 3.6Å; F39-Y61 HydrophobicContact CZ-CE1 4.45Å; I54-Y61 HydrophobicContact CG2-CD1 4.16Å; Q55-Y61 WeakPolarHBondContact O-CA 3.49Å; N56-Y61 HydrophobicContact CB-CD1 4.09Å; N56-Y61 HydrophobicContact CB-CE1 3.98Å; Y61-K68 WeakPolarHBondContact O-CA 3.47Å; Y61-F69 PolarHBondContact N-O 3.37Å; Y61-F69 PolarHBondContact O-N 3.35Å; Y61-A70 WeakPolarHBondContact CD2-O 3.41Å; Y61-A70 WeakPolarHBondContact CE2-O 3.42Å; Y61-L72 HydrophobicContact CD1-CD2 3.46Å; Y61-L72 VanDerWaalsContact CD1-CD2 3.46Å; Y61-L72 HydrophobicContact CD1-CG 3.66Å; Y61-L72 HydrophobicContact CE1-CD1 4.15Å; Y61-L72 HydrophobicContact CE1-CD2 3.85Å; Y61-L72 HydrophobicContact CE1-CG 3.54Å; Y61-L72 HydrophobicContact CG-CD2 4.09Å; Y61-L72 HydrophobicContact CG-CG 4.26Å
62	D	81.9	Confident	76.5	Confident	24 Å²	24	60.6 Å²	60.6	13%	0.128	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.7	-177.7	-176.1	-22	0	0	0	110.2	I54 Q55 Y60 Y64 G65	I54-D62 CarbonylContact C-O 3.58Å; I54-D62 WeakPolarHBondContact CA-O 3.48Å; Q55-D62 PolarHBondContact N-O 3.46Å; Q55-D62 PolarHBondContact O-N 3.31Å; Y60-D62 HydrophobicContact CD2-CB 4.14Å; Y60-D62 HydrophobicContact CE2-CB 4.08Å; D62-Y64 PolarHBondContact O-N 3.42Å; D62-G65 PolarHBondContact OD1-N 2.98Å
63	L	77.6	Confident	75.8	Confident	11 Å²	11	60.5 Å²	60.5	6%	0.058	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	90.2	175.9	-171.2	128.1	0	0	0	109.5	L41 I52 I54 G65 G66 L75 Y79 L86	L41-L63 HydrophobicContact CD2-CD1 3.98Å; I52-L63 HydrophobicContact CG2-CD1 3.91Å; I52-L63 HydrophobicContact CG2-CD2 3.97Å; I52-L63 HydrophobicContact CG2-CG 3.78Å; I54-L63 HydrophobicContact CD1-CD1 4.42Å; I54-L63 HydrophobicContact CG1-CD1 3.91Å; L63-G65 VanDerWaalsContact C-N 3.3Å; L63-G65 PolarHBondContact O-N 3.25Å; L63-G65 VanDerWaalsContact O-N 3.08Å; L63-G66 PolarHBondContact O-N 3.49Å; L63-L75 HydrophobicContact CB-CD1 4.29Å; L63-L75 HydrophobicContact CD1-CD2 4.12Å; L63-Y79 HydrophobicContact CD2-CE2 4.4Å; L63-L86 HydrophobicContact CD1-CD1 4.42Å; L63-L86 HydrophobicContact CD2-CD1 4.23Å; L63-L86 HydrophobicContact CD2-CD2 3.56Å; L63-L86 HydrophobicContact CD2-CG 3.95Å
64	Y	65.8	Low	75.5	Confident	150 Å²	150	60.2 Å²	60.2	59%	0.588	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	41	47.1	173.2	-150.8	-93.6	0	0	0	115.2	R53 D62 K89	R53-Y64 HydrophobicContact CB-CD2 4.49Å; D62-Y64 PolarHBondContact O-N 3.42Å; Y64-K89 PolarHBondContact OH-NZ 3.35Å; Y64-K89 VanDerWaalsContact OH-NZ 3.15Å
65	G	57.2	Low	75.3	Confident	71 Å²	71	60.2 Å²	60.2	73%	0.732	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	15.1	176.8	0	0	0	0	0	114.8	D62 L63	D62-G65 PolarHBondContact OD1-N 2.98Å; L63-G65 VanDerWaalsContact C-N 3.3Å; L63-G65 PolarHBondContact O-N 3.25Å; L63-G65 VanDerWaalsContact O-N 3.08Å
66	G	68	Low	75.1	Confident	38 Å²	38	55.9 Å²	55.9	39%	0.392	32%	0.324	S	S	.	.	S	Bend	trans	-86.8	-151.6	170.2	0	0	0	0	0	113.3	L63	L63-G66 PolarHBondContact O-N 3.49Å
67	E	75.3	Confident	75	Confident	114 Å²	114	57.2 Å²	57.2	53%	0.533	33%	0.331	S	S	.	.			trans	-68.3	155	175.8	-69.2	-65.9	148.5	0	0	111.6	F69 Y78	E67-F69 HydrophobicContact CB-CE1 4.47Å; E67-F69 HydrophobicContact CB-CE2 3.77Å; E67-F69 HydrophobicContact CB-CZ 3.6Å; E67-F69 WeakPolarHBondContact O-CD2 3.42Å; E67-F69 VanDerWaalsContact O-CE2 3.23Å; E67-F69 WeakPolarHBondContact O-CE2 3.25Å; E67-Y78 HydrophobicContact CG-CE1 4.35Å
68	K	82.3	Confident	75.2	Confident	118 Å²	118	58.4 Å²	58.4	51%	0.513	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.8	-177.8	-63	177.7	-178.2	-175.6	0	110.8	Y60 Y61	Y60-K68 HydrophobicContact CD1-CD 4.45Å; Y60-K68 HydrophobicContact CD2-CB 4.13Å; Y60-K68 HydrophobicContact CD2-CD 3.79Å; Y60-K68 HydrophobicContact CD2-CG 3.9Å; Y60-K68 HydrophobicContact CE1-CD 4.34Å; Y60-K68 HydrophobicContact CE2-CD 3.66Å; Y60-K68 HydrophobicContact CE2-CG 4.09Å; Y60-K68 HydrophobicContact CG-CB 4.36Å; Y60-K68 HydrophobicContact CG-CD 4.19Å; Y60-K68 PolarHBondContact OH-NZ 3.37Å; Y61-K68 WeakPolarHBondContact O-CA 3.47Å
69	F	80.7	Confident	75.9	Confident	21 Å²	21	56.3 Å²	56.3	9%	0.092	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150	-174.1	-56.6	-84.8	0	0	0	112.2	Y60 Y61 E67 E74 L75 Y78 Y79	Y60-F69 WeakPolarHBondContact CA-O 3.36Å; Y61-F69 PolarHBondContact N-O 3.37Å; Y61-F69 PolarHBondContact O-N 3.35Å; E67-F69 HydrophobicContact CB-CE1 4.47Å; E67-F69 HydrophobicContact CB-CE2 3.77Å; E67-F69 HydrophobicContact CB-CZ 3.6Å; E67-F69 WeakPolarHBondContact O-CD2 3.42Å; E67-F69 VanDerWaalsContact O-CE2 3.23Å; E67-F69 WeakPolarHBondContact O-CE2 3.25Å; F69-E74 HydrophobicContact CB-CB 4.39Å; F69-E74 HydrophobicContact CD1-CB 4.31Å; F69-L75 HydrophobicContact CB-CB 3.88Å; F69-L75 HydrophobicContact CD1-CB 4.31Å; F69-L75 HydrophobicContact CD2-CB 3.55Å; F69-L75 HydrophobicContact CD2-CD1 3.79Å; F69-L75 HydrophobicContact CD2-CG 3.56Å; F69-L75 HydrophobicContact CE2-CB 4.16Å; F69-L75 HydrophobicContact CE2-CD1 4.35Å; F69-L75 HydrophobicContact CE2-CG 3.85Å; F69-L75 VanDerWaalsContact CG-CA 3.48Å; F69-L75 HydrophobicContact CG-CB 3.63Å; F69-L75 HydrophobicContact CG-CG 4.18Å; F69-Y78 VanDerWaalsContact CE1-CB 3.43Å; F69-Y78 AromaticContact CE1-CD1 3.9Å; F69-Y78 HydrophobicContact CE1-CD1 3.9Å; F69-Y78 AromaticContact CE1-CD2 3.98Å; F69-Y78 HydrophobicContact CE1-CD2 3.98Å; F69-Y78 AromaticContact CE1-CG 3.5Å; F69-Y78 HydrophobicContact CE1-CG 3.5Å; F69-Y78 VanDerWaalsContact CE1-CG 3.5Å; F69-Y78 AromaticContact CZ-CD1 3.52Å; F69-Y78 HydrophobicContact CZ-CD1 3.52Å; F69-Y78 HydrophobicContact CZ-CD2 4.39Å; F69-Y78 HydrophobicContact CZ-CE1 4.15Å; F69-Y78 AromaticContact CZ-CG 3.66Å; F69-Y78 HydrophobicContact CZ-CG 3.66Å; F69-Y79 HydrophobicContact CE2-CD2 4.48Å; F69-Y79 AromaticContact CE2-CE2 3.72Å; F69-Y79 HydrophobicContact CE2-CE2 3.72Å; F69-Y79 HydrophobicContact CZ-CD2 4.44Å; F69-Y79 AromaticContact CZ-CE2 3.89Å; F69-Y79 HydrophobicContact CZ-CE2 3.89Å
70	A	75.2	Confident	76.2	Confident	67 Å²	67	52.4 Å²	52.4	55%	0.554	28%	0.283	S	S	*	.	S	Bend	trans	-79.4	-29	178.5	0	0	0	0	0	112	Y61 E74	Y61-A70 WeakPolarHBondContact CD2-O 3.41Å; Y61-A70 WeakPolarHBondContact CE2-O 3.42Å; A70-E74 WeakPolarHBondContact CB-OE2 3.01Å; A70-E74 PolarHBondContact N-OE2 2.79Å
71	T	74.3	Confident	75.9	Confident	32 Å²	32	51.3 Å²	51.3	20%	0.196	29%	0.288	C	S	.	.	S	Bend	trans	-133.5	154	175.2	68.4	0	0	0	0	111.9	S73 E74 L75	T71-S73 PolarHBondContact O-N 3.04Å; T71-E74 PolarHBondContact N-OE2 3.4Å; T71-E74 PolarHBondContact O-N 3.33Å; T71-E74 WeakPolarHBondContact OG1-CG 3.47Å; T71-E74 PolarHBondContact OG1-N 3.33Å; T71-E74 VanDerWaalsContact OG1-N 3.13Å; T71-L75 PolarHBondContact O-N 3.13Å; T71-L75 VanDerWaalsContact O-N 3.12Å
72	L	74.6	Confident	75.1	Confident	5 Å²	5	59.8 Å²	59.8	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-57.6	-30.3	169.6	-74.5	177.2	0	0	0	112	W4 F5 F39 I54 Y61 L75 V76 P142	W4-L72 HydrophobicContact CH2-CB 3.95Å; W4-L72 WeakPolarHBondContact CH2-O 3.19Å; F5-L72 HydrophobicContact CD2-CD1 4.24Å; F5-L72 HydrophobicContact CE2-CD1 3.96Å; F39-L72 HydrophobicContact CB-CD2 4.44Å; F39-L72 HydrophobicContact CD1-CD1 3.83Å; F39-L72 HydrophobicContact CD2-CD1 4.05Å; F39-L72 HydrophobicContact CD2-CD2 4.33Å; F39-L72 HydrophobicContact CE1-CD1 3.96Å; F39-L72 HydrophobicContact CE2-CD1 4.22Å; F39-L72 HydrophobicContact CG-CD1 3.85Å; F39-L72 HydrophobicContact CG-CD2 4.37Å; F39-L72 HydrophobicContact CZ-CD1 4.16Å; I54-L72 HydrophobicContact CD1-CD2 3.95Å; I54-L72 HydrophobicContact CG2-CD2 3.83Å; Y61-L72 HydrophobicContact CD1-CD2 3.46Å; Y61-L72 VanDerWaalsContact CD1-CD2 3.46Å; Y61-L72 HydrophobicContact CD1-CG 3.66Å; Y61-L72 HydrophobicContact CE1-CD1 4.15Å; Y61-L72 HydrophobicContact CE1-CD2 3.85Å; Y61-L72 HydrophobicContact CE1-CG 3.54Å; Y61-L72 HydrophobicContact CG-CD2 4.09Å; Y61-L72 HydrophobicContact CG-CG 4.26Å; L72-L75 PolarHBondContact O-N 2.88Å; L72-V76 PolarHBondContact O-N 3.49Å; L72-V76 VanDerWaalsContact O-N 3.1Å; L72-P142 HydrophobicContact CD1-CB 4.33Å; L72-P142 HydrophobicContact CD1-CG 3.84Å
73	S	74.9	Confident	74	Confident	16 Å²	16	64.8 Å²	64.8	11%	0.112	36%	0.356	C	S	.	.	H	α-helix	trans	-64.2	-48.9	177.3	-55.4	0	0	0	0	111.5	V2 T71 L75 V76 D77	V2-S73 WeakPolarHBondContact CG2-OG 3.19Å; T71-S73 PolarHBondContact O-N 3.04Å; S73-L75 VanDerWaalsContact C-N 3.32Å; S73-L75 PolarHBondContact O-N 3.18Å; S73-V76 PolarHBondContact O-N 2.82Å; S73-D77 WeakPolarHBondContact O-CB 3.5Å; S73-D77 VanDerWaalsContact O-CG 3.23Å; S73-D77 PolarHBondContact O-N 3.23Å
74	E	78.8	Confident	73.2	Confident	95 Å²	95	65 Å²	65	44%	0.444	36%	0.36	S	S	.	.	H	α-helix	trans	-62	-39.7	176.2	-73.4	167.3	-171.5	0	0	112.2	F69 A70 T71 D77 Y78	F69-E74 HydrophobicContact CB-CB 4.39Å; F69-E74 HydrophobicContact CD1-CB 4.31Å; A70-E74 WeakPolarHBondContact CB-OE2 3.01Å; A70-E74 PolarHBondContact N-OE2 2.79Å; T71-E74 PolarHBondContact N-OE2 3.4Å; T71-E74 PolarHBondContact O-N 3.33Å; T71-E74 WeakPolarHBondContact OG1-CG 3.47Å; T71-E74 PolarHBondContact OG1-N 3.33Å; T71-E74 VanDerWaalsContact OG1-N 3.13Å; E74-D77 PolarHBondContact O-N 2.87Å; E74-Y78 VanDerWaalsContact O-CB 3.27Å; E74-Y78 WeakPolarHBondContact O-CB 3.5Å; E74-Y78 PolarHBondContact O-N 2.9Å
75	L	82.4	Confident	73.3	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-56.9	-51.5	175.5	-177.8	159	0	0	0	110.9	I54 L63 F69 T71 L72 S73 Y78 Y79	I54-L75 HydrophobicContact CD1-CD1 4.26Å; I54-L75 HydrophobicContact CD1-CD2 4.25Å; I54-L75 HydrophobicContact CG1-CD1 4.33Å; I54-L75 HydrophobicContact CG2-CD1 3.99Å; L63-L75 HydrophobicContact CB-CD1 4.29Å; L63-L75 HydrophobicContact CD1-CD2 4.12Å; F69-L75 HydrophobicContact CB-CB 3.88Å; F69-L75 HydrophobicContact CD1-CB 4.31Å; F69-L75 HydrophobicContact CD2-CB 3.55Å; F69-L75 HydrophobicContact CD2-CD1 3.79Å; F69-L75 HydrophobicContact CD2-CG 3.56Å; F69-L75 HydrophobicContact CE2-CB 4.16Å; F69-L75 HydrophobicContact CE2-CD1 4.35Å; F69-L75 HydrophobicContact CE2-CG 3.85Å; F69-L75 VanDerWaalsContact CG-CA 3.48Å; F69-L75 HydrophobicContact CG-CB 3.63Å; F69-L75 HydrophobicContact CG-CG 4.18Å; T71-L75 PolarHBondContact O-N 3.13Å; T71-L75 VanDerWaalsContact O-N 3.12Å; L72-L75 PolarHBondContact O-N 2.88Å; S73-L75 VanDerWaalsContact C-N 3.32Å; S73-L75 PolarHBondContact O-N 3.18Å; L75-Y78 PolarHBondContact O-N 3.4Å; L75-Y79 HydrophobicContact CD2-CD2 4.07Å; L75-Y79 HydrophobicContact CD2-CE2 4.43Å; L75-Y79 HydrophobicContact CG-CD2 4.3Å; L75-Y79 HydrophobicContact CG-CE2 4.33Å; L75-Y79 VanDerWaalsContact O-CD2 3.22Å; L75-Y79 WeakPolarHBondContact O-CD2 3.22Å; L75-Y79 PolarHBondContact O-N 3.18Å
76	V	81.3	Confident	74.2	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.012	33%	0.329	C	S	.	.	H	α-helix	trans	-67.7	-47.2	179.3	170.7	0	0	0	0	110.9	W4 F27 L72 S73 Y78 Y79 T80	W4-V76 HydrophobicContact CD2-CG1 4.43Å; W4-V76 HydrophobicContact CD2-CG2 4.19Å; W4-V76 HydrophobicContact CE3-CG2 4.25Å; W4-V76 HydrophobicContact CH2-CB 4.01Å; W4-V76 HydrophobicContact CH2-CG2 3.37Å; W4-V76 HydrophobicContact CZ2-CB 3.38Å; W4-V76 HydrophobicContact CZ2-CG1 3.86Å; W4-V76 HydrophobicContact CZ2-CG2 3.24Å; W4-V76 HydrophobicContact CZ3-CG2 3.88Å; F27-V76 HydrophobicContact CE2-CG1 3.5Å; F27-V76 HydrophobicContact CE2-CG2 4.43Å; F27-V76 HydrophobicContact CZ-CG1 3.6Å; L72-V76 PolarHBondContact O-N 3.49Å; L72-V76 VanDerWaalsContact O-N 3.1Å; S73-V76 PolarHBondContact O-N 2.82Å; V76-Y78 PolarHBondContact O-N 2.92Å; V76-Y79 PolarHBondContact O-N 2.6Å; V76-Y79 VanDerWaalsContact O-N 3.1Å; V76-T80 WeakPolarHBondContact CG1-OG1 3.49Å; V76-T80 WeakPolarHBondContact O-CB 3.35Å; V76-T80 PolarHBondContact O-N 3.17Å; V76-T80 PolarHBondContact O-OG1 3.43Å
77	D	76.9	Confident	74.7	Confident	76 Å²	76	64.5 Å²	64.5	41%	0.406	34%	0.337	S	S	.	.	H	α-helix	trans	-55.8	-37.2	179.7	-71.3	-18.1	0	0	0	111	S73 E74 A81	S73-D77 WeakPolarHBondContact O-CB 3.5Å; S73-D77 VanDerWaalsContact O-CG 3.23Å; S73-D77 PolarHBondContact O-N 3.23Å; E74-D77 PolarHBondContact O-N 2.87Å; D77-A81 WeakPolarHBondContact O-CB 3.36Å; D77-A81 PolarHBondContact O-N 3.42Å; D77-A81 VanDerWaalsContact O-N 3.15Å
78	Y	81.3	Confident	74.5	Confident	86 Å²	86	61.9 Å²	61.9	34%	0.337	33%	0.327	S	S	.	.	H	α-helix	trans	-64.2	-48.6	175	-178.8	-92.2	0	0	0	113.4	E67 F69 E74 L75 V76 T80 A81	E67-Y78 HydrophobicContact CG-CE1 4.35Å; F69-Y78 VanDerWaalsContact CE1-CB 3.43Å; F69-Y78 AromaticContact CE1-CD1 3.9Å; F69-Y78 HydrophobicContact CE1-CD1 3.9Å; F69-Y78 AromaticContact CE1-CD2 3.98Å; F69-Y78 HydrophobicContact CE1-CD2 3.98Å; F69-Y78 AromaticContact CE1-CG 3.5Å; F69-Y78 HydrophobicContact CE1-CG 3.5Å; F69-Y78 VanDerWaalsContact CE1-CG 3.5Å; F69-Y78 AromaticContact CZ-CD1 3.52Å; F69-Y78 HydrophobicContact CZ-CD1 3.52Å; F69-Y78 HydrophobicContact CZ-CD2 4.39Å; F69-Y78 HydrophobicContact CZ-CE1 4.15Å; F69-Y78 AromaticContact CZ-CG 3.66Å; F69-Y78 HydrophobicContact CZ-CG 3.66Å; E74-Y78 VanDerWaalsContact O-CB 3.27Å; E74-Y78 WeakPolarHBondContact O-CB 3.5Å; E74-Y78 PolarHBondContact O-N 2.9Å; L75-Y78 PolarHBondContact O-N 3.4Å; V76-Y78 PolarHBondContact O-N 2.92Å; Y78-T80 VanDerWaalsContact C-N 3.32Å; Y78-A81 PolarHBondContact O-N 2.74Å
79	Y	81.3	Confident	73.9	Confident	20 Å²	20	64.1 Å²	64.1	8%	0.078	34%	0.337	C	S	.	.	H	α-helix	trans	-81.5	-9.6	-178.7	-73.3	-68.3	0	0	0	114.3	L63 F69 L75 V76 L86	L63-Y79 HydrophobicContact CD2-CE2 4.4Å; F69-Y79 HydrophobicContact CE2-CD2 4.48Å; F69-Y79 AromaticContact CE2-CE2 3.72Å; F69-Y79 HydrophobicContact CE2-CE2 3.72Å; F69-Y79 HydrophobicContact CZ-CD2 4.44Å; F69-Y79 AromaticContact CZ-CE2 3.89Å; F69-Y79 HydrophobicContact CZ-CE2 3.89Å; L75-Y79 HydrophobicContact CD2-CD2 4.07Å; L75-Y79 HydrophobicContact CD2-CE2 4.43Å; L75-Y79 HydrophobicContact CG-CD2 4.3Å; L75-Y79 HydrophobicContact CG-CE2 4.33Å; L75-Y79 VanDerWaalsContact O-CD2 3.22Å; L75-Y79 WeakPolarHBondContact O-CD2 3.22Å; L75-Y79 PolarHBondContact O-N 3.18Å; V76-Y79 PolarHBondContact O-N 2.6Å; V76-Y79 VanDerWaalsContact O-N 3.1Å; Y79-L86 HydrophobicContact CD1-CB 4.15Å; Y79-L86 HydrophobicContact CD1-CD1 3.7Å; Y79-L86 HydrophobicContact CD1-CG 3.86Å; Y79-L86 HydrophobicContact CD2-CD1 4.04Å; Y79-L86 HydrophobicContact CE1-CB 4.43Å; Y79-L86 HydrophobicContact CE1-CD1 4.17Å; Y79-L86 HydrophobicContact CE1-CG 3.94Å; Y79-L86 HydrophobicContact CE2-CD1 4.48Å; Y79-L86 HydrophobicContact CG-CD1 3.65Å; Y79-L86 HydrophobicContact CG-CG 4.31Å
80	T	77.5	Confident	73.5	Confident	60 Å²	60	68.8 Å²	68.8	37%	0.368	36%	0.362	S	S	.	.	H	α-helix	trans	-90.6	-21.1	171.1	-37.1	0	0	0	0	111	V76 Y78 L96	V76-T80 WeakPolarHBondContact CG1-OG1 3.49Å; V76-T80 WeakPolarHBondContact O-CB 3.35Å; V76-T80 PolarHBondContact O-N 3.17Å; V76-T80 PolarHBondContact O-OG1 3.43Å; Y78-T80 VanDerWaalsContact C-N 3.32Å; T80-L96 WeakPolarHBondContact CG2-O 3.39Å
81	A	71.3	Confident	73.4	Confident	48 Å²	48	67.7 Å²	67.7	40%	0.397	36%	0.358	S	S	.	.	S	Bend	trans	-82.5	158.7	173.4	0	0	0	0	0	111.6	D77 Y78 N83 G84	D77-A81 WeakPolarHBondContact O-CB 3.36Å; D77-A81 PolarHBondContact O-N 3.42Å; D77-A81 VanDerWaalsContact O-N 3.15Å; Y78-A81 PolarHBondContact O-N 2.74Å; A81-N83 PolarHBondContact O-N 3.29Å; A81-G84 PolarHBondContact O-N 2.85Å
82	E	58.8	Low	73.6	Confident	202 Å²	202	69 Å²	69	94%	0.944	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-5.1	-176.9	-66.8	-173.6	160	0	0	115.6
83	N	57.8	Low	73.9	Confident	129 Å²	129	73.2 Å²	73.2	69%	0.69	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-13	-173.7	-61.6	-33.9	0	0	0	114.2	A81	A81-N83 PolarHBondContact O-N 3.29Å
84	G	61.2	Low	74.3	Confident	15 Å²	15	72.7 Å²	72.7	16%	0.155	38%	0.383	C	S	.	.			trans	-110.2	110.2	-175.7	0	0	0	0	0	113.6	A81	A81-G84 PolarHBondContact O-N 2.85Å
85	I	68.9	Low	74.5	Confident	123 Å²	123	71.9 Å²	71.9	63%	0.631	38%	0.38	S	S	*	.			trans	-95.7	123.1	169.5	-61.7	171.5	0	0	0	108.9	Q87 I93	I85-Q87 HydrophobicContact CG2-CG 4Å; I85-I93 HydrophobicContact CG2-CG2 4.39Å
86	L	76.3	Confident	74.6	Confident	7 Å²	7	72.3 Å²	72.3	4%	0.037	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.1	177.9	-130.6	162	0	0	0	107.4	L41 I52 L63 Y79 I94 L96	L41-L86 HydrophobicContact CD2-CD1 4.3Å; I52-L86 HydrophobicContact CD1-CD2 3.38Å; L63-L86 HydrophobicContact CD1-CD1 4.42Å; L63-L86 HydrophobicContact CD2-CD1 4.23Å; L63-L86 HydrophobicContact CD2-CD2 3.56Å; L63-L86 HydrophobicContact CD2-CG 3.95Å; Y79-L86 HydrophobicContact CD1-CB 4.15Å; Y79-L86 HydrophobicContact CD1-CD1 3.7Å; Y79-L86 HydrophobicContact CD1-CG 3.86Å; Y79-L86 HydrophobicContact CD2-CD1 4.04Å; Y79-L86 HydrophobicContact CE1-CB 4.43Å; Y79-L86 HydrophobicContact CE1-CD1 4.17Å; Y79-L86 HydrophobicContact CE1-CG 3.94Å; Y79-L86 HydrophobicContact CE2-CD1 4.48Å; Y79-L86 HydrophobicContact CG-CD1 3.65Å; Y79-L86 HydrophobicContact CG-CG 4.31Å; L86-I94 HydrophobicContact CB-CB 4.21Å; L86-I94 WeakPolarHBondContact CB-O 3.44Å; L86-I94 PolarHBondContact O-N 2.92Å; L86-L96 HydrophobicContact CD1-CD1 4.07Å; L86-L96 HydrophobicContact CD1-CG 4.35Å
87	Q	77	Confident	74.6	Confident	118 Å²	118	76.9 Å²	76.9	55%	0.551	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.7	-176.9	-78.4	177	0.9	0	0	111.1	I85 T92 I93	I85-Q87 HydrophobicContact CG2-CG 4Å; Q87-T92 VanDerWaalsContact CA-O 3.31Å; Q87-T92 WeakPolarHBondContact CA-O 3.41Å; Q87-I93 HydrophobicContact CG-CG1 4.16Å
88	D	71.6	Confident	74.8	Confident	60 Å²	60	76 Å²	76	32%	0.321	39%	0.393	S	S	.	.			trans	-79.7	168.5	170.1	-152.6	-13.5	0	0	0	111.1	T50 D90 G91 T92 I94	T50-D88 WeakPolarHBondContact CG2-OD2 3.35Å; D88-D90 WeakPolarHBondContact CB-OD1 3.45Å; D88-D90 PolarHBondContact O-N 2.99Å; D88-D90 VanDerWaalsContact O-N 3.1Å; D88-G91 PolarHBondContact O-N 3.12Å; D88-T92 PolarHBondContact N-O 3.22Å; D88-I94 HydrophobicContact CB-CD1 4.06Å
89	K	69.8	Low	74.7	Confident	165 Å²	165	73.9 Å²	73.9	72%	0.717	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.9	-177.7	-67.7	-178.1	179.3	177.4	0	114	Y64	Y64-K89 PolarHBondContact OH-NZ 3.35Å; Y64-K89 VanDerWaalsContact OH-NZ 3.15Å
90	D	72.8	Confident	74.6	Confident	118 Å²	118	73.2 Å²	73.2	63%	0.631	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-0.2	176.8	65.4	0.7	0	0	0	113.3	D88 T92	D88-D90 WeakPolarHBondContact CB-OD1 3.45Å; D88-D90 PolarHBondContact O-N 2.99Å; D88-D90 VanDerWaalsContact O-N 3.1Å; D90-T92 VanDerWaalsContact CG-OG1 3.27Å; D90-T92 VanDerWaalsContact OD1-CB 3.24Å; D90-T92 WeakPolarHBondContact OD1-CB 3.33Å; D90-T92 PolarHBondContact OD1-N 3.33Å; D90-T92 PolarHBondContact OD1-OG1 3.34Å; D90-T92 PolarHBondContact OD2-OG1 3Å
91	G	72.3	Confident	74.3	Confident	45 Å²	45	70.9 Å²	70.9	46%	0.464	37%	0.373	S	S	.	.			trans	88.7	3.3	-178.9	0	0	0	0	0	114.6	D88 I93	D88-G91 PolarHBondContact O-N 3.12Å; G91-I93 PolarHBondContact O-N 3.43Å
92	T	78.7	Confident	74.3	Confident	59 Å²	59	70.1 Å²	70.1	36%	0.362	37%	0.365	S	S	.	.			trans	-66.2	125.6	176.5	-56.4	0	0	0	0	110.6	V45 Q87 D88 D90	V45-T92 HydrophobicContact CG1-CG2 4.06Å; Q87-T92 VanDerWaalsContact CA-O 3.31Å; Q87-T92 WeakPolarHBondContact CA-O 3.41Å; D88-T92 PolarHBondContact N-O 3.22Å; D90-T92 VanDerWaalsContact CG-OG1 3.27Å; D90-T92 VanDerWaalsContact OD1-CB 3.24Å; D90-T92 WeakPolarHBondContact OD1-CB 3.33Å; D90-T92 PolarHBondContact OD1-N 3.33Å; D90-T92 PolarHBondContact OD1-OG1 3.34Å; D90-T92 PolarHBondContact OD2-OG1 3Å
93	I	81.4	Confident	74.4	Confident	93 Å²	93	64.9 Å²	64.9	48%	0.477	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	127.4	174.8	-60.6	173.7	0	0	0	109	I85 Q87 G91 E95	I85-I93 HydrophobicContact CG2-CG2 4.39Å; Q87-I93 HydrophobicContact CG-CG1 4.16Å; G91-I93 PolarHBondContact O-N 3.43Å; I93-E95 HydrophobicContact CG2-CG 4.2Å
94	I	83.8	Confident	74.7	Confident	6 Å²	6	60.6 Å²	60.6	3%	0.031	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	113.7	178.2	-55.5	179	0	0	0	107.8	V43 V45 T50 I52 L86 D88	V43-I94 HydrophobicContact CB-CG2 3.84Å; V43-I94 HydrophobicContact CG1-CG2 3.59Å; V43-I94 HydrophobicContact CG2-CG2 3.94Å; V45-I94 HydrophobicContact CG2-CG1 4.23Å; V45-I94 HydrophobicContact CG2-CG2 4.15Å; T50-I94 HydrophobicContact CG2-CD1 4.05Å; I52-I94 HydrophobicContact CD1-CD1 3.63Å; I52-I94 HydrophobicContact CD1-CG2 4.38Å; I52-I94 HydrophobicContact CG1-CD1 4.37Å; L86-I94 HydrophobicContact CB-CB 4.21Å; L86-I94 WeakPolarHBondContact CB-O 3.44Å; L86-I94 PolarHBondContact O-N 2.92Å; D88-I94 HydrophobicContact CB-CD1 4.06Å
95	E	83.2	Confident	75.1	Confident	78 Å²	78	62.2 Å²	62.2	36%	0.364	34%	0.335	S	S	.	.			trans	-98.6	127	178.5	-60	-177.8	151.4	0	0	110.3	G25 I93 K97	G25-E95 WeakPolarHBondContact CA-O 3.18Å; I93-E95 HydrophobicContact CG2-CG 4.2Å; E95-K97 HydrophobicContact CB-CD 4.39Å; E95-K97 HydrophobicContact CB-CG 4.23Å; E95-K97 IonicContact OE1-NZ 2.75Å; E95-K97 WeakPolarHBondContact OE2-CE 3.31Å; E95-K97 IonicContact OE2-NZ 2.87Å; E95-K97 PolarHBondContact OE2-NZ 3.35Å
96	L	83.8	Confident	75.1	Confident	8 Å²	8	57.1 Å²	57.1	4%	0.042	31%	0.31	C	S	.	.			trans	-91.5	100.7	169	-58.4	-179.4	0	0	0	108.1	F27 L41 V43 T80 L86	F27-L96 HydrophobicContact CB-CD2 3.59Å; F27-L96 HydrophobicContact CD1-CB 3.8Å; F27-L96 HydrophobicContact CD1-CD2 4Å; F27-L96 HydrophobicContact CD1-CG 4.46Å; F27-L96 HydrophobicContact CD2-CD2 4.19Å; F27-L96 HydrophobicContact CE1-CB 3.89Å; F27-L96 HydrophobicContact CG-CB 4.31Å; F27-L96 HydrophobicContact CG-CD2 3.67Å; F27-L96 HydrophobicContact CG-CG 4.48Å; F27-L96 HydrophobicContact CZ-CB 4.47Å; L41-L96 HydrophobicContact CD2-CD1 3.95Å; L41-L96 HydrophobicContact CD2-CD2 3.99Å; L41-L96 HydrophobicContact CG-CD2 4.44Å; V43-L96 HydrophobicContact CB-CD2 4.43Å; V43-L96 HydrophobicContact CG1-CD2 4.03Å; V43-L96 HydrophobicContact CG2-CD2 3.49Å; V43-L96 VanDerWaalsContact CG2-CD2 3.49Å; T80-L96 WeakPolarHBondContact CG2-O 3.39Å; L86-L96 HydrophobicContact CD1-CD1 4.07Å; L86-L96 HydrophobicContact CD1-CG 4.35Å
97	K	80.6	Confident	74.7	Confident	98 Å²	98	60.8 Å²	60.8	43%	0.426	33%	0.332	S	S	.	.			trans	-112.2	-48	-177.5	-76	-179.3	166	165.1	0	112.9	G25 E95	G25-K97 PolarHBondContact O-N 3.19Å; E95-K97 HydrophobicContact CB-CD 4.39Å; E95-K97 HydrophobicContact CB-CG 4.23Å; E95-K97 IonicContact OE1-NZ 2.75Å; E95-K97 WeakPolarHBondContact OE2-CE 3.31Å; E95-K97 IonicContact OE2-NZ 2.87Å; E95-K97 PolarHBondContact OE2-NZ 3.35Å
98	Y	81.1	Confident	74.6	Confident	59 Å²	59	58.5 Å²	58.5	23%	0.231	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	104.1	-167.5	-48.4	-68.7	0	0	0	110.9	I23 H24 G25 S26 F27 V100 L478	I23-Y98 HydrophobicContact CD1-CD2 3.57Å; I23-Y98 HydrophobicContact CD1-CE1 4.42Å; I23-Y98 HydrophobicContact CD1-CE2 3.45Å; I23-Y98 VanDerWaalsContact CD1-CE2 3.45Å; I23-Y98 HydrophobicContact CD1-CG 4.1Å; I23-Y98 HydrophobicContact CG1-CD2 3.54Å; I23-Y98 HydrophobicContact CG1-CE2 3.85Å; I23-Y98 HydrophobicContact CG1-CG 4.19Å; H24-Y98 WeakPolarHBondContact O-CD2 3.34Å; H24-Y98 VanDerWaalsContact O-CE2 3.32Å; H24-Y98 WeakPolarHBondContact O-CE2 3.47Å; G25-Y98 PolarHBondContact O-N 3.36Å; S26-Y98 CarbonylContact C-O 3.58Å; S26-Y98 WeakPolarHBondContact CA-O 3.47Å; F27-Y98 PolarHBondContact N-O 3.08Å; Y98-V100 PolarHBondContact O-N 3.3Å; Y98-L478 HydrophobicContact CD1-CD2 3.64Å; Y98-L478 HydrophobicContact CE1-CD2 3.9Å
99	P	80.7	Confident	75.1	Confident	41 Å²	41	56.3 Å²	56.3	27%	0.266	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	128.1	177.4	25.9	-32.2	0	0	0	110.9	W4 F27	W4-P99 HydrophobicContact CB-CB 3.81Å; W4-P99 HydrophobicContact CG-CB 4.27Å; F27-P99 HydrophobicContact CE1-CB 4.06Å; F27-P99 HydrophobicContact CE2-CB 4.27Å; F27-P99 HydrophobicContact CZ-CB 3.8Å
100	V	77.4	Confident	75.8	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.036	28%	0.276	C	S	.	.			trans	-92	109.9	172.3	-179.1	0	0	0	0	109	H6 I17 L18 F27 L28 Y98	H6-V100 PolarHBondContact NE2-O 2.8Å; I17-V100 HydrophobicContact CG2-CG1 3.74Å; L18-V100 HydrophobicContact CD2-CB 4.37Å; L18-V100 HydrophobicContact CD2-CG2 3.74Å; F27-V100 PolarHBondContact O-N 3.45Å; L28-V100 HydrophobicContact CB-CB 4.47Å; L28-V100 HydrophobicContact CD2-CB 4.48Å; Y98-V100 PolarHBondContact O-N 3.3Å
101	N	72.3	Confident	76.4	Confident	11 Å²	11	43.3 Å²	43.3	6%	0.059	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-75.7	144.9	-170.1	-67.6	-26.8	0	0	0	112.9	R3 H6 D481	R3-N101 HydrophobicContact CB-CB 3.85Å; R3-N101 VanDerWaalsContact CB-CG 3.43Å; R3-N101 WeakPolarHBondContact CB-OD1 3.42Å; R3-N101 CarbonylContact O-C 3.57Å; R3-N101 VanDerWaalsContact O-CA 3.29Å; R3-N101 WeakPolarHBondContact O-CA 3.47Å; H6-N101 PolarHBondContact CE1-O 3.1Å; N101-D481 WeakPolarHBondContact CB-O 3.38Å; N101-D481 PolarHBondContact ND2-O 2.81Å
102	S	70.1	Confident	76.9	Confident	32 Å²	32	42 Å²	42	22%	0.224	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-77.4	150.7	168.6	-153	0	0	0	0	110.2	R3 H6 I217	R3-S102 PolarHBondContact O-N 3.34Å; H6-S102 WeakPolarHBondContact CE1-CA 3.27Å; H6-S102 PolarHBondContact ND1-OG 2.99Å; H6-S102 PolarHBondContact NE2-N 3.29Å; S102-I217 WeakPolarHBondContact O-CD1 3.29Å
103	S	62.5	Low	76.9	Confident	92 Å²	92	39.2 Å²	39.2	64%	0.643	21%	0.212	S	C	*	.	P	Polyproline II helix	trans	-61.4	138.9	174.8	-60.2	0	0	0	0	110.6
104	D	64	Low	76.7	Confident	38 Å²	38	36.3 Å²	36.3	20%	0.203	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-62.5	137.9	178.2	-78.1	-29.6	0	0	0	109.6	R3 T106 Y111	R3-D104 IonicContact CZ-OD1 2.82Å; R3-D104 IonicContact CZ-OD2 2.93Å; R3-D104 IonicContact NE-OD1 3Å; R3-D104 IonicContact NH1-OD2 3.29Å; R3-D104 VanDerWaalsContact NH2-CG 3.31Å; R3-D104 IonicContact NH2-OD1 2.94Å; R3-D104 PolarHBondContact NH2-OD1 3.19Å; R3-D104 IonicContact NH2-OD2 3.78Å; R3-D104 PolarHBondContact NH2-OD2 3.07Å; D104-T106 WeakPolarHBondContact CB-O 3.46Å; D104-T106 PolarHBondContact O-N 2.94Å; D104-T106 VanDerWaalsContact O-N 3.1Å; D104-Y111 HydrophobicContact CB-CD1 4.25Å; D104-Y111 HydrophobicContact CB-CE1 4.13Å; D104-Y111 WeakPolarHBondContact OD1-CE1 3.24Å
105	P	69.3	Low	76.6	Confident	50 Å²	50	37.1 Å²	37.1	33%	0.325	20%	0.2	S	C	.	.	S	Bend	trans	-67.9	-9.9	-179.2	30.3	-37.9	0	0	0	113	Y111 F145 L185	P105-Y111 VanDerWaalsContact CD-CE1 3.5Å; P105-Y111 HydrophobicContact CG-CE1 3.97Å; P105-Y111 HydrophobicContact CG-CE2 3.89Å; P105-F145 HydrophobicContact CB-CZ 4.28Å; P105-F145 HydrophobicContact CG-CE1 3.82Å; P105-F145 HydrophobicContact CG-CZ 3.98Å; P105-L185 HydrophobicContact CB-CD1 3.92Å; P105-L185 HydrophobicContact CG-CD1 3.67Å
106	T	68.7	Low	76.7	Confident	15 Å²	15	34.8 Å²	34.8	9%	0.092	19%	0.192	C	C	.	.			trans	-154.2	150.8	175	-177.3	0	0	0	0	109	D104 E108 W110 Y111 T186	D104-T106 WeakPolarHBondContact CB-O 3.46Å; D104-T106 PolarHBondContact O-N 2.94Å; D104-T106 VanDerWaalsContact O-N 3.1Å; T106-E108 VanDerWaalsContact C-N 3.25Å; T106-E108 HydrophobicContact CG2-CB 4.03Å; T106-E108 WeakPolarHBondContact OG1-CB 3.26Å; T106-E108 VanDerWaalsContact OG1-CG 3.23Å; T106-E108 WeakPolarHBondContact OG1-CG 3.49Å; T106-E108 PolarHBondContact OG1-N 3.07Å; T106-W110 HydrophobicContact CG2-CH2 3.97Å; T106-W110 HydrophobicContact CG2-CZ2 4.48Å; T106-W110 HydrophobicContact CG2-CZ3 4.26Å; T106-Y111 HydrophobicContact CG2-CD1 4.47Å; T106-Y111 HydrophobicContact CG2-CD2 4.4Å; T106-Y111 HydrophobicContact CG2-CG 3.95Å; T106-T186 PolarHBondContact OG1-OG1 3.17Å; T106-T186 VanDerWaalsContact OG1-OG1 3.09Å
107	T	67.8	Low	76.9	Confident	84 Å²	84	35 Å²	35	52%	0.515	20%	0.196	S	C	.	.			trans	-83.9	-5.6	171.9	58.5	0	0	0	0	111.9	Q227	T107-Q227 VanDerWaalsContact CB-NE2 3.34Å; T107-Q227 PolarHBondContact O-NE2 3.43Å; T107-Q227 PolarHBondContact O-OE1 3.37Å; T107-Q227 PolarHBondContact OG1-NE2 2.94Å
108	E	75.4	Confident	77.4	Confident	71 Å²	71	34.6 Å²	34.6	33%	0.332	20%	0.204	S	C	.	.			trans	-61.8	133.8	-174.5	-73.1	-67	149	0	0	113.8	T106 W110 Y111 T186	T106-E108 VanDerWaalsContact C-N 3.25Å; T106-E108 HydrophobicContact CG2-CB 4.03Å; T106-E108 WeakPolarHBondContact OG1-CB 3.26Å; T106-E108 VanDerWaalsContact OG1-CG 3.23Å; T106-E108 WeakPolarHBondContact OG1-CG 3.49Å; T106-E108 PolarHBondContact OG1-N 3.07Å; E108-W110 HydrophobicContact CB-CD2 4Å; E108-W110 HydrophobicContact CB-CG 4.29Å; E108-W110 HydrophobicContact CB-CH2 4.4Å; E108-W110 HydrophobicContact CB-CZ2 3.63Å; E108-W110 VanDerWaalsContact CB-NE1 3.31Å; E108-W110 HydrophobicContact CG-CZ2 3.7Å; E108-W110 PolarHBondContact O-N 3.05Å; E108-W110 VanDerWaalsContact O-N 3.14Å; E108-W110 PolarHBondContact OE2-NE1 3.16Å; E108-Y111 WeakPolarHBondContact O-CB 3.37Å; E108-Y111 PolarHBondContact O-N 3.28Å; E108-Y111 VanDerWaalsContact O-N 3.08Å; E108-T186 HydrophobicContact CG-CG2 4.19Å
109	R	81.2	Confident	77.6	Confident	13 Å²	13	35.9 Å²	35.9	5%	0.049	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.7	-176.6	-70.7	172.5	70.9	-150.6	3.9	113.7	Y111 F212 S213 E249 E250	R109-Y111 PolarHBondContact O-N 3.14Å; R109-F212 HydrophobicContact CB-CB 4.11Å; R109-F212 HydrophobicContact CB-CD1 3.29Å; R109-F212 HydrophobicContact CB-CE1 3.91Å; R109-F212 HydrophobicContact CB-CG 3.98Å; R109-F212 HydrophobicContact CG-CD1 4.43Å; R109-F212 CarbonylContact O-C 3.58Å; R109-F212 WeakPolarHBondContact O-CA 3.46Å; R109-S213 WeakPolarHBondContact O-CB 3.48Å; R109-S213 PolarHBondContact O-N 3.39Å; R109-E249 IonicContact NH1-OE2 2.9Å; R109-E249 PolarHBondContact NH1-OE2 2.8Å; R109-E249 IonicContact NH2-OE2 3.11Å; R109-E250 IonicContact CZ-OE1 3.46Å; R109-E250 IonicContact NE-OE1 3.31Å; R109-E250 PolarHBondContact NE-OE1 3.01Å; R109-E250 IonicContact NH2-OE1 3.8Å; R109-E250 PolarHBondContact NH2-OE1 3.1Å
110	W	85.6	Confident	77.9	Confident	5 Å²	5	34 Å²	34	2%	0.019	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-4.1	176.2	50.7	-101.6	0	0	0	113.7	T106 E108 H112 F133 V135 L185 V189 P210	T106-W110 HydrophobicContact CG2-CH2 3.97Å; T106-W110 HydrophobicContact CG2-CZ2 4.48Å; T106-W110 HydrophobicContact CG2-CZ3 4.26Å; E108-W110 HydrophobicContact CB-CD2 4Å; E108-W110 HydrophobicContact CB-CG 4.29Å; E108-W110 HydrophobicContact CB-CH2 4.4Å; E108-W110 HydrophobicContact CB-CZ2 3.63Å; E108-W110 VanDerWaalsContact CB-NE1 3.31Å; E108-W110 HydrophobicContact CG-CZ2 3.7Å; E108-W110 PolarHBondContact O-N 3.05Å; E108-W110 VanDerWaalsContact O-N 3.14Å; E108-W110 PolarHBondContact OE2-NE1 3.16Å; W110-H112 PolarHBondContact O-CD2 3.16Å; W110-F133 HydrophobicContact CB-CE2 3.98Å; W110-F133 HydrophobicContact CD2-CE2 4.26Å; W110-F133 AromaticContact CG-CE2 3.91Å; W110-F133 HydrophobicContact CG-CE2 3.91Å; W110-F133 HydrophobicContact CG-CZ 4.43Å; W110-V135 HydrophobicContact CE3-CB 3.56Å; W110-V135 HydrophobicContact CE3-CG2 3.4Å; W110-V135 VanDerWaalsContact CE3-CG2 3.4Å; W110-V135 HydrophobicContact CH2-CG2 4.44Å; W110-V135 HydrophobicContact CZ3-CB 3.48Å; W110-V135 VanDerWaalsContact CZ3-CB 3.48Å; W110-V135 HydrophobicContact CZ3-CG1 4.08Å; W110-V135 HydrophobicContact CZ3-CG2 3.34Å; W110-V135 PolarHBondContact O-N 3.28Å; W110-L185 HydrophobicContact CH2-CB 3.99Å; W110-V189 HydrophobicContact CE3-CG2 4.31Å; W110-V189 HydrophobicContact CH2-CB 4.19Å; W110-V189 HydrophobicContact CH2-CG2 3.6Å; W110-V189 HydrophobicContact CZ2-CB 3.95Å; W110-V189 HydrophobicContact CZ2-CG1 4.19Å; W110-V189 HydrophobicContact CZ2-CG2 3.87Å; W110-V189 HydrophobicContact CZ3-CG2 3.86Å; W110-P210 HydrophobicContact CB-CB 3.65Å; W110-P210 HydrophobicContact CG-CB 4.39Å
111	Y	85.1	Confident	78.6	Confident	6 Å²	6	37.8 Å²	37.8	2%	0.024	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-87.3	125.9	173.7	-175.2	-109.8	0	0	0	110.9	D104 P105 T106 E108 R109 G113 V135 E137 F145 S213	D104-Y111 HydrophobicContact CB-CD1 4.25Å; D104-Y111 HydrophobicContact CB-CE1 4.13Å; D104-Y111 WeakPolarHBondContact OD1-CE1 3.24Å; P105-Y111 VanDerWaalsContact CD-CE1 3.5Å; P105-Y111 HydrophobicContact CG-CE1 3.97Å; P105-Y111 HydrophobicContact CG-CE2 3.89Å; T106-Y111 HydrophobicContact CG2-CD1 4.47Å; T106-Y111 HydrophobicContact CG2-CD2 4.4Å; T106-Y111 HydrophobicContact CG2-CG 3.95Å; E108-Y111 WeakPolarHBondContact O-CB 3.37Å; E108-Y111 PolarHBondContact O-N 3.28Å; E108-Y111 VanDerWaalsContact O-N 3.08Å; R109-Y111 PolarHBondContact O-N 3.14Å; Y111-G113 VanDerWaalsContact CE1-CA 3.42Å; Y111-G113 VanDerWaalsContact CZ-CA 3.45Å; Y111-V135 WeakPolarHBondContact CA-O 3.44Å; Y111-V135 HydrophobicContact CD2-CB 4.25Å; Y111-V135 HydrophobicContact CD2-CG1 4.05Å; Y111-V135 HydrophobicContact CE2-CG1 4.39Å; Y111-E137 VanDerWaalsContact OH-CG 3.28Å; Y111-E137 WeakPolarHBondContact OH-CG 3.29Å; Y111-E137 PolarHBondContact OH-OE1 2.89Å; Y111-E137 VanDerWaalsContact OH-OE1 3.08Å; Y111-F145 AromaticContact CE2-CD1 3.86Å; Y111-F145 HydrophobicContact CE2-CD1 3.86Å; Y111-F145 AromaticContact CE2-CE1 3.91Å; Y111-F145 HydrophobicContact CE2-CE1 3.91Å; Y111-F145 WeakPolarHBondContact OH-CE1 3.46Å; Y111-S213 VanDerWaalsContact O-CB 3.27Å; Y111-S213 WeakPolarHBondContact O-CB 3.46Å
112	H	82.8	Confident	79.3	Confident	18 Å²	18	44.6 Å²	44.6	8%	0.083	25%	0.248	C	C	.	.			trans	-106.8	0.8	-177.2	-74.5	-112.3	0	0	0	112.7	W110 H114 L115 V135 Y211	W110-H112 PolarHBondContact O-CD2 3.16Å; H112-H114 PolarHBondContact O-N 3.37Å; H112-L115 HydrophobicContact CB-CB 4.12Å; H112-L115 HydrophobicContact CB-CD2 3.9Å; H112-V135 PolarHBondContact N-O 2.91Å; H112-Y211 AromaticContact CE1-CD1 3.4Å; H112-Y211 WeakPolarHBondContact CE1-CD1 3.31Å; H112-Y211 AromaticContact CE1-CE1 3.83Å; H112-Y211 AromaticContact NE2-CD1 3.67Å; H112-Y211 PolarHBondContact NE2-O 3.45Å
113	G	79.1	Confident	80.1	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.252	C	S	.	.	S	Bend	trans	54.2	-127.1	-174	0	0	0	0	0	111.3	Y111 L115 R136 E137	Y111-G113 VanDerWaalsContact CE1-CA 3.42Å; Y111-G113 VanDerWaalsContact CZ-CA 3.45Å; G113-L115 PolarHBondContact O-N 2.69Å; G113-R136 CarbonylContact O-C 3.57Å; G113-R136 VanDerWaalsContact O-CA 3.31Å; G113-R136 WeakPolarHBondContact O-CA 3.31Å; G113-R136 WeakPolarHBondContact O-CB 3.48Å; G113-E137 PolarHBondContact O-N 3.46Å
114	H	75.9	Confident	81.3	Confident	32 Å²	32	41.3 Å²	41.3	15%	0.148	22%	0.221	C	C	.	.	S	Bend	trans	-74	93.7	179	-172.2	80	0	0	0	113.3	M1 V2 H112 L139	M1-H114 PolarHBondContact N-NE2 2.99Å; V2-H114 WeakPolarHBondContact CB-CE1 3.45Å; V2-H114 VanDerWaalsContact CB-ND1 3.29Å; V2-H114 WeakPolarHBondContact CB-ND1 3.39Å; V2-H114 WeakPolarHBondContact CG2-CE1 3.26Å; V2-H114 PolarHBondContact N-CD2 3.3Å; V2-H114 PolarHBondContact N-NE2 3.4Å; V2-H114 VanDerWaalsContact O-CB 3.31Å; V2-H114 WeakPolarHBondContact O-CB 3.48Å; H112-H114 PolarHBondContact O-N 3.37Å; H114-L139 WeakPolarHBondContact CE1-CD2 3.16Å; H114-L139 WeakPolarHBondContact ND1-CD2 3.12Å
115	L	82.4	Confident	82.4	Confident	23 Å²	23	41.7 Å²	41.7	12%	0.12	23%	0.225	C	C	.	.			trans	-129.4	129.9	173.5	-175	68.1	0	0	0	109.1	H112 G113 N119 A120 L123 L134 R136	H112-L115 HydrophobicContact CB-CB 4.12Å; H112-L115 HydrophobicContact CB-CD2 3.9Å; G113-L115 PolarHBondContact O-N 2.69Å; L115-N119 HydrophobicContact CD1-CB 3.65Å; L115-N119 HydrophobicContact CG-CB 4.38Å; L115-A120 HydrophobicContact CD2-CB 3.72Å; L115-A120 HydrophobicContact CG-CB 4.14Å; L115-L123 HydrophobicContact CD1-CD1 4.11Å; L115-L123 HydrophobicContact CD2-CD1 3.96Å; L115-L134 HydrophobicContact CD2-CD1 3.8Å; L115-L134 HydrophobicContact CD2-CD2 3.94Å; L115-R136 HydrophobicContact CB-CB 3.86Å; L115-R136 VanDerWaalsContact O-CD 3.27Å; L115-R136 WeakPolarHBondContact O-CD 3.49Å; L115-R136 PolarHBondContact O-NH1 3.31Å
116	S	86	Confident	83	Confident	28 Å²	28	43.4 Å²	43.4	20%	0.196	24%	0.243	C	C	.	.			trans	-72.1	154.1	175.5	71.4	0	0	0	0	110.9	N119 A120	S116-N119 PolarHBondContact O-N 3.25Å; S116-N119 WeakPolarHBondContact OG-CB 3.01Å; S116-N119 VanDerWaalsContact OG-CG 3.3Å; S116-N119 PolarHBondContact OG-N 3.32Å; S116-N119 PolarHBondContact OG-ND2 2.61Å; S116-A120 PolarHBondContact O-N 2.94Å
117	G	87.8	Confident	83.6	Confident	12 Å²	12	46.8 Å²	46.8	12%	0.124	25%	0.254	C	S	.	.	H	α-helix	trans	-51.1	-54.4	174	0	0	0	0	0	112.6	N119 A120 E121	G117-N119 VanDerWaalsContact C-N 3.31Å; G117-N119 PolarHBondContact O-N 3.2Å; G117-A120 WeakPolarHBondContact O-CA 3.47Å; G117-A120 WeakPolarHBondContact O-CB 3.32Å; G117-A120 PolarHBondContact O-N 2.94Å; G117-E121 WeakPolarHBondContact O-CG 3.43Å; G117-E121 PolarHBondContact O-N 2.87Å
118	P	89.8	Confident	84.4	Confident	90 Å²	90	47.3 Å²	47.3	58%	0.584	25%	0.254	S	S	*	.	H	α-helix	trans	-58.9	-36.9	178.9	-27.2	35.7	0	0	0	114.4	E121 K122	P118-E121 PolarHBondContact O-N 2.93Å; P118-K122 PolarHBondContact O-N 3.18Å
119	N	84.9	Confident	85	Confident	87 Å²	87	47.8 Å²	47.8	47%	0.465	26%	0.256	S	S	.	.	H	α-helix	trans	-70.9	-38.5	176	-74.3	-20.2	0	0	0	111.5	L115 S116 G117 E121 K122 L123	L115-N119 HydrophobicContact CD1-CB 3.65Å; L115-N119 HydrophobicContact CG-CB 4.38Å; S116-N119 PolarHBondContact O-N 3.25Å; S116-N119 WeakPolarHBondContact OG-CB 3.01Å; S116-N119 VanDerWaalsContact OG-CG 3.3Å; S116-N119 PolarHBondContact OG-N 3.32Å; S116-N119 PolarHBondContact OG-ND2 2.61Å; G117-N119 VanDerWaalsContact C-N 3.31Å; G117-N119 PolarHBondContact O-N 3.2Å; N119-E121 VanDerWaalsContact C-N 3.32Å; N119-K122 PolarHBondContact O-N 2.81Å; N119-L123 WeakPolarHBondContact O-CG 3.39Å; N119-L123 PolarHBondContact O-N 3.43Å
120	A	88.3	Confident	85.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-42.4	172	0	0	0	0	0	111.6	L115 S116 G117 K122 L123 L124 L134	L115-A120 HydrophobicContact CD2-CB 3.72Å; L115-A120 HydrophobicContact CG-CB 4.14Å; S116-A120 PolarHBondContact O-N 2.94Å; G117-A120 WeakPolarHBondContact O-CA 3.47Å; G117-A120 WeakPolarHBondContact O-CB 3.32Å; G117-A120 PolarHBondContact O-N 2.94Å; A120-K122 PolarHBondContact O-N 3Å; A120-L123 PolarHBondContact O-N 3.22Å; A120-L124 WeakPolarHBondContact O-CB 3.33Å; A120-L124 VanDerWaalsContact O-CG 3.32Å; A120-L124 WeakPolarHBondContact O-CG 3.31Å; A120-L124 PolarHBondContact O-N 2.82Å; A120-L134 HydrophobicContact CB-CD1 4.05Å; A120-L134 HydrophobicContact CB-CD2 4.35Å
121	E	91.7	Very high	85.6	Confident	86 Å²	86	48.5 Å²	48.5	40%	0.402	26%	0.264	S	S	.	.	H	α-helix	trans	-59.3	-45.9	174.8	-67.2	-179	176.8	0	0	111.7	G117 P118 N119 L123 L124 T125 V162 H164	G117-E121 WeakPolarHBondContact O-CG 3.43Å; G117-E121 PolarHBondContact O-N 2.87Å; P118-E121 PolarHBondContact O-N 2.93Å; N119-E121 VanDerWaalsContact C-N 3.32Å; E121-L123 PolarHBondContact O-N 2.77Å; E121-L124 PolarHBondContact O-N 2.8Å; E121-T125 WeakPolarHBondContact O-CB 3.36Å; E121-T125 PolarHBondContact O-N 2.84Å; E121-T125 PolarHBondContact O-OG1 2.85Å; E121-V162 HydrophobicContact CB-CG2 4.44Å; E121-V162 HydrophobicContact CG-CB 3.97Å; E121-V162 HydrophobicContact CG-CG1 4.16Å; E121-V162 HydrophobicContact CG-CG2 4.35Å; E121-H164 IonicContact OE1-CD2 2.64Å; E121-H164 IonicContact OE1-NE2 3.13Å; E121-H164 PolarHBondContact OE1-NE2 2.69Å
122	K	87.1	Confident	85.9	Confident	154 Å²	154	48.2 Å²	48.2	67%	0.67	26%	0.263	S	S	*	.	H	α-helix	trans	-60.1	-44.5	177.7	-172.8	178.3	179.8	179.9	0	112.3	P118 N119 A120 A126	P118-K122 PolarHBondContact O-N 3.18Å; N119-K122 PolarHBondContact O-N 2.81Å; A120-K122 PolarHBondContact O-N 3Å; K122-A126 WeakPolarHBondContact O-CB 3.48Å; K122-A126 PolarHBondContact O-N 2.85Å
123	L	86.4	Confident	86.5	Confident	55 Å²	55	47.4 Å²	47.4	29%	0.288	26%	0.259	S	S	.	.	H	α-helix	trans	-65.3	-49.1	178.9	-68.1	176.1	0	0	0	111.7	L115 N119 A120 E121 A126 R127 Y211	L115-L123 HydrophobicContact CD1-CD1 4.11Å; L115-L123 HydrophobicContact CD2-CD1 3.96Å; N119-L123 WeakPolarHBondContact O-CG 3.39Å; N119-L123 PolarHBondContact O-N 3.43Å; A120-L123 PolarHBondContact O-N 3.22Å; E121-L123 PolarHBondContact O-N 2.77Å; L123-A126 PolarHBondContact O-N 2.92Å; L123-R127 PolarHBondContact O-N 2.92Å; L123-Y211 HydrophobicContact CB-CE1 4.41Å; L123-Y211 HydrophobicContact CB-CE2 4.1Å; L123-Y211 HydrophobicContact CD1-CE1 4.41Å; L123-Y211 WeakPolarHBondContact O-CE2 3.49Å
124	L	88.4	Confident	87.3	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.1	-44.7	-178.3	-71.2	173	0	0	0	111.6	A120 E121 A126 R127 D128 T132 L134 L150 V162 Y211	A120-L124 WeakPolarHBondContact O-CB 3.33Å; A120-L124 VanDerWaalsContact O-CG 3.32Å; A120-L124 WeakPolarHBondContact O-CG 3.31Å; A120-L124 PolarHBondContact O-N 2.82Å; E121-L124 PolarHBondContact O-N 2.8Å; L124-A126 VanDerWaalsContact C-N 3.33Å; L124-A126 PolarHBondContact O-N 2.8Å; L124-R127 PolarHBondContact O-N 3.38Å; L124-D128 PolarHBondContact O-N 3.08Å; L124-T132 HydrophobicContact CD2-CG2 3.51Å; L124-L134 HydrophobicContact CD1-CD2 4.28Å; L124-L134 HydrophobicContact CD1-CG 4.33Å; L124-L134 HydrophobicContact CD2-CD2 4.11Å; L124-L134 HydrophobicContact CD2-CG 4.46Å; L124-L134 HydrophobicContact CG-CD2 4Å; L124-L150 HydrophobicContact CB-CB 4.27Å; L124-L150 HydrophobicContact CB-CD1 4.42Å; L124-L150 WeakPolarHBondContact O-CD2 3.33Å; L124-V162 HydrophobicContact CB-CG2 4.02Å; L124-V162 HydrophobicContact CD1-CG1 3.67Å; L124-V162 HydrophobicContact CD1-CG2 4.27Å; L124-Y211 HydrophobicContact CD2-CD2 4.18Å; L124-Y211 HydrophobicContact CD2-CG 4.46Å
125	T	87.1	Confident	88.1	Confident	47 Å²	47	45.9 Å²	45.9	29%	0.288	25%	0.252	S	S	.	.	H	α-helix	trans	-65	-37.4	178	-52.1	0	0	0	0	111.6	E121 R127 D128	E121-T125 WeakPolarHBondContact O-CB 3.36Å; E121-T125 PolarHBondContact O-N 2.84Å; E121-T125 PolarHBondContact O-OG1 2.85Å; T125-R127 VanDerWaalsContact C-N 3.25Å; T125-R127 PolarHBondContact O-N 3.48Å; T125-D128 PolarHBondContact O-N 3.17Å; T125-D128 VanDerWaalsContact O-N 3.16Å
126	A	82.4	Confident	88.5	Confident	86 Å²	86	45.6 Å²	45.6	71%	0.711	25%	0.25	S	C	*	.	H	α-helix	trans	-67.1	-25.5	177.1	0	0	0	0	0	113.5	K122 L123 L124	K122-A126 WeakPolarHBondContact O-CB 3.48Å; K122-A126 PolarHBondContact O-N 2.85Å; L123-A126 PolarHBondContact O-N 2.92Å; L124-A126 VanDerWaalsContact C-N 3.33Å; L124-A126 PolarHBondContact O-N 2.8Å
127	R	80.4	Confident	88.5	Confident	85 Å²	85	46.3 Å²	46.3	32%	0.321	25%	0.25	S	C	.	.	H	α-helix	trans	-77.6	-28.1	173	-176	163.6	170.9	172.9	0.9	112.4	L123 L124 T125 E129 P210 Y211	L123-R127 PolarHBondContact O-N 2.92Å; L124-R127 PolarHBondContact O-N 3.38Å; T125-R127 VanDerWaalsContact C-N 3.25Å; T125-R127 PolarHBondContact O-N 3.48Å; R127-E129 HydrophobicContact CG-CB 4.07Å; R127-E129 IonicContact CZ-OE2 3.17Å; R127-E129 IonicContact NE-OE2 3.82Å; R127-E129 PolarHBondContact NE-OE2 2.73Å; R127-E129 IonicContact NH2-OE2 3.75Å; R127-E129 PolarHBondContact NH2-OE2 3.49Å; R127-E129 PolarHBondContact O-N 2.8Å; R127-E129 VanDerWaalsContact O-N 3.09Å; R127-P210 PolarHBondContact NH1-O 2.89Å; R127-Y211 HydrophobicContact CB-CD2 4.34Å; R127-Y211 HydrophobicContact CB-CE2 4.11Å
128	D	84.4	Confident	88.4	Confident	95 Å²	95	46.1 Å²	46.1	51%	0.508	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	26.3	173.5	-163.8	30.4	0	0	0	115.2	L124 T125 K160	L124-D128 PolarHBondContact O-N 3.08Å; T125-D128 PolarHBondContact O-N 3.17Å; T125-D128 VanDerWaalsContact O-N 3.16Å; D128-K160 PolarHBondContact O-NZ 2.77Å; D128-K160 WeakPolarHBondContact OD1-CD 3.46Å; D128-K160 WeakPolarHBondContact OD1-CE 3.41Å; D128-K160 IonicContact OD1-NZ 2.61Å; D128-K160 PolarHBondContact OD1-NZ 3.37Å; D128-K160 IonicContact OD2-NZ 3.63Å
129	E	88.1	Confident	88	Confident	82 Å²	82	44.1 Å²	44.1	38%	0.383	23%	0.231	S	C	.	.			trans	-116.1	105.3	-176.2	-165.1	-170.9	-177.1	0	0	109.9	R127 T132 L150 Q209	R127-E129 HydrophobicContact CG-CB 4.07Å; R127-E129 IonicContact CZ-OE2 3.17Å; R127-E129 IonicContact NE-OE2 3.82Å; R127-E129 PolarHBondContact NE-OE2 2.73Å; R127-E129 IonicContact NH2-OE2 3.75Å; R127-E129 PolarHBondContact NH2-OE2 3.49Å; R127-E129 PolarHBondContact O-N 2.8Å; R127-E129 VanDerWaalsContact O-N 3.09Å; E129-T132 WeakPolarHBondContact O-CB 3.35Å; E129-T132 PolarHBondContact O-N 2.85Å; E129-T132 PolarHBondContact O-OG1 2.85Å; E129-L150 WeakPolarHBondContact O-CD2 3.18Å; E129-Q209 VanDerWaalsContact CG-NE2 3.35Å; E129-Q209 PolarHBondContact O-NE2 2.94Å
130	P	90.3	Very high	87.8	Confident	28 Å²	28	44.1 Å²	44.1	18%	0.182	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	147	-176.4	-24.4	34.4	0	0	0	113.7	T132 D152 K160 Q209	P130-T132 PolarHBondContact O-N 3.45Å; P130-D152 WeakPolarHBondContact CB-OD1 3.33Å; P130-D152 WeakPolarHBondContact CG-OD1 3.42Å; P130-K160 HydrophobicContact CG-CD 4.03Å; P130-Q209 PolarHBondContact O-NE2 3.38Å
131	G	89.3	Confident	87.4	Confident	5 Å²	5	49.3 Å²	49.3	5%	0.052	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	3.7	-171.8	0	0	0	0	0	114.1	L150 H206 R208 Q209	G131-L150 PolarHBondContact N-O 2.74Å; G131-H206 WeakPolarHBondContact CA-O 3.12Å; G131-R208 PolarHBondContact O-N 2.77Å; G131-Q209 PolarHBondContact O-N 2.75Å
132	T	92.3	Very high	86.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	128.3	170.6	-60.6	0	0	0	0	109.8	L124 E129 P130 V149 L150 Q209 Y211	L124-T132 HydrophobicContact CD2-CG2 3.51Å; E129-T132 WeakPolarHBondContact O-CB 3.35Å; E129-T132 PolarHBondContact O-N 2.85Å; E129-T132 PolarHBondContact O-OG1 2.85Å; P130-T132 PolarHBondContact O-N 3.45Å; T132-V149 CarbonylContact O-C 3.6Å; T132-V149 WeakPolarHBondContact O-CA 3.48Å; T132-L150 PolarHBondContact O-N 3.17Å; T132-Q209 CarbonylContact C-O 3.47Å; T132-Q209 WeakPolarHBondContact CA-O 3.47Å; T132-Q209 VanDerWaalsContact N-NE2 3.2Å; T132-Q209 PolarHBondContact OG1-NE2 2.98Å; T132-Y211 HydrophobicContact CG2-CD2 4.02Å; T132-Y211 HydrophobicContact CG2-CG 4.38Å
133	F	95.1	Very high	85.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	156	-179.9	73.4	-85.7	0	0	0	114.1	W110 L147 S148 V149 V189 K193 L207 Q209 P210 Y211	W110-F133 HydrophobicContact CB-CE2 3.98Å; W110-F133 HydrophobicContact CD2-CE2 4.26Å; W110-F133 AromaticContact CG-CE2 3.91Å; W110-F133 HydrophobicContact CG-CE2 3.91Å; W110-F133 HydrophobicContact CG-CZ 4.43Å; F133-L147 HydrophobicContact CB-CD1 4.14Å; F133-L147 HydrophobicContact CD2-CD1 3.78Å; F133-L147 HydrophobicContact CG-CD1 4.34Å; F133-S148 CarbonylContact C-O 3.57Å; F133-S148 VanDerWaalsContact CA-O 3.26Å; F133-S148 WeakPolarHBondContact CA-O 3.22Å; F133-V149 HydrophobicContact CB-CB 4.34Å; F133-V149 HydrophobicContact CB-CG1 4.13Å; F133-V149 HydrophobicContact CB-CG2 3.87Å; F133-V189 HydrophobicContact CE2-CG1 3.67Å; F133-V189 HydrophobicContact CZ-CG1 3.92Å; F133-K193 HydrophobicContact CE1-CD 4.33Å; F133-K193 HydrophobicContact CE1-CG 4.42Å; F133-K193 HydrophobicContact CZ-CD 3.99Å; F133-K193 HydrophobicContact CZ-CG 4.4Å; F133-L207 HydrophobicContact CB-CD2 3.87Å; F133-L207 HydrophobicContact CD1-CB 3.72Å; F133-L207 HydrophobicContact CD1-CD2 4.38Å; F133-L207 HydrophobicContact CE1-CB 3.95Å; F133-L207 HydrophobicContact CG-CB 4.19Å; F133-L207 HydrophobicContact CG-CD2 4.06Å; F133-Q209 WeakPolarHBondContact CD1-O 3.36Å; F133-Q209 VanDerWaalsContact CE1-C 3.48Å; F133-Q209 PolarHBondContact N-O 2.76Å; F133-P210 HydrophobicContact CE1-CB 4.12Å; F133-P210 HydrophobicContact CE2-CB 4.43Å; F133-P210 HydrophobicContact CZ-CB 3.92Å; F133-P210 CarbonylContact O-C 3.47Å; F133-P210 WeakPolarHBondContact O-CA 3.45Å; F133-Y211 PolarHBondContact O-N 3.47Å
134	L	94.6	Very high	85.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	157.1	166.8	60.4	85.2	0	0	0	110.9	L115 A120 L124 R136 S148 Y211	L115-L134 HydrophobicContact CD2-CD1 3.8Å; L115-L134 HydrophobicContact CD2-CD2 3.94Å; A120-L134 HydrophobicContact CB-CD1 4.05Å; A120-L134 HydrophobicContact CB-CD2 4.35Å; L124-L134 HydrophobicContact CD1-CD2 4.28Å; L124-L134 HydrophobicContact CD1-CG 4.33Å; L124-L134 HydrophobicContact CD2-CD2 4.11Å; L124-L134 HydrophobicContact CD2-CG 4.46Å; L124-L134 HydrophobicContact CG-CD2 4Å; L134-R136 HydrophobicContact CD1-CB 4.21Å; L134-R136 HydrophobicContact CD1-CG 4.27Å; L134-S148 PolarHBondContact N-O 3.37Å; L134-S148 PolarHBondContact O-N 3.3Å; L134-Y211 HydrophobicContact CD2-CG 4.44Å
135	V	93.3	Very high	86	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.6	171.4	-179.8	0	0	0	0	109.5	W110 Y111 H112 F145 V146 L147 I167 V189	W110-V135 HydrophobicContact CE3-CB 3.56Å; W110-V135 HydrophobicContact CE3-CG2 3.4Å; W110-V135 VanDerWaalsContact CE3-CG2 3.4Å; W110-V135 HydrophobicContact CH2-CG2 4.44Å; W110-V135 HydrophobicContact CZ3-CB 3.48Å; W110-V135 VanDerWaalsContact CZ3-CB 3.48Å; W110-V135 HydrophobicContact CZ3-CG1 4.08Å; W110-V135 HydrophobicContact CZ3-CG2 3.34Å; W110-V135 PolarHBondContact O-N 3.28Å; Y111-V135 WeakPolarHBondContact CA-O 3.44Å; Y111-V135 HydrophobicContact CD2-CB 4.25Å; Y111-V135 HydrophobicContact CD2-CG1 4.05Å; Y111-V135 HydrophobicContact CE2-CG1 4.39Å; H112-V135 PolarHBondContact N-O 2.91Å; V135-F145 HydrophobicContact CG1-CB 4.23Å; V135-V146 WeakPolarHBondContact CA-O 3.46Å; V135-L147 HydrophobicContact CG2-CB 4.44Å; V135-L147 HydrophobicContact CG2-CD1 3.66Å; V135-I167 HydrophobicContact CG1-CD1 4.14Å; V135-I167 HydrophobicContact CG2-CD1 4.49Å; V135-V189 HydrophobicContact CG2-CG2 4.03Å
136	R	90.9	Very high	86.4	Confident	18 Å²	18	36.9 Å²	36.9	7%	0.068	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	164.7	-178.3	62.8	-169.9	-176.2	70.1	-1.1	110.5	G113 L115 L134 F145 V146 S148 H164	G113-R136 CarbonylContact O-C 3.57Å; G113-R136 VanDerWaalsContact O-CA 3.31Å; G113-R136 WeakPolarHBondContact O-CA 3.31Å; G113-R136 WeakPolarHBondContact O-CB 3.48Å; L115-R136 HydrophobicContact CB-CB 3.86Å; L115-R136 VanDerWaalsContact O-CD 3.27Å; L115-R136 WeakPolarHBondContact O-CD 3.49Å; L115-R136 PolarHBondContact O-NH1 3.31Å; L134-R136 HydrophobicContact CD1-CB 4.21Å; L134-R136 HydrophobicContact CD1-CG 4.27Å; R136-F145 CarbonylContact O-C 3.57Å; R136-F145 WeakPolarHBondContact O-CA 3.41Å; R136-F145 WeakPolarHBondContact O-CB 3.36Å; R136-V146 HydrophobicContact CG-CB 4.05Å; R136-V146 WeakPolarHBondContact CG-O 3.4Å; R136-V146 PolarHBondContact N-O 2.66Å; R136-V146 PolarHBondContact O-N 2.77Å; R136-S148 PolarHBondContact NE-OG 3.15Å; R136-H164 PolarHBondContact NH2-ND1 2.84Å
137	E	85.4	Confident	87	Confident	42 Å²	42	32.8 Å²	32.8	20%	0.196	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	149.6	173.4	-68.4	174.8	-167	0	0	112.1	Y111 G113 L139 F145	Y111-E137 VanDerWaalsContact OH-CG 3.28Å; Y111-E137 WeakPolarHBondContact OH-CG 3.29Å; Y111-E137 PolarHBondContact OH-OE1 2.89Å; Y111-E137 VanDerWaalsContact OH-OE1 3.08Å; G113-E137 PolarHBondContact O-N 3.46Å; E137-L139 PolarHBondContact O-N 3.29Å; E137-F145 HydrophobicContact CG-CD1 4.22Å; E137-F145 HydrophobicContact CG-CE1 4.09Å
138	S	85.8	Confident	87.8	Confident	8 Å²	8	28.7 Å²	28.7	6%	0.056	16%	0.158	C	C	.	.			trans	-81.7	110.8	172.5	177.3	0	0	0	0	110.4	S140 K141 D144	S138-S140 VanDerWaalsContact C-N 3.31Å; S138-S140 PolarHBondContact OG-OG 3.14Å; S138-K141 WeakPolarHBondContact CB-O 3.44Å; S138-K141 CarbonylContact O-C 3.54Å; S138-K141 PolarHBondContact OG-N 2.89Å; S138-K141 VanDerWaalsContact OG-N 3.12Å; S138-K141 PolarHBondContact OG-O 3.06Å; S138-D144 VanDerWaalsContact CB-C 3.46Å; S138-D144 WeakPolarHBondContact CB-O 3.3Å; S138-D144 PolarHBondContact N-O 2.75Å
139	L	81.9	Confident	88.3	Confident	49 Å²	49	24.2 Å²	24.2	26%	0.257	13%	0.134	S	C	.	.	S	Bend	trans	-71.5	-29.6	175.1	-52.6	-167.5	0	0	0	112.5	H114 E137	H114-L139 WeakPolarHBondContact CE1-CD2 3.16Å; H114-L139 WeakPolarHBondContact ND1-CD2 3.12Å; E137-L139 PolarHBondContact O-N 3.29Å
140	S	81.4	Confident	88.6	Confident	86 Å²	86	20.3 Å²	20.3	60%	0.601	12%	0.116	S	C	*	.	S	Bend	trans	-76.6	-26	179.5	51.1	0	0	0	0	113.5	S138	S138-S140 VanDerWaalsContact C-N 3.31Å; S138-S140 PolarHBondContact OG-OG 3.14Å
141	K	79.7	Confident	88.6	Confident	110 Å²	110	19.6 Å²	19.6	48%	0.478	11%	0.111	S	C	.	.	S	Bend	trans	-143.1	94	-177.9	-173.3	163.7	169.7	-124.6	0	109.4	S138 G143 D144	S138-K141 WeakPolarHBondContact CB-O 3.44Å; S138-K141 CarbonylContact O-C 3.54Å; S138-K141 PolarHBondContact OG-N 2.89Å; S138-K141 VanDerWaalsContact OG-N 3.12Å; S138-K141 PolarHBondContact OG-O 3.06Å; K141-G143 PolarHBondContact O-N 3.25Å; K141-D144 HydrophobicContact CB-CB 4.45Å; K141-D144 WeakPolarHBondContact CD-OD2 3.37Å; K141-D144 WeakPolarHBondContact CE-OD2 3.21Å; K141-D144 IonicContact NZ-OD1 3.8Å; K141-D144 IonicContact NZ-OD2 2.81Å; K141-D144 PolarHBondContact NZ-OD2 3.49Å; K141-D144 PolarHBondContact O-N 3.04Å
142	P	73.9	Confident	88.3	Confident	39 Å²	39	24.5 Å²	24.5	25%	0.253	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	130.4	-178.3	-28.1	34.5	0	0	0	112.1	F5 L72	F5-P142 HydrophobicContact CD1-CB 4.48Å; F5-P142 HydrophobicContact CE1-CB 4.06Å; F5-P142 HydrophobicContact CE2-CB 4.33Å; F5-P142 HydrophobicContact CZ-CB 3.98Å; L72-P142 HydrophobicContact CD1-CB 4.33Å; L72-P142 HydrophobicContact CD1-CG 3.84Å
143	G	73	Confident	87.9	Confident	14 Å²	14	27.6 Å²	27.6	14%	0.144	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.9	-20.3	-176.9	0	0	0	0	0	115.2	R7 K141 F145	R7-G143 PolarHBondContact NE-O 3.06Å; R7-G143 PolarHBondContact NH1-O 2.95Å; R7-G143 PolarHBondContact NH2-O 2.87Å; K141-G143 PolarHBondContact O-N 3.25Å; G143-F145 WeakPolarHBondContact O-CE2 3.27Å
144	D	86.6	Confident	87.2	Confident	13 Å²	13	33.7 Å²	33.7	7%	0.07	18%	0.182	C	C	.	.			trans	-81.9	166.9	168.1	-73	-15.3	0	0	0	110.6	S138 K141 I167 M168 C169	S138-D144 VanDerWaalsContact CB-C 3.46Å; S138-D144 WeakPolarHBondContact CB-O 3.3Å; S138-D144 PolarHBondContact N-O 2.75Å; K141-D144 HydrophobicContact CB-CB 4.45Å; K141-D144 WeakPolarHBondContact CD-OD2 3.37Å; K141-D144 WeakPolarHBondContact CE-OD2 3.21Å; K141-D144 IonicContact NZ-OD1 3.8Å; K141-D144 IonicContact NZ-OD2 2.81Å; K141-D144 PolarHBondContact NZ-OD2 3.49Å; K141-D144 PolarHBondContact O-N 3.04Å; D144-I167 WeakPolarHBondContact CB-O 3.21Å; D144-M168 WeakPolarHBondContact OD1-CA 3.32Å; D144-C169 PolarHBondContact OD1-N 3.27Å
145	F	91.2	Very high	86.1	Confident	6 Å²	6	36 Å²	36	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	170.2	177.8	-55.8	-91	0	0	0	110.8	P105 Y111 V135 R136 E137 G143 I167 Y174 L185	P105-F145 HydrophobicContact CB-CZ 4.28Å; P105-F145 HydrophobicContact CG-CE1 3.82Å; P105-F145 HydrophobicContact CG-CZ 3.98Å; Y111-F145 AromaticContact CE2-CD1 3.86Å; Y111-F145 HydrophobicContact CE2-CD1 3.86Å; Y111-F145 AromaticContact CE2-CE1 3.91Å; Y111-F145 HydrophobicContact CE2-CE1 3.91Å; Y111-F145 WeakPolarHBondContact OH-CE1 3.46Å; V135-F145 HydrophobicContact CG1-CB 4.23Å; R136-F145 CarbonylContact O-C 3.57Å; R136-F145 WeakPolarHBondContact O-CA 3.41Å; R136-F145 WeakPolarHBondContact O-CB 3.36Å; E137-F145 HydrophobicContact CG-CD1 4.22Å; E137-F145 HydrophobicContact CG-CE1 4.09Å; G143-F145 WeakPolarHBondContact O-CE2 3.27Å; F145-I167 HydrophobicContact CB-CB 3.98Å; F145-I167 HydrophobicContact CB-CD1 4.31Å; F145-I167 HydrophobicContact CB-CG2 4.41Å; F145-I167 PolarHBondContact N-O 3.31Å; F145-I167 PolarHBondContact O-N 2.96Å; F145-Y174 HydrophobicContact CD2-CD1 4.32Å; F145-Y174 HydrophobicContact CD2-CE1 4.06Å; F145-Y174 HydrophobicContact CE2-CD1 4.36Å; F145-Y174 AromaticContact CE2-CE1 3.66Å; F145-Y174 HydrophobicContact CE2-CE1 3.66Å; F145-L185 HydrophobicContact CD1-CD1 4.12Å; F145-L185 HydrophobicContact CD2-CD1 4.3Å; F145-L185 HydrophobicContact CD2-CD2 4.12Å; F145-L185 HydrophobicContact CE1-CD1 4.1Å; F145-L185 HydrophobicContact CE2-CD1 4.31Å; F145-L185 HydrophobicContact CG-CD1 4.21Å; F145-L185 HydrophobicContact CG-CD2 4.31Å; F145-L185 HydrophobicContact CZ-CD1 4.19Å
146	V	94.8	Very high	85	Confident	8 Å²	8	46.6 Å²	46.6	5%	0.048	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	124.5	176.3	-174.1	0	0	0	0	109.3	V135 R136 H164 I165	V135-V146 WeakPolarHBondContact CA-O 3.46Å; R136-V146 HydrophobicContact CG-CB 4.05Å; R136-V146 WeakPolarHBondContact CG-O 3.4Å; R136-V146 PolarHBondContact N-O 2.66Å; R136-V146 PolarHBondContact O-N 2.77Å; V146-H164 HydrophobicContact CG1-CB 3.89Å; V146-I165 CarbonylContact C-O 3.23Å; V146-I165 WeakPolarHBondContact CA-O 3.48Å
147	L	95.6	Very high	84	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	114.7	167.5	174.9	64.8	0	0	0	108.5	F133 V135 V149 I165 I167 I197 L207	F133-L147 HydrophobicContact CB-CD1 4.14Å; F133-L147 HydrophobicContact CD2-CD1 3.78Å; F133-L147 HydrophobicContact CG-CD1 4.34Å; V135-L147 HydrophobicContact CG2-CB 4.44Å; V135-L147 HydrophobicContact CG2-CD1 3.66Å; L147-V149 HydrophobicContact CD1-CG2 4.23Å; L147-V149 HydrophobicContact CD2-CG2 4.43Å; L147-V149 HydrophobicContact CG-CG2 3.88Å; L147-I165 HydrophobicContact CB-CB 4.29Å; L147-I165 HydrophobicContact CD2-CD1 4.33Å; L147-I165 PolarHBondContact N-O 2.97Å; L147-I165 PolarHBondContact O-N 3.43Å; L147-I167 HydrophobicContact CB-CD1 3.87Å; L147-I167 HydrophobicContact CB-CG1 4.36Å; L147-I197 HydrophobicContact CD2-CD1 3.46Å; L147-I197 VanDerWaalsContact CD2-CD1 3.46Å; L147-L207 HydrophobicContact CD1-CD1 4.46Å; L147-L207 HydrophobicContact CD1-CD2 4.2Å; L147-L207 HydrophobicContact CD2-CD1 3.89Å; L147-L207 HydrophobicContact CD2-CD2 3.92Å; L147-L207 HydrophobicContact CG-CD2 4.32Å
148	S	95.9	Very high	83.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	126.2	179.7	-52.1	0	0	0	0	109.7	F133 L134 R136 S163 H164	F133-S148 CarbonylContact C-O 3.57Å; F133-S148 VanDerWaalsContact CA-O 3.26Å; F133-S148 WeakPolarHBondContact CA-O 3.22Å; L134-S148 PolarHBondContact N-O 3.37Å; L134-S148 PolarHBondContact O-N 3.3Å; R136-S148 PolarHBondContact NE-OG 3.15Å; S148-S163 CarbonylContact C-O 3.6Å; S148-S163 VanDerWaalsContact CA-O 3.26Å; S148-S163 WeakPolarHBondContact CA-O 3.26Å; S148-H164 WeakPolarHBondContact CB-ND1 3.23Å; S148-H164 PolarHBondContact OG-CE1 3.28Å; S148-H164 PolarHBondContact OG-ND1 2.94Å
149	V	95.4	Very high	82.9	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.2	-172	-167.3	0	0	0	0	110.5	T132 F133 L147 T151 V162 S163 V205 L207	T132-V149 CarbonylContact O-C 3.6Å; T132-V149 WeakPolarHBondContact O-CA 3.48Å; F133-V149 HydrophobicContact CB-CB 4.34Å; F133-V149 HydrophobicContact CB-CG1 4.13Å; F133-V149 HydrophobicContact CB-CG2 3.87Å; L147-V149 HydrophobicContact CD1-CG2 4.23Å; L147-V149 HydrophobicContact CD2-CG2 4.43Å; L147-V149 HydrophobicContact CG-CG2 3.88Å; V149-T151 PolarHBondContact O-N 2.95Å; V149-V162 CarbonylContact O-C 3.53Å; V149-V162 WeakPolarHBondContact O-CA 3.25Å; V149-S163 PolarHBondContact N-O 2.75Å; V149-S163 PolarHBondContact O-N 2.98Å; V149-V205 HydrophobicContact CB-CG1 3.56Å; V149-V205 HydrophobicContact CG1-CG1 3.56Å; V149-V205 HydrophobicContact CG2-CG1 3.67Å; V149-L207 HydrophobicContact CB-CD2 4.42Å; V149-L207 HydrophobicContact CG1-CD2 4.09Å; V149-L207 HydrophobicContact CG2-CD2 3.43Å; V149-L207 VanDerWaalsContact CG2-CD2 3.43Å
150	L	93.6	Very high	82.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	120.2	170.1	-167.7	68.8	0	0	0	109.4	L124 E129 G131 T132 K160 V162	L124-L150 HydrophobicContact CB-CB 4.27Å; L124-L150 HydrophobicContact CB-CD1 4.42Å; L124-L150 WeakPolarHBondContact O-CD2 3.33Å; E129-L150 WeakPolarHBondContact O-CD2 3.18Å; G131-L150 PolarHBondContact N-O 2.74Å; T132-L150 PolarHBondContact O-N 3.17Å; L150-K160 HydrophobicContact CD1-CB 3.75Å; L150-K160 HydrophobicContact CD2-CD 4.14Å; L150-K160 HydrophobicContact CG-CB 4.22Å; L150-K160 HydrophobicContact CG-CD 4.46Å; L150-V162 HydrophobicContact CD1-CG2 3.6Å
151	T	90.1	Very high	83.3	Confident	12 Å²	12	52.9 Å²	52.9	7%	0.074	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	165	179.4	68.4	0	0	0	0	111.1	V149 E153 R161 V205	V149-T151 PolarHBondContact O-N 2.95Å; T151-E153 PolarHBondContact O-N 3.29Å; T151-E153 PolarHBondContact OG1-N 3.28Å; T151-R161 PolarHBondContact N-O 3.39Å; T151-R161 PolarHBondContact OG1-O 3.31Å; T151-V205 HydrophobicContact CG2-CG2 4.29Å
152	D	84.8	Confident	83.9	Confident	109 Å²	109	48.4 Å²	48.4	58%	0.583	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	-9.4	172.6	-76	-55.7	0	0	0	113	P130	P130-D152 WeakPolarHBondContact CB-OD1 3.33Å; P130-D152 WeakPolarHBondContact CG-OD1 3.42Å
153	E	83.6	Confident	84.8	Confident	64 Å²	64	46.9 Å²	46.9	30%	0.299	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	142.4	-179	-68.8	172.5	-137.7	0	0	111.7	T151 K160 R161 N203	T151-E153 PolarHBondContact O-N 3.29Å; T151-E153 PolarHBondContact OG1-N 3.28Å; E153-K160 CarbonylContact O-C 3.59Å; E153-K160 VanDerWaalsContact O-CA 3.31Å; E153-K160 WeakPolarHBondContact O-CA 3.26Å; E153-R161 HydrophobicContact CB-CB 4.16Å; E153-R161 PolarHBondContact O-N 3.19Å; E153-R161 IonicContact OE1-CZ 3.49Å; E153-R161 IonicContact OE1-NE 2.85Å; E153-R161 IonicContact OE1-NH2 3.08Å; E153-R161 PolarHBondContact OE1-NH2 3.33Å; E153-R161 IonicContact OE2-CZ 3.13Å; E153-R161 VanDerWaalsContact OE2-CZ 3.25Å; E153-R161 IonicContact OE2-NE 2.79Å; E153-R161 PolarHBondContact OE2-NE 3.3Å; E153-R161 IonicContact OE2-NH2 3.68Å; E153-R161 PolarHBondContact OE2-NH2 3.03Å; E153-N203 VanDerWaalsContact CD-ND2 3.31Å; E153-N203 WeakPolarHBondContact OE1-CB 3.12Å; E153-N203 PolarHBondContact OE1-ND2 2.82Å; E153-N203 PolarHBondContact OE2-ND2 2.91Å
154	I	78.7	Confident	85.8	Confident	128 Å²	128	49.3 Å²	49.3	66%	0.656	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	124	177.1	-57.4	175.4	0	0	0	108.7
155	S	72.9	Confident	86.1	Confident	48 Å²	48	49.6 Å²	49.6	34%	0.336	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-73.8	165.3	173.9	-179.8	0	0	0	0	111.3	N157 G158 S159	S155-N157 WeakPolarHBondContact CB-OD1 3.48Å; S155-N157 PolarHBondContact O-N 3.33Å; S155-N157 PolarHBondContact OG-OD1 2.98Å; S155-G158 PolarHBondContact O-N 3.12Å; S155-S159 WeakPolarHBondContact CB-O 3.04Å; S155-S159 PolarHBondContact N-O 2.89Å
156	K	70.6	Confident	86.2	Confident	223 Å²	223	55.7 Å²	55.7	97%	0.97	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-19.5	-176.3	-65.2	-177	179.3	179.4	0	114.3
157	N	68.6	Low	86.1	Confident	119 Å²	119	55.3 Å²	55.3	64%	0.636	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	3.7	178.4	61.3	-6.6	0	0	0	113.6	S155 S159	S155-N157 WeakPolarHBondContact CB-OD1 3.48Å; S155-N157 PolarHBondContact O-N 3.33Å; S155-N157 PolarHBondContact OG-OD1 2.98Å; N157-S159 VanDerWaalsContact C-N 3.32Å; N157-S159 PolarHBondContact ND2-OG 3.19Å; N157-S159 PolarHBondContact O-N 3.46Å; N157-S159 PolarHBondContact OD1-N 3.5Å; N157-S159 PolarHBondContact OD1-OG 3.09Å
158	G	72.1	Confident	85.8	Confident	61 Å²	61	57.7 Å²	57.7	63%	0.629	30%	0.3	S	S	*	.	S	Bend	trans	82.4	-0.1	179.4	0	0	0	0	0	115.1	S155	S155-G158 PolarHBondContact O-N 3.12Å
159	S	76	Confident	85.2	Confident	37 Å²	37	58.7 Å²	58.7	26%	0.259	31%	0.307	S	S	.	.	S	Bend	trans	-93.4	153.1	173.1	67.2	0	0	0	0	111.4	S155 N157	S155-S159 WeakPolarHBondContact CB-O 3.04Å; S155-S159 PolarHBondContact N-O 2.89Å; N157-S159 VanDerWaalsContact C-N 3.32Å; N157-S159 PolarHBondContact ND2-OG 3.19Å; N157-S159 PolarHBondContact O-N 3.46Å; N157-S159 PolarHBondContact OD1-N 3.5Å; N157-S159 PolarHBondContact OD1-OG 3.09Å
160	K	83.3	Confident	84.6	Confident	51 Å²	51	62.8 Å²	62.8	22%	0.222	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	138.5	172	-72.8	173.8	-178.9	148.3	0	110.8	D128 P130 L150 E153	D128-K160 PolarHBondContact O-NZ 2.77Å; D128-K160 WeakPolarHBondContact OD1-CD 3.46Å; D128-K160 WeakPolarHBondContact OD1-CE 3.41Å; D128-K160 IonicContact OD1-NZ 2.61Å; D128-K160 PolarHBondContact OD1-NZ 3.37Å; D128-K160 IonicContact OD2-NZ 3.63Å; P130-K160 HydrophobicContact CG-CD 4.03Å; L150-K160 HydrophobicContact CD1-CB 3.75Å; L150-K160 HydrophobicContact CD2-CD 4.14Å; L150-K160 HydrophobicContact CG-CB 4.22Å; L150-K160 HydrophobicContact CG-CD 4.46Å; E153-K160 CarbonylContact O-C 3.59Å; E153-K160 VanDerWaalsContact O-CA 3.31Å; E153-K160 WeakPolarHBondContact O-CA 3.26Å
161	R	89.3	Confident	83.7	Confident	68 Å²	68	70.3 Å²	70.3	26%	0.257	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	137.8	-179.6	179.2	177.4	80.9	112.7	-2	109.5	T151 E153 E199	T151-R161 PolarHBondContact N-O 3.39Å; T151-R161 PolarHBondContact OG1-O 3.31Å; E153-R161 HydrophobicContact CB-CB 4.16Å; E153-R161 PolarHBondContact O-N 3.19Å; E153-R161 IonicContact OE1-CZ 3.49Å; E153-R161 IonicContact OE1-NE 2.85Å; E153-R161 IonicContact OE1-NH2 3.08Å; E153-R161 PolarHBondContact OE1-NH2 3.33Å; E153-R161 IonicContact OE2-CZ 3.13Å; E153-R161 VanDerWaalsContact OE2-CZ 3.25Å; E153-R161 IonicContact OE2-NE 2.79Å; E153-R161 PolarHBondContact OE2-NE 3.3Å; E153-R161 IonicContact OE2-NH2 3.68Å; E153-R161 PolarHBondContact OE2-NH2 3.03Å; R161-E199 IonicContact CZ-OE1 2.83Å; R161-E199 IonicContact CZ-OE2 2.74Å; R161-E199 IonicContact NH1-OE1 3.4Å; R161-E199 IonicContact NH1-OE2 3.8Å; R161-E199 PolarHBondContact NH1-OE2 2.93Å; R161-E199 VanDerWaalsContact NH1-OE2 3.16Å; R161-E199 IonicContact NH2-OE1 3.9Å; R161-E199 PolarHBondContact NH2-OE1 2.99Å; R161-E199 IonicContact NH2-OE2 2.62Å; R161-E199 PolarHBondContact NH2-OE2 3.39Å
162	V	91.8	Very high	82.9	Confident	16 Å²	16	75.2 Å²	75.2	10%	0.097	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.5	167.9	175.2	0	0	0	0	108.6	E121 L124 V149 L150	E121-V162 HydrophobicContact CB-CG2 4.44Å; E121-V162 HydrophobicContact CG-CB 3.97Å; E121-V162 HydrophobicContact CG-CG1 4.16Å; E121-V162 HydrophobicContact CG-CG2 4.35Å; L124-V162 HydrophobicContact CB-CG2 4.02Å; L124-V162 HydrophobicContact CD1-CG1 3.67Å; L124-V162 HydrophobicContact CD1-CG2 4.27Å; V149-V162 CarbonylContact O-C 3.53Å; V149-V162 WeakPolarHBondContact O-CA 3.25Å; L150-V162 HydrophobicContact CD1-CG2 3.6Å
163	S	92.9	Very high	82.8	Confident	6 Å²	6	74.6 Å²	74.6	4%	0.042	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	140	172.4	179.3	0	0	0	0	110.3	S148 V149 E199	S148-S163 CarbonylContact C-O 3.6Å; S148-S163 VanDerWaalsContact CA-O 3.26Å; S148-S163 WeakPolarHBondContact CA-O 3.26Å; V149-S163 PolarHBondContact N-O 2.75Å; V149-S163 PolarHBondContact O-N 2.98Å; S163-E199 WeakPolarHBondContact CB-OE1 3.4Å; S163-E199 PolarHBondContact OG-OE1 3.02Å
164	H	93.3	Very high	83	Confident	65 Å²	65	72.9 Å²	72.9	30%	0.301	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	103.2	177.3	-67.3	-62.9	0	0	0	110.1	E121 R136 V146 S148	E121-H164 IonicContact OE1-CD2 2.64Å; E121-H164 IonicContact OE1-NE2 3.13Å; E121-H164 PolarHBondContact OE1-NE2 2.69Å; R136-H164 PolarHBondContact NH2-ND1 2.84Å; V146-H164 HydrophobicContact CG1-CB 3.89Å; S148-H164 WeakPolarHBondContact CB-ND1 3.23Å; S148-H164 PolarHBondContact OG-CE1 3.28Å; S148-H164 PolarHBondContact OG-ND1 2.94Å
165	I	93.4	Very high	83.6	Confident	19 Å²	19	66.9 Å²	66.9	10%	0.097	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	120.6	-177.4	-60.2	156.7	0	0	0	108.4	V146 L147 V176 I197 V205	V146-I165 CarbonylContact C-O 3.23Å; V146-I165 WeakPolarHBondContact CA-O 3.48Å; L147-I165 HydrophobicContact CB-CB 4.29Å; L147-I165 HydrophobicContact CD2-CD1 4.33Å; L147-I165 PolarHBondContact N-O 2.97Å; L147-I165 PolarHBondContact O-N 3.43Å; I165-V176 HydrophobicContact CG2-CB 4.02Å; I165-V176 HydrophobicContact CG2-CG1 3.92Å; I165-I197 HydrophobicContact CD1-CB 4.16Å; I165-I197 HydrophobicContact CD1-CD1 3.71Å; I165-I197 HydrophobicContact CD1-CG2 3.93Å; I165-V205 HydrophobicContact CD1-CB 4.3Å; I165-V205 HydrophobicContact CD1-CG1 4.11Å; I165-V205 HydrophobicContact CD1-CG2 4.44Å
166	K	92.8	Very high	84.5	Confident	135 Å²	135	66.1 Å²	66.1	59%	0.587	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	131.5	178.7	-69.4	-178.8	-179.8	177.2	0	110.1	V176	K166-V176 WeakPolarHBondContact O-CA 3.41Å
167	I	93	Very high	85.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111.8	170	-61.2	162.9	0	0	0	106.9	V135 D144 F145 L147 Y174 T175 V176 L185 L188	V135-I167 HydrophobicContact CG1-CD1 4.14Å; V135-I167 HydrophobicContact CG2-CD1 4.49Å; D144-I167 WeakPolarHBondContact CB-O 3.21Å; F145-I167 HydrophobicContact CB-CB 3.98Å; F145-I167 HydrophobicContact CB-CD1 4.31Å; F145-I167 HydrophobicContact CB-CG2 4.41Å; F145-I167 PolarHBondContact N-O 3.31Å; F145-I167 PolarHBondContact O-N 2.96Å; L147-I167 HydrophobicContact CB-CD1 3.87Å; L147-I167 HydrophobicContact CB-CG1 4.36Å; I167-Y174 HydrophobicContact CG2-CD1 4.22Å; I167-T175 CarbonylContact C-O 3.56Å; I167-T175 WeakPolarHBondContact CA-O 3.45Å; I167-V176 HydrophobicContact CG1-CG1 3.98Å; I167-L185 HydrophobicContact CD1-CD2 4.35Å; I167-L185 HydrophobicContact CG2-CD2 3.92Å; I167-L188 HydrophobicContact CD1-CD2 4.09Å; I167-L188 HydrophobicContact CG1-CD1 4.4Å; I167-L188 HydrophobicContact CG1-CD2 4.31Å; I167-L188 HydrophobicContact CG2-CD1 3.73Å
168	M	90.3	Very high	85.5	Confident	49 Å²	49	54.6 Å²	54.6	24%	0.241	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	139.8	176.7	-63.5	175.7	-72.7	0	0	110.1	D144 Q170 Y174 T175	D144-M168 WeakPolarHBondContact OD1-CA 3.32Å; M168-Q170 HydrophobicContact CB-CG 4.44Å; M168-Y174 WeakPolarHBondContact O-CA 3.43Å; M168-T175 HydrophobicContact CB-CG2 4.21Å; M168-T175 HydrophobicContact CE-CG2 4.21Å; M168-T175 PolarHBondContact N-O 2.96Å; M168-T175 PolarHBondContact O-N 3.48Å
169	C	82.6	Confident	85.9	Confident	22 Å²	22	57.1 Å²	57.1	15%	0.149	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	114.4	171.8	-172.7	0	0	0	0	109.2	R7 D144 R173 Y174	R7-C169 PolarHBondContact NH1-SG 3.32Å; R7-C169 VanDerWaalsContact NH1-SG 3.4Å; R7-C169 PolarHBondContact NH2-SG 3.04Å; D144-C169 PolarHBondContact OD1-N 3.27Å; C169-R173 CarbonylContact C-O 3.54Å; C169-R173 VanDerWaalsContact CA-O 3.3Å; C169-R173 WeakPolarHBondContact CA-O 3.41Å; C169-Y174 HydrophobicContact CB-CD1 4.24Å; C169-Y174 HydrophobicContact CB-CE1 4.23Å
170	Q	82.1	Confident	86.5	Confident	86 Å²	86	57.5 Å²	57.5	40%	0.402	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	122.9	-177.1	-60.1	179.5	9.7	0	0	108.7	M168 D172 R173	M168-Q170 HydrophobicContact CB-CG 4.44Å; Q170-D172 VanDerWaalsContact C-N 3.33Å; Q170-D172 PolarHBondContact O-N 3.38Å; Q170-R173 PolarHBondContact N-O 2.97Å; Q170-R173 PolarHBondContact O-N 3.28Å
171	N	75.9	Confident	86.8	Confident	158 Å²	158	58.4 Å²	58.4	85%	0.845	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	49.5	-178.6	-55.6	-30.7	0	0	0	112.9	R173	N171-R173 PolarHBondContact O-N 3.49Å; N171-R173 VanDerWaalsContact O-N 3.12Å
172	D	73.1	Confident	86.7	Confident	116 Å²	116	56.3 Å²	56.3	62%	0.62	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	16.7	-177.7	-55.2	-32.8	0	0	0	115.8	Q170	Q170-D172 VanDerWaalsContact C-N 3.33Å; Q170-D172 PolarHBondContact O-N 3.38Å
173	R	82.3	Confident	86.1	Confident	96 Å²	96	60.4 Å²	60.4	36%	0.362	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	152.7	175.2	-56.1	-173.1	81.6	-148.1	-3.2	111.3	C169 Q170 N171 M181 F182 D183	C169-R173 CarbonylContact C-O 3.54Å; C169-R173 VanDerWaalsContact CA-O 3.3Å; C169-R173 WeakPolarHBondContact CA-O 3.41Å; Q170-R173 PolarHBondContact N-O 2.97Å; Q170-R173 PolarHBondContact O-N 3.28Å; N171-R173 PolarHBondContact O-N 3.49Å; N171-R173 VanDerWaalsContact O-N 3.12Å; R173-M181 HydrophobicContact CB-CB 4.5Å; R173-M181 HydrophobicContact CB-SD 4.36Å; R173-M181 PolarHBondContact NH2-O 2.85Å; R173-F182 CarbonylContact C-O 3.56Å; R173-F182 VanDerWaalsContact CA-O 3.26Å; R173-F182 WeakPolarHBondContact CA-O 3.48Å; R173-F182 WeakPolarHBondContact CB-O 3.43Å; R173-D183 IonicContact CZ-OD1 4Å; R173-D183 VanDerWaalsContact CZ-OD1 3.29Å; R173-D183 IonicContact NE-OD1 2.82Å; R173-D183 PolarHBondContact NE-OD1 3.1Å; R173-D183 IonicContact NH2-OD1 3.48Å; R173-D183 PolarHBondContact NH2-OD1 3.47Å
174	Y	88.6	Confident	85.6	Confident	27 Å²	27	62.8 Å²	62.8	11%	0.106	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	139.3	-173.9	-56.7	-85.5	0	0	0	111.4	F145 I167 M168 C169 M181 F182 D183 L185	F145-Y174 HydrophobicContact CD2-CD1 4.32Å; F145-Y174 HydrophobicContact CD2-CE1 4.06Å; F145-Y174 HydrophobicContact CE2-CD1 4.36Å; F145-Y174 AromaticContact CE2-CE1 3.66Å; F145-Y174 HydrophobicContact CE2-CE1 3.66Å; I167-Y174 HydrophobicContact CG2-CD1 4.22Å; M168-Y174 WeakPolarHBondContact O-CA 3.43Å; C169-Y174 HydrophobicContact CB-CD1 4.24Å; C169-Y174 HydrophobicContact CB-CE1 4.23Å; Y174-M181 WeakPolarHBondContact O-CA 3.23Å; Y174-F182 PolarHBondContact N-O 3.49Å; Y174-F182 WeakPolarHBondContact O-CD2 3.44Å; Y174-F182 PolarHBondContact O-N 3.37Å; Y174-D183 WeakPolarHBondContact CE2-O 3.14Å; Y174-L185 HydrophobicContact CD1-CD2 3.4Å; Y174-L185 VanDerWaalsContact CD1-CD2 3.4Å; Y174-L185 HydrophobicContact CD1-CG 3.87Å; Y174-L185 HydrophobicContact CE1-CD1 4.37Å; Y174-L185 HydrophobicContact CE1-CD2 3.72Å; Y174-L185 HydrophobicContact CE1-CG 3.71Å; Y174-L185 HydrophobicContact CE2-CG 4.42Å; Y174-L185 HydrophobicContact CG-CD2 3.89Å; Y174-L185 HydrophobicContact CG-CG 4.28Å
175	T	91.4	Very high	85.2	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.012	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	153.7	174.9	-176.1	0	0	0	0	111.7	I167 M168 G177 D180 M181	I167-T175 CarbonylContact C-O 3.56Å; I167-T175 WeakPolarHBondContact CA-O 3.45Å; M168-T175 HydrophobicContact CB-CG2 4.21Å; M168-T175 HydrophobicContact CE-CG2 4.21Å; M168-T175 PolarHBondContact N-O 2.96Å; M168-T175 PolarHBondContact O-N 3.48Å; T175-G177 PolarHBondContact OG1-N 3.37Å; T175-D180 WeakPolarHBondContact CB-O 3.36Å; T175-D180 PolarHBondContact OG1-O 3.16Å; T175-M181 HydrophobicContact CG2-CE 4.24Å
176	V	90.6	Very high	84.7	Confident	33 Å²	33	60.3 Å²	60.3	20%	0.2	34%	0.339	C	S	.	.	S	Bend	trans	-94.6	10.4	171.9	-61.2	0	0	0	0	113.1	I165 K166 I167 L188 Y192	I165-V176 HydrophobicContact CG2-CB 4.02Å; I165-V176 HydrophobicContact CG2-CG1 3.92Å; K166-V176 WeakPolarHBondContact O-CA 3.41Å; I167-V176 HydrophobicContact CG1-CG1 3.98Å; V176-L188 HydrophobicContact CG1-CD1 4.37Å; V176-L188 HydrophobicContact CG1-CD2 4.35Å; V176-Y192 HydrophobicContact CG1-CE2 4.09Å; V176-Y192 HydrophobicContact CG2-CE1 4.41Å; V176-Y192 HydrophobicContact CG2-CE2 3.76Å; V176-Y192 WeakPolarHBondContact CG2-OH 3.47Å
177	G	83.1	Confident	84.4	Confident	55 Å²	55	57.5 Å²	57.5	57%	0.567	33%	0.33	S	S	*	.	S	Bend	trans	100.1	9.2	-179.9	0	0	0	0	0	115.4	T175	T175-G177 PolarHBondContact OG1-N 3.37Å
178	G	78.1	Confident	84.4	Confident	45 Å²	45	57.5 Å²	57.5	46%	0.464	33%	0.33	S	S	.	.	S	Bend	trans	-94.6	-168.5	169.7	0	0	0	0	0	113	D180	G178-D180 VanDerWaalsContact C-N 3.28Å
179	S	80.4	Confident	84.4	Confident	113 Å²	113	55.1 Å²	55.1	79%	0.79	32%	0.319	S	S	*	.	S	Bend	trans	-71	-24.1	173.5	53	0	0	0	0	113.5
180	D	87.5	Confident	84.6	Confident	45 Å²	45	57.1 Å²	57.1	24%	0.241	33%	0.328	C	S	.	.			trans	-75.9	127.6	-175.1	-59.2	-32.9	0	0	0	110.1	T175 G178 F182 F191 K195	T175-D180 WeakPolarHBondContact CB-O 3.36Å; T175-D180 PolarHBondContact OG1-O 3.16Å; G178-D180 VanDerWaalsContact C-N 3.28Å; D180-F182 HydrophobicContact CB-CE2 3.84Å; D180-F182 HydrophobicContact CB-CZ 3.77Å; D180-F191 WeakPolarHBondContact OD2-CE1 3.4Å; D180-F191 WeakPolarHBondContact OD2-CZ 3.33Å; D180-K195 IonicContact OD2-NZ 3.53Å; D180-K195 PolarHBondContact OD2-NZ 3.2Å; D180-K195 VanDerWaalsContact OD2-NZ 3.11Å
181	M	90.3	Very high	85	Confident	70 Å²	70	56.3 Å²	56.3	35%	0.345	32%	0.323	S	S	.	.			trans	-127	139.1	175.6	-68.3	-140.7	179.6	0	0	110.4	R173 Y174 T175	R173-M181 HydrophobicContact CB-CB 4.5Å; R173-M181 HydrophobicContact CB-SD 4.36Å; R173-M181 PolarHBondContact NH2-O 2.85Å; Y174-M181 WeakPolarHBondContact O-CA 3.23Å; T175-M181 HydrophobicContact CG2-CE 4.24Å
182	F	88.4	Confident	85.8	Confident	24 Å²	24	49.4 Å²	49.4	11%	0.105	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-124.4	148.7	-171.5	-56.2	-84.2	0	0	0	111.3	R173 Y174 D180 D187 L188 F191 Y192	R173-F182 CarbonylContact C-O 3.56Å; R173-F182 VanDerWaalsContact CA-O 3.26Å; R173-F182 WeakPolarHBondContact CA-O 3.48Å; R173-F182 WeakPolarHBondContact CB-O 3.43Å; Y174-F182 PolarHBondContact N-O 3.49Å; Y174-F182 WeakPolarHBondContact O-CD2 3.44Å; Y174-F182 PolarHBondContact O-N 3.37Å; D180-F182 HydrophobicContact CB-CE2 3.84Å; D180-F182 HydrophobicContact CB-CZ 3.77Å; F182-D187 HydrophobicContact CB-CB 4.26Å; F182-D187 HydrophobicContact CD1-CB 4.2Å; F182-L188 HydrophobicContact CB-CB 3.93Å; F182-L188 HydrophobicContact CD1-CB 4.45Å; F182-L188 HydrophobicContact CD2-CB 3.67Å; F182-L188 HydrophobicContact CD2-CD1 3.84Å; F182-L188 HydrophobicContact CD2-CG 3.71Å; F182-L188 HydrophobicContact CE2-CB 4.34Å; F182-L188 HydrophobicContact CE2-CD1 4.43Å; F182-L188 HydrophobicContact CE2-CG 4.07Å; F182-L188 HydrophobicContact CG-CB 3.74Å; F182-L188 HydrophobicContact CG-CG 4.31Å; F182-F191 HydrophobicContact CD1-CB 4.45Å; F182-F191 HydrophobicContact CE1-CB 3.54Å; F182-F191 AromaticContact CE1-CD1 3.9Å; F182-F191 HydrophobicContact CE1-CD1 3.9Å; F182-F191 HydrophobicContact CE1-CD2 4.01Å; F182-F191 AromaticContact CE1-CG 3.56Å; F182-F191 HydrophobicContact CE1-CG 3.56Å; F182-F191 HydrophobicContact CE2-CD1 4.4Å; F182-F191 HydrophobicContact CZ-CB 3.87Å; F182-F191 AromaticContact CZ-CD1 3.38Å; F182-F191 HydrophobicContact CZ-CD1 3.38Å; F182-F191 HydrophobicContact CZ-CD2 4.24Å; F182-F191 AromaticContact CZ-CE1 3.82Å; F182-F191 HydrophobicContact CZ-CE1 3.82Å; F182-F191 AromaticContact CZ-CG 3.58Å; F182-F191 HydrophobicContact CZ-CG 3.58Å; F182-F191 HydrophobicContact CZ-CZ 4.42Å; F182-Y192 AromaticContact CE2-CE2 3.86Å; F182-Y192 HydrophobicContact CE2-CE2 3.86Å; F182-Y192 HydrophobicContact CZ-CE2 4.21Å
183	D	78.7	Confident	86.6	Confident	103 Å²	103	47.9 Å²	47.9	55%	0.551	27%	0.273	S	S	*	.	S	Bend	trans	-83.6	-28.8	-177.2	-57.1	-21.3	0	0	0	111.3	R173 Y174	R173-D183 IonicContact CZ-OD1 4Å; R173-D183 VanDerWaalsContact CZ-OD1 3.29Å; R173-D183 IonicContact NE-OD1 2.82Å; R173-D183 PolarHBondContact NE-OD1 3.1Å; R173-D183 IonicContact NH2-OD1 3.48Å; R173-D183 PolarHBondContact NH2-OD1 3.47Å; Y174-D183 WeakPolarHBondContact CE2-O 3.14Å
184	T	81.2	Confident	86.9	Confident	56 Å²	56	54 Å²	54	34%	0.344	30%	0.296	S	S	.	.	S	Bend	trans	-128.8	157.8	174.2	74.1	0	0	0	0	112.5	T186 D187 L188	T184-T186 PolarHBondContact O-N 3.35Å; T184-T186 PolarHBondContact OG1-N 2.9Å; T184-D187 WeakPolarHBondContact CB-OD2 3.32Å; T184-D187 PolarHBondContact N-OD2 3.39Å; T184-D187 PolarHBondContact O-N 3.2Å; T184-D187 PolarHBondContact OG1-N 3Å; T184-D187 PolarHBondContact OG1-OD2 2.9Å; T184-L188 PolarHBondContact O-N 3.49Å
185	L	84.9	Confident	87	Confident	1 Å²	1	58 Å²	58	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-60.6	-31.5	170.3	-73.9	175.7	0	0	0	111.8	P105 W110 F145 I167 Y174 L188 V189	P105-L185 HydrophobicContact CB-CD1 3.92Å; P105-L185 HydrophobicContact CG-CD1 3.67Å; W110-L185 HydrophobicContact CH2-CB 3.99Å; F145-L185 HydrophobicContact CD1-CD1 4.12Å; F145-L185 HydrophobicContact CD2-CD1 4.3Å; F145-L185 HydrophobicContact CD2-CD2 4.12Å; F145-L185 HydrophobicContact CE1-CD1 4.1Å; F145-L185 HydrophobicContact CE2-CD1 4.31Å; F145-L185 HydrophobicContact CG-CD1 4.21Å; F145-L185 HydrophobicContact CG-CD2 4.31Å; F145-L185 HydrophobicContact CZ-CD1 4.19Å; I167-L185 HydrophobicContact CD1-CD2 4.35Å; I167-L185 HydrophobicContact CG2-CD2 3.92Å; Y174-L185 HydrophobicContact CD1-CD2 3.4Å; Y174-L185 VanDerWaalsContact CD1-CD2 3.4Å; Y174-L185 HydrophobicContact CD1-CG 3.87Å; Y174-L185 HydrophobicContact CE1-CD1 4.37Å; Y174-L185 HydrophobicContact CE1-CD2 3.72Å; Y174-L185 HydrophobicContact CE1-CG 3.71Å; Y174-L185 HydrophobicContact CE2-CG 4.42Å; Y174-L185 HydrophobicContact CG-CD2 3.89Å; Y174-L185 HydrophobicContact CG-CG 4.28Å; L185-L188 PolarHBondContact O-N 3.31Å; L185-V189 WeakPolarHBondContact O-CG2 3.37Å; L185-V189 PolarHBondContact O-N 3.3Å
186	T	84.2	Confident	86.8	Confident	30 Å²	30	58 Å²	58	18%	0.184	32%	0.315	C	S	.	.	H	α-helix	trans	-65.2	-46.3	177.7	-55	0	0	0	0	111.2	T106 E108 T184 L188 V189 D190	T106-T186 PolarHBondContact OG1-OG1 3.17Å; T106-T186 VanDerWaalsContact OG1-OG1 3.09Å; E108-T186 HydrophobicContact CG-CG2 4.19Å; T184-T186 PolarHBondContact O-N 3.35Å; T184-T186 PolarHBondContact OG1-N 2.9Å; T186-L188 VanDerWaalsContact C-N 3.31Å; T186-L188 PolarHBondContact O-N 2.98Å; T186-V189 PolarHBondContact O-N 2.99Å; T186-D190 WeakPolarHBondContact O-CB 3.46Å; T186-D190 PolarHBondContact O-N 3.4Å
187	D	85.4	Confident	86.8	Confident	76 Å²	76	57 Å²	57	41%	0.406	31%	0.309	S	S	.	.	H	α-helix	trans	-61.2	-41.8	177.2	-58.5	-43.5	0	0	0	111.6	F182 T184 D190 F191	F182-D187 HydrophobicContact CB-CB 4.26Å; F182-D187 HydrophobicContact CD1-CB 4.2Å; T184-D187 WeakPolarHBondContact CB-OD2 3.32Å; T184-D187 PolarHBondContact N-OD2 3.39Å; T184-D187 PolarHBondContact O-N 3.2Å; T184-D187 PolarHBondContact OG1-N 3Å; T184-D187 PolarHBondContact OG1-OD2 2.9Å; D187-D190 PolarHBondContact O-N 3.28Å; D187-F191 VanDerWaalsContact O-CB 3.3Å; D187-F191 WeakPolarHBondContact O-CB 3.17Å; D187-F191 PolarHBondContact O-N 3.03Å
188	L	92.7	Very high	87.1	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-59.2	-50.3	175.9	-176.7	155	0	0	0	110.9	I167 V176 F182 T184 L185 T186 F191 Y192	I167-L188 HydrophobicContact CD1-CD2 4.09Å; I167-L188 HydrophobicContact CG1-CD1 4.4Å; I167-L188 HydrophobicContact CG1-CD2 4.31Å; I167-L188 HydrophobicContact CG2-CD1 3.73Å; V176-L188 HydrophobicContact CG1-CD1 4.37Å; V176-L188 HydrophobicContact CG1-CD2 4.35Å; F182-L188 HydrophobicContact CB-CB 3.93Å; F182-L188 HydrophobicContact CD1-CB 4.45Å; F182-L188 HydrophobicContact CD2-CB 3.67Å; F182-L188 HydrophobicContact CD2-CD1 3.84Å; F182-L188 HydrophobicContact CD2-CG 3.71Å; F182-L188 HydrophobicContact CE2-CB 4.34Å; F182-L188 HydrophobicContact CE2-CD1 4.43Å; F182-L188 HydrophobicContact CE2-CG 4.07Å; F182-L188 HydrophobicContact CG-CB 3.74Å; F182-L188 HydrophobicContact CG-CG 4.31Å; T184-L188 PolarHBondContact O-N 3.49Å; L185-L188 PolarHBondContact O-N 3.31Å; T186-L188 VanDerWaalsContact C-N 3.31Å; T186-L188 PolarHBondContact O-N 2.98Å; L188-F191 PolarHBondContact O-N 3.15Å; L188-Y192 HydrophobicContact CD2-CD2 3.84Å; L188-Y192 HydrophobicContact CD2-CE2 4.27Å; L188-Y192 HydrophobicContact CG-CD2 4.03Å; L188-Y192 HydrophobicContact CG-CE2 4.09Å; L188-Y192 VanDerWaalsContact O-CD2 3.22Å; L188-Y192 WeakPolarHBondContact O-CD2 2.94Å; L188-Y192 PolarHBondContact O-N 3.22Å; L188-Y192 VanDerWaalsContact O-N 3.12Å
189	V	91.1	Very high	87.3	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-44.5	-178.6	167.9	0	0	0	0	110.9	W110 F133 V135 L185 T186 F191 Y192 K193	W110-V189 HydrophobicContact CE3-CG2 4.31Å; W110-V189 HydrophobicContact CH2-CB 4.19Å; W110-V189 HydrophobicContact CH2-CG2 3.6Å; W110-V189 HydrophobicContact CZ2-CB 3.95Å; W110-V189 HydrophobicContact CZ2-CG1 4.19Å; W110-V189 HydrophobicContact CZ2-CG2 3.87Å; W110-V189 HydrophobicContact CZ3-CG2 3.86Å; F133-V189 HydrophobicContact CE2-CG1 3.67Å; F133-V189 HydrophobicContact CZ-CG1 3.92Å; V135-V189 HydrophobicContact CG2-CG2 4.03Å; L185-V189 WeakPolarHBondContact O-CG2 3.37Å; L185-V189 PolarHBondContact O-N 3.3Å; T186-V189 PolarHBondContact O-N 2.99Å; V189-F191 VanDerWaalsContact C-N 3.33Å; V189-F191 PolarHBondContact O-N 3.32Å; V189-Y192 PolarHBondContact O-N 3.12Å; V189-K193 HydrophobicContact CG1-CD 3.78Å; V189-K193 HydrophobicContact CG1-CG 4.22Å; V189-K193 WeakPolarHBondContact O-CB 3.4Å; V189-K193 VanDerWaalsContact O-CG 3.25Å; V189-K193 WeakPolarHBondContact O-CG 3.43Å; V189-K193 PolarHBondContact O-N 3.02Å
190	D	86.4	Confident	87.3	Confident	64 Å²	64	63 Å²	63	34%	0.342	30%	0.301	S	S	.	.	H	α-helix	trans	-66.2	-34	-179.9	-83.6	-18	0	0	0	113.1	T186 D187 K193	T186-D190 WeakPolarHBondContact O-CB 3.46Å; T186-D190 PolarHBondContact O-N 3.4Å; D187-D190 PolarHBondContact O-N 3.28Å; D190-K193 IonicContact OD1-NZ 3.22Å
191	F	91.5	Very high	86.8	Confident	68 Å²	68	64.6 Å²	64.6	30%	0.298	32%	0.316	S	S	.	.	H	α-helix	trans	-62.6	-50.8	171.5	178.4	-97.2	0	0	0	111.4	D180 F182 D187 L188 V189 K193 R194 K195	D180-F191 WeakPolarHBondContact OD2-CE1 3.4Å; D180-F191 WeakPolarHBondContact OD2-CZ 3.33Å; F182-F191 HydrophobicContact CD1-CB 4.45Å; F182-F191 HydrophobicContact CE1-CB 3.54Å; F182-F191 AromaticContact CE1-CD1 3.9Å; F182-F191 HydrophobicContact CE1-CD1 3.9Å; F182-F191 HydrophobicContact CE1-CD2 4.01Å; F182-F191 AromaticContact CE1-CG 3.56Å; F182-F191 HydrophobicContact CE1-CG 3.56Å; F182-F191 HydrophobicContact CE2-CD1 4.4Å; F182-F191 HydrophobicContact CZ-CB 3.87Å; F182-F191 AromaticContact CZ-CD1 3.38Å; F182-F191 HydrophobicContact CZ-CD1 3.38Å; F182-F191 HydrophobicContact CZ-CD2 4.24Å; F182-F191 AromaticContact CZ-CE1 3.82Å; F182-F191 HydrophobicContact CZ-CE1 3.82Å; F182-F191 AromaticContact CZ-CG 3.58Å; F182-F191 HydrophobicContact CZ-CG 3.58Å; F182-F191 HydrophobicContact CZ-CZ 4.42Å; D187-F191 VanDerWaalsContact O-CB 3.3Å; D187-F191 WeakPolarHBondContact O-CB 3.17Å; D187-F191 PolarHBondContact O-N 3.03Å; L188-F191 PolarHBondContact O-N 3.15Å; V189-F191 VanDerWaalsContact C-N 3.33Å; V189-F191 PolarHBondContact O-N 3.32Å; F191-K193 VanDerWaalsContact C-N 3.34Å; F191-K193 PolarHBondContact O-N 2.92Å; F191-R194 PolarHBondContact O-N 3.36Å; F191-R194 VanDerWaalsContact O-N 3.13Å; F191-K195 HydrophobicContact CD1-CD 4.35Å; F191-K195 HydrophobicContact CE1-CB 4.46Å; F191-K195 HydrophobicContact CE1-CD 3.43Å; F191-K195 VanDerWaalsContact CE1-CD 3.43Å; F191-K195 HydrophobicContact CE2-CD 4.4Å; F191-K195 HydrophobicContact CZ-CD 3.47Å; F191-K195 VanDerWaalsContact CZ-CD 3.47Å; F191-K195 PolarHBondContact O-N 2.77Å
192	Y	92.8	Very high	86.3	Confident	13 Å²	13	63 Å²	63	5%	0.051	32%	0.318	C	S	.	.	H	α-helix	trans	-75.6	-19.1	-177.5	-75.1	-60.5	0	0	0	114.3	V176 F182 L188 V189 R194 G196 I197	V176-Y192 HydrophobicContact CG1-CE2 4.09Å; V176-Y192 HydrophobicContact CG2-CE1 4.41Å; V176-Y192 HydrophobicContact CG2-CE2 3.76Å; V176-Y192 WeakPolarHBondContact CG2-OH 3.47Å; F182-Y192 AromaticContact CE2-CE2 3.86Å; F182-Y192 HydrophobicContact CE2-CE2 3.86Å; F182-Y192 HydrophobicContact CZ-CE2 4.21Å; L188-Y192 HydrophobicContact CD2-CD2 3.84Å; L188-Y192 HydrophobicContact CD2-CE2 4.27Å; L188-Y192 HydrophobicContact CG-CD2 4.03Å; L188-Y192 HydrophobicContact CG-CE2 4.09Å; L188-Y192 VanDerWaalsContact O-CD2 3.22Å; L188-Y192 WeakPolarHBondContact O-CD2 2.94Å; L188-Y192 PolarHBondContact O-N 3.22Å; L188-Y192 VanDerWaalsContact O-N 3.12Å; V189-Y192 PolarHBondContact O-N 3.12Å; Y192-R194 VanDerWaalsContact C-N 3.25Å; Y192-R194 PolarHBondContact O-N 3.43Å; Y192-G196 WeakPolarHBondContact CD1-O 2.99Å; Y192-G196 WeakPolarHBondContact O-CA 3.41Å; Y192-G196 PolarHBondContact O-N 3.49Å; Y192-I197 HydrophobicContact CD1-CB 4.42Å; Y192-I197 HydrophobicContact CD1-CD1 4.02Å; Y192-I197 HydrophobicContact CD1-CG1 3.23Å; Y192-I197 HydrophobicContact CD2-CD1 4.23Å; Y192-I197 HydrophobicContact CD2-CG1 4.31Å; Y192-I197 HydrophobicContact CE1-CG1 3.83Å; Y192-I197 HydrophobicContact CG-CD1 3.77Å; Y192-I197 HydrophobicContact CG-CG1 3.51Å
193	K	89.3	Confident	86.1	Confident	85 Å²	85	64.7 Å²	64.7	37%	0.37	33%	0.328	S	S	.	.	H	α-helix	trans	-62.2	-33	166.1	-78.4	170.5	75.4	-173.4	0	112.6	F133 V189 D190 F191 L207	F133-K193 HydrophobicContact CE1-CD 4.33Å; F133-K193 HydrophobicContact CE1-CG 4.42Å; F133-K193 HydrophobicContact CZ-CD 3.99Å; F133-K193 HydrophobicContact CZ-CG 4.4Å; V189-K193 HydrophobicContact CG1-CD 3.78Å; V189-K193 HydrophobicContact CG1-CG 4.22Å; V189-K193 WeakPolarHBondContact O-CB 3.4Å; V189-K193 VanDerWaalsContact O-CG 3.25Å; V189-K193 WeakPolarHBondContact O-CG 3.43Å; V189-K193 PolarHBondContact O-N 3.02Å; D190-K193 IonicContact OD1-NZ 3.22Å; F191-K193 VanDerWaalsContact C-N 3.34Å; F191-K193 PolarHBondContact O-N 2.92Å; K193-L207 HydrophobicContact CB-CB 4.42Å; K193-L207 HydrophobicContact CG-CB 3.61Å; K193-L207 HydrophobicContact CG-CD1 4.12Å; K193-L207 HydrophobicContact CG-CG 4.49Å
194	R	89.1	Confident	86.5	Confident	223 Å²	223	66 Å²	66	84%	0.842	33%	0.325	S	S	*	.	H	α-helix	trans	-87.4	-43.5	178.5	-59.4	178.9	-158.2	-160.5	4.3	112.3	F191 Y192	F191-R194 PolarHBondContact O-N 3.36Å; F191-R194 VanDerWaalsContact O-N 3.13Å; Y192-R194 VanDerWaalsContact C-N 3.25Å; Y192-R194 PolarHBondContact O-N 3.43Å
195	K	89.4	Confident	87	Confident	112 Å²	112	63.4 Å²	63.4	49%	0.487	31%	0.31	S	S	.	.	H	α-helix	trans	-83.6	-31.5	-172.9	-169.5	176.5	175.2	-178.5	0	113.2	D180 F191 W204	D180-K195 IonicContact OD2-NZ 3.53Å; D180-K195 PolarHBondContact OD2-NZ 3.2Å; D180-K195 VanDerWaalsContact OD2-NZ 3.11Å; F191-K195 HydrophobicContact CD1-CD 4.35Å; F191-K195 HydrophobicContact CE1-CB 4.46Å; F191-K195 HydrophobicContact CE1-CD 3.43Å; F191-K195 VanDerWaalsContact CE1-CD 3.43Å; F191-K195 HydrophobicContact CE2-CD 4.4Å; F191-K195 HydrophobicContact CZ-CD 3.47Å; F191-K195 VanDerWaalsContact CZ-CD 3.47Å; F191-K195 PolarHBondContact O-N 2.77Å; K195-W204 WeakPolarHBondContact O-CZ3 3.42Å
196	G	88.3	Confident	87.2	Confident	3 Å²	3	67.7 Å²	67.7	3%	0.031	33%	0.329	C	S	.	.			trans	73.1	164.5	-162	0	0	0	0	0	111.9	Y192 V205	Y192-G196 WeakPolarHBondContact CD1-O 2.99Å; Y192-G196 WeakPolarHBondContact O-CA 3.41Å; Y192-G196 PolarHBondContact O-N 3.49Å; G196-V205 WeakPolarHBondContact CA-O 3.35Å
197	I	91.1	Very high	87.6	Confident	11 Å²	11	66.6 Å²	66.6	6%	0.056	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.3	178.4	-60.6	166.7	0	0	0	108.6	L147 I165 Y192 V205	L147-I197 HydrophobicContact CD2-CD1 3.46Å; L147-I197 VanDerWaalsContact CD2-CD1 3.46Å; I165-I197 HydrophobicContact CD1-CB 4.16Å; I165-I197 HydrophobicContact CD1-CD1 3.71Å; I165-I197 HydrophobicContact CD1-CG2 3.93Å; Y192-I197 HydrophobicContact CD1-CB 4.42Å; Y192-I197 HydrophobicContact CD1-CD1 4.02Å; Y192-I197 HydrophobicContact CD1-CG1 3.23Å; Y192-I197 HydrophobicContact CD2-CD1 4.23Å; Y192-I197 HydrophobicContact CD2-CG1 4.31Å; Y192-I197 HydrophobicContact CE1-CG1 3.83Å; Y192-I197 HydrophobicContact CG-CD1 3.77Å; Y192-I197 HydrophobicContact CG-CG1 3.51Å; I197-V205 HydrophobicContact CB-CB 4.45Å; I197-V205 PolarHBondContact N-O 2.9Å; I197-V205 PolarHBondContact O-N 3.5Å
198	E	87.9	Confident	87.7	Confident	120 Å²	120	70.6 Å²	70.6	56%	0.561	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	124.1	172.7	-172.3	172.9	-155.6	0	0	109.8	W204	E198-W204 HydrophobicContact CB-CD2 4.28Å; E198-W204 HydrophobicContact CB-CH2 4.25Å; E198-W204 HydrophobicContact CB-CZ2 3.96Å; E198-W204 HydrophobicContact CG-CZ2 4.22Å
199	E	83.7	Confident	87.4	Confident	32 Å²	32	72.1 Å²	72.1	15%	0.15	34%	0.339	C	S	.	.			trans	-77.3	158.2	173.5	-70.8	-176.2	179.3	0	0	111.3	R161 S163 S201 G202 N203 V205	R161-E199 IonicContact CZ-OE1 2.83Å; R161-E199 IonicContact CZ-OE2 2.74Å; R161-E199 IonicContact NH1-OE1 3.4Å; R161-E199 IonicContact NH1-OE2 3.8Å; R161-E199 PolarHBondContact NH1-OE2 2.93Å; R161-E199 VanDerWaalsContact NH1-OE2 3.16Å; R161-E199 IonicContact NH2-OE1 3.9Å; R161-E199 PolarHBondContact NH2-OE1 2.99Å; R161-E199 IonicContact NH2-OE2 2.62Å; R161-E199 PolarHBondContact NH2-OE2 3.39Å; S163-E199 WeakPolarHBondContact CB-OE1 3.4Å; S163-E199 PolarHBondContact OG-OE1 3.02Å; E199-S201 VanDerWaalsContact CB-OG 3.22Å; E199-S201 WeakPolarHBondContact CB-OG 3.41Å; E199-S201 PolarHBondContact O-N 2.85Å; E199-S201 VanDerWaalsContact O-N 3.12Å; E199-S201 PolarHBondContact OE2-OG 3.46Å; E199-S201 VanDerWaalsContact OE2-OG 3.08Å; E199-G202 WeakPolarHBondContact O-CA 3.32Å; E199-G202 PolarHBondContact O-N 3.35Å; E199-N203 PolarHBondContact N-O 3.32Å; E199-V205 HydrophobicContact CG-CG2 3.97Å; E199-V205 WeakPolarHBondContact OE1-CG2 3.19Å
200	I	78.6	Confident	87.3	Confident	187 Å²	187	73.3 Å²	73.3	96%	0.959	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-26	173.9	-57.1	170.5	0	0	0	111.6	G202	I200-G202 PolarHBondContact O-N 2.88Å
201	S	78.1	Confident	87.2	Confident	78 Å²	78	72.7 Å²	72.7	55%	0.545	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-11.3	173	53.9	0	0	0	0	113.9	E199	E199-S201 VanDerWaalsContact CB-OG 3.22Å; E199-S201 WeakPolarHBondContact CB-OG 3.41Å; E199-S201 PolarHBondContact O-N 2.85Å; E199-S201 VanDerWaalsContact O-N 3.12Å; E199-S201 PolarHBondContact OE2-OG 3.46Å; E199-S201 VanDerWaalsContact OE2-OG 3.08Å
202	G	79.3	Confident	86.8	Confident	38 Å²	38	72.1 Å²	72.1	39%	0.392	34%	0.337	S	S	.	.	S	Bend	trans	88.2	2.2	-172.7	0	0	0	0	0	114.3	E199 I200	E199-G202 WeakPolarHBondContact O-CA 3.32Å; E199-G202 PolarHBondContact O-N 3.35Å; I200-G202 PolarHBondContact O-N 2.88Å
203	N	83.9	Confident	86.2	Confident	58 Å²	58	71.9 Å²	71.9	31%	0.31	34%	0.337	S	S	.	.			trans	-84.8	140.7	-178.7	-65.7	-18.6	0	0	0	111.7	E153 E199	E153-N203 VanDerWaalsContact CD-ND2 3.31Å; E153-N203 WeakPolarHBondContact OE1-CB 3.12Å; E153-N203 PolarHBondContact OE1-ND2 2.82Å; E153-N203 PolarHBondContact OE2-ND2 2.91Å; E199-N203 PolarHBondContact N-O 3.32Å
204	W	88	Confident	85.9	Confident	130 Å²	130	69.7 Å²	69.7	49%	0.492	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	126.6	178.8	-77.9	77.5	0	0	0	111.7	K195 E198	K195-W204 WeakPolarHBondContact O-CZ3 3.42Å; E198-W204 HydrophobicContact CB-CD2 4.28Å; E198-W204 HydrophobicContact CB-CH2 4.25Å; E198-W204 HydrophobicContact CB-CZ2 3.96Å; E198-W204 HydrophobicContact CG-CZ2 4.22Å
205	V	90.3	Very high	85.6	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.018	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120.7	177.6	-178.7	0	0	0	0	108.7	V149 T151 I165 G196 I197 E199	V149-V205 HydrophobicContact CB-CG1 3.56Å; V149-V205 HydrophobicContact CG1-CG1 3.56Å; V149-V205 HydrophobicContact CG2-CG1 3.67Å; T151-V205 HydrophobicContact CG2-CG2 4.29Å; I165-V205 HydrophobicContact CD1-CB 4.3Å; I165-V205 HydrophobicContact CD1-CG1 4.11Å; I165-V205 HydrophobicContact CD1-CG2 4.44Å; G196-V205 WeakPolarHBondContact CA-O 3.35Å; I197-V205 HydrophobicContact CB-CB 4.45Å; I197-V205 PolarHBondContact N-O 2.9Å; I197-V205 PolarHBondContact O-N 3.5Å; E199-V205 HydrophobicContact CG-CG2 3.97Å; E199-V205 WeakPolarHBondContact OE1-CG2 3.19Å
206	H	90.6	Very high	85.3	Confident	91 Å²	91	57.7 Å²	57.7	42%	0.421	28%	0.283	S	S	.	.			trans	-109.6	128.9	-179.3	-62.7	-71.9	0	0	0	111.1	G131 R208	G131-H206 WeakPolarHBondContact CA-O 3.12Å; H206-R208 HydrophobicContact CB-CG 4.32Å; H206-R208 PolarHBondContact O-N 2.86Å
207	L	91.9	Very high	84.9	Confident	6 Å²	6	57.7 Å²	57.7	3%	0.031	28%	0.283	C	S	.	.			trans	-90.4	92.1	176.8	-46.7	-178	0	0	0	108.6	F133 L147 V149 K193	F133-L207 HydrophobicContact CB-CD2 3.87Å; F133-L207 HydrophobicContact CD1-CB 3.72Å; F133-L207 HydrophobicContact CD1-CD2 4.38Å; F133-L207 HydrophobicContact CE1-CB 3.95Å; F133-L207 HydrophobicContact CG-CB 4.19Å; F133-L207 HydrophobicContact CG-CD2 4.06Å; L147-L207 HydrophobicContact CD1-CD1 4.46Å; L147-L207 HydrophobicContact CD1-CD2 4.2Å; L147-L207 HydrophobicContact CD2-CD1 3.89Å; L147-L207 HydrophobicContact CD2-CD2 3.92Å; L147-L207 HydrophobicContact CG-CD2 4.32Å; V149-L207 HydrophobicContact CB-CD2 4.42Å; V149-L207 HydrophobicContact CG1-CD2 4.09Å; V149-L207 HydrophobicContact CG2-CD2 3.43Å; V149-L207 VanDerWaalsContact CG2-CD2 3.43Å; K193-L207 HydrophobicContact CB-CB 4.42Å; K193-L207 HydrophobicContact CG-CB 3.61Å; K193-L207 HydrophobicContact CG-CD1 4.12Å; K193-L207 HydrophobicContact CG-CG 4.49Å
208	R	87.8	Confident	84.6	Confident	160 Å²	160	57.1 Å²	57.1	60%	0.604	28%	0.28	S	S	*	.			trans	-90.9	-54.1	-174.7	-65.3	-173.8	-177.4	-157.6	4	111.4	G131 H206	G131-R208 PolarHBondContact O-N 2.77Å; H206-R208 HydrophobicContact CB-CG 4.32Å; H206-R208 PolarHBondContact O-N 2.86Å
209	Q	87.1	Confident	84.4	Confident	33 Å²	33	52 Å²	52	15%	0.154	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140.4	-178.9	63	-77.3	-10.4	0	0	112.1	E129 P130 G131 T132 F133	E129-Q209 VanDerWaalsContact CG-NE2 3.35Å; E129-Q209 PolarHBondContact O-NE2 2.94Å; P130-Q209 PolarHBondContact O-NE2 3.38Å; G131-Q209 PolarHBondContact O-N 2.75Å; T132-Q209 CarbonylContact C-O 3.47Å; T132-Q209 WeakPolarHBondContact CA-O 3.47Å; T132-Q209 VanDerWaalsContact N-NE2 3.2Å; T132-Q209 PolarHBondContact OG1-NE2 2.98Å; F133-Q209 WeakPolarHBondContact CD1-O 3.36Å; F133-Q209 VanDerWaalsContact CE1-C 3.48Å; F133-Q209 PolarHBondContact N-O 2.76Å
210	P	88.1	Confident	84.3	Confident	24 Å²	24	53 Å²	53	16%	0.156	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	145.7	175	29.4	-34.8	0	0	0	111.9	W110 R127 F133 F212	W110-P210 HydrophobicContact CB-CB 3.65Å; W110-P210 HydrophobicContact CG-CB 4.39Å; R127-P210 PolarHBondContact NH1-O 2.89Å; F133-P210 HydrophobicContact CE1-CB 4.12Å; F133-P210 HydrophobicContact CE2-CB 4.43Å; F133-P210 HydrophobicContact CZ-CB 3.92Å; F133-P210 CarbonylContact O-C 3.47Å; F133-P210 WeakPolarHBondContact O-CA 3.45Å; P210-F212 HydrophobicContact CB-CD1 3.91Å; P210-F212 HydrophobicContact CB-CE1 3.66Å; P210-F212 HydrophobicContact CB-CZ 4.25Å; P210-F212 HydrophobicContact CG-CD1 3.87Å; P210-F212 HydrophobicContact CG-CE1 3.18Å; P210-F212 HydrophobicContact CG-CE2 4.07Å; P210-F212 HydrophobicContact CG-CZ 3.3Å
211	Y	84.9	Confident	84.8	Confident	52 Å²	52	44.2 Å²	44.2	20%	0.204	22%	0.219	C	C	.	.			trans	-86.8	107.4	157.6	-165	-70.6	0	0	0	107.8	H112 L123 L124 R127 T132 F133 L134	H112-Y211 AromaticContact CE1-CD1 3.4Å; H112-Y211 WeakPolarHBondContact CE1-CD1 3.31Å; H112-Y211 AromaticContact CE1-CE1 3.83Å; H112-Y211 AromaticContact NE2-CD1 3.67Å; H112-Y211 PolarHBondContact NE2-O 3.45Å; L123-Y211 HydrophobicContact CB-CE1 4.41Å; L123-Y211 HydrophobicContact CB-CE2 4.1Å; L123-Y211 HydrophobicContact CD1-CE1 4.41Å; L123-Y211 WeakPolarHBondContact O-CE2 3.49Å; L124-Y211 HydrophobicContact CD2-CD2 4.18Å; L124-Y211 HydrophobicContact CD2-CG 4.46Å; R127-Y211 HydrophobicContact CB-CD2 4.34Å; R127-Y211 HydrophobicContact CB-CE2 4.11Å; T132-Y211 HydrophobicContact CG2-CD2 4.02Å; T132-Y211 HydrophobicContact CG2-CG 4.38Å; F133-Y211 PolarHBondContact O-N 3.47Å; L134-Y211 HydrophobicContact CD2-CG 4.44Å
212	F	81.8	Confident	85.2	Confident	55 Å²	55	42.7 Å²	42.7	24%	0.241	20%	0.204	C	C	.	.			trans	-75.5	133.4	-178.6	-63.7	-48.7	0	0	0	112.1	R109 P210	R109-F212 HydrophobicContact CB-CB 4.11Å; R109-F212 HydrophobicContact CB-CD1 3.29Å; R109-F212 HydrophobicContact CB-CE1 3.91Å; R109-F212 HydrophobicContact CB-CG 3.98Å; R109-F212 HydrophobicContact CG-CD1 4.43Å; R109-F212 CarbonylContact O-C 3.58Å; R109-F212 WeakPolarHBondContact O-CA 3.46Å; P210-F212 HydrophobicContact CB-CD1 3.91Å; P210-F212 HydrophobicContact CB-CE1 3.66Å; P210-F212 HydrophobicContact CB-CZ 4.25Å; P210-F212 HydrophobicContact CG-CD1 3.87Å; P210-F212 HydrophobicContact CG-CE1 3.18Å; P210-F212 HydrophobicContact CG-CE2 4.07Å; P210-F212 HydrophobicContact CG-CZ 3.3Å
213	S	80.7	Confident	85.5	Confident	8 Å²	8	43.1 Å²	43.1	6%	0.056	20%	0.202	C	C	.	.			trans	-81.8	131.7	168.3	179.6	0	0	0	0	109.2	R109 Y111 R215 R224	R109-S213 WeakPolarHBondContact O-CB 3.48Å; R109-S213 PolarHBondContact O-N 3.39Å; Y111-S213 VanDerWaalsContact O-CB 3.27Å; Y111-S213 WeakPolarHBondContact O-CB 3.46Å; S213-R215 PolarHBondContact OG-N 3.35Å; S213-R224 PolarHBondContact O-NH1 2.93Å
214	T	82.9	Confident	85.7	Confident	39 Å²	39	41 Å²	41	24%	0.239	19%	0.189	C	C	.	.			trans	-89	-16	171.9	53.7	0	0	0	0	111.8	R224 E250 D485 P487	T214-R224 PolarHBondContact O-NH1 2.89Å; T214-R224 VanDerWaalsContact O-NH1 3.1Å; T214-E250 HydrophobicContact CG2-CG 4.47Å; T214-D485 WeakPolarHBondContact CB-OD1 3.36Å; T214-D485 VanDerWaalsContact OG1-CG 3.31Å; T214-D485 PolarHBondContact OG1-OD1 2.84Å; T214-D485 PolarHBondContact OG1-OD2 2.97Å; T214-P487 HydrophobicContact CG2-CB 4.21Å; T214-P487 HydrophobicContact CG2-CG 3.7Å
215	R	82.3	Confident	85.7	Confident	76 Å²	76	35.3 Å²	35.3	29%	0.287	17%	0.169	S	C	.	.			trans	-69.9	141.6	176.7	-171.9	-177	-66.9	-150.1	7.6	111.1	S213 R224 D483 I484	S213-R215 PolarHBondContact OG-N 3.35Å; R215-R224 PolarHBondContact O-NH1 2.98Å; R215-R224 PolarHBondContact O-NH2 3.47Å; R215-D483 WeakPolarHBondContact CD-OD2 3.36Å; R215-D483 HydrophobicContact CG-CB 4.32Å; R215-D483 IonicContact CZ-OD2 3.55Å; R215-D483 IonicContact NE-OD2 4Å; R215-D483 IonicContact NH1-OD2 2.74Å; R215-D483 PolarHBondContact NH1-OD2 2.96Å; R215-I484 WeakPolarHBondContact CA-O 3.18Å
216	V	83.4	Confident	85.6	Confident	7 Å²	7	40.8 Å²	40.8	4%	0.042	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	148	177.4	65.3	0	0	0	0	109.7	D220 I221 R224 I484	V216-D220 HydrophobicContact CG2-CB 4.29Å; V216-I221 HydrophobicContact CG1-CD1 3.6Å; V216-R224 HydrophobicContact CG2-CB 3.92Å; V216-I484 HydrophobicContact CG1-CB 4.47Å; V216-I484 PolarHBondContact N-O 2.9Å; V216-I484 PolarHBondContact O-N 3.5Å; V216-I484 VanDerWaalsContact O-O 3.13Å
217	I	80.4	Confident	85.1	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.015	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	135.2	169.1	-57.1	177.3	0	0	0	107.7	S102 S219 D220 I221	S102-I217 WeakPolarHBondContact O-CD1 3.29Å; I217-S219 VanDerWaalsContact C-N 3.26Å; I217-S219 WeakPolarHBondContact CG2-OG 3.42Å; I217-S219 PolarHBondContact O-N 3.2Å; I217-D220 HydrophobicContact CB-CB 4.48Å; I217-D220 PolarHBondContact O-N 3.38Å; I217-I221 PolarHBondContact O-N 3.42Å
218	A	85	Confident	84.7	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-51.6	-46.8	-176.7	0	0	0	0	0	112	D220 I221 I475 L480 C482 I484 I518	A218-D220 PolarHBondContact O-N 3.36Å; A218-I221 WeakPolarHBondContact O-CB 3.39Å; A218-I221 VanDerWaalsContact O-CG2 3.31Å; A218-I221 WeakPolarHBondContact O-CG2 3.25Å; A218-I221 PolarHBondContact O-N 3.26Å; A218-I221 VanDerWaalsContact O-N 3.08Å; A218-I475 HydrophobicContact CB-CG1 4.32Å; A218-L480 WeakPolarHBondContact CB-O 3.17Å; A218-C482 PolarHBondContact N-O 2.97Å; A218-I484 HydrophobicContact CB-CD1 3.34Å; A218-I484 HydrophobicContact CB-CG1 3.88Å; A218-I518 HydrophobicContact CB-CD1 3.74Å; A218-I518 WeakPolarHBondContact O-CD1 3.45Å
219	S	82.6	Confident	84.4	Confident	13 Å²	13	33 Å²	33	9%	0.091	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-59	-21.2	178.7	58	0	0	0	0	114.9	I217 L480 D481 K522	I217-S219 VanDerWaalsContact C-N 3.26Å; I217-S219 WeakPolarHBondContact CG2-OG 3.42Å; I217-S219 PolarHBondContact O-N 3.2Å; S219-L480 VanDerWaalsContact CB-O 3.26Å; S219-L480 WeakPolarHBondContact CB-O 3.37Å; S219-L480 PolarHBondContact N-O 3.03Å; S219-L480 PolarHBondContact OG-O 2.8Å; S219-D481 PolarHBondContact OG-OD1 2.91Å; S219-K522 PolarHBondContact O-NZ 2.85Å
220	D	83.4	Confident	83.5	Confident	53 Å²	53	37.1 Å²	37.1	28%	0.283	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-102.4	7.5	-179.5	-66.9	-37.2	0	0	0	113.7	V216 I217 A218 D222 S223 R224	V216-D220 HydrophobicContact CG2-CB 4.29Å; I217-D220 HydrophobicContact CB-CB 4.48Å; I217-D220 PolarHBondContact O-N 3.38Å; A218-D220 PolarHBondContact O-N 3.36Å; D220-D222 PolarHBondContact O-N 3.04Å; D220-D222 VanDerWaalsContact O-N 3.16Å; D220-S223 WeakPolarHBondContact O-CB 3.42Å; D220-S223 PolarHBondContact O-N 3.03Å; D220-S223 VanDerWaalsContact O-N 3.12Å; D220-R224 PolarHBondContact O-N 3.33Å
221	I	88.3	Confident	81.9	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-56.1	-35.8	-177.5	-167	65.6	0	0	0	112.8	V216 I217 A218 S223 R224 V225 I486 Y511 V514 I518	V216-I221 HydrophobicContact CG1-CD1 3.6Å; I217-I221 PolarHBondContact O-N 3.42Å; A218-I221 WeakPolarHBondContact O-CB 3.39Å; A218-I221 VanDerWaalsContact O-CG2 3.31Å; A218-I221 WeakPolarHBondContact O-CG2 3.25Å; A218-I221 PolarHBondContact O-N 3.26Å; A218-I221 VanDerWaalsContact O-N 3.08Å; I221-S223 VanDerWaalsContact C-N 3.35Å; I221-S223 PolarHBondContact O-N 3.27Å; I221-R224 CarbonylContact O-C 3.54Å; I221-R224 WeakPolarHBondContact O-CA 3.26Å; I221-R224 WeakPolarHBondContact O-CB 3.16Å; I221-R224 PolarHBondContact O-N 3.47Å; I221-R224 VanDerWaalsContact O-N 3.1Å; I221-V225 WeakPolarHBondContact O-CG2 3.35Å; I221-V225 PolarHBondContact O-N 3.45Å; I221-I486 HydrophobicContact CD1-CD1 4.21Å; I221-Y511 HydrophobicContact CD1-CD1 3.75Å; I221-Y511 HydrophobicContact CD1-CE1 4.04Å; I221-V514 HydrophobicContact CG1-CG1 4.2Å; I221-I518 HydrophobicContact CB-CD1 4.5Å; I221-I518 HydrophobicContact CG2-CB 4.48Å; I221-I518 HydrophobicContact CG2-CD1 3.83Å
222	D	87.4	Confident	80.2	Confident	46 Å²	46	38.4 Å²	38.4	25%	0.246	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-41.1	-179.5	-176.1	79.3	0	0	0	111.8	D220 R224 V225 K226 Q519	D220-D222 PolarHBondContact O-N 3.04Å; D220-D222 VanDerWaalsContact O-N 3.16Å; D222-R224 VanDerWaalsContact C-N 3.32Å; D222-R224 PolarHBondContact O-N 2.92Å; D222-V225 PolarHBondContact O-N 3.49Å; D222-K226 WeakPolarHBondContact O-CG 3.38Å; D222-K226 PolarHBondContact O-N 2.98Å; D222-K226 VanDerWaalsContact OD2-CE 3.26Å; D222-K226 WeakPolarHBondContact OD2-CE 3.46Å; D222-K226 IonicContact OD2-NZ 2.73Å; D222-K226 PolarHBondContact OD2-NZ 3.07Å; D222-Q519 PolarHBondContact OD1-NE2 2.91Å
223	S	85.3	Confident	78.3	Confident	48 Å²	48	42 Å²	42	34%	0.336	22%	0.224	S	C	.	.	H	α-helix	trans	-62	-41.5	173.3	-61.3	0	0	0	0	110.9	D220 I221 K226 Q227	D220-S223 WeakPolarHBondContact O-CB 3.42Å; D220-S223 PolarHBondContact O-N 3.03Å; D220-S223 VanDerWaalsContact O-N 3.12Å; I221-S223 VanDerWaalsContact C-N 3.35Å; I221-S223 PolarHBondContact O-N 3.27Å; S223-K226 PolarHBondContact O-N 3.2Å; S223-Q227 WeakPolarHBondContact O-CG 3.33Å; S223-Q227 PolarHBondContact O-N 3.2Å
224	R	87.2	Confident	76.4	Confident	14 Å²	14	49.4 Å²	49.4	5%	0.053	26%	0.255	C	S	.	.	H	α-helix	trans	-64.4	-42.4	175.3	176.1	59.4	63	74.5	7.4	112.1	S213 T214 R215 V216 D220 I221 D222 K226 Q227 L228 Y511	S213-R224 PolarHBondContact O-NH1 2.93Å; T214-R224 PolarHBondContact O-NH1 2.89Å; T214-R224 VanDerWaalsContact O-NH1 3.1Å; R215-R224 PolarHBondContact O-NH1 2.98Å; R215-R224 PolarHBondContact O-NH2 3.47Å; V216-R224 HydrophobicContact CG2-CB 3.92Å; D220-R224 PolarHBondContact O-N 3.33Å; I221-R224 CarbonylContact O-C 3.54Å; I221-R224 WeakPolarHBondContact O-CA 3.26Å; I221-R224 WeakPolarHBondContact O-CB 3.16Å; I221-R224 PolarHBondContact O-N 3.47Å; I221-R224 VanDerWaalsContact O-N 3.1Å; D222-R224 VanDerWaalsContact C-N 3.32Å; D222-R224 PolarHBondContact O-N 2.92Å; R224-K226 VanDerWaalsContact C-N 3.33Å; R224-K226 PolarHBondContact O-N 3.16Å; R224-Q227 PolarHBondContact O-N 3.12Å; R224-L228 HydrophobicContact CG-CD1 3.98Å; R224-L228 HydrophobicContact CG-CG 4.34Å; R224-L228 WeakPolarHBondContact O-CG 3.42Å; R224-L228 PolarHBondContact O-N 2.95Å; R224-Y511 HydrophobicContact CG-CD1 4.49Å; R224-Y511 HydrophobicContact CG-CE1 3.95Å
225	V	88.6	Confident	74.2	Confident	10 Å²	10	53.4 Å²	53.4	6%	0.061	28%	0.282	C	S	.	.	H	α-helix	trans	-57.3	-48.4	175.7	174.9	0	0	0	0	110.3	I221 D222 Q227 L228 D229 F247 Y511 L512	I221-V225 WeakPolarHBondContact O-CG2 3.35Å; I221-V225 PolarHBondContact O-N 3.45Å; D222-V225 PolarHBondContact O-N 3.49Å; V225-Q227 VanDerWaalsContact C-N 3.33Å; V225-Q227 PolarHBondContact O-N 3.18Å; V225-L228 PolarHBondContact O-N 2.66Å; V225-D229 PolarHBondContact O-N 2.98Å; V225-F247 HydrophobicContact CG1-CZ 4.24Å; V225-Y511 HydrophobicContact CG2-CD1 4.32Å; V225-L512 HydrophobicContact CG1-CD2 3.73Å
226	K	87.1	Confident	72.3	Confident	118 Å²	118	56.8 Å²	56.8	51%	0.513	31%	0.305	S	S	.	.	H	α-helix	trans	-58.4	-43.3	177.1	-72.5	166.5	176.1	159.1	0	112.1	D222 S223 R224 D229 L230	D222-K226 WeakPolarHBondContact O-CG 3.38Å; D222-K226 PolarHBondContact O-N 2.98Å; D222-K226 VanDerWaalsContact OD2-CE 3.26Å; D222-K226 WeakPolarHBondContact OD2-CE 3.46Å; D222-K226 IonicContact OD2-NZ 2.73Å; D222-K226 PolarHBondContact OD2-NZ 3.07Å; S223-K226 PolarHBondContact O-N 3.2Å; R224-K226 VanDerWaalsContact C-N 3.33Å; R224-K226 PolarHBondContact O-N 3.16Å; K226-D229 PolarHBondContact O-N 2.69Å; K226-L230 WeakPolarHBondContact O-CB 3.31Å; K226-L230 WeakPolarHBondContact O-CD1 3.33Å; K226-L230 WeakPolarHBondContact O-CG 3.4Å; K226-L230 PolarHBondContact O-N 3.3Å
227	Q	81.8	Confident	70.1	Confident	35 Å²	35	66.5 Å²	66.5	16%	0.164	35%	0.35	C	S	.	.	H	α-helix	trans	-63.7	-41.5	177.7	-73.4	176	-14.2	0	0	113.5	T107 S223 R224 V225 D229 T231	T107-Q227 VanDerWaalsContact CB-NE2 3.34Å; T107-Q227 PolarHBondContact O-NE2 3.43Å; T107-Q227 PolarHBondContact O-OE1 3.37Å; T107-Q227 PolarHBondContact OG1-NE2 2.94Å; S223-Q227 WeakPolarHBondContact O-CG 3.33Å; S223-Q227 PolarHBondContact O-N 3.2Å; R224-Q227 PolarHBondContact O-N 3.12Å; V225-Q227 VanDerWaalsContact C-N 3.33Å; V225-Q227 PolarHBondContact O-N 3.18Å; Q227-D229 VanDerWaalsContact C-N 3.27Å; Q227-D229 PolarHBondContact O-N 2.96Å; Q227-T231 PolarHBondContact O-N 2.85Å; Q227-T231 PolarHBondContact O-OG1 3.02Å
228	L	82.7	Confident	68.1	Low	2 Å²	2	69.4 Å²	69.4	1%	0.01	38%	0.38	C	S	.	.	H	α-helix	trans	-71.4	-24.4	178.2	-66.2	176.7	0	0	0	112.2	R224 V225 T231 G246 F247 E250 Y511	R224-L228 HydrophobicContact CG-CD1 3.98Å; R224-L228 HydrophobicContact CG-CG 4.34Å; R224-L228 WeakPolarHBondContact O-CG 3.42Å; R224-L228 PolarHBondContact O-N 2.95Å; V225-L228 PolarHBondContact O-N 2.66Å; L228-T231 PolarHBondContact O-OG1 2.87Å; L228-G246 WeakPolarHBondContact O-CA 3.27Å; L228-F247 HydrophobicContact CB-CD1 4.13Å; L228-F247 HydrophobicContact CB-CD2 3.58Å; L228-F247 HydrophobicContact CB-CE1 3.99Å; L228-F247 HydrophobicContact CB-CE2 3.43Å; L228-F247 VanDerWaalsContact CB-CE2 3.43Å; L228-F247 HydrophobicContact CB-CG 3.93Å; L228-F247 HydrophobicContact CB-CZ 3.65Å; L228-F247 HydrophobicContact CD1-CD1 3.84Å; L228-F247 HydrophobicContact CD1-CE1 3.53Å; L228-F247 HydrophobicContact CD1-CG 4.45Å; L228-F247 HydrophobicContact CD1-CZ 3.91Å; L228-F247 HydrophobicContact CG-CE1 4.42Å; L228-F247 HydrophobicContact CG-CZ 4.43Å; L228-E250 HydrophobicContact CD2-CG 4.26Å; L228-Y511 HydrophobicContact CD1-CD1 4.24Å; L228-Y511 HydrophobicContact CD1-CE1 3.78Å
229	D	80.8	Confident	65.8	Low	57 Å²	57	79.2 Å²	79.2	31%	0.305	43%	0.426	S	S	.	.	H	α-helix	trans	-79.4	-43.2	171.5	-85.2	-19.9	0	0	0	112.5	V225 K226 Q227 T231 S232 F247 K508	V225-D229 PolarHBondContact O-N 2.98Å; K226-D229 PolarHBondContact O-N 2.69Å; Q227-D229 VanDerWaalsContact C-N 3.27Å; Q227-D229 PolarHBondContact O-N 2.96Å; D229-T231 PolarHBondContact O-N 3.3Å; D229-S232 PolarHBondContact O-N 3.34Å; D229-S232 PolarHBondContact O-OG 3.16Å; D229-F247 VanDerWaalsContact OD1-CE2 3.27Å; D229-F247 WeakPolarHBondContact OD1-CE2 3.34Å; D229-K508 VanDerWaalsContact CG-NZ 3.3Å; D229-K508 WeakPolarHBondContact OD1-CE 3.41Å; D229-K508 IonicContact OD1-NZ 2.71Å; D229-K508 PolarHBondContact OD1-NZ 3.05Å; D229-K508 IonicContact OD2-NZ 2.81Å; D229-K508 PolarHBondContact OD2-NZ 2.92Å
230	L	68.2	Low	63.5	Low	119 Å²	119	82.6 Å²	82.6	62%	0.623	46%	0.463	S	S	*	.	H	α-helix	trans	-62.4	-25.6	-178.3	-76.2	166.2	0	0	0	114.2	K226 S232 D233	K226-L230 WeakPolarHBondContact O-CB 3.31Å; K226-L230 WeakPolarHBondContact O-CD1 3.33Å; K226-L230 WeakPolarHBondContact O-CG 3.4Å; K226-L230 PolarHBondContact O-N 3.3Å; L230-S232 PolarHBondContact O-N 3.38Å; L230-D233 PolarHBondContact O-N 2.8Å
231	T	55.2	Low	61.3	Low	45 Å²	45	88 Å²	88	28%	0.276	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-71.3	-17.3	-177.8	28.1	0	0	0	0	112.8	Q227 L228 D229 D233 A245 G246	Q227-T231 PolarHBondContact O-N 2.85Å; Q227-T231 PolarHBondContact O-OG1 3.02Å; L228-T231 PolarHBondContact O-OG1 2.87Å; D229-T231 PolarHBondContact O-N 3.3Å; T231-D233 PolarHBondContact O-N 3.47Å; T231-A245 WeakPolarHBondContact O-CB 3.36Å; T231-G246 WeakPolarHBondContact OG1-CA 3.28Å; T231-G246 PolarHBondContact OG1-N 3.46Å
232	S	49.5	Very low	59.1	Low	57 Å²	57	97.4 Å²	97.4	40%	0.399	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-69.8	-13.2	175.7	65	0	0	0	0	115	D229 L230	D229-S232 PolarHBondContact O-N 3.34Å; D229-S232 PolarHBondContact O-OG 3.16Å; L230-S232 PolarHBondContact O-N 3.38Å
233	D	40.7	Very low	57.1	Low	130 Å²	130	97.2 Å²	97.2	70%	0.695	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-107.6	4	-169.4	-82.6	-24.5	0	0	0	115.8	L230 T231 P235	L230-D233 PolarHBondContact O-N 2.8Å; T231-D233 PolarHBondContact O-N 3.47Å; D233-P235 WeakPolarHBondContact O-CD 3.39Å
234	K	41.6	Very low	55.6	Low	165 Å²	165	100.7 Å²	100.7	72%	0.717	54%	0.539	S	S	*	.			trans	-82.1	111.6	173.3	-77.4	-171.2	179	179.9	0	110.6	L236 S243	K234-L236 PolarHBondContact O-N 3.31Å; K234-S243 PolarHBondContact O-OG 3.41Å
235	P	36.9	Very low	54.3	Low	122 Å²	122	101.2 Å²	101.2	79%	0.792	55%	0.546	S	S	*	.			trans	-74.4	119.4	172.5	0.3	18.7	0	0	0	107.7	D233	D233-P235 WeakPolarHBondContact O-CD 3.39Å
236	L	42.4	Very low	53.9	Low	147 Å²	147	100.8 Å²	100.8	77%	0.77	54%	0.544	S	S	*	.			trans	-71.6	135.2	152.9	-80.4	153.4	0	0	0	106.4	K234 G238	K234-L236 PolarHBondContact O-N 3.31Å; L236-G238 VanDerWaalsContact C-N 3.34Å; L236-G238 PolarHBondContact O-N 3.13Å
237	E	38	Very low	53.6	Low	211 Å²	211	95.3 Å²	95.3	99%	0.986	52%	0.52	S	S	*	.	S	Bend	trans	-60.1	96.9	171.3	-69.9	-178.6	160.6	0	0	108.8
238	G	37.9	Very low	53.5	Low	64 Å²	64	97.5 Å²	97.5	66%	0.66	53%	0.527	S	S	*	.	S	Bend	trans	167.4	121.7	-178.9	0	0	0	0	0	110.9	L236	L236-G238 VanDerWaalsContact C-N 3.34Å; L236-G238 PolarHBondContact O-N 3.13Å
239	E	35.5	Very low	53.1	Low	206 Å²	206	100.5 Å²	100.5	96%	0.963	54%	0.541	S	S	*	.	S	Bend	trans	-56.5	130.1	-169.5	-61.8	175.5	149.8	0	0	114.4
240	G	35	Very low	53.2	Low	85 Å²	85	98.1 Å²	98.1	88%	0.876	53%	0.528	S	S	*	.	S	Bend	trans	106.3	-11.7	140.8	0	0	0	0	0	120.4
241	E	38.1	Very low	53.8	Low	165 Å²	165	93.3 Å²	93.3	77%	0.771	50%	0.502	S	S	*	.			trans	-108.2	121.4	174.8	-77.5	-167	141.1	0	0	111.4	S243	E241-S243 PolarHBondContact O-N 2.85Å; E241-S243 VanDerWaalsContact O-N 3.1Å
242	K	42.2	Very low	54.6	Low	200 Å²	200	93 Å²	93	87%	0.87	50%	0.499	S	S	*	.			trans	-52.8	121	165.1	-73.9	-175.2	176.8	-174.3	0	107.7	K244	K242-K244 PolarHBondContact O-N 3.44Å
243	S	43.8	Very low	55.8	Low	42 Å²	42	92.4 Å²	92.4	29%	0.294	50%	0.497	S	S	.	.			trans	-58.8	106.9	-177.1	-135	0	0	0	0	109.3	K234 E241 A245	K234-S243 PolarHBondContact O-OG 3.41Å; E241-S243 PolarHBondContact O-N 2.85Å; E241-S243 VanDerWaalsContact O-N 3.1Å; S243-A245 PolarHBondContact O-N 3.37Å; S243-A245 VanDerWaalsContact O-N 3.08Å
244	K	55.4	Low	57.4	Low	121 Å²	121	86.6 Å²	86.6	53%	0.526	47%	0.466	S	S	.	.			trans	-76.8	93.5	178.8	-58.9	179.7	-173.7	160.1	0	108.4	K242 W248	K242-K244 PolarHBondContact O-N 3.44Å; K244-W248 HydrophobicContact CB-CB 4.22Å; K244-W248 HydrophobicContact CB-CD2 3.41Å; K244-W248 VanDerWaalsContact CB-CD2 3.41Å; K244-W248 HydrophobicContact CB-CE3 3.4Å; K244-W248 HydrophobicContact CB-CG 3.74Å; K244-W248 HydrophobicContact CB-CH2 4.43Å; K244-W248 HydrophobicContact CB-CZ2 4.45Å; K244-W248 HydrophobicContact CB-CZ3 3.93Å; K244-W248 HydrophobicContact CD-CD2 3.9Å; K244-W248 VanDerWaalsContact CD-CE2 3.49Å; K244-W248 HydrophobicContact CD-CE3 4.32Å; K244-W248 HydrophobicContact CD-CG 4.4Å; K244-W248 HydrophobicContact CD-CH2 4.05Å; K244-W248 HydrophobicContact CD-CZ2 3.59Å; K244-W248 HydrophobicContact CD-CZ3 4.38Å; K244-W248 HydrophobicContact CG-CD2 4.19Å; K244-W248 HydrophobicContact CG-CE3 4.5Å; K244-W248 HydrophobicContact CG-CG 4.41Å
245	A	59.6	Low	58.8	Low	25 Å²	25	81.7 Å²	81.7	21%	0.207	45%	0.445	C	S	.	.			trans	-142.8	159	-170.9	0	0	0	0	0	111.8	T231 S243 F247	T231-A245 WeakPolarHBondContact O-CB 3.36Å; S243-A245 PolarHBondContact O-N 3.37Å; S243-A245 VanDerWaalsContact O-N 3.08Å; A245-F247 PolarHBondContact O-N 3.01Å
246	G	78.9	Confident	60.3	Low	0 Å²	0	82.2 Å²	82.2	0%	0	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	-109.5	-177.7	0	0	0	0	0	112.6	L228 T231 W248 E249 E250	L228-G246 WeakPolarHBondContact O-CA 3.27Å; T231-G246 WeakPolarHBondContact OG1-CA 3.28Å; T231-G246 PolarHBondContact OG1-N 3.46Å; G246-W248 VanDerWaalsContact C-N 3.31Å; G246-W248 PolarHBondContact O-N 2.83Å; G246-E249 PolarHBondContact O-N 2.95Å; G246-E250 PolarHBondContact O-N 2.76Å; G246-E250 VanDerWaalsContact O-N 3.09Å
247	F	82.6	Confident	61.4	Low	4 Å²	4	79 Å²	79	2%	0.018	42%	0.417	C	S	.	.	H	α-helix	trans	-56.8	-43.2	179.5	-77	-69.5	0	0	0	112.7	V225 L228 D229 A245 F251 E504 Y507 K508 Y511	V225-F247 HydrophobicContact CG1-CZ 4.24Å; L228-F247 HydrophobicContact CB-CD1 4.13Å; L228-F247 HydrophobicContact CB-CD2 3.58Å; L228-F247 HydrophobicContact CB-CE1 3.99Å; L228-F247 HydrophobicContact CB-CE2 3.43Å; L228-F247 VanDerWaalsContact CB-CE2 3.43Å; L228-F247 HydrophobicContact CB-CG 3.93Å; L228-F247 HydrophobicContact CB-CZ 3.65Å; L228-F247 HydrophobicContact CD1-CD1 3.84Å; L228-F247 HydrophobicContact CD1-CE1 3.53Å; L228-F247 HydrophobicContact CD1-CG 4.45Å; L228-F247 HydrophobicContact CD1-CZ 3.91Å; L228-F247 HydrophobicContact CG-CE1 4.42Å; L228-F247 HydrophobicContact CG-CZ 4.43Å; D229-F247 VanDerWaalsContact OD1-CE2 3.27Å; D229-F247 WeakPolarHBondContact OD1-CE2 3.34Å; A245-F247 PolarHBondContact O-N 3.01Å; F247-F251 VanDerWaalsContact O-CB 3.27Å; F247-F251 WeakPolarHBondContact O-CB 3.48Å; F247-F251 PolarHBondContact O-N 3.29Å; F247-E504 HydrophobicContact CB-CG 4.42Å; F247-Y507 AromaticContact CD1-CD1 3.95Å; F247-Y507 HydrophobicContact CD1-CD1 3.95Å; F247-Y507 AromaticContact CD1-CE1 3.85Å; F247-Y507 HydrophobicContact CD1-CE1 3.85Å; F247-K508 HydrophobicContact CD1-CB 4.03Å; F247-K508 HydrophobicContact CD1-CG 4.3Å; F247-K508 HydrophobicContact CD2-CD 3.93Å; F247-K508 HydrophobicContact CD2-CG 4.16Å; F247-K508 HydrophobicContact CE1-CB 4.25Å; F247-K508 HydrophobicContact CE1-CG 4.16Å; F247-K508 HydrophobicContact CE2-CD 3.99Å; F247-K508 HydrophobicContact CE2-CG 4.01Å; F247-K508 HydrophobicContact CG-CB 4.18Å; F247-K508 HydrophobicContact CG-CD 4.39Å; F247-K508 HydrophobicContact CG-CG 4.3Å; F247-K508 HydrophobicContact CZ-CD 4.5Å; F247-K508 HydrophobicContact CZ-CG 4.01Å; F247-Y511 HydrophobicContact CD1-CD2 4.31Å; F247-Y511 HydrophobicContact CE1-CD1 4.15Å; F247-Y511 AromaticContact CE1-CD2 3.68Å; F247-Y511 HydrophobicContact CE1-CD2 3.68Å; F247-Y511 HydrophobicContact CE1-CE2 4.21Å; F247-Y511 AromaticContact CE1-CG 3.64Å; F247-Y511 HydrophobicContact CE1-CG 3.64Å; F247-Y511 HydrophobicContact CZ-CG 4.34Å
248	W	78.1	Confident	62.7	Low	80 Å²	80	71.7 Å²	71.7	30%	0.303	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-42	178.2	-176.8	89.9	0	0	0	112	K244 G246 F251 D252 E504	K244-W248 HydrophobicContact CB-CB 4.22Å; K244-W248 HydrophobicContact CB-CD2 3.41Å; K244-W248 VanDerWaalsContact CB-CD2 3.41Å; K244-W248 HydrophobicContact CB-CE3 3.4Å; K244-W248 HydrophobicContact CB-CG 3.74Å; K244-W248 HydrophobicContact CB-CH2 4.43Å; K244-W248 HydrophobicContact CB-CZ2 4.45Å; K244-W248 HydrophobicContact CB-CZ3 3.93Å; K244-W248 HydrophobicContact CD-CD2 3.9Å; K244-W248 VanDerWaalsContact CD-CE2 3.49Å; K244-W248 HydrophobicContact CD-CE3 4.32Å; K244-W248 HydrophobicContact CD-CG 4.4Å; K244-W248 HydrophobicContact CD-CH2 4.05Å; K244-W248 HydrophobicContact CD-CZ2 3.59Å; K244-W248 HydrophobicContact CD-CZ3 4.38Å; K244-W248 HydrophobicContact CG-CD2 4.19Å; K244-W248 HydrophobicContact CG-CE3 4.5Å; K244-W248 HydrophobicContact CG-CG 4.41Å; G246-W248 VanDerWaalsContact C-N 3.31Å; G246-W248 PolarHBondContact O-N 2.83Å; W248-F251 PolarHBondContact O-N 2.9Å; W248-D252 HydrophobicContact CD2-CB 4.23Å; W248-D252 HydrophobicContact CE3-CB 4.2Å; W248-D252 HydrophobicContact CH2-CB 4.04Å; W248-D252 HydrophobicContact CZ2-CB 4.05Å; W248-D252 HydrophobicContact CZ3-CB 4.11Å; W248-D252 WeakPolarHBondContact O-CB 3.37Å; W248-D252 PolarHBondContact O-N 2.72Å; W248-E504 PolarHBondContact N-OE1 2.94Å
249	E	75.8	Confident	63.5	Low	66 Å²	66	72.8 Å²	72.8	31%	0.308	39%	0.386	S	S	.	.	H	α-helix	trans	-63.8	-46.9	-179.5	-175.1	-167.6	-176.4	0	0	111.1	R109 G246 F251 D252 A253	R109-E249 IonicContact NH1-OE2 2.9Å; R109-E249 PolarHBondContact NH1-OE2 2.8Å; R109-E249 IonicContact NH2-OE2 3.11Å; G246-E249 PolarHBondContact O-N 2.95Å; E249-F251 VanDerWaalsContact C-N 3.35Å; E249-F251 PolarHBondContact O-N 3.4Å; E249-D252 PolarHBondContact O-N 2.79Å; E249-A253 WeakPolarHBondContact O-CB 3.48Å; E249-A253 PolarHBondContact O-N 3.33Å
250	E	82.6	Confident	64.5	Low	7 Å²	7	71 Å²	71	3%	0.033	38%	0.375	C	S	.	.	H	α-helix	trans	-63.8	-41.3	176.8	-65.9	-166.7	170.9	0	0	111.6	R109 T214 L228 G246 L254 Y507 Y511	R109-E250 IonicContact CZ-OE1 3.46Å; R109-E250 IonicContact NE-OE1 3.31Å; R109-E250 PolarHBondContact NE-OE1 3.01Å; R109-E250 IonicContact NH2-OE1 3.8Å; R109-E250 PolarHBondContact NH2-OE1 3.1Å; T214-E250 HydrophobicContact CG2-CG 4.47Å; L228-E250 HydrophobicContact CD2-CG 4.26Å; G246-E250 PolarHBondContact O-N 2.76Å; G246-E250 VanDerWaalsContact O-N 3.09Å; E250-L254 PolarHBondContact O-N 3.17Å; E250-L254 VanDerWaalsContact O-N 3.16Å; E250-Y507 HydrophobicContact CB-CE1 4.05Å; E250-Y507 VanDerWaalsContact CB-OH 3.26Å; E250-Y507 WeakPolarHBondContact CB-OH 3.14Å; E250-Y507 PolarHBondContact OE2-OH 2.99Å; E250-Y511 PolarHBondContact OE2-OH 3.22Å
251	F	79.1	Confident	65.9	Low	18 Å²	18	69.4 Å²	69.4	8%	0.079	35%	0.348	C	S	.	.	H	α-helix	trans	-68.5	-41.2	178.1	-173.8	-109	0	0	0	112.5	F247 W248 E249 L254 Q255 E504 Y507	F247-F251 VanDerWaalsContact O-CB 3.27Å; F247-F251 WeakPolarHBondContact O-CB 3.48Å; F247-F251 PolarHBondContact O-N 3.29Å; W248-F251 PolarHBondContact O-N 2.9Å; E249-F251 VanDerWaalsContact C-N 3.35Å; E249-F251 PolarHBondContact O-N 3.4Å; F251-L254 WeakPolarHBondContact O-CB 3.28Å; F251-L254 PolarHBondContact O-N 2.83Å; F251-Q255 HydrophobicContact CD1-CG 4.32Å; F251-Q255 HydrophobicContact CE1-CG 3.98Å; F251-Q255 HydrophobicContact CZ-CG 4.27Å; F251-Q255 WeakPolarHBondContact O-CG 3.34Å; F251-Q255 PolarHBondContact O-N 3.37Å; F251-E504 HydrophobicContact CD1-CB 3.97Å; F251-E504 HydrophobicContact CE1-CB 4.45Å; F251-E504 HydrophobicContact CG-CB 4.38Å; F251-Y507 HydrophobicContact CB-CD1 4.02Å; F251-Y507 HydrophobicContact CB-CE1 4.39Å; F251-Y507 HydrophobicContact CB-CG 4.15Å; F251-Y507 HydrophobicContact CD2-CD1 4.44Å; F251-Y507 AromaticContact CD2-CD2 3.87Å; F251-Y507 HydrophobicContact CD2-CD2 3.87Å; F251-Y507 AromaticContact CD2-CG 3.73Å; F251-Y507 HydrophobicContact CD2-CG 3.73Å; F251-Y507 HydrophobicContact CG-CG 4.29Å
252	D	73.8	Confident	67.4	Low	38 Å²	38	71.1 Å²	71.1	20%	0.203	35%	0.353	C	S	.	.	H	α-helix	trans	-64.9	-39.6	176.8	-177.4	64.2	0	0	0	111.6	W248 E249 L254 Q255 K256	W248-D252 HydrophobicContact CD2-CB 4.23Å; W248-D252 HydrophobicContact CE3-CB 4.2Å; W248-D252 HydrophobicContact CH2-CB 4.04Å; W248-D252 HydrophobicContact CZ2-CB 4.05Å; W248-D252 HydrophobicContact CZ3-CB 4.11Å; W248-D252 WeakPolarHBondContact O-CB 3.37Å; W248-D252 PolarHBondContact O-N 2.72Å; E249-D252 PolarHBondContact O-N 2.79Å; D252-L254 VanDerWaalsContact C-N 3.29Å; D252-L254 PolarHBondContact O-N 2.86Å; D252-Q255 WeakPolarHBondContact O-CB 3.48Å; D252-Q255 PolarHBondContact O-N 2.71Å; D252-K256 WeakPolarHBondContact O-CG 3.29Å; D252-K256 PolarHBondContact O-N 3.45Å; D252-K256 WeakPolarHBondContact OD2-CE 3.3Å; D252-K256 IonicContact OD2-NZ 3.44Å; D252-K256 PolarHBondContact OD2-NZ 3.37Å
253	A	73.9	Confident	69.4	Low	44 Å²	44	64.3 Å²	64.3	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-58.1	-42.9	172	0	0	0	0	0	111.5	E249 K256 M257	E249-A253 WeakPolarHBondContact O-CB 3.48Å; E249-A253 PolarHBondContact O-N 3.33Å; A253-K256 PolarHBondContact O-N 3.23Å; A253-M257 WeakPolarHBondContact O-CG 3.34Å; A253-M257 PolarHBondContact O-N 3.13Å
254	L	74.7	Confident	71.5	Confident	8 Å²	8	64 Å²	64	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-65	-38.5	176	-169	72.9	0	0	0	112.3	E250 F251 D252 M257 E258 P487 I490 Q491	E250-L254 PolarHBondContact O-N 3.17Å; E250-L254 VanDerWaalsContact O-N 3.16Å; F251-L254 WeakPolarHBondContact O-CB 3.28Å; F251-L254 PolarHBondContact O-N 2.83Å; D252-L254 VanDerWaalsContact C-N 3.29Å; D252-L254 PolarHBondContact O-N 2.86Å; L254-M257 PolarHBondContact O-N 3.06Å; L254-E258 PolarHBondContact O-N 3.34Å; L254-P487 HydrophobicContact CD1-CB 4.5Å; L254-I490 HydrophobicContact CD2-CB 3.86Å; L254-I490 HydrophobicContact CD2-CD1 4.36Å; L254-I490 HydrophobicContact CD2-CG2 3.53Å; L254-Q491 HydrophobicContact CD1-CB 3.96Å
255	Q	70.4	Confident	73.2	Confident	62 Å²	62	62.8 Å²	62.8	29%	0.29	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-40.9	174.1	-70.6	-50.8	112.7	0	0	112.1	F251 D252 M257 E258	F251-Q255 HydrophobicContact CD1-CG 4.32Å; F251-Q255 HydrophobicContact CE1-CG 3.98Å; F251-Q255 HydrophobicContact CZ-CG 4.27Å; F251-Q255 WeakPolarHBondContact O-CG 3.34Å; F251-Q255 PolarHBondContact O-N 3.37Å; D252-Q255 WeakPolarHBondContact O-CB 3.48Å; D252-Q255 PolarHBondContact O-N 2.71Å; Q255-M257 VanDerWaalsContact C-N 3.27Å; Q255-M257 PolarHBondContact O-N 3.02Å; Q255-E258 PolarHBondContact NE2-OE2 2.98Å; Q255-E258 VanDerWaalsContact O-CB 3.31Å; Q255-E258 WeakPolarHBondContact O-CB 3.47Å; Q255-E258 PolarHBondContact O-N 3.26Å; Q255-E258 VanDerWaalsContact O-N 3.15Å
256	K	67.9	Low	74.8	Confident	133 Å²	133	67.6 Å²	67.6	58%	0.578	33%	0.332	S	S	*	.	H	α-helix	trans	-64.9	-30.4	177.1	-73.3	165.8	174.2	160	0	112.6	D252 A253	D252-K256 WeakPolarHBondContact O-CG 3.29Å; D252-K256 PolarHBondContact O-N 3.45Å; D252-K256 WeakPolarHBondContact OD2-CE 3.3Å; D252-K256 IonicContact OD2-NZ 3.44Å; D252-K256 PolarHBondContact OD2-NZ 3.37Å; A253-K256 PolarHBondContact O-N 3.23Å
257	M	67	Low	75.5	Confident	79 Å²	79	69.1 Å²	69.1	39%	0.389	34%	0.339	S	S	.	.	H	α-helix	trans	-70.9	-30	174.2	-65.6	-173.5	-168	0	0	112.7	A253 L254 Q255 A259 K260	A253-M257 WeakPolarHBondContact O-CG 3.34Å; A253-M257 PolarHBondContact O-N 3.13Å; L254-M257 PolarHBondContact O-N 3.06Å; Q255-M257 VanDerWaalsContact C-N 3.27Å; Q255-M257 PolarHBondContact O-N 3.02Å; M257-A259 PolarHBondContact O-N 3.01Å; M257-K260 WeakPolarHBondContact O-CB 3.32Å; M257-K260 PolarHBondContact O-N 2.81Å
258	E	64.6	Low	75.8	Confident	59 Å²	59	69 Å²	69	28%	0.276	34%	0.339	S	S	.	.	H	α-helix	trans	-59.6	-34.3	-179.9	-168.6	170.7	-161.5	0	0	112.3	L254 Q255 K260 V261 R494 G499	L254-E258 PolarHBondContact O-N 3.34Å; Q255-E258 PolarHBondContact NE2-OE2 2.98Å; Q255-E258 VanDerWaalsContact O-CB 3.31Å; Q255-E258 WeakPolarHBondContact O-CB 3.47Å; Q255-E258 PolarHBondContact O-N 3.26Å; Q255-E258 VanDerWaalsContact O-N 3.15Å; E258-K260 PolarHBondContact O-N 3.01Å; E258-V261 PolarHBondContact O-N 3.32Å; E258-R494 IonicContact OE2-NH1 3.25Å; E258-G499 WeakPolarHBondContact OE1-CA 3.26Å; E258-G499 PolarHBondContact OE1-N 2.81Å
259	A	55.5	Low	76.4	Confident	87 Å²	87	71 Å²	71	72%	0.719	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.7	175.8	0	0	0	0	0	113.8	M257	M257-A259 PolarHBondContact O-N 3.01Å
260	K	56	Low	77.3	Confident	168 Å²	168	72.4 Å²	72.4	73%	0.73	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-15.2	178.8	-58	-178.6	-179.3	178.8	0	112.8	M257 E258 K262	M257-K260 WeakPolarHBondContact O-CB 3.32Å; M257-K260 PolarHBondContact O-N 2.81Å; E258-K260 PolarHBondContact O-N 3.01Å; K260-K262 PolarHBondContact O-N 3.07Å; K260-K262 VanDerWaalsContact O-N 3.12Å
261	V	62.9	Low	77.8	Confident	52 Å²	52	77 Å²	77	32%	0.315	39%	0.385	S	S	.	.			trans	-79.3	97	-178.3	-176.5	0	0	0	0	109.9	E258 K263 F285	E258-V261 PolarHBondContact O-N 3.32Å; V261-K263 HydrophobicContact CG1-CB 4.49Å; V261-K263 HydrophobicContact CG1-CD 4.25Å; V261-K263 HydrophobicContact CG1-CG 3.91Å; V261-K263 PolarHBondContact O-N 3.39Å; V261-F285 HydrophobicContact CG1-CZ 4.26Å
262	K	70.8	Confident	78.6	Confident	201 Å²	201	80.6 Å²	80.6	87%	0.874	40%	0.402	S	S	*	.			trans	-97.5	77.9	176.4	-64.7	-176.9	-178.2	-179.8	0	110.7	K260	K260-K262 PolarHBondContact O-N 3.07Å; K260-K262 VanDerWaalsContact O-N 3.12Å
263	K	83.8	Confident	79.6	Confident	57 Å²	57	78.8 Å²	78.8	25%	0.248	39%	0.392	C	S	.	.			trans	-107.9	141.7	175.3	-68.5	-165.2	175.2	-153.2	0	112	V261 F285 E495	V261-K263 HydrophobicContact CG1-CB 4.49Å; V261-K263 HydrophobicContact CG1-CD 4.25Å; V261-K263 HydrophobicContact CG1-CG 3.91Å; V261-K263 PolarHBondContact O-N 3.39Å; K263-F285 HydrophobicContact CB-CD1 3.45Å; K263-F285 VanDerWaalsContact CB-CD1 3.45Å; K263-F285 HydrophobicContact CB-CD2 4.43Å; K263-F285 HydrophobicContact CB-CE1 3.62Å; K263-F285 HydrophobicContact CB-CG 3.91Å; K263-F285 HydrophobicContact CB-CZ 4.17Å; K263-F285 HydrophobicContact CD-CD1 4.4Å; K263-F285 HydrophobicContact CD-CD2 3.88Å; K263-F285 HydrophobicContact CD-CE2 4.08Å; K263-F285 HydrophobicContact CD-CG 4.06Å; K263-F285 HydrophobicContact CD-CZ 4.43Å; K263-E495 WeakPolarHBondContact CD-O 3.4Å; K263-E495 WeakPolarHBondContact CE-O 3.32Å; K263-E495 PolarHBondContact NZ-O 2.77Å
264	S	88.6	Confident	80.4	Confident	36 Å²	36	82.8 Å²	82.8	25%	0.252	40%	0.401	S	S	.	.			trans	-72.4	144.4	-179.9	-175.8	0	0	0	0	111.5	E266 F285 N286	S264-E266 VanDerWaalsContact OG-CG 3.31Å; S264-E266 WeakPolarHBondContact OG-CG 3.5Å; S264-E266 PolarHBondContact OG-N 3.01Å; S264-E266 PolarHBondContact OG-OE1 3.05Å; S264-F285 WeakPolarHBondContact O-CA 2.92Å; S264-N286 PolarHBondContact O-N 2.99Å; S264-N286 PolarHBondContact OG-ND2 3.28Å; S264-N286 VanDerWaalsContact OG-ND2 3.16Å
265	R	91	Very high	81.4	Confident	95 Å²	95	86.3 Å²	86.3	36%	0.358	43%	0.427	S	S	.	.			trans	-135.1	20.5	179.3	-64.7	169.8	-72.4	-177.8	-1.2	111	E267 G268 Q269 L283 F285 N286	R265-E267 VanDerWaalsContact C-N 3.27Å; R265-E267 PolarHBondContact O-N 3.29Å; R265-G268 PolarHBondContact O-N 3.12Å; R265-Q269 WeakPolarHBondContact O-CG 3.35Å; R265-Q269 PolarHBondContact O-N 3.16Å; R265-L283 HydrophobicContact CB-CB 4.13Å; R265-L283 HydrophobicContact CB-CD1 4.47Å; R265-L283 HydrophobicContact CG-CB 4.48Å; R265-F285 HydrophobicContact CG-CD1 3.66Å; R265-F285 HydrophobicContact CG-CE1 4.14Å; R265-N286 WeakPolarHBondContact CA-OD1 2.99Å
266	E	92.1	Very high	82.6	Confident	125 Å²	125	84.9 Å²	84.9	58%	0.584	42%	0.42	S	S	*	.	H	α-helix	trans	-59.7	-35.6	-170.7	-73.3	159.9	-133.3	0	0	112.6	S264 G268 Q269 R270 N286	S264-E266 VanDerWaalsContact OG-CG 3.31Å; S264-E266 WeakPolarHBondContact OG-CG 3.5Å; S264-E266 PolarHBondContact OG-N 3.01Å; S264-E266 PolarHBondContact OG-OE1 3.05Å; E266-G268 VanDerWaalsContact C-N 3.3Å; E266-G268 PolarHBondContact O-N 3.39Å; E266-Q269 WeakPolarHBondContact O-CB 3.39Å; E266-Q269 PolarHBondContact O-N 2.92Å; E266-R270 PolarHBondContact O-N 3.34Å; E266-N286 PolarHBondContact N-ND2 3.49Å; E266-N286 PolarHBondContact N-OD1 3.03Å
267	E	93.3	Very high	83.8	Confident	32 Å²	32	79.3 Å²	79.3	15%	0.15	40%	0.396	C	S	.	.	H	α-helix	trans	-62	-39.5	179.3	-69	-58.2	139.1	0	0	111.7	R265 Q269 R270 N273 N286 Y304	R265-E267 VanDerWaalsContact C-N 3.27Å; R265-E267 PolarHBondContact O-N 3.29Å; E267-Q269 VanDerWaalsContact C-N 3.27Å; E267-Q269 PolarHBondContact O-N 3.46Å; E267-R270 VanDerWaalsContact CD-NE 3.31Å; E267-R270 PolarHBondContact O-N 3.44Å; E267-R270 IonicContact OE1-CZ 4Å; E267-R270 IonicContact OE1-NE 2.86Å; E267-R270 PolarHBondContact OE1-NE 3.1Å; E267-R270 IonicContact OE1-NH2 3.74Å; E267-R270 PolarHBondContact OE1-NH2 3.25Å; E267-R270 WeakPolarHBondContact OE2-CD 3.48Å; E267-R270 IonicContact OE2-CZ 3.96Å; E267-R270 IonicContact OE2-NE 2.91Å; E267-R270 PolarHBondContact OE2-NE 3.44Å; E267-R270 IonicContact OE2-NH2 3.99Å; E267-N273 PolarHBondContact O-ND2 3.47Å; E267-N286 PolarHBondContact N-OD1 2.86Å; E267-Y304 HydrophobicContact CB-CD2 4.45Å
268	G	90.8	Very high	85.1	Confident	2 Å²	2	77.6 Å²	77.6	2%	0.021	39%	0.385	C	S	.	.	H	α-helix	trans	-73	-17.5	174.8	0	0	0	0	0	114.3	R265 E266 N277 Y304	R265-G268 PolarHBondContact O-N 3.12Å; E266-G268 VanDerWaalsContact C-N 3.3Å; E266-G268 PolarHBondContact O-N 3.39Å; G268-N277 PolarHBondContact O-ND2 2.67Å; G268-Y304 VanDerWaalsContact CA-CE2 3.47Å; G268-Y304 WeakPolarHBondContact CA-OH 3.31Å
269	Q	90	Very high	86.1	Confident	122 Å²	122	78.9 Å²	78.9	57%	0.57	39%	0.388	S	S	*	.	H	α-helix	trans	-88.5	-11.7	179.2	-66.8	177.8	-12.9	0	0	113.3	R265 E266 E267 L283	R265-Q269 WeakPolarHBondContact O-CG 3.35Å; R265-Q269 PolarHBondContact O-N 3.16Å; E266-Q269 WeakPolarHBondContact O-CB 3.39Å; E266-Q269 PolarHBondContact O-N 2.92Å; E267-Q269 VanDerWaalsContact C-N 3.27Å; E267-Q269 PolarHBondContact O-N 3.46Å; Q269-L283 HydrophobicContact CB-CD1 4.48Å; Q269-L283 HydrophobicContact CG-CD1 3.42Å; Q269-L283 VanDerWaalsContact CG-CD1 3.42Å
270	R	93.7	Very high	87.2	Confident	95 Å²	95	81.9 Å²	81.9	36%	0.358	39%	0.385	S	S	.	.	S	Bend	trans	-54	139.9	177.6	-70.1	-174.5	-176.5	-101.7	-1	111.5	E266 E267 E272 N273 K274	E266-R270 PolarHBondContact O-N 3.34Å; E267-R270 VanDerWaalsContact CD-NE 3.31Å; E267-R270 PolarHBondContact O-N 3.44Å; E267-R270 IonicContact OE1-CZ 4Å; E267-R270 IonicContact OE1-NE 2.86Å; E267-R270 PolarHBondContact OE1-NE 3.1Å; E267-R270 IonicContact OE1-NH2 3.74Å; E267-R270 PolarHBondContact OE1-NH2 3.25Å; E267-R270 WeakPolarHBondContact OE2-CD 3.48Å; E267-R270 IonicContact OE2-CZ 3.96Å; E267-R270 IonicContact OE2-NE 2.91Å; E267-R270 PolarHBondContact OE2-NE 3.44Å; E267-R270 IonicContact OE2-NH2 3.99Å; R270-E272 PolarHBondContact O-N 2.97Å; R270-N273 HydrophobicContact CB-CB 4.3Å; R270-N273 PolarHBondContact O-N 2.91Å; R270-N273 VanDerWaalsContact O-N 3.07Å; R270-K274 PolarHBondContact O-N 2.81Å
271	P	94.1	Very high	88.4	Confident	105 Å²	105	79.9 Å²	79.9	68%	0.682	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-52.6	-39.9	178.5	-27.2	35.2	0	0	0	113.5	N273 K274	P271-N273 VanDerWaalsContact C-N 3.32Å; P271-N273 PolarHBondContact O-N 3.34Å; P271-K274 WeakPolarHBondContact O-CB 3.49Å; P271-K274 PolarHBondContact O-N 2.7Å
272	E	95.3	Very high	89.4	Confident	93 Å²	93	79.2 Å²	79.2	44%	0.435	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-66.5	-33.3	-179	-57.7	77.2	-167.4	0	0	112	R270 V300	R270-E272 PolarHBondContact O-N 2.97Å; E272-V300 HydrophobicContact CG-CB 4.43Å; E272-V300 HydrophobicContact CG-CG1 4.42Å
273	N	95.7	Very high	90.3	Very high	0 Å²	0	70 Å²	70	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-89.4	-10.1	-176.8	-68.2	-24.8	0	0	0	113.2	E267 R270 P271 S275 K276 N277 G301 Y304	E267-N273 PolarHBondContact O-ND2 3.47Å; R270-N273 HydrophobicContact CB-CB 4.3Å; R270-N273 PolarHBondContact O-N 2.91Å; R270-N273 VanDerWaalsContact O-N 3.07Å; P271-N273 VanDerWaalsContact C-N 3.32Å; P271-N273 PolarHBondContact O-N 3.34Å; N273-S275 VanDerWaalsContact C-N 3.27Å; N273-S275 PolarHBondContact O-N 2.79Å; N273-K276 WeakPolarHBondContact O-CA 3.47Å; N273-K276 WeakPolarHBondContact O-CB 3.32Å; N273-K276 PolarHBondContact O-N 3.1Å; N273-N277 PolarHBondContact O-N 3.35Å; N273-N277 PolarHBondContact O-ND2 2.94Å; N273-N277 VanDerWaalsContact O-ND2 3.09Å; N273-G301 WeakPolarHBondContact OD1-CA 3.32Å; N273-G301 PolarHBondContact OD1-O 2.9Å; N273-Y304 HydrophobicContact CB-CD1 3.69Å; N273-Y304 HydrophobicContact CB-CD2 4.34Å; N273-Y304 HydrophobicContact CB-CE1 3.86Å; N273-Y304 HydrophobicContact CB-CG 3.93Å; N273-Y304 VanDerWaalsContact CG-CB 3.48Å; N273-Y304 WeakPolarHBondContact ND2-CB 3.45Å; N273-Y304 VanDerWaalsContact ND2-CG 3.34Å; N273-Y304 VanDerWaalsContact OD1-CB 3.25Å; N273-Y304 WeakPolarHBondContact OD1-CB 3.25Å
274	K	91.3	Very high	90.8	Very high	127 Å²	127	67.2 Å²	67.2	55%	0.552	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-58	-38.1	-176.6	-171.1	178.7	176.6	-173.6	0	112.9	R270 P271 K276 N277	R270-K274 PolarHBondContact O-N 2.81Å; P271-K274 WeakPolarHBondContact O-CB 3.49Å; P271-K274 PolarHBondContact O-N 2.7Å; K274-K276 VanDerWaalsContact C-N 3.31Å; K274-N277 PolarHBondContact O-N 3.28Å
275	S	94.6	Very high	91.1	Very high	83 Å²	83	65.9 Å²	65.9	58%	0.58	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-77.5	-14.9	177.7	59.2	0	0	0	0	113.6	N273 N277 L330	N273-S275 VanDerWaalsContact C-N 3.27Å; N273-S275 PolarHBondContact O-N 2.79Å; S275-N277 VanDerWaalsContact C-N 3.31Å; S275-L330 WeakPolarHBondContact O-CD1 3.44Å
276	K	96.8	Very high	91.2	Very high	32 Å²	32	63 Å²	63	14%	0.139	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-84.3	-6.1	174.4	-59.8	-176.7	170.9	-167.8	0	112.4	N273 K274 G301 Y304 Q327 T333 D336	N273-K276 WeakPolarHBondContact O-CA 3.47Å; N273-K276 WeakPolarHBondContact O-CB 3.32Å; N273-K276 PolarHBondContact O-N 3.1Å; K274-K276 VanDerWaalsContact C-N 3.31Å; K276-G301 PolarHBondContact NZ-O 3.49Å; K276-Y304 HydrophobicContact CB-CD1 3.89Å; K276-Y304 HydrophobicContact CB-CE1 3.91Å; K276-Y304 HydrophobicContact CD-CD1 3.75Å; K276-Y304 HydrophobicContact CG-CD1 4.46Å; K276-Y304 PolarHBondContact NZ-O 3.19Å; K276-Q327 PolarHBondContact O-NE2 3.17Å; K276-T333 HydrophobicContact CB-CG2 3.98Å; K276-T333 HydrophobicContact CG-CG2 4.27Å; K276-D336 IonicContact NZ-OD2 2.67Å
277	N	92.8	Very high	91.4	Very high	15 Å²	15	62.8 Å²	62.8	8%	0.08	31%	0.309	C	S	.	.			trans	-100.7	122.3	178.7	-63.6	-46.3	0	0	0	111.2	G268 N273 K274 S275 Y279 L283 Y304 N306	G268-N277 PolarHBondContact O-ND2 2.67Å; N273-N277 PolarHBondContact O-N 3.35Å; N273-N277 PolarHBondContact O-ND2 2.94Å; N273-N277 VanDerWaalsContact O-ND2 3.09Å; K274-N277 PolarHBondContact O-N 3.28Å; S275-N277 VanDerWaalsContact C-N 3.31Å; N277-Y279 PolarHBondContact O-N 2.86Å; N277-L283 HydrophobicContact CB-CD2 4.2Å; N277-L283 VanDerWaalsContact CG-CD2 3.45Å; N277-L283 VanDerWaalsContact ND2-CD2 3.25Å; N277-L283 WeakPolarHBondContact ND2-CD2 3.4Å; N277-Y304 PolarHBondContact OD1-OH 3.2Å; N277-N306 PolarHBondContact OD1-ND2 3.34Å
278	R	93.8	Very high	91.5	Very high	43 Å²	43	62.2 Å²	62.2	16%	0.162	31%	0.307	C	S	.	.	S	Bend	trans	-62.9	-36.5	174.6	179.2	175.5	-68	-78.4	-5.4	111.6	G328 C329 L330 N361 K362 S456	R278-G328 PolarHBondContact NE-O 2.99Å; R278-G328 PolarHBondContact NH2-O 3.44Å; R278-C329 VanDerWaalsContact NH2-C 3.33Å; R278-C329 PolarHBondContact NH2-O 2.98Å; R278-L330 HydrophobicContact CB-CD2 4.09Å; R278-L330 HydrophobicContact CB-CG 4.46Å; R278-L330 HydrophobicContact CG-CD2 4.27Å; R278-N361 PolarHBondContact NH1-O 3.44Å; R278-N361 VanDerWaalsContact NH1-O 3.09Å; R278-K362 PolarHBondContact NE-O 3.32Å; R278-K362 VanDerWaalsContact NE-O 3.11Å; R278-K362 PolarHBondContact NH1-O 3.03Å; R278-K362 PolarHBondContact NH2-O 3.46Å; R278-S456 WeakPolarHBondContact CD-O 3.12Å
279	Y	85.4	Confident	91.9	Very high	87 Å²	87	63.4 Å²	63.4	34%	0.341	31%	0.311	S	S	.	.	S	Bend	trans	-126.3	125.2	177.1	-60	-76.6	0	0	0	109.7	N277 N281 I282 S456 A457	N277-Y279 PolarHBondContact O-N 2.86Å; Y279-N281 PolarHBondContact O-N 2.93Å; Y279-I282 HydrophobicContact CD2-CD1 3.9Å; Y279-I282 HydrophobicContact CG-CD1 3.93Å; Y279-I282 PolarHBondContact O-N 3.26Å; Y279-S456 PolarHBondContact OH-OG 2.96Å; Y279-A457 HydrophobicContact CD2-CB 3.7Å; Y279-A457 HydrophobicContact CE2-CB 3.63Å
280	K	79.3	Confident	92.3	Very high	149 Å²	149	57.6 Å²	57.6	65%	0.648	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-35	-175.6	-175.3	-175.1	173.8	-170.8	0	113.9
281	N	79.4	Confident	92.5	Very high	126 Å²	126	57.3 Å²	57.3	67%	0.674	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-0	-171	-57.9	-22.2	0	0	0	113.5	Y279	Y279-N281 PolarHBondContact O-N 2.93Å
282	I	83.9	Confident	92.6	Very high	38 Å²	38	52.7 Å²	52.7	20%	0.195	26%	0.258	C	S	.	.			trans	-108.4	96	179.3	-54.2	178	0	0	0	107.2	Y279 N306 A457 I459	Y279-I282 HydrophobicContact CD2-CD1 3.9Å; Y279-I282 HydrophobicContact CG-CD1 3.93Å; Y279-I282 PolarHBondContact O-N 3.26Å; I282-N306 PolarHBondContact O-ND2 2.91Å; I282-A457 HydrophobicContact CD1-CB 3.69Å; I282-A457 HydrophobicContact CG2-CB 4.43Å; I282-I459 HydrophobicContact CD1-CD1 3.92Å; I282-I459 HydrophobicContact CG2-CD1 4.07Å; I282-I459 HydrophobicContact CG2-CG2 4.02Å
283	L	90.8	Very high	92.5	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.037	26%	0.261	C	S	.	.			trans	-123.3	147.7	-169.8	-57	178.5	0	0	0	110.1	R265 Q269 N277	R265-L283 HydrophobicContact CB-CB 4.13Å; R265-L283 HydrophobicContact CB-CD1 4.47Å; R265-L283 HydrophobicContact CG-CB 4.48Å; Q269-L283 HydrophobicContact CB-CD1 4.48Å; Q269-L283 HydrophobicContact CG-CD1 3.42Å; Q269-L283 VanDerWaalsContact CG-CD1 3.42Å; N277-L283 HydrophobicContact CB-CD2 4.2Å; N277-L283 VanDerWaalsContact CG-CD2 3.45Å; N277-L283 VanDerWaalsContact ND2-CD2 3.25Å; N277-L283 WeakPolarHBondContact ND2-CD2 3.4Å
284	P	94.2	Very high	92	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.299	C	S	.	.			trans	-68.9	148.8	176	32.1	-35.7	0	0	0	110.7	R289 Y304 N308	P284-R289 HydrophobicContact CB-CB 4.11Å; P284-R289 HydrophobicContact CG-CB 4.4Å; P284-Y304 WeakPolarHBondContact CD-OH 3.42Å; P284-Y304 HydrophobicContact CG-CE2 3.85Å; P284-N308 WeakPolarHBondContact CA-OD1 3.26Å; P284-N308 WeakPolarHBondContact CB-OD1 3.38Å
285	F	94.6	Very high	91.5	Very high	8 Å²	8	55.8 Å²	55.8	4%	0.035	28%	0.284	C	S	.	.			trans	-70.2	141.4	166.6	-65	-45.1	0	0	0	110.6	V261 K263 S264 R265 D287 T288 R289 N308 R494 S498	V261-F285 HydrophobicContact CG1-CZ 4.26Å; K263-F285 HydrophobicContact CB-CD1 3.45Å; K263-F285 VanDerWaalsContact CB-CD1 3.45Å; K263-F285 HydrophobicContact CB-CD2 4.43Å; K263-F285 HydrophobicContact CB-CE1 3.62Å; K263-F285 HydrophobicContact CB-CG 3.91Å; K263-F285 HydrophobicContact CB-CZ 4.17Å; K263-F285 HydrophobicContact CD-CD1 4.4Å; K263-F285 HydrophobicContact CD-CD2 3.88Å; K263-F285 HydrophobicContact CD-CE2 4.08Å; K263-F285 HydrophobicContact CD-CG 4.06Å; K263-F285 HydrophobicContact CD-CZ 4.43Å; S264-F285 WeakPolarHBondContact O-CA 2.92Å; R265-F285 HydrophobicContact CG-CD1 3.66Å; R265-F285 HydrophobicContact CG-CE1 4.14Å; F285-D287 PolarHBondContact O-N 3.33Å; F285-T288 PolarHBondContact O-N 3.44Å; F285-R289 WeakPolarHBondContact O-CB 3.37Å; F285-R289 PolarHBondContact O-N 3.25Å; F285-N308 PolarHBondContact N-ND2 3.07Å; F285-N308 PolarHBondContact O-ND2 2.89Å; F285-R494 VanDerWaalsContact CE2-O 3.31Å; F285-R494 WeakPolarHBondContact CE2-O 3.4Å; F285-S498 VanDerWaalsContact CE2-N 3.29Å
286	N	94.1	Very high	91.1	Very high	35 Å²	35	55.6 Å²	55.6	19%	0.187	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-62.7	-41.3	-178.1	-70.6	1.3	0	0	0	112.1	S264 R265 E266 E267 T288 R289	S264-N286 PolarHBondContact O-N 2.99Å; S264-N286 PolarHBondContact OG-ND2 3.28Å; S264-N286 VanDerWaalsContact OG-ND2 3.16Å; R265-N286 WeakPolarHBondContact CA-OD1 2.99Å; E266-N286 PolarHBondContact N-ND2 3.49Å; E266-N286 PolarHBondContact N-OD1 3.03Å; E267-N286 PolarHBondContact N-OD1 2.86Å; N286-T288 PolarHBondContact O-N 3.38Å; N286-R289 PolarHBondContact O-N 3.34Å
287	D	95.3	Very high	90.5	Very high	119 Å²	119	60 Å²	60	64%	0.636	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-63.9	-24.4	-174.4	-48	-19.5	0	0	0	113.9	F285	F285-D287 PolarHBondContact O-N 3.33Å
288	T	96.7	Very high	90.2	Very high	20 Å²	20	66.2 Å²	66.2	12%	0.123	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-126.7	7.3	-173.2	54.8	0	0	0	0	112.3	F285 N286 N308 Y309 Q496	F285-T288 PolarHBondContact O-N 3.44Å; N286-T288 PolarHBondContact O-N 3.38Å; T288-N308 VanDerWaalsContact C-ND2 3.29Å; T288-N308 CarbonylContact O-C 3.55Å; T288-N308 WeakPolarHBondContact O-CA 3.39Å; T288-N308 PolarHBondContact O-ND2 3.33Å; T288-N308 PolarHBondContact OG1-ND2 3.29Å; T288-Y309 PolarHBondContact O-N 3.46Å; T288-Q496 HydrophobicContact CG2-CB 4.39Å; T288-Q496 HydrophobicContact CG2-CG 4.39Å; T288-Q496 PolarHBondContact OG1-O 3.26Å
289	R	97.7	Very high	90	Very high	28 Å²	28	67.9 Å²	67.9	11%	0.106	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	149.9	179.8	73.1	-179.3	178.7	94.8	-7.3	110.2	P284 F285 N286 I291 D303 A307 N308	P284-R289 HydrophobicContact CB-CB 4.11Å; P284-R289 HydrophobicContact CG-CB 4.4Å; F285-R289 WeakPolarHBondContact O-CB 3.37Å; F285-R289 PolarHBondContact O-N 3.25Å; N286-R289 PolarHBondContact O-N 3.34Å; R289-I291 HydrophobicContact CG-CG1 4.2Å; R289-D303 IonicContact CZ-OD2 2.63Å; R289-D303 VanDerWaalsContact CZ-OD2 3.28Å; R289-D303 PolarHBondContact NH1-O 2.81Å; R289-D303 IonicContact NH1-OD2 2.7Å; R289-D303 PolarHBondContact NH1-OD2 3.24Å; R289-D303 IonicContact NH2-OD2 2.77Å; R289-D303 PolarHBondContact NH2-OD2 3.37Å; R289-A307 VanDerWaalsContact CA-O 3.3Å; R289-A307 WeakPolarHBondContact CA-O 3.12Å; R289-N308 WeakPolarHBondContact CA-ND2 3.4Å; R289-N308 PolarHBondContact N-ND2 3.09Å
290	V	98.3	Very high	90.2	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	131.1	166.1	-175.7	0	0	0	0	108.5	I305 A307 Y309 I324 M340	V290-I305 HydrophobicContact CB-CG2 3.88Å; V290-I305 HydrophobicContact CG1-CG2 4.18Å; V290-A307 HydrophobicContact CB-CB 4.14Å; V290-A307 HydrophobicContact CG2-CB 3.77Å; V290-A307 PolarHBondContact N-O 2.81Å; V290-Y309 HydrophobicContact CB-CE2 4.24Å; V290-Y309 HydrophobicContact CG1-CE2 4.46Å; V290-Y309 HydrophobicContact CG2-CD1 4.5Å; V290-Y309 HydrophobicContact CG2-CD2 4.15Å; V290-Y309 HydrophobicContact CG2-CE1 4.24Å; V290-Y309 HydrophobicContact CG2-CE2 3.86Å; V290-Y309 HydrophobicContact CG2-CG 4.47Å; V290-I324 HydrophobicContact CG2-CD1 4.31Å; V290-I324 HydrophobicContact CG2-CG1 4.27Å; V290-I324 HydrophobicContact CG2-CG2 3.97Å; V290-M340 HydrophobicContact CB-SD 4.24Å; V290-M340 HydrophobicContact CG1-CG 3.96Å; V290-M340 HydrophobicContact CG1-SD 4.06Å; V290-M340 HydrophobicContact CG2-SD 4.1Å
291	I	97.8	Very high	90.7	Very high	88 Å²	88	60.8 Å²	60.8	45%	0.451	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	118	176.9	-53.2	-174	0	0	0	107.1	R289 Q293 D303 Q343	R289-I291 HydrophobicContact CG-CG1 4.2Å; I291-Q293 PolarHBondContact O-N 3.15Å; I291-D303 HydrophobicContact CG2-CB 3.96Å; I291-Q343 PolarHBondContact O-NE2 2.97Å
292	L	96.9	Very high	91.3	Very high	8 Å²	8	56 Å²	56	4%	0.042	31%	0.313	C	S	.	.			trans	-69.7	124	179.9	-59.7	175.6	0	0	0	110.1	D303 I305 D336 Q339 M340	L292-D303 PolarHBondContact N-O 3.24Å; L292-I305 HydrophobicContact CD1-CB 4.19Å; L292-I305 HydrophobicContact CD2-CB 4.16Å; L292-I305 HydrophobicContact CD2-CG2 3.79Å; L292-I305 HydrophobicContact CG-CB 4.2Å; L292-I305 HydrophobicContact CG-CG2 4.02Å; L292-D336 HydrophobicContact CD1-CB 3.78Å; L292-Q339 HydrophobicContact CB-CG 4.31Å; L292-Q339 HydrophobicContact CD2-CB 4.37Å; L292-Q339 HydrophobicContact CD2-CG 4.11Å; L292-M340 HydrophobicContact CD2-CB 3.86Å
293	Q	94	Very high	91.9	Very high	107 Å²	107	55.9 Å²	55.9	50%	0.5	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	156.9	177.2	-63.6	179.4	11.3	0	0	110.7	I291 A295 Q339	I291-Q293 PolarHBondContact O-N 3.15Å; Q293-A295 PolarHBondContact O-N 3.48Å; Q293-A295 VanDerWaalsContact O-N 3.12Å; Q293-Q339 PolarHBondContact O-NE2 3.43Å
294	N	84.4	Confident	92.2	Very high	149 Å²	149	55.6 Å²	55.6	80%	0.797	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	19.4	179.5	-51.6	-44.1	0	0	0	114.7
295	A	81.6	Confident	92.4	Very high	29 Å²	29	56 Å²	56	24%	0.24	31%	0.313	C	S	.	.			trans	-71.3	148.8	170.9	0	0	0	0	0	110.5	Q293 P297 S302 D303	Q293-A295 PolarHBondContact O-N 3.48Å; Q293-A295 VanDerWaalsContact O-N 3.12Å; A295-P297 WeakPolarHBondContact O-CD 3.49Å; A295-S302 WeakPolarHBondContact CB-O 3.43Å; A295-S302 WeakPolarHBondContact CB-OG 3.43Å; A295-D303 HydrophobicContact CB-CB 4.32Å
296	D	85.1	Confident	92.6	Very high	79 Å²	79	55.7 Å²	55.7	42%	0.422	31%	0.312	S	S	.	.			trans	-63.9	115.1	179.1	-175.2	-13.6	0	0	0	109.9	N298 V299 S302	D296-N298 PolarHBondContact O-N 2.99Å; D296-N298 VanDerWaalsContact O-N 3.14Å; D296-N298 WeakPolarHBondContact OD1-CB 3.21Å; D296-N298 PolarHBondContact OD1-N 2.89Å; D296-N298 PolarHBondContact OD1-ND2 3.11Å; D296-V299 HydrophobicContact CB-CB 4.13Å; D296-V299 HydrophobicContact CB-CG2 3.88Å; D296-V299 PolarHBondContact O-N 2.71Å; D296-V299 WeakPolarHBondContact OD2-CG2 3.19Å; D296-S302 PolarHBondContact O-OG 3.16Å
297	P	83.8	Confident	92.8	Very high	125 Å²	125	54 Å²	54	81%	0.812	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.4	-179	-21.2	33.6	0	0	0	113.5	A295	A295-P297 WeakPolarHBondContact O-CD 3.49Å
298	N	88.3	Confident	93	Very high	145 Å²	145	48.4 Å²	48.4	78%	0.775	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-12.9	179.2	-53.8	-65.6	0	0	0	112.6	D296	D296-N298 PolarHBondContact O-N 2.99Å; D296-N298 VanDerWaalsContact O-N 3.14Å; D296-N298 WeakPolarHBondContact OD1-CB 3.21Å; D296-N298 PolarHBondContact OD1-N 2.89Å; D296-N298 PolarHBondContact OD1-ND2 3.11Å
299	V	89.6	Confident	93	Very high	79 Å²	79	50.6 Å²	50.6	48%	0.479	28%	0.279	S	S	.	.	S	Bend	trans	-100.7	107.3	179.5	178.9	0	0	0	0	109	D296 G301 S302	D296-V299 HydrophobicContact CB-CB 4.13Å; D296-V299 HydrophobicContact CB-CG2 3.88Å; D296-V299 PolarHBondContact O-N 2.71Å; D296-V299 WeakPolarHBondContact OD2-CG2 3.19Å; V299-G301 PolarHBondContact O-N 2.83Å; V299-S302 WeakPolarHBondContact O-CB 3.19Å; V299-S302 PolarHBondContact O-N 3.25Å; V299-S302 VanDerWaalsContact O-N 3.13Å; V299-S302 PolarHBondContact O-OG 2.7Å
300	V	89.6	Confident	93	Very high	80 Å²	80	49.2 Å²	49.2	49%	0.485	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	129.2	178.1	-178.6	0	0	0	0	110.3	E272 S302	E272-V300 HydrophobicContact CG-CB 4.43Å; E272-V300 HydrophobicContact CG-CG1 4.42Å; V300-S302 VanDerWaalsContact C-N 3.3Å; V300-S302 PolarHBondContact O-N 2.85Å
301	G	88.9	Confident	92.8	Very high	6 Å²	6	54.4 Å²	54.4	6%	0.062	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	9.3	-179.3	0	0	0	0	0	114.8	N273 K276 V299 D303 Y304	N273-G301 WeakPolarHBondContact OD1-CA 3.32Å; N273-G301 PolarHBondContact OD1-O 2.9Å; K276-G301 PolarHBondContact NZ-O 3.49Å; V299-G301 PolarHBondContact O-N 2.83Å; G301-D303 PolarHBondContact O-N 3.35Å; G301-Y304 WeakPolarHBondContact O-CB 3.5Å; G301-Y304 PolarHBondContact O-N 2.58Å
302	S	92.4	Very high	92.5	Very high	27 Å²	27	50.8 Å²	50.8	19%	0.189	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.2	173.3	64.4	0	0	0	0	112.5	A295 D296 V299 V300 Y304	A295-S302 WeakPolarHBondContact CB-O 3.43Å; A295-S302 WeakPolarHBondContact CB-OG 3.43Å; D296-S302 PolarHBondContact O-OG 3.16Å; V299-S302 WeakPolarHBondContact O-CB 3.19Å; V299-S302 PolarHBondContact O-N 3.25Å; V299-S302 VanDerWaalsContact O-N 3.13Å; V299-S302 PolarHBondContact O-OG 2.7Å; V300-S302 VanDerWaalsContact C-N 3.3Å; V300-S302 PolarHBondContact O-N 2.85Å; S302-Y304 VanDerWaalsContact C-N 3.28Å; S302-Y304 PolarHBondContact O-N 3.09Å
303	D	95.9	Very high	92.1	Very high	35 Å²	35	55.3 Å²	55.3	19%	0.187	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	1.1	179.7	76.8	-41.4	0	0	0	114	R289 I291 L292 A295 G301	R289-D303 IonicContact CZ-OD2 2.63Å; R289-D303 VanDerWaalsContact CZ-OD2 3.28Å; R289-D303 PolarHBondContact NH1-O 2.81Å; R289-D303 IonicContact NH1-OD2 2.7Å; R289-D303 PolarHBondContact NH1-OD2 3.24Å; R289-D303 IonicContact NH2-OD2 2.77Å; R289-D303 PolarHBondContact NH2-OD2 3.37Å; I291-D303 HydrophobicContact CG2-CB 3.96Å; L292-D303 PolarHBondContact N-O 3.24Å; A295-D303 HydrophobicContact CB-CB 4.32Å; G301-D303 PolarHBondContact O-N 3.35Å
304	Y	97.9	Very high	91.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.2	-170.3	-178.6	-94.6	0	0	0	113.6	E267 G268 N273 K276 N277 P284 G301 S302 N306	E267-Y304 HydrophobicContact CB-CD2 4.45Å; G268-Y304 VanDerWaalsContact CA-CE2 3.47Å; G268-Y304 WeakPolarHBondContact CA-OH 3.31Å; N273-Y304 HydrophobicContact CB-CD1 3.69Å; N273-Y304 HydrophobicContact CB-CD2 4.34Å; N273-Y304 HydrophobicContact CB-CE1 3.86Å; N273-Y304 HydrophobicContact CB-CG 3.93Å; N273-Y304 VanDerWaalsContact CG-CB 3.48Å; N273-Y304 WeakPolarHBondContact ND2-CB 3.45Å; N273-Y304 VanDerWaalsContact ND2-CG 3.34Å; N273-Y304 VanDerWaalsContact OD1-CB 3.25Å; N273-Y304 WeakPolarHBondContact OD1-CB 3.25Å; K276-Y304 HydrophobicContact CB-CD1 3.89Å; K276-Y304 HydrophobicContact CB-CE1 3.91Å; K276-Y304 HydrophobicContact CD-CD1 3.75Å; K276-Y304 HydrophobicContact CG-CD1 4.46Å; K276-Y304 PolarHBondContact NZ-O 3.19Å; N277-Y304 PolarHBondContact OD1-OH 3.2Å; P284-Y304 WeakPolarHBondContact CD-OH 3.42Å; P284-Y304 HydrophobicContact CG-CE2 3.85Å; G301-Y304 WeakPolarHBondContact O-CB 3.5Å; G301-Y304 PolarHBondContact O-N 2.58Å; S302-Y304 VanDerWaalsContact C-N 3.28Å; S302-Y304 PolarHBondContact O-N 3.09Å; Y304-N306 HydrophobicContact CE1-CB 4.4Å
305	I	98.4	Very high	90.8	Very high	8 Å²	8	47.9 Å²	47.9	4%	0.041	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	145	161.2	-173.3	163	0	0	0	109.5	V290 L292 A307 D336 F337 M340	V290-I305 HydrophobicContact CB-CG2 3.88Å; V290-I305 HydrophobicContact CG1-CG2 4.18Å; L292-I305 HydrophobicContact CD1-CB 4.19Å; L292-I305 HydrophobicContact CD2-CB 4.16Å; L292-I305 HydrophobicContact CD2-CG2 3.79Å; L292-I305 HydrophobicContact CG-CB 4.2Å; L292-I305 HydrophobicContact CG-CG2 4.02Å; I305-A307 HydrophobicContact CG1-CB 4.45Å; I305-A307 HydrophobicContact CG2-CB 4.14Å; I305-A307 PolarHBondContact O-N 2.91Å; I305-D336 HydrophobicContact CD1-CB 4.25Å; I305-F337 HydrophobicContact CD1-CB 4.5Å; I305-M340 HydrophobicContact CD1-CB 4.08Å; I305-M340 HydrophobicContact CD1-CE 3.99Å; I305-M340 HydrophobicContact CD1-SD 3.87Å; I305-M340 HydrophobicContact CG2-SD 4.21Å
306	N	98.1	Very high	89.8	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.016	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	74.7	176.5	-169.4	-38.3	0	0	0	111	N277 I282 Y304 T326 Q327 R497	N277-N306 PolarHBondContact OD1-ND2 3.34Å; I282-N306 PolarHBondContact O-ND2 2.91Å; Y304-N306 HydrophobicContact CE1-CB 4.4Å; N306-T326 PolarHBondContact O-OG1 3.24Å; N306-Q327 HydrophobicContact CB-CG 4.04Å; N306-Q327 PolarHBondContact ND2-OE1 2.85Å; N306-Q327 PolarHBondContact O-N 3.2Å; N306-R497 PolarHBondContact OD1-NH1 3.45Å; N306-R497 VanDerWaalsContact OD1-NH1 3.17Å; N306-R497 PolarHBondContact OD1-NH2 3.13Å
307	A	98.5	Very high	88.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	151	-180	0	0	0	0	0	110.8	R289 V290 I305 I324 A325 M340	R289-A307 VanDerWaalsContact CA-O 3.3Å; R289-A307 WeakPolarHBondContact CA-O 3.12Å; V290-A307 HydrophobicContact CB-CB 4.14Å; V290-A307 HydrophobicContact CG2-CB 3.77Å; V290-A307 PolarHBondContact N-O 2.81Å; I305-A307 HydrophobicContact CG1-CB 4.45Å; I305-A307 HydrophobicContact CG2-CB 4.14Å; I305-A307 PolarHBondContact O-N 2.91Å; A307-I324 HydrophobicContact CB-CG2 3.92Å; A307-A325 CarbonylContact C-O 3.58Å; A307-A325 WeakPolarHBondContact CA-O 3.45Å; A307-M340 HydrophobicContact CB-CE 4.49Å; A307-M340 HydrophobicContact CB-SD 3.7Å
308	N	98.6	Very high	87.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	143.5	172.2	-67.9	99.4	0	0	0	111.2	P284 F285 T288 R289 I324 A325 Q496 R497	P284-N308 WeakPolarHBondContact CA-OD1 3.26Å; P284-N308 WeakPolarHBondContact CB-OD1 3.38Å; F285-N308 PolarHBondContact N-ND2 3.07Å; F285-N308 PolarHBondContact O-ND2 2.89Å; T288-N308 VanDerWaalsContact C-ND2 3.29Å; T288-N308 CarbonylContact O-C 3.55Å; T288-N308 WeakPolarHBondContact O-CA 3.39Å; T288-N308 PolarHBondContact O-ND2 3.33Å; T288-N308 PolarHBondContact OG1-ND2 3.29Å; R289-N308 WeakPolarHBondContact CA-ND2 3.4Å; R289-N308 PolarHBondContact N-ND2 3.09Å; N308-I324 WeakPolarHBondContact O-CA 3.39Å; N308-A325 PolarHBondContact N-O 2.75Å; N308-A325 PolarHBondContact O-N 2.73Å; N308-Q496 WeakPolarHBondContact CB-O 3.47Å; N308-R497 HydrophobicContact CB-CB 4.03Å; N308-R497 HydrophobicContact CB-CG 4.35Å; N308-R497 WeakPolarHBondContact OD1-CG 3.48Å; N308-R497 PolarHBondContact OD1-NH1 2.79Å
309	Y	98.4	Very high	86.1	Confident	66 Å²	66	49 Å²	49	26%	0.259	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	135.5	161.2	-60.7	-77.9	0	0	0	109.7	T288 V290 Y323 I324 E344 P450	T288-Y309 PolarHBondContact O-N 3.46Å; V290-Y309 HydrophobicContact CB-CE2 4.24Å; V290-Y309 HydrophobicContact CG1-CE2 4.46Å; V290-Y309 HydrophobicContact CG2-CD1 4.5Å; V290-Y309 HydrophobicContact CG2-CD2 4.15Å; V290-Y309 HydrophobicContact CG2-CE1 4.24Å; V290-Y309 HydrophobicContact CG2-CE2 3.86Å; V290-Y309 HydrophobicContact CG2-CG 4.47Å; Y309-Y323 WeakPolarHBondContact CA-O 3.47Å; Y309-I324 HydrophobicContact CD1-CD1 4.23Å; Y309-I324 HydrophobicContact CD1-CG1 3.78Å; Y309-I324 HydrophobicContact CE1-CD1 3.9Å; Y309-I324 HydrophobicContact CE1-CG1 3.99Å; Y309-E344 VanDerWaalsContact CE1-OE2 3.25Å; Y309-E344 WeakPolarHBondContact CE1-OE2 3.45Å; Y309-E344 PolarHBondContact OH-OE1 2.93Å; Y309-E344 PolarHBondContact OH-OE2 3.26Å; Y309-P450 HydrophobicContact CE1-CG 4.44Å
310	V	97.1	Very high	85.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	124	175.5	-173.1	0	0	0	0	106.9	Y323 A325 V466 M470 V493 Q496 M500	V310-Y323 PolarHBondContact N-O 3.14Å; V310-Y323 WeakPolarHBondContact O-CD2 3.4Å; V310-Y323 PolarHBondContact O-N 3.1Å; V310-A325 HydrophobicContact CG2-CB 3.89Å; V310-V466 HydrophobicContact CG1-CG1 4.11Å; V310-M470 HydrophobicContact CG1-CE 3.87Å; V310-V493 HydrophobicContact CG1-CB 3.97Å; V310-V493 HydrophobicContact CG1-CG1 3.7Å; V310-Q496 HydrophobicContact CG1-CB 4.47Å; V310-Q496 HydrophobicContact CG2-CB 4.35Å; V310-M500 HydrophobicContact CG2-CE 4.5Å
311	K	94.3	Very high	85.4	Confident	108 Å²	108	45.6 Å²	45.6	47%	0.47	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	154.8	177	58.9	178.1	-179.2	176.5	0	110.3	K313 Q496	K311-K313 HydrophobicContact CG-CG 4.29Å; K311-Q496 PolarHBondContact O-NE2 3.16Å
312	D	91.4	Very high	85.6	Confident	12 Å²	12	48 Å²	48	6%	0.064	28%	0.276	C	S	.	.			trans	-66.2	138.6	168.8	-161.7	-13.3	0	0	0	109.4	L314 W315 Q320 M492	D312-L314 WeakPolarHBondContact OD1-CB 3.34Å; D312-L314 PolarHBondContact OD1-N 3.36Å; D312-W315 VanDerWaalsContact OD2-CD1 3.26Å; D312-W315 PolarHBondContact OD2-NE1 3.43Å; D312-Q320 PolarHBondContact O-OE1 2.73Å; D312-M492 HydrophobicContact CB-CE 4.44Å
313	K	88.3	Confident	85.8	Confident	104 Å²	104	46.7 Å²	46.7	45%	0.452	27%	0.267	S	S	.	.			trans	-129.4	4	177	-62.4	-174.9	179.6	-178.7	0	111.7	K311 M492	K311-K313 HydrophobicContact CG-CG 4.29Å; K313-M492 HydrophobicContact CB-CG 3.99Å; K313-M492 HydrophobicContact CB-SD 4.38Å; K313-M492 HydrophobicContact CG-SD 4.46Å
314	L	81.3	Confident	86	Confident	52 Å²	52	45 Å²	45	27%	0.272	26%	0.258	S	S	.	.	S	Bend	trans	-87.6	-20.2	-173.1	-64.4	-174.1	0	0	0	113.2	D312 K488 Y489 M492	D312-L314 WeakPolarHBondContact OD1-CB 3.34Å; D312-L314 PolarHBondContact OD1-N 3.36Å; L314-K488 HydrophobicContact CD1-CD 4.48Å; L314-K488 HydrophobicContact CD1-CG 4.23Å; L314-K488 HydrophobicContact CD2-CD 4.04Å; L314-K488 HydrophobicContact CD2-CG 3.95Å; L314-Y489 HydrophobicContact CD1-CD1 3.8Å; L314-Y489 HydrophobicContact CD1-CD2 3.78Å; L314-Y489 HydrophobicContact CD1-CE1 3.94Å; L314-Y489 HydrophobicContact CD1-CE2 3.9Å; L314-Y489 HydrophobicContact CD1-CG 3.71Å; L314-M492 HydrophobicContact CD1-CB 4.49Å; L314-M492 HydrophobicContact CD2-CB 4.11Å; L314-M492 HydrophobicContact CD2-CG 4.15Å; L314-M492 HydrophobicContact CG-CB 4.26Å; L314-M492 HydrophobicContact CG-CE 4.37Å; L314-M492 HydrophobicContact CG-CG 4.12Å
315	W	70.6	Confident	86	Confident	47 Å²	47	45 Å²	45	18%	0.178	26%	0.258	C	S	.	.	S	Bend	trans	-146.4	148.2	172	64.3	-64.8	0	0	0	109.1	D312 A317 Q320 T474 T477 L478	D312-W315 VanDerWaalsContact OD2-CD1 3.26Å; D312-W315 PolarHBondContact OD2-NE1 3.43Å; W315-A317 HydrophobicContact CD2-CB 4.42Å; W315-A317 HydrophobicContact CE3-CB 3.47Å; W315-A317 VanDerWaalsContact CE3-CB 3.47Å; W315-A317 HydrophobicContact CH2-CB 3.58Å; W315-A317 HydrophobicContact CZ3-CB 3.02Å; W315-Q320 HydrophobicContact CZ2-CG 4.23Å; W315-Q320 PolarHBondContact O-NE2 2.72Å; W315-T474 PolarHBondContact NE1-OG1 3.42Å; W315-T477 HydrophobicContact CH2-CG2 3.55Å; W315-T477 HydrophobicContact CZ3-CG2 3.94Å; W315-L478 HydrophobicContact CE3-CD2 4.23Å; W315-L478 HydrophobicContact CZ3-CD2 3.99Å; W315-L478 HydrophobicContact CZ3-CG 4.47Å
316	E	58.7	Low	86	Confident	202 Å²	202	44.8 Å²	44.8	94%	0.944	26%	0.257	S	S	*	.			trans	-104.4	95.1	-179.9	-68.2	-174.7	170.3	0	0	108.5
317	A	57.2	Low	86	Confident	37 Å²	37	45 Å²	45	31%	0.306	26%	0.258	S	S	.	.			trans	-121	144.2	162.7	0	0	0	0	0	110	W315 G319	W315-A317 HydrophobicContact CD2-CB 4.42Å; W315-A317 HydrophobicContact CE3-CB 3.47Å; W315-A317 VanDerWaalsContact CE3-CB 3.47Å; W315-A317 HydrophobicContact CH2-CB 3.58Å; W315-A317 HydrophobicContact CZ3-CB 3.02Å; A317-G319 PolarHBondContact O-N 3.33Å
318	G	57.6	Low	85.9	Confident	85 Å²	85	45 Å²	45	88%	0.876	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	135.9	172.5	0	0	0	0	0	110.6
319	G	65.3	Low	85.9	Confident	78 Å²	78	45.1 Å²	45.1	80%	0.804	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.3	13.5	170.9	0	0	0	0	0	116.9	A317	A317-G319 PolarHBondContact O-N 3.33Å
320	Q	76.1	Confident	85.8	Confident	44 Å²	44	43.4 Å²	43.4	21%	0.206	25%	0.254	C	S	.	.			trans	-60.7	142.6	176.1	-73.7	174	-8	0	0	113.1	D312 W315	D312-Q320 PolarHBondContact O-OE1 2.73Å; W315-Q320 HydrophobicContact CZ2-CG 4.23Å; W315-Q320 PolarHBondContact O-NE2 2.72Å
321	K	87.9	Confident	85.8	Confident	43 Å²	43	47.4 Å²	47.4	19%	0.187	29%	0.287	C	S	.	.			trans	-61.5	139.4	172.8	-64	-179.1	-146.4	160.6	0	111.6	Y323 N439 M451 D469 E473	K321-Y323 HydrophobicContact CB-CE1 4.47Å; K321-Y323 HydrophobicContact CB-CE2 3.93Å; K321-Y323 WeakPolarHBondContact O-CE2 3.48Å; K321-N439 PolarHBondContact NZ-ND2 2.78Å; K321-N439 PolarHBondContact NZ-OD1 2.87Å; K321-M451 HydrophobicContact CD-CE 3.69Å; K321-D469 IonicContact NZ-OD1 3.44Å; K321-D469 IonicContact NZ-OD2 2.88Å; K321-D469 PolarHBondContact NZ-OD2 2.83Å; K321-E473 WeakPolarHBondContact CB-OE2 3.44Å; K321-E473 WeakPolarHBondContact CD-OE2 3.43Å; K321-E473 WeakPolarHBondContact CG-OE2 3.2Å; K321-E473 PolarHBondContact N-OE1 3.35Å; K321-E473 VanDerWaalsContact N-OE1 3.08Å; K321-E473 IonicContact NZ-OE2 3.6Å
322	V	93.4	Very high	85.8	Confident	56 Å²	56	46.7 Å²	46.7	34%	0.339	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	141.6	170.1	-174.8	0	0	0	0	108.5	P450 M451	V322-P450 HydrophobicContact CB-CB 4.15Å; V322-P450 HydrophobicContact CB-CG 4.04Å; V322-P450 HydrophobicContact CG1-CB 3.99Å; V322-P450 HydrophobicContact CG1-CG 3.76Å; V322-P450 CarbonylContact O-C 3.57Å; V322-P450 WeakPolarHBondContact O-CA 3.36Å; V322-P450 WeakPolarHBondContact O-CB 3.39Å; V322-M451 PolarHBondContact O-N 3.29Å
323	Y	97.9	Very high	86.1	Confident	1 Å²	1	46.5 Å²	46.5	0%	0.004	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	152.4	-177.7	-49.3	-98.7	0	0	0	110.1	Y309 V310 K321 M451 I453 V466 D469 M470 E473	Y309-Y323 WeakPolarHBondContact CA-O 3.47Å; V310-Y323 PolarHBondContact N-O 3.14Å; V310-Y323 WeakPolarHBondContact O-CD2 3.4Å; V310-Y323 PolarHBondContact O-N 3.1Å; K321-Y323 HydrophobicContact CB-CE1 4.47Å; K321-Y323 HydrophobicContact CB-CE2 3.93Å; K321-Y323 WeakPolarHBondContact O-CE2 3.48Å; Y323-M451 CarbonylContact C-O 3.49Å; Y323-M451 WeakPolarHBondContact CA-O 3.23Å; Y323-M451 HydrophobicContact CD1-CB 4.46Å; Y323-M451 HydrophobicContact CD1-CE 3.85Å; Y323-M451 HydrophobicContact CE1-CE 3.38Å; Y323-I453 HydrophobicContact CD1-CD1 3.83Å; Y323-I453 HydrophobicContact CD1-CG1 4.47Å; Y323-I453 HydrophobicContact CE1-CD1 4.36Å; Y323-V466 HydrophobicContact CD1-CG2 4.39Å; Y323-V466 HydrophobicContact CD2-CG1 4.33Å; Y323-V466 HydrophobicContact CG-CG1 4.27Å; Y323-D469 HydrophobicContact CE1-CB 4.25Å; Y323-D469 WeakPolarHBondContact CE1-OD2 3.39Å; Y323-D469 PolarHBondContact OH-OD2 3Å; Y323-M470 HydrophobicContact CD2-CE 3.53Å; Y323-M470 HydrophobicContact CE2-CE 3.5Å; Y323-M470 VanDerWaalsContact CE2-CE 3.5Å; Y323-M470 HydrophobicContact CE2-CG 3.78Å; Y323-E473 PolarHBondContact OH-OE2 3.26Å
324	I	98.8	Very high	86.5	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	113.3	164.9	-69.8	168.1	0	0	0	107.9	V290 A307 N308 Y309 M340 E344 P450 M451 I452 I453	V290-I324 HydrophobicContact CG2-CD1 4.31Å; V290-I324 HydrophobicContact CG2-CG1 4.27Å; V290-I324 HydrophobicContact CG2-CG2 3.97Å; A307-I324 HydrophobicContact CB-CG2 3.92Å; N308-I324 WeakPolarHBondContact O-CA 3.39Å; Y309-I324 HydrophobicContact CD1-CD1 4.23Å; Y309-I324 HydrophobicContact CD1-CG1 3.78Å; Y309-I324 HydrophobicContact CE1-CD1 3.9Å; Y309-I324 HydrophobicContact CE1-CG1 3.99Å; I324-M340 HydrophobicContact CG2-CE 4.12Å; I324-M340 HydrophobicContact CG2-SD 3.76Å; I324-E344 HydrophobicContact CD1-CB 4.02Å; I324-E344 HydrophobicContact CD1-CG 3.65Å; I324-P450 HydrophobicContact CD1-CB 3.86Å; I324-P450 HydrophobicContact CD1-CG 4.16Å; I324-P450 HydrophobicContact CG1-CB 3.78Å; I324-P450 HydrophobicContact CG1-CG 4.34Å; I324-M451 PolarHBondContact N-O 2.99Å; I324-I452 HydrophobicContact CB-CG1 3.97Å; I324-I452 HydrophobicContact CD1-CG1 4.2Å; I324-I452 HydrophobicContact CG2-CG1 4.27Å; I324-I453 PolarHBondContact O-N 3.23Å
325	A	98.6	Very high	87.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	116.1	174.3	0	0	0	0	0	109.5	A307 N308 V310 I453 T462 M500	A307-A325 CarbonylContact C-O 3.58Å; A307-A325 WeakPolarHBondContact CA-O 3.45Å; N308-A325 PolarHBondContact N-O 2.75Å; N308-A325 PolarHBondContact O-N 2.73Å; V310-A325 HydrophobicContact CG2-CB 3.89Å; A325-I453 WeakPolarHBondContact CA-O 3.36Å; A325-T462 HydrophobicContact CB-CG2 3.79Å; A325-M500 HydrophobicContact CB-CE 4.06Å; A325-M500 HydrophobicContact CB-SD 4.42Å
326	T	98.6	Very high	88.5	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	161.4	-176.5	-170.9	0	0	0	0	112.7	N306 F337 M340 I452 I453 H454 G458	N306-T326 PolarHBondContact O-OG1 3.24Å; T326-F337 HydrophobicContact CG2-CE2 4.1Å; T326-M340 HydrophobicContact CG2-CE 4.11Å; T326-I452 HydrophobicContact CG2-CG2 3.83Å; T326-I453 PolarHBondContact N-O 2.88Å; T326-I453 VanDerWaalsContact N-O 3.16Å; T326-H454 HydrophobicContact CG2-CB 3.53Å; T326-H454 WeakPolarHBondContact O-CA 3.34Å; T326-H454 WeakPolarHBondContact O-CB 3.39Å; T326-G458 WeakPolarHBondContact O-CA 3.12Å
327	Q	97.2	Very high	90.4	Very high	7 Å²	7	33.3 Å²	33.3	3%	0.033	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-74.4	162.7	173.2	72.2	176.3	20	0	0	111.6	K276 N306 S456	K276-Q327 PolarHBondContact O-NE2 3.17Å; N306-Q327 HydrophobicContact CB-CG 4.04Å; N306-Q327 PolarHBondContact ND2-OE1 2.85Å; N306-Q327 PolarHBondContact O-N 3.2Å; Q327-S456 WeakPolarHBondContact CB-O 3.28Å
328	G	97.4	Very high	92.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-66.8	133.3	170.1	0	0	0	0	0	111	R278 L330 C455 S456	R278-G328 PolarHBondContact NE-O 2.99Å; R278-G328 PolarHBondContact NH2-O 3.44Å; G328-L330 PolarHBondContact O-N 2.87Å; G328-C455 WeakPolarHBondContact CA-O 3.48Å; G328-C455 PolarHBondContact N-O 3.48Å; G328-S456 PolarHBondContact N-O 2.93Å
329	C	97.9	Very high	94.2	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.014	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-53.2	135.3	-174.2	-65.7	0	0	0	0	113.1	R278 V334 F337 C363 V364 Y366	R278-C329 VanDerWaalsContact NH2-C 3.33Å; R278-C329 PolarHBondContact NH2-O 2.98Å; C329-V334 HydrophobicContact CB-CG2 4.42Å; C329-F337 VanDerWaalsContact SG-CD2 3.5Å; C329-F337 WeakPolarHBondContact SG-CG 3.46Å; C329-C363 PolarHBondContact N-SG 2.94Å; C329-V364 HydrophobicContact CB-CG2 4.09Å; C329-V364 WeakPolarHBondContact O-CG2 3.41Å; C329-V364 PolarHBondContact O-N 2.97Å; C329-Y366 HydrophobicContact CB-CD1 3.92Å; C329-Y366 VanDerWaalsContact SG-CD1 3.5Å
330	L	97.1	Very high	95.8	Very high	30 Å²	30	25.1 Å²	25.1	16%	0.157	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-90.7	161.3	164.5	-61.1	171.7	0	0	0	108.9	S275 R278 G328 T332 T333 V334	S275-L330 WeakPolarHBondContact O-CD1 3.44Å; R278-L330 HydrophobicContact CB-CD2 4.09Å; R278-L330 HydrophobicContact CB-CG 4.46Å; R278-L330 HydrophobicContact CG-CD2 4.27Å; G328-L330 PolarHBondContact O-N 2.87Å; L330-T332 PolarHBondContact O-N 2.87Å; L330-T332 VanDerWaalsContact O-N 3.17Å; L330-T333 HydrophobicContact CB-CG2 4.16Å; L330-T333 HydrophobicContact CD1-CG2 4.3Å; L330-T333 PolarHBondContact N-OG1 3.46Å; L330-T333 PolarHBondContact O-N 3.1Å; L330-T333 PolarHBondContact O-OG1 3.01Å; L330-V334 WeakPolarHBondContact O-CG2 3.42Å; L330-V334 PolarHBondContact O-N 3.32Å
331	A	95.6	Very high	96.8	Very high	84 Å²	84	23 Å²	23	69%	0.694	14%	0.138	S	C	*	.	G	3₁₀ helix	trans	-55.4	-34.9	175.4	0	0	0	0	0	112.4
332	T	95.3	Very high	97.2	Very high	93 Å²	93	23.8 Å²	23.8	57%	0.571	14%	0.139	S	C	*	.	G	3₁₀ helix	trans	-79.3	-15.3	179.4	48.6	0	0	0	0	114.4	L330	L330-T332 PolarHBondContact O-N 2.87Å; L330-T332 VanDerWaalsContact O-N 3.17Å
333	T	97.1	Very high	97.4	Very high	8 Å²	8	22.1 Å²	22.1	5%	0.049	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-113.3	8.6	-174.2	70.7	0	0	0	0	112.9	K276 L330 N335 D336 F337	K276-T333 HydrophobicContact CB-CG2 3.98Å; K276-T333 HydrophobicContact CG-CG2 4.27Å; L330-T333 HydrophobicContact CB-CG2 4.16Å; L330-T333 HydrophobicContact CD1-CG2 4.3Å; L330-T333 PolarHBondContact N-OG1 3.46Å; L330-T333 PolarHBondContact O-N 3.1Å; L330-T333 PolarHBondContact O-OG1 3.01Å; T333-N335 VanDerWaalsContact C-N 3.34Å; T333-D336 PolarHBondContact O-N 3.47Å; T333-F337 WeakPolarHBondContact O-CB 3.42Å; T333-F337 PolarHBondContact O-N 2.79Å
334	V	97.6	Very high	97.4	Very high	15 Å²	15	23.2 Å²	23.2	9%	0.091	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-42.5	178.5	172	0	0	0	0	111	C329 L330 F337 W338 V364 V376	C329-V334 HydrophobicContact CB-CG2 4.42Å; L330-V334 WeakPolarHBondContact O-CG2 3.42Å; L330-V334 PolarHBondContact O-N 3.32Å; V334-F337 WeakPolarHBondContact O-CB 3.31Å; V334-F337 PolarHBondContact O-N 3.07Å; V334-W338 VanDerWaalsContact O-CD1 3.3Å; V334-W338 PolarHBondContact O-N 2.92Å; V334-W338 VanDerWaalsContact O-N 3.16Å; V334-V364 HydrophobicContact CG2-CG2 3.76Å; V334-V376 HydrophobicContact CG1-CG1 4.07Å
335	N	96.2	Very high	97.3	Very high	82 Å²	82	29.6 Å²	29.6	44%	0.439	16%	0.161	S	C	.	.	H	α-helix	trans	-67	-44.9	179.2	-62.4	-8.9	0	0	0	110.9	T333 F337 W338 Q339	T333-N335 VanDerWaalsContact C-N 3.34Å; N335-F337 VanDerWaalsContact C-N 3.26Å; N335-F337 PolarHBondContact O-N 3.08Å; N335-W338 PolarHBondContact O-N 2.87Å; N335-Q339 PolarHBondContact O-N 3.08Å
336	D	96.9	Very high	97.3	Very high	29 Å²	29	29.6 Å²	29.6	16%	0.155	16%	0.161	C	C	.	.	H	α-helix	trans	-57	-40.3	174.7	-63.4	-14.9	0	0	0	111.5	K276 L292 I305 T333 Q339 M340	K276-D336 IonicContact NZ-OD2 2.67Å; L292-D336 HydrophobicContact CD1-CB 3.78Å; I305-D336 HydrophobicContact CD1-CB 4.25Å; T333-D336 PolarHBondContact O-N 3.47Å; D336-Q339 PolarHBondContact O-N 3.27Å; D336-M340 PolarHBondContact O-N 2.92Å
337	F	98.3	Very high	97.2	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.009	17%	0.166	C	C	.	.	H	α-helix	trans	-63	-45.6	177.1	179.9	-93.6	0	0	0	112	I305 T326 C329 T333 V334 N335 M340 V341 I349 Y366 I452	I305-F337 HydrophobicContact CD1-CB 4.5Å; T326-F337 HydrophobicContact CG2-CE2 4.1Å; C329-F337 VanDerWaalsContact SG-CD2 3.5Å; C329-F337 WeakPolarHBondContact SG-CG 3.46Å; T333-F337 WeakPolarHBondContact O-CB 3.42Å; T333-F337 PolarHBondContact O-N 2.79Å; V334-F337 WeakPolarHBondContact O-CB 3.31Å; V334-F337 PolarHBondContact O-N 3.07Å; N335-F337 VanDerWaalsContact C-N 3.26Å; N335-F337 PolarHBondContact O-N 3.08Å; F337-M340 HydrophobicContact CD2-CE 3.83Å; F337-M340 HydrophobicContact CE2-CE 4Å; F337-M340 WeakPolarHBondContact O-CB 3.13Å; F337-M340 PolarHBondContact O-N 3.33Å; F337-V341 HydrophobicContact CD1-CG2 4Å; F337-V341 HydrophobicContact CE1-CG2 3.65Å; F337-V341 HydrophobicContact CZ-CG2 4.06Å; F337-V341 VanDerWaalsContact O-CG2 3.31Å; F337-V341 WeakPolarHBondContact O-CG2 3.36Å; F337-V341 PolarHBondContact O-N 3.43Å; F337-I349 HydrophobicContact CE1-CD1 4.05Å; F337-I349 HydrophobicContact CZ-CD1 4.12Å; F337-I349 HydrophobicContact CZ-CG2 4.21Å; F337-Y366 AromaticContact CD1-CD2 3.97Å; F337-Y366 HydrophobicContact CD1-CD2 3.97Å; F337-Y366 HydrophobicContact CD1-CE2 4.28Å; F337-Y366 HydrophobicContact CD1-CG 4.23Å; F337-Y366 AromaticContact CE1-CD2 3.62Å; F337-Y366 HydrophobicContact CE1-CD2 3.62Å; F337-Y366 HydrophobicContact CE1-CE1 4.39Å; F337-Y366 AromaticContact CE1-CE2 3.46Å; F337-Y366 HydrophobicContact CE1-CE2 3.46Å; F337-Y366 VanDerWaalsContact CE1-CE2 3.46Å; F337-Y366 HydrophobicContact CE1-CG 4.19Å; F337-Y366 AromaticContact CE1-CZ 3.87Å; F337-Y366 HydrophobicContact CZ-CD2 4.46Å; F337-Y366 HydrophobicContact CZ-CE1 4.4Å; F337-Y366 AromaticContact CZ-CE2 3.97Å; F337-Y366 HydrophobicContact CZ-CE2 3.97Å; F337-Y366 AromaticContact CZ-CZ 3.91Å; F337-I452 HydrophobicContact CE2-CG2 3.95Å; F337-I452 HydrophobicContact CZ-CG2 4.18Å
338	W	97.7	Very high	97.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-71.3	-31.6	178.3	-75.6	115.2	0	0	0	113.3	V334 N335 V341 W342 Y366 V376 V381 L397 I399 I411	V334-W338 VanDerWaalsContact O-CD1 3.3Å; V334-W338 PolarHBondContact O-N 2.92Å; V334-W338 VanDerWaalsContact O-N 3.16Å; N335-W338 PolarHBondContact O-N 2.87Å; W338-V341 HydrophobicContact CE3-CB 3.91Å; W338-V341 HydrophobicContact CE3-CG1 3.92Å; W338-V341 HydrophobicContact CE3-CG2 4.03Å; W338-V341 HydrophobicContact CZ3-CB 4.37Å; W338-V341 HydrophobicContact CZ3-CG1 3.93Å; W338-V341 HydrophobicContact CZ3-CG2 4.38Å; W338-V341 PolarHBondContact O-N 3.11Å; W338-W342 WeakPolarHBondContact O-CB 3.42Å; W338-W342 PolarHBondContact O-N 2.77Å; W338-Y366 AromaticContact CZ2-CD2 3.79Å; W338-Y366 HydrophobicContact CZ2-CD2 3.79Å; W338-Y366 HydrophobicContact CZ2-CE2 4.37Å; W338-Y366 WeakPolarHBondContact CZ2-O 3.3Å; W338-Y366 PolarHBondContact NE1-O 3.34Å; W338-V376 HydrophobicContact CB-CG2 4Å; W338-V376 HydrophobicContact CG-CB 4.37Å; W338-V376 HydrophobicContact CG-CG2 3.76Å; W338-V381 HydrophobicContact CD2-CG2 3.74Å; W338-V381 HydrophobicContact CE3-CG2 3.95Å; W338-V381 HydrophobicContact CG-CG2 4.28Å; W338-V381 HydrophobicContact CH2-CG1 3.77Å; W338-V381 HydrophobicContact CH2-CG2 4.01Å; W338-V381 HydrophobicContact CZ2-CB 4.29Å; W338-V381 HydrophobicContact CZ2-CG1 3.7Å; W338-V381 HydrophobicContact CZ2-CG2 3.83Å; W338-V381 HydrophobicContact CZ3-CG1 4.49Å; W338-V381 HydrophobicContact CZ3-CG2 4.07Å; W338-L397 HydrophobicContact CH2-CD1 3.81Å; W338-L397 HydrophobicContact CZ2-CD1 4.28Å; W338-I399 HydrophobicContact CB-CD1 4.42Å; W338-I399 HydrophobicContact CD2-CD1 4.37Å; W338-I399 HydrophobicContact CE3-CD1 3.62Å; W338-I399 HydrophobicContact CZ3-CD1 4.23Å; W338-I411 HydrophobicContact CZ3-CG1 4.5Å
339	Q	97.3	Very high	97.3	Very high	29 Å²	29	30.3 Å²	30.3	14%	0.136	16%	0.164	C	C	.	.	H	α-helix	trans	-58.3	-47.6	168.2	177.5	59.6	50.1	0	0	111.1	L292 Q293 N335 D336 W342 Q343 Y379	L292-Q339 HydrophobicContact CB-CG 4.31Å; L292-Q339 HydrophobicContact CD2-CB 4.37Å; L292-Q339 HydrophobicContact CD2-CG 4.11Å; Q293-Q339 PolarHBondContact O-NE2 3.43Å; N335-Q339 PolarHBondContact O-N 3.08Å; D336-Q339 PolarHBondContact O-N 3.27Å; Q339-W342 PolarHBondContact O-N 2.53Å; Q339-Q343 WeakPolarHBondContact O-CG 3.13Å; Q339-Q343 PolarHBondContact O-N 3.14Å; Q339-Y379 HydrophobicContact CB-CE2 4.32Å; Q339-Y379 PolarHBondContact NE2-OH 3.36Å; Q339-Y379 PolarHBondContact OE1-OH 2.83Å
340	M	98.1	Very high	97.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.6	-49.7	174.2	174.7	177.2	77.5	0	0	111.8	V290 L292 I305 A307 I324 T326 D336 F337 W342 Q343 E344 I452	V290-M340 HydrophobicContact CB-SD 4.24Å; V290-M340 HydrophobicContact CG1-CG 3.96Å; V290-M340 HydrophobicContact CG1-SD 4.06Å; V290-M340 HydrophobicContact CG2-SD 4.1Å; L292-M340 HydrophobicContact CD2-CB 3.86Å; I305-M340 HydrophobicContact CD1-CB 4.08Å; I305-M340 HydrophobicContact CD1-CE 3.99Å; I305-M340 HydrophobicContact CD1-SD 3.87Å; I305-M340 HydrophobicContact CG2-SD 4.21Å; A307-M340 HydrophobicContact CB-CE 4.49Å; A307-M340 HydrophobicContact CB-SD 3.7Å; I324-M340 HydrophobicContact CG2-CE 4.12Å; I324-M340 HydrophobicContact CG2-SD 3.76Å; T326-M340 HydrophobicContact CG2-CE 4.11Å; D336-M340 PolarHBondContact O-N 2.92Å; F337-M340 HydrophobicContact CD2-CE 3.83Å; F337-M340 HydrophobicContact CE2-CE 4Å; F337-M340 WeakPolarHBondContact O-CB 3.13Å; F337-M340 PolarHBondContact O-N 3.33Å; M340-W342 VanDerWaalsContact C-N 3.27Å; M340-W342 PolarHBondContact O-N 2.93Å; M340-Q343 WeakPolarHBondContact O-CG 3.43Å; M340-Q343 PolarHBondContact O-N 3.23Å; M340-E344 HydrophobicContact CG-CG 4.2Å; M340-E344 VanDerWaalsContact O-CB 3.32Å; M340-E344 WeakPolarHBondContact O-CB 3.3Å; M340-E344 WeakPolarHBondContact O-CG 3.46Å; M340-E344 PolarHBondContact O-N 3.34Å; M340-E344 VanDerWaalsContact O-N 3.1Å; M340-I452 HydrophobicContact CE-CD1 3.91Å; M340-I452 HydrophobicContact CE-CG1 4.34Å; M340-I452 HydrophobicContact CE-CG2 4.23Å
341	V	98.1	Very high	97.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-55	-46.5	177.7	172	0	0	0	0	110.5	F337 W338 T346 I349 R409 I411 I452	F337-V341 HydrophobicContact CD1-CG2 4Å; F337-V341 HydrophobicContact CE1-CG2 3.65Å; F337-V341 HydrophobicContact CZ-CG2 4.06Å; F337-V341 VanDerWaalsContact O-CG2 3.31Å; F337-V341 WeakPolarHBondContact O-CG2 3.36Å; F337-V341 PolarHBondContact O-N 3.43Å; W338-V341 HydrophobicContact CE3-CB 3.91Å; W338-V341 HydrophobicContact CE3-CG1 3.92Å; W338-V341 HydrophobicContact CE3-CG2 4.03Å; W338-V341 HydrophobicContact CZ3-CB 4.37Å; W338-V341 HydrophobicContact CZ3-CG1 3.93Å; W338-V341 HydrophobicContact CZ3-CG2 4.38Å; W338-V341 PolarHBondContact O-N 3.11Å; V341-T346 PolarHBondContact O-N 2.97Å; V341-I349 HydrophobicContact CG1-CD1 4.41Å; V341-I349 HydrophobicContact CG2-CD1 3.89Å; V341-R409 PolarHBondContact O-NH2 3.21Å; V341-I411 HydrophobicContact CG1-CD1 3.89Å; V341-I411 HydrophobicContact CG1-CG1 4.44Å; V341-I452 HydrophobicContact CB-CD1 4.27Å; V341-I452 HydrophobicContact CG2-CD1 3.54Å
342	W	97.2	Very high	97.4	Very high	58 Å²	58	24.9 Å²	24.9	22%	0.22	12%	0.123	C	C	.	.	H	α-helix	trans	-63.4	-56.4	-178.5	-179.4	-97.8	0	0	0	112.5	W338 Q339 M340 E344 K345 Y379 I399 P401 L407 R409	W338-W342 WeakPolarHBondContact O-CB 3.42Å; W338-W342 PolarHBondContact O-N 2.77Å; Q339-W342 PolarHBondContact O-N 2.53Å; M340-W342 VanDerWaalsContact C-N 3.27Å; M340-W342 PolarHBondContact O-N 2.93Å; W342-E344 VanDerWaalsContact C-N 3.28Å; W342-E344 PolarHBondContact O-N 2.97Å; W342-K345 PolarHBondContact O-N 2.98Å; W342-K345 VanDerWaalsContact O-N 3.17Å; W342-Y379 HydrophobicContact CB-CD1 4.33Å; W342-Y379 HydrophobicContact CB-CE1 3.67Å; W342-Y379 HydrophobicContact CB-CE2 4.19Å; W342-Y379 AromaticContact CD1-CE1 3.49Å; W342-Y379 VanDerWaalsContact CD1-CE1 3.49Å; W342-Y379 AromaticContact CD1-CZ 3.58Å; W342-Y379 HydrophobicContact CD2-CD1 4.11Å; W342-Y379 AromaticContact CD2-CE1 3.53Å; W342-Y379 HydrophobicContact CD2-CE1 3.53Å; W342-Y379 AromaticContact CE2-CE1 3.93Å; W342-Y379 HydrophobicContact CE3-CD1 4.34Å; W342-Y379 HydrophobicContact CE3-CE1 4.21Å; W342-Y379 HydrophobicContact CG-CD1 4.1Å; W342-Y379 AromaticContact CG-CE1 3.23Å; W342-Y379 HydrophobicContact CG-CE1 3.23Å; W342-Y379 AromaticContact CG-CZ 3.5Å; W342-Y379 AromaticContact NE1-CE1 3.84Å; W342-I399 HydrophobicContact CB-CD1 4.26Å; W342-I399 HydrophobicContact CE3-CD1 4.23Å; W342-I399 HydrophobicContact CE3-CG1 4.08Å; W342-I399 HydrophobicContact CE3-CG2 4.05Å; W342-I399 HydrophobicContact CZ3-CG2 4.28Å; W342-P401 VanDerWaalsContact CH2-CD 3.5Å; W342-P401 HydrophobicContact CH2-CG 3.69Å; W342-P401 HydrophobicContact CZ2-CG 3.49Å; W342-P401 VanDerWaalsContact CZ2-CG 3.49Å; W342-P401 HydrophobicContact CZ3-CG 4.34Å; W342-L407 HydrophobicContact CH2-CB 4.23Å; W342-L407 VanDerWaalsContact CH2-O 3.28Å; W342-L407 WeakPolarHBondContact CH2-O 3.26Å; W342-R409 HydrophobicContact CZ3-CB 4.39Å; W342-R409 PolarHBondContact O-NH1 3.06Å
343	Q	97.3	Very high	97.4	Very high	22 Å²	22	20.5 Å²	20.5	10%	0.103	10%	0.096	C	C	.	.	H	α-helix	trans	-62.7	-35.5	-173.7	74.1	178.9	57.2	0	0	112.2	I291 Q339 M340 K345	I291-Q343 PolarHBondContact O-NE2 2.97Å; Q339-Q343 WeakPolarHBondContact O-CG 3.13Å; Q339-Q343 PolarHBondContact O-N 3.14Å; M340-Q343 WeakPolarHBondContact O-CG 3.43Å; M340-Q343 PolarHBondContact O-N 3.23Å; Q343-K345 PolarHBondContact O-N 3.19Å
344	E	97.4	Very high	97.3	Very high	24 Å²	24	25.3 Å²	25.3	11%	0.112	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	2.5	-176.8	-61.3	-54.5	137	0	0	112.7	Y309 I324 M340 W342 T346 G449 P450	Y309-E344 VanDerWaalsContact CE1-OE2 3.25Å; Y309-E344 WeakPolarHBondContact CE1-OE2 3.45Å; Y309-E344 PolarHBondContact OH-OE1 2.93Å; Y309-E344 PolarHBondContact OH-OE2 3.26Å; I324-E344 HydrophobicContact CD1-CB 4.02Å; I324-E344 HydrophobicContact CD1-CG 3.65Å; M340-E344 HydrophobicContact CG-CG 4.2Å; M340-E344 VanDerWaalsContact O-CB 3.32Å; M340-E344 WeakPolarHBondContact O-CB 3.3Å; M340-E344 WeakPolarHBondContact O-CG 3.46Å; M340-E344 PolarHBondContact O-N 3.34Å; M340-E344 VanDerWaalsContact O-N 3.1Å; W342-E344 VanDerWaalsContact C-N 3.28Å; W342-E344 PolarHBondContact O-N 2.97Å; E344-T346 PolarHBondContact O-N 3.16Å; E344-G449 VanDerWaalsContact O-CA 3.31Å; E344-G449 WeakPolarHBondContact O-CA 3.48Å; E344-P450 WeakPolarHBondContact O-CD 3.35Å
345	K	96.6	Very high	97.1	Very high	134 Å²	134	27.3 Å²	27.3	58%	0.583	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	31	-178.1	-56.6	179.4	-177	177.3	0	113.3	W342 Q343 H347 G449	W342-K345 PolarHBondContact O-N 2.98Å; W342-K345 VanDerWaalsContact O-N 3.17Å; Q343-K345 PolarHBondContact O-N 3.19Å; K345-H347 PolarHBondContact O-CE1 3.35Å; K345-H347 PolarHBondContact O-ND1 3.35Å; K345-G449 PolarHBondContact O-N 3.02Å
346	T	97.5	Very high	96.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.121	C	C	.	.			trans	-64.4	137.8	177.1	-61.3	0	0	0	0	110.2	V341 E344 V348 I349 R409 I411 P450 I452	V341-T346 PolarHBondContact O-N 2.97Å; E344-T346 PolarHBondContact O-N 3.16Å; T346-V348 WeakPolarHBondContact CG2-O 3.48Å; T346-I349 HydrophobicContact CG2-CG1 4.26Å; T346-R409 PolarHBondContact O-NE 3.41Å; T346-R409 PolarHBondContact O-NH2 3.44Å; T346-R409 VanDerWaalsContact O-NH2 3.07Å; T346-I411 WeakPolarHBondContact O-CD1 3.43Å; T346-P450 WeakPolarHBondContact CB-O 3.12Å; T346-P450 WeakPolarHBondContact CG2-O 3.48Å; T346-P450 PolarHBondContact OG1-O 2.97Å; T346-I452 HydrophobicContact CG2-CB 4.37Å; T346-I452 HydrophobicContact CG2-CD1 3.83Å; T346-I452 HydrophobicContact CG2-CG1 3.95Å; T346-I452 WeakPolarHBondContact OG1-CD1 3.43Å
347	H	97.3	Very high	96.5	Very high	25 Å²	25	25.8 Å²	25.8	12%	0.116	12%	0.116	C	C	.	.			trans	-113	-22.2	171.7	-70	79.4	0	0	0	112.8	K345 I411 W412 Y445 A448	K345-H347 PolarHBondContact O-CE1 3.35Å; K345-H347 PolarHBondContact O-ND1 3.35Å; H347-I411 CarbonylContact O-C 3.55Å; H347-I411 WeakPolarHBondContact O-CA 3.31Å; H347-W412 PolarHBondContact O-N 3.42Å; H347-Y445 HydrophobicContact CB-CD2 4.07Å; H347-Y445 HydrophobicContact CB-CG 4.17Å; H347-Y445 AromaticContact CD2-CD1 3.56Å; H347-Y445 AromaticContact CD2-CE1 3.83Å; H347-Y445 AromaticContact CD2-CG 3.88Å; H347-Y445 AromaticContact CG-CG 3.97Å; H347-Y445 AromaticContact NE2-CD1 3.94Å; H347-A448 HydrophobicContact CB-CB 4.15Å; H347-A448 VanDerWaalsContact ND1-CB 3.34Å; H347-A448 WeakPolarHBondContact ND1-CB 3.34Å
348	V	98.3	Very high	95.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.6	-176.9	-177	0	0	0	0	110.9	T346 V350 W412 Y414 V438 K441 Q442 M451 I452	T346-V348 WeakPolarHBondContact CG2-O 3.48Å; V348-V350 HydrophobicContact CG1-CG2 4.3Å; V348-W412 WeakPolarHBondContact CA-O 3.5Å; V348-W412 HydrophobicContact CG2-CB 4.48Å; V348-Y414 HydrophobicContact CG1-CD2 3.97Å; V348-Y414 HydrophobicContact CG1-CE2 4.19Å; V348-V438 HydrophobicContact CG1-CG1 3.98Å; V348-K441 HydrophobicContact CG2-CG 4.24Å; V348-Q442 HydrophobicContact CG2-CB 4.21Å; V348-Q442 VanDerWaalsContact CG2-OE1 3.29Å; V348-M451 HydrophobicContact CB-CG 4.29Å; V348-M451 HydrophobicContact CG1-SD 4.45Å; V348-I452 PolarHBondContact O-N 3.02Å
349	I	98.7	Very high	95.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	130.4	175.1	-58.3	174.8	0	0	0	108.9	F337 V341 T346 I411 W412 Y414 I452	F337-I349 HydrophobicContact CE1-CD1 4.05Å; F337-I349 HydrophobicContact CZ-CD1 4.12Å; F337-I349 HydrophobicContact CZ-CG2 4.21Å; V341-I349 HydrophobicContact CG1-CD1 4.41Å; V341-I349 HydrophobicContact CG2-CD1 3.89Å; T346-I349 HydrophobicContact CG2-CG1 4.26Å; I349-I411 HydrophobicContact CD1-CG2 3.56Å; I349-I411 HydrophobicContact CG1-CG2 3.88Å; I349-W412 PolarHBondContact N-O 3.39Å; I349-Y414 PolarHBondContact O-N 3.44Å; I349-I452 CarbonylContact C-O 3.56Å; I349-I452 WeakPolarHBondContact CA-O 3.18Å; I349-I452 HydrophobicContact CG1-CB 4.41Å; I349-I452 HydrophobicContact CG2-CG2 4.46Å
350	V	98.6	Very high	94.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	109.3	-179.8	-178.9	0	0	0	0	109.8	V348 T352 Y414 F434 V438 I452 I453 H454	V348-V350 HydrophobicContact CG1-CG2 4.3Å; V350-T352 HydrophobicContact CG1-CG2 4.01Å; V350-Y414 CarbonylContact C-O 3.54Å; V350-Y414 WeakPolarHBondContact CA-O 3.45Å; V350-F434 HydrophobicContact CG1-CE1 3.68Å; V350-F434 HydrophobicContact CG1-CZ 3.83Å; V350-V438 HydrophobicContact CG2-CG1 3.67Å; V350-V438 HydrophobicContact CG2-CG2 4.12Å; V350-I452 PolarHBondContact N-O 2.84Å; V350-I453 HydrophobicContact CB-CB 4.34Å; V350-I453 HydrophobicContact CB-CD1 4.48Å; V350-I453 HydrophobicContact CB-CG1 4.03Å; V350-I453 HydrophobicContact CB-CG2 4.11Å; V350-I453 HydrophobicContact CG1-CG2 4.06Å; V350-I453 HydrophobicContact CG2-CG1 4.34Å; V350-I453 CarbonylContact O-C 3.52Å; V350-I453 WeakPolarHBondContact O-CA 3.31Å; V350-H454 PolarHBondContact O-N 2.75Å
351	M	98.4	Very high	94.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.9	175.8	178.6	170.8	-177.8	0	0	109.9	T353 C363 W367 Y414 Q415 Y416 H454	M351-T353 HydrophobicContact CE-CG2 3.78Å; M351-T353 VanDerWaalsContact CE-O 3.31Å; M351-T353 WeakPolarHBondContact CE-O 3.18Å; M351-T353 HydrophobicContact CG-CG2 4.2Å; M351-C363 HydrophobicContact CE-CB 3.6Å; M351-W367 HydrophobicContact CE-CH2 4Å; M351-W367 HydrophobicContact CE-CZ3 4.34Å; M351-W367 HydrophobicContact SD-CH2 3.67Å; M351-W367 HydrophobicContact SD-CZ3 3.68Å; M351-Y414 PolarHBondContact N-O 3.04Å; M351-Q415 HydrophobicContact CB-CB 4.29Å; M351-Q415 HydrophobicContact CB-CG 4.19Å; M351-Q415 HydrophobicContact CG-CG 3.97Å; M351-Q415 CarbonylContact O-C 3.52Å; M351-Q415 WeakPolarHBondContact O-CA 3.37Å; M351-Q415 HydrophobicContact SD-CG 3.94Å; M351-Y416 PolarHBondContact O-N 2.81Å; M351-H454 VanDerWaalsContact CG-CE1 3.41Å; M351-H454 WeakPolarHBondContact CG-CE1 3.49Å
352	T	96.5	Very high	94.2	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	24%	0.243	C	C	.	.			trans	-111.4	32	-174	57.7	0	0	0	0	112.8	V350 H454 C455 R461 I465	V350-T352 HydrophobicContact CG1-CG2 4.01Å; T352-H454 PolarHBondContact N-O 3.21Å; T352-H454 PolarHBondContact OG1-O 3.41Å; T352-C455 VanDerWaalsContact OG1-CB 3.23Å; T352-C455 WeakPolarHBondContact OG1-CB 3.46Å; T352-R461 WeakPolarHBondContact O-CD 3.31Å; T352-R461 PolarHBondContact O-NH1 3.3Å; T352-I465 HydrophobicContact CG2-CG1 3.9Å
353	T	94	Very high	94.2	Very high	1 Å²	1	48 Å²	48	1%	0.006	23%	0.234	C	C	.	.	S	Bend	trans	-149.9	154.4	-177.9	-171.7	0	0	0	0	110.6	M351 E357 K362 C363 Q415 C455	M351-T353 HydrophobicContact CE-CG2 3.78Å; M351-T353 VanDerWaalsContact CE-O 3.31Å; M351-T353 WeakPolarHBondContact CE-O 3.18Å; M351-T353 HydrophobicContact CG-CG2 4.2Å; T353-E357 PolarHBondContact OG1-OE1 2.77Å; T353-E357 VanDerWaalsContact OG1-OE1 3.1Å; T353-K362 HydrophobicContact CG2-CB 4.28Å; T353-K362 VanDerWaalsContact OG1-CB 3.31Å; T353-K362 WeakPolarHBondContact OG1-CB 3.36Å; T353-C363 HydrophobicContact CG2-CB 4.13Å; T353-Q415 PolarHBondContact O-NE2 3.24Å; T353-C455 WeakPolarHBondContact CG2-O 3.35Å
354	R	94.5	Very high	94.2	Very high	110 Å²	110	48.8 Å²	48.8	42%	0.415	24%	0.24	S	C	.	.			trans	-75.6	162.9	159.8	-65.4	176.8	-173.3	-95.8	3	109.7	V356 E357 K362 L417	R354-V356 VanDerWaalsContact C-N 3.29Å; R354-V356 PolarHBondContact O-N 3.02Å; R354-E357 HydrophobicContact CB-CG 4.04Å; R354-E357 PolarHBondContact N-OE1 3.49Å; R354-K362 WeakPolarHBondContact O-CB 3.42Å; R354-L417 HydrophobicContact CG-CD2 3.9Å; R354-L417 VanDerWaalsContact CZ-O 3.25Å; R354-L417 PolarHBondContact NE-O 2.9Å; R354-L417 VanDerWaalsContact NE-O 3.08Å; R354-L417 PolarHBondContact NH2-O 3.4Å
355	E	93.4	Very high	94.1	Very high	57 Å²	57	50.9 Å²	50.9	27%	0.266	26%	0.256	S	S	.	.	S	Bend	trans	-60.8	-43.9	176.3	-59.2	73.9	-164.2	0	0	110.3	K362 C363 P365 W367 Q415	E355-K362 PolarHBondContact O-N 2.88Å; E355-C363 VanDerWaalsContact CA-O 3.32Å; E355-C363 WeakPolarHBondContact CA-O 3.33Å; E355-C363 PolarHBondContact O-N 2.83Å; E355-P365 HydrophobicContact CG-CG 3.99Å; E355-W367 HydrophobicContact CG-CH2 4.5Å; E355-W367 WeakPolarHBondContact OE1-CZ2 3.17Å; E355-Q415 PolarHBondContact OE1-NE2 3.37Å
356	V	92.6	Very high	94.1	Very high	70 Å²	70	44.6 Å²	44.6	42%	0.424	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.4	179.8	-174.1	0	0	0	0	109.5	R354 R360 N361	R354-V356 VanDerWaalsContact C-N 3.29Å; R354-V356 PolarHBondContact O-N 3.02Å; V356-R360 WeakPolarHBondContact CA-O 3.49Å; V356-N361 WeakPolarHBondContact CG2-OD1 3.48Å
357	E	88.1	Confident	94	Very high	9 Å²	9	45.5 Å²	45.5	4%	0.042	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.7	174.8	-67.7	179.5	178.5	0	0	108.6	T353 R354 G359 R360 K362 D421 R461	T353-E357 PolarHBondContact OG1-OE1 2.77Å; T353-E357 VanDerWaalsContact OG1-OE1 3.1Å; R354-E357 HydrophobicContact CB-CG 4.04Å; R354-E357 PolarHBondContact N-OE1 3.49Å; E357-G359 PolarHBondContact O-N 3.08Å; E357-R360 PolarHBondContact N-O 3.05Å; E357-R360 PolarHBondContact O-N 3.44Å; E357-K362 HydrophobicContact CB-CD 4.48Å; E357-K362 HydrophobicContact CB-CG 3.92Å; E357-K362 HydrophobicContact CG-CG 3.91Å; E357-K362 WeakPolarHBondContact OE2-CE 3.38Å; E357-K362 IonicContact OE2-NZ 3.96Å; E357-D421 WeakPolarHBondContact CB-OD1 3.47Å; E357-D421 WeakPolarHBondContact CG-OD1 3.37Å; E357-R461 IonicContact OE1-CZ 2.76Å; E357-R461 IonicContact OE1-NH1 2.81Å; E357-R461 PolarHBondContact OE1-NH1 3.44Å; E357-R461 IonicContact OE1-NH2 3.65Å; E357-R461 PolarHBondContact OE1-NH2 2.87Å; E357-R461 IonicContact OE2-CZ 3.97Å; E357-R461 IonicContact OE2-NH1 3.45Å; E357-R461 PolarHBondContact OE2-NH1 3.44Å; E357-R461 IonicContact OE2-NH2 3.4Å; E357-R461 PolarHBondContact OE2-NH2 2.68Å
358	K	83.5	Confident	93.8	Very high	136 Å²	136	44.8 Å²	44.8	59%	0.591	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.7	41	-174.5	-54.4	-165.6	171.5	-171.5	0	114.3	R360 D421 H422	K358-R360 PolarHBondContact O-N 2.86Å; K358-D421 HydrophobicContact CD-CB 4.29Å; K358-D421 VanDerWaalsContact CE-OD2 3.27Å; K358-D421 WeakPolarHBondContact CE-OD2 3.36Å; K358-D421 HydrophobicContact CG-CB 4.27Å; K358-D421 WeakPolarHBondContact CG-OD2 3.49Å; K358-H422 PolarHBondContact NZ-CD2 3.48Å; K358-H422 PolarHBondContact NZ-NE2 3.24Å
359	G	86.3	Confident	93.3	Very high	71 Å²	71	51.1 Å²	51.1	73%	0.732	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	10.3	-179.3	0	0	0	0	0	114.9	E357	E357-G359 PolarHBondContact O-N 3.08Å
360	R	87.1	Confident	92.5	Very high	189 Å²	189	54.3 Å²	54.3	71%	0.713	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.7	174.4	-63.9	-175.3	-178.2	-178.7	1.1	110.6	V356 E357 K358 K362	V356-R360 WeakPolarHBondContact CA-O 3.49Å; E357-R360 PolarHBondContact N-O 3.05Å; E357-R360 PolarHBondContact O-N 3.44Å; K358-R360 PolarHBondContact O-N 2.86Å; R360-K362 PolarHBondContact O-N 3.41Å
361	N	92.3	Very high	91.4	Very high	110 Å²	110	63 Å²	63	59%	0.588	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	119.6	176.9	-65.7	-20.4	0	0	0	110.7	R278 V356	R278-N361 PolarHBondContact NH1-O 3.44Å; R278-N361 VanDerWaalsContact NH1-O 3.09Å; V356-N361 WeakPolarHBondContact CG2-OD1 3.48Å
362	K	92.9	Very high	90.8	Very high	45 Å²	45	70.2 Å²	70.2	20%	0.196	36%	0.36	C	S	.	.	S	Bend	trans	-99.9	-37.9	178.3	-61.4	-62	-172.5	163.3	0	112.4	R278 T353 R354 E355 E357 R360 S456	R278-K362 PolarHBondContact NE-O 3.32Å; R278-K362 VanDerWaalsContact NE-O 3.11Å; R278-K362 PolarHBondContact NH1-O 3.03Å; R278-K362 PolarHBondContact NH2-O 3.46Å; T353-K362 HydrophobicContact CG2-CB 4.28Å; T353-K362 VanDerWaalsContact OG1-CB 3.31Å; T353-K362 WeakPolarHBondContact OG1-CB 3.36Å; R354-K362 WeakPolarHBondContact O-CB 3.42Å; E355-K362 PolarHBondContact O-N 2.88Å; E357-K362 HydrophobicContact CB-CD 4.48Å; E357-K362 HydrophobicContact CB-CG 3.92Å; E357-K362 HydrophobicContact CG-CG 3.91Å; E357-K362 WeakPolarHBondContact OE2-CE 3.38Å; E357-K362 IonicContact OE2-NZ 3.96Å; R360-K362 PolarHBondContact O-N 3.41Å; K362-S456 WeakPolarHBondContact CD-OG 3.32Å; K362-S456 PolarHBondContact O-OG 2.79Å
363	C	96.8	Very high	90.5	Very high	3 Å²	3	74.4 Å²	74.4	2%	0.02	39%	0.386	C	S	.	.			trans	-154.4	135.4	177.5	-174	0	0	0	0	108.5	C329 M351 T353 E355	C329-C363 PolarHBondContact N-SG 2.94Å; M351-C363 HydrophobicContact CE-CB 3.6Å; T353-C363 HydrophobicContact CG2-CB 4.13Å; E355-C363 VanDerWaalsContact CA-O 3.32Å; E355-C363 WeakPolarHBondContact CA-O 3.33Å; E355-C363 PolarHBondContact O-N 2.83Å
364	V	96.6	Very high	90.4	Very high	39 Å²	39	79 Å²	79	24%	0.236	41%	0.407	C	S	.	.			trans	-78.9	146.3	168.5	-52.3	0	0	0	0	109.2	C329 V334 Y366	C329-V364 HydrophobicContact CB-CG2 4.09Å; C329-V364 WeakPolarHBondContact O-CG2 3.41Å; C329-V364 PolarHBondContact O-N 2.97Å; V334-V364 HydrophobicContact CG2-CG2 3.76Å; V364-Y366 PolarHBondContact O-N 3.01Å
365	P	96.1	Very high	90.4	Very high	69 Å²	69	80.5 Å²	80.5	45%	0.448	42%	0.418	S	S	.	.			trans	-59.3	125.3	170.2	-21.3	32	0	0	0	110.3	E355 W367	E355-P365 HydrophobicContact CG-CG 3.99Å; P365-W367 HydrophobicContact CB-CH2 4.43Å; P365-W367 HydrophobicContact CB-CZ2 4.21Å
366	Y	96.4	Very high	90.3	Very high	1 Å²	1	78 Å²	78	0%	0.004	41%	0.406	C	S	.	.			trans	-110.8	2.2	176.4	54	-98	0	0	0	112.5	C329 F337 W338 V364 H413 H454	C329-Y366 HydrophobicContact CB-CD1 3.92Å; C329-Y366 VanDerWaalsContact SG-CD1 3.5Å; F337-Y366 AromaticContact CD1-CD2 3.97Å; F337-Y366 HydrophobicContact CD1-CD2 3.97Å; F337-Y366 HydrophobicContact CD1-CE2 4.28Å; F337-Y366 HydrophobicContact CD1-CG 4.23Å; F337-Y366 AromaticContact CE1-CD2 3.62Å; F337-Y366 HydrophobicContact CE1-CD2 3.62Å; F337-Y366 HydrophobicContact CE1-CE1 4.39Å; F337-Y366 AromaticContact CE1-CE2 3.46Å; F337-Y366 HydrophobicContact CE1-CE2 3.46Å; F337-Y366 VanDerWaalsContact CE1-CE2 3.46Å; F337-Y366 HydrophobicContact CE1-CG 4.19Å; F337-Y366 AromaticContact CE1-CZ 3.87Å; F337-Y366 HydrophobicContact CZ-CD2 4.46Å; F337-Y366 HydrophobicContact CZ-CE1 4.4Å; F337-Y366 AromaticContact CZ-CE2 3.97Å; F337-Y366 HydrophobicContact CZ-CE2 3.97Å; F337-Y366 AromaticContact CZ-CZ 3.91Å; W338-Y366 AromaticContact CZ2-CD2 3.79Å; W338-Y366 HydrophobicContact CZ2-CD2 3.79Å; W338-Y366 HydrophobicContact CZ2-CE2 4.37Å; W338-Y366 WeakPolarHBondContact CZ2-O 3.3Å; W338-Y366 PolarHBondContact NE1-O 3.34Å; V364-Y366 PolarHBondContact O-N 3.01Å; Y366-H413 AromaticContact CE2-CD2 3.83Å; Y366-H413 AromaticContact CE2-NE2 3.81Å; Y366-H413 AromaticContact CZ-CD2 3.87Å; Y366-H413 AromaticContact CZ-NE2 3.45Å; Y366-H413 PolarHBondContact OH-CD2 3.02Å; Y366-H413 PolarHBondContact OH-NE2 2.91Å; Y366-H454 AromaticContact CE1-CE1 3.75Å; Y366-H454 AromaticContact CE1-NE2 3.54Å; Y366-H454 AromaticContact CZ-NE2 3.56Å; Y366-H454 PolarHBondContact OH-NE2 3.08Å
367	W	95.6	Very high	90.1	Very high	20 Å²	20	77 Å²	77	8%	0.076	41%	0.411	C	S	.	.	S	Bend	trans	-105.5	154.5	174.9	57.6	90.5	0	0	0	110.4	M351 E355 P365 L397 H413	M351-W367 HydrophobicContact CE-CH2 4Å; M351-W367 HydrophobicContact CE-CZ3 4.34Å; M351-W367 HydrophobicContact SD-CH2 3.67Å; M351-W367 HydrophobicContact SD-CZ3 3.68Å; E355-W367 HydrophobicContact CG-CH2 4.5Å; E355-W367 WeakPolarHBondContact OE1-CZ2 3.17Å; P365-W367 HydrophobicContact CB-CH2 4.43Å; P365-W367 HydrophobicContact CB-CZ2 4.21Å; W367-L397 HydrophobicContact CB-CD1 3.96Å; W367-L397 HydrophobicContact CB-CD2 4.18Å; W367-H413 AromaticContact CE3-NE2 3.87Å; W367-H413 AromaticContact CZ3-CE1 3.97Å; W367-H413 AromaticContact CZ3-NE2 3.86Å
368	P	93.2	Very high	90.3	Very high	9 Å²	9	79.4 Å²	79.4	6%	0.058	43%	0.433	C	S	.	.			trans	-79.9	166	170.8	34.5	-37.1	0	0	0	112.3	E372 K374 V381 C383	P368-E372 VanDerWaalsContact CB-O 3.24Å; P368-E372 WeakPolarHBondContact CB-O 3.27Å; P368-K374 HydrophobicContact CB-CB 3.88Å; P368-V381 HydrophobicContact CG-CG1 4.27Å; P368-V381 WeakPolarHBondContact CG-O 3.22Å; P368-C383 HydrophobicContact CG-CB 4.09Å
369	D	87.8	Confident	90.9	Very high	134 Å²	134	73.6 Å²	73.6	72%	0.717	41%	0.407	S	S	*	.			trans	-73	156.4	163.1	-63.3	-39.2	0	0	0	110.4	Q371 E372	D369-Q371 PolarHBondContact O-N 3.44Å; D369-E372 PolarHBondContact O-N 2.83Å
370	C	81.9	Confident	91.4	Very high	66 Å²	66	72 Å²	72	45%	0.446	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-4.3	-175.6	-58.9	0	0	0	0	115.7	C383	C370-C383 WeakPolarHBondContact CA-O 3.37Å; C370-C383 PolarHBondContact SG-SG 3.5Å
371	Q	76.2	Confident	91.8	Very high	183 Å²	183	63 Å²	63	86%	0.855	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-29.8	-174.6	-64.3	-174.1	-2	0	0	113.3	D369	D369-Q371 PolarHBondContact O-N 3.44Å
372	E	85.5	Confident	92	Very high	152 Å²	152	60 Å²	60	71%	0.71	34%	0.336	S	S	*	.	S	Bend	trans	-137.2	127	-172.3	-67.2	-171.5	169.9	0	0	111.9	P368 D369	P368-E372 VanDerWaalsContact CB-O 3.24Å; P368-E372 WeakPolarHBondContact CB-O 3.27Å; D369-E372 PolarHBondContact O-N 2.83Å
373	P	89.8	Confident	92.1	Very high	88 Å²	88	58.2 Å²	58.2	57%	0.571	33%	0.33	S	S	*	.			trans	-64.8	145.3	170.3	28.3	-32.9	0	0	0	110.3	V380 V381	P373-V380 HydrophobicContact CB-CG1 3.72Å; P373-V381 CarbonylContact C-O 3.51Å; P373-V381 WeakPolarHBondContact CA-O 3.4Å
374	K	93	Very high	92	Very high	99 Å²	99	64 Å²	64	43%	0.43	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.5	179.7	-175	174	-177.3	175.1	0	110.8	P368 V376 V381	P368-K374 HydrophobicContact CB-CB 3.88Å; K374-V376 HydrophobicContact CG-CG1 4.32Å; K374-V381 PolarHBondContact N-O 3.33Å; K374-V381 PolarHBondContact O-N 3.12Å
375	E	93.3	Very high	91.9	Very high	141 Å²	141	64.2 Å²	64.2	66%	0.659	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	129.7	170.7	-61.1	-172	174.5	0	0	110.2	V380	E375-V380 HydrophobicContact CG-CG2 4.27Å
376	V	91.1	Very high	91.8	Very high	3 Å²	3	64.3 Å²	64.3	2%	0.018	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	82.4	-178.3	-72.1	0	0	0	0	109	V334 W338 K374 A378 Y379 V381	V334-V376 HydrophobicContact CG1-CG1 4.07Å; W338-V376 HydrophobicContact CB-CG2 4Å; W338-V376 HydrophobicContact CG-CB 4.37Å; W338-V376 HydrophobicContact CG-CG2 3.76Å; K374-V376 HydrophobicContact CG-CG1 4.32Å; V376-A378 PolarHBondContact O-N 3.46Å; V376-Y379 PolarHBondContact N-O 3.26Å; V376-Y379 PolarHBondContact O-N 2.97Å; V376-V381 HydrophobicContact CG2-CB 4.44Å; V376-V381 HydrophobicContact CG2-CG2 3.61Å
377	G	89.6	Confident	91.7	Very high	51 Å²	51	69.5 Å²	69.5	53%	0.526	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	-118.7	-175.1	0	0	0	0	0	111.6	Y379	G377-Y379 VanDerWaalsContact C-N 3.27Å; G377-Y379 PolarHBondContact O-N 3.42Å
378	A	92.3	Very high	91.6	Very high	59 Å²	59	75.4 Å²	75.4	49%	0.488	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	5.8	-179	0	0	0	0	0	114.1	V376 P401 V402	V376-A378 PolarHBondContact O-N 3.46Å; A378-P401 WeakPolarHBondContact O-CA 3.38Å; A378-V402 PolarHBondContact O-N 2.83Å
379	Y	95.7	Very high	91.5	Very high	14 Å²	14	77 Å²	77	6%	0.055	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	154	-174.6	-51.7	-76.6	0	0	0	112.1	Q339 W342 V376 G377 I399 A400 P401	Q339-Y379 HydrophobicContact CB-CE2 4.32Å; Q339-Y379 PolarHBondContact NE2-OH 3.36Å; Q339-Y379 PolarHBondContact OE1-OH 2.83Å; W342-Y379 HydrophobicContact CB-CD1 4.33Å; W342-Y379 HydrophobicContact CB-CE1 3.67Å; W342-Y379 HydrophobicContact CB-CE2 4.19Å; W342-Y379 AromaticContact CD1-CE1 3.49Å; W342-Y379 VanDerWaalsContact CD1-CE1 3.49Å; W342-Y379 AromaticContact CD1-CZ 3.58Å; W342-Y379 HydrophobicContact CD2-CD1 4.11Å; W342-Y379 AromaticContact CD2-CE1 3.53Å; W342-Y379 HydrophobicContact CD2-CE1 3.53Å; W342-Y379 AromaticContact CE2-CE1 3.93Å; W342-Y379 HydrophobicContact CE3-CD1 4.34Å; W342-Y379 HydrophobicContact CE3-CE1 4.21Å; W342-Y379 HydrophobicContact CG-CD1 4.1Å; W342-Y379 AromaticContact CG-CE1 3.23Å; W342-Y379 HydrophobicContact CG-CE1 3.23Å; W342-Y379 AromaticContact CG-CZ 3.5Å; W342-Y379 AromaticContact NE1-CE1 3.84Å; V376-Y379 PolarHBondContact N-O 3.26Å; V376-Y379 PolarHBondContact O-N 2.97Å; G377-Y379 VanDerWaalsContact C-N 3.27Å; G377-Y379 PolarHBondContact O-N 3.42Å; Y379-I399 HydrophobicContact CD1-CD1 4.15Å; Y379-I399 HydrophobicContact CD1-CG1 4.27Å; Y379-I399 HydrophobicContact CG-CD1 3.96Å; Y379-I399 HydrophobicContact CG-CG1 4.31Å; Y379-A400 CarbonylContact C-O 3.47Å; Y379-A400 WeakPolarHBondContact CA-O 3.5Å; Y379-P401 HydrophobicContact CD1-CB 4.41Å; Y379-P401 HydrophobicContact CD1-CG 4.42Å; Y379-P401 HydrophobicContact CE1-CG 4.38Å
380	V	96.1	Very high	91.5	Very high	38 Å²	38	77.1 Å²	77.1	23%	0.23	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.2	166.2	-171.2	0	0	0	0	107.7	P373 E375 I399 A400 V402	P373-V380 HydrophobicContact CB-CG1 3.72Å; E375-V380 HydrophobicContact CG-CG2 4.27Å; V380-I399 WeakPolarHBondContact O-CA 3.45Å; V380-A400 PolarHBondContact N-O 2.7Å; V380-A400 PolarHBondContact O-N 2.88Å; V380-V402 HydrophobicContact CG2-CB 4.41Å; V380-V402 HydrophobicContact CG2-CG2 3.79Å
381	V	96.6	Very high	92	Very high	0 Å²	0	76.2 Å²	76.2	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132.7	173	179.8	0	0	0	0	108.8	W338 P368 P373 K374 V376 L397 H398 I399	W338-V381 HydrophobicContact CD2-CG2 3.74Å; W338-V381 HydrophobicContact CE3-CG2 3.95Å; W338-V381 HydrophobicContact CG-CG2 4.28Å; W338-V381 HydrophobicContact CH2-CG1 3.77Å; W338-V381 HydrophobicContact CH2-CG2 4.01Å; W338-V381 HydrophobicContact CZ2-CB 4.29Å; W338-V381 HydrophobicContact CZ2-CG1 3.7Å; W338-V381 HydrophobicContact CZ2-CG2 3.83Å; W338-V381 HydrophobicContact CZ3-CG1 4.49Å; W338-V381 HydrophobicContact CZ3-CG2 4.07Å; P368-V381 HydrophobicContact CG-CG1 4.27Å; P368-V381 WeakPolarHBondContact CG-O 3.22Å; P373-V381 CarbonylContact C-O 3.51Å; P373-V381 WeakPolarHBondContact CA-O 3.4Å; K374-V381 PolarHBondContact N-O 3.33Å; K374-V381 PolarHBondContact O-N 3.12Å; V376-V381 HydrophobicContact CG2-CB 4.44Å; V376-V381 HydrophobicContact CG2-CG2 3.61Å; V381-L397 HydrophobicContact CG1-CB 4.41Å; V381-H398 CarbonylContact C-O 3.6Å; V381-H398 VanDerWaalsContact CA-O 3.24Å; V381-H398 WeakPolarHBondContact CA-O 3.43Å; V381-I399 HydrophobicContact CG2-CB 4.3Å; V381-I399 HydrophobicContact CG2-CD1 4.33Å; V381-I399 HydrophobicContact CG2-CG1 4.17Å
382	S	95.4	Very high	92.9	Very high	45 Å²	45	68.9 Å²	68.9	32%	0.315	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	153.8	171.5	59	0	0	0	0	110.6	L397 H398	S382-L397 CarbonylContact O-C 3.53Å; S382-L397 VanDerWaalsContact O-CA 3.26Å; S382-L397 WeakPolarHBondContact O-CA 3.45Å; S382-H398 PolarHBondContact N-O 2.91Å; S382-H398 PolarHBondContact O-N 3.09Å
383	C	95.8	Very high	93.4	Very high	9 Å²	9	63.6 Å²	63.6	6%	0.061	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	118.6	174.3	-175.7	0	0	0	0	108.7	P368 C370 L397	P368-C383 HydrophobicContact CG-CB 4.09Å; C370-C383 WeakPolarHBondContact CA-O 3.37Å; C370-C383 PolarHBondContact SG-SG 3.5Å; C383-L397 HydrophobicContact CB-CD2 3.63Å
384	E	94.4	Very high	93.7	Very high	125 Å²	125	60.2 Å²	60.2	58%	0.584	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	-45.8	-179.4	-178.6	-178.3	162.7	0	0	111.5	L396 H398	E384-L396 HydrophobicContact CB-CD2 4.46Å; E384-L396 HydrophobicContact CB-CG 4.32Å; E384-L396 PolarHBondContact N-O 3.46Å; E384-L396 WeakPolarHBondContact OE2-CD2 3.4Å; E384-H398 IonicContact OE2-CE1 2.7Å; E384-H398 PolarHBondContact OE2-CE1 3.23Å; E384-H398 IonicContact OE2-ND1 3.75Å; E384-H398 IonicContact OE2-NE2 3.81Å
385	S	94.2	Very high	93.9	Very high	42 Å²	42	55.9 Å²	55.9	29%	0.294	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	151.6	-179.4	60.1	0	0	0	0	112	R395 L396	S385-R395 VanDerWaalsContact O-CA 3.31Å; S385-R395 WeakPolarHBondContact O-CA 3.35Å; S385-L396 PolarHBondContact O-N 2.99Å
386	E	95.1	Very high	94.1	Very high	71 Å²	71	50.1 Å²	50.1	33%	0.332	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.5	169.9	-179.2	166.5	148.2	0	0	108.4	K393 V394 R395	E386-K393 WeakPolarHBondContact OE1-CD 3.38Å; E386-K393 IonicContact OE1-NZ 3.62Å; E386-K393 PolarHBondContact OE1-NZ 2.83Å; E386-V394 CarbonylContact C-O 3.55Å; E386-V394 WeakPolarHBondContact CA-O 3.41Å; E386-R395 HydrophobicContact CB-CG 4.25Å; E386-R395 HydrophobicContact CG-CG 4.03Å; E386-R395 IonicContact OE1-NH2 3.46Å; E386-R395 PolarHBondContact OE1-NH2 3.34Å; E386-R395 IonicContact OE2-CZ 2.92Å; E386-R395 IonicContact OE2-NE 3.27Å; E386-R395 PolarHBondContact OE2-NE 3.39Å; E386-R395 IonicContact OE2-NH2 2.72Å; E386-R395 PolarHBondContact OE2-NH2 3.41Å
387	L	94.1	Very high	94.4	Very high	111 Å²	111	50 Å²	50	58%	0.581	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.7	176.2	-62.6	174.4	0	0	0	108.7	K393 V394	L387-K393 CarbonylContact O-C 3.53Å; L387-K393 WeakPolarHBondContact O-CA 3.48Å; L387-V394 HydrophobicContact CB-CB 4.42Å; L387-V394 PolarHBondContact N-O 3.07Å; L387-V394 PolarHBondContact O-N 3.34Å
388	E	92.7	Very high	94.7	Very high	143 Å²	143	49.5 Å²	49.5	67%	0.668	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	121.4	174.5	-59.7	-166.3	155.5	0	0	109.8	K393	E388-K393 HydrophobicContact CG-CD 4.45Å; E388-K393 HydrophobicContact CG-CG 4.22Å; E388-K393 WeakPolarHBondContact OE1-CE 3.47Å; E388-K393 IonicContact OE1-NZ 3.49Å; E388-K393 PolarHBondContact OE1-NZ 3.47Å
389	A	90.5	Very high	94.9	Very high	43 Å²	43	46.7 Å²	46.7	36%	0.355	25%	0.252	S	S	.	.			trans	-105.2	173.4	165.6	0	0	0	0	0	109.5	D391 Y392	A389-D391 PolarHBondContact O-N 2.82Å; A389-Y392 CarbonylContact C-O 3.57Å; A389-Y392 WeakPolarHBondContact CA-O 3.49Å; A389-Y392 HydrophobicContact CB-CD1 4.16Å; A389-Y392 HydrophobicContact CB-CD2 4.18Å; A389-Y392 HydrophobicContact CB-CE1 3.92Å; A389-Y392 HydrophobicContact CB-CE2 3.93Å; A389-Y392 HydrophobicContact CB-CG 4.28Å; A389-Y392 WeakPolarHBondContact CB-O 3.43Å; A389-Y392 PolarHBondContact N-O 3.08Å
390	T	88.8	Confident	95	Very high	136 Å²	136	46.6 Å²	46.6	83%	0.834	25%	0.253	S	S	*	.	S	Bend	trans	-56.4	-47.2	-177.5	-49.1	0	0	0	0	112.6
391	D	91.4	Very high	94.9	Very high	47 Å²	47	45.7 Å²	45.7	25%	0.251	25%	0.249	S	C	.	.	S	Bend	trans	-106.5	-12.7	-172.2	-67.2	-48.1	0	0	0	114.8	A389 Y416 L417 S418	A389-D391 PolarHBondContact O-N 2.82Å; D391-Y416 HydrophobicContact CB-CD2 4.5Å; D391-Y416 HydrophobicContact CB-CE2 3.76Å; D391-L417 PolarHBondContact O-N 3.31Å; D391-S418 VanDerWaalsContact CA-OG 3.32Å; D391-S418 WeakPolarHBondContact CA-OG 3.26Å; D391-S418 PolarHBondContact O-N 3.47Å; D391-S418 VanDerWaalsContact OD1-CB 3.23Å; D391-S418 WeakPolarHBondContact OD1-CB 3.26Å; D391-S418 PolarHBondContact OD1-OG 3.26Å
392	Y	94.9	Very high	94.8	Very high	29 Å²	29	48.4 Å²	48.4	11%	0.114	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	160.7	-173.2	63.8	-89.3	0	0	0	112.1	A389 V394 Y414 Q415 F434	A389-Y392 CarbonylContact C-O 3.57Å; A389-Y392 WeakPolarHBondContact CA-O 3.49Å; A389-Y392 HydrophobicContact CB-CD1 4.16Å; A389-Y392 HydrophobicContact CB-CD2 4.18Å; A389-Y392 HydrophobicContact CB-CE1 3.92Å; A389-Y392 HydrophobicContact CB-CE2 3.93Å; A389-Y392 HydrophobicContact CB-CG 4.28Å; A389-Y392 WeakPolarHBondContact CB-O 3.43Å; A389-Y392 PolarHBondContact N-O 3.08Å; Y392-V394 HydrophobicContact CD2-CG2 3.62Å; Y392-V394 HydrophobicContact CE2-CG2 3.41Å; Y392-V394 VanDerWaalsContact CE2-CG2 3.41Å; Y392-Y414 HydrophobicContact CD2-CD1 4.32Å; Y392-Y414 HydrophobicContact CE2-CD1 4.35Å; Y392-Y414 HydrophobicContact CE2-CE1 4.46Å; Y392-Q415 CarbonylContact C-O 3.46Å; Y392-Q415 WeakPolarHBondContact CA-O 3.33Å; Y392-Q415 VanDerWaalsContact CB-O 3.3Å; Y392-Q415 WeakPolarHBondContact CB-O 3.41Å; Y392-F434 HydrophobicContact CD1-CB 4.29Å; Y392-F434 AromaticContact CD1-CD2 3.65Å; Y392-F434 HydrophobicContact CD1-CD2 3.65Å; Y392-F434 HydrophobicContact CD1-CE2 4.49Å; Y392-F434 HydrophobicContact CD1-CG 4.45Å; Y392-F434 AromaticContact CD2-CD2 3.98Å; Y392-F434 HydrophobicContact CD2-CD2 3.98Å; Y392-F434 HydrophobicContact CD2-CE2 4.17Å; Y392-F434 HydrophobicContact CE1-CD2 4.24Å; Y392-F434 AromaticContact CG-CD2 3.51Å; Y392-F434 HydrophobicContact CG-CD2 3.51Å; Y392-F434 AromaticContact CG-CE2 3.92Å; Y392-F434 HydrophobicContact CG-CE2 3.92Å
393	K	96.1	Very high	94.6	Very high	42 Å²	42	53.5 Å²	53.5	18%	0.183	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	145.2	169.7	-69.2	-178.7	168.4	-142.7	0	110.1	E386 L387 E388 Q415 L417	E386-K393 WeakPolarHBondContact OE1-CD 3.38Å; E386-K393 IonicContact OE1-NZ 3.62Å; E386-K393 PolarHBondContact OE1-NZ 2.83Å; L387-K393 CarbonylContact O-C 3.53Å; L387-K393 WeakPolarHBondContact O-CA 3.48Å; E388-K393 HydrophobicContact CG-CD 4.45Å; E388-K393 HydrophobicContact CG-CG 4.22Å; E388-K393 WeakPolarHBondContact OE1-CE 3.47Å; E388-K393 IonicContact OE1-NZ 3.49Å; E388-K393 PolarHBondContact OE1-NZ 3.47Å; K393-Q415 HydrophobicContact CB-CB 4.45Å; K393-Q415 PolarHBondContact N-O 3.46Å; K393-Q415 PolarHBondContact O-N 2.87Å; K393-L417 HydrophobicContact CD-CD1 3.79Å; K393-L417 HydrophobicContact CG-CD1 3.67Å
394	V	97.2	Very high	94.5	Very high	17 Å²	17	58.2 Å²	58.2	10%	0.103	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.4	172.9	-170.7	0	0	0	0	108.3	E386 L387 Y392 W412 H413 Y414	E386-V394 CarbonylContact C-O 3.55Å; E386-V394 WeakPolarHBondContact CA-O 3.41Å; L387-V394 HydrophobicContact CB-CB 4.42Å; L387-V394 PolarHBondContact N-O 3.07Å; L387-V394 PolarHBondContact O-N 3.34Å; Y392-V394 HydrophobicContact CD2-CG2 3.62Å; Y392-V394 HydrophobicContact CE2-CG2 3.41Å; Y392-V394 VanDerWaalsContact CE2-CG2 3.41Å; V394-W412 HydrophobicContact CG1-CE3 3.95Å; V394-W412 HydrophobicContact CG1-CZ3 4.35Å; V394-H413 CarbonylContact C-O 3.59Å; V394-H413 WeakPolarHBondContact CA-O 3.18Å; V394-Y414 HydrophobicContact CG1-CD1 4.38Å; V394-Y414 HydrophobicContact CG1-CE1 4.08Å; V394-Y414 HydrophobicContact CG2-CD1 3.75Å; V394-Y414 HydrophobicContact CG2-CE1 3.67Å
395	R	97.1	Very high	94.2	Very high	8 Å²	8	56.7 Å²	56.7	3%	0.03	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.3	170.8	-57.8	179.8	-177.8	90.2	12.7	109.5	S385 E386 L397 H413	S385-R395 VanDerWaalsContact O-CA 3.31Å; S385-R395 WeakPolarHBondContact O-CA 3.35Å; E386-R395 HydrophobicContact CB-CG 4.25Å; E386-R395 HydrophobicContact CG-CG 4.03Å; E386-R395 IonicContact OE1-NH2 3.46Å; E386-R395 PolarHBondContact OE1-NH2 3.34Å; E386-R395 IonicContact OE2-CZ 2.92Å; E386-R395 IonicContact OE2-NE 3.27Å; E386-R395 PolarHBondContact OE2-NE 3.39Å; E386-R395 IonicContact OE2-NH2 2.72Å; E386-R395 PolarHBondContact OE2-NH2 3.41Å; R395-L397 HydrophobicContact CB-CD2 3.97Å; R395-L397 HydrophobicContact CB-CG 4.22Å; R395-H413 HydrophobicContact CB-CB 4.16Å; R395-H413 PolarHBondContact N-O 2.78Å; R395-H413 PolarHBondContact NH1-CE1 3.46Å; R395-H413 PolarHBondContact O-N 2.88Å
396	L	97.1	Very high	94	Very high	20 Å²	20	64.4 Å²	64.4	11%	0.105	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	103.8	167.9	179.7	56.2	0	0	0	108	E384 S385 P410 W412	E384-L396 HydrophobicContact CB-CD2 4.46Å; E384-L396 HydrophobicContact CB-CG 4.32Å; E384-L396 PolarHBondContact N-O 3.46Å; E384-L396 WeakPolarHBondContact OE2-CD2 3.4Å; S385-L396 PolarHBondContact O-N 2.99Å; L396-P410 HydrophobicContact CD1-CB 4.08Å; L396-W412 HydrophobicContact CD1-CD2 4.01Å; L396-W412 HydrophobicContact CD1-CE3 4.39Å; L396-W412 HydrophobicContact CD1-CH2 4.29Å; L396-W412 HydrophobicContact CD1-CZ2 3.9Å; L396-W412 HydrophobicContact CD2-CH2 4.33Å; L396-W412 HydrophobicContact CD2-CZ2 4.43Å
397	L	97.6	Very high	93.8	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	155.6	178.6	-52.2	177.7	0	0	0	109.8	W338 W367 V381 S382 C383 R395 P410 I411 H413	W338-L397 HydrophobicContact CH2-CD1 3.81Å; W338-L397 HydrophobicContact CZ2-CD1 4.28Å; W367-L397 HydrophobicContact CB-CD1 3.96Å; W367-L397 HydrophobicContact CB-CD2 4.18Å; V381-L397 HydrophobicContact CG1-CB 4.41Å; S382-L397 CarbonylContact O-C 3.53Å; S382-L397 VanDerWaalsContact O-CA 3.26Å; S382-L397 WeakPolarHBondContact O-CA 3.45Å; C383-L397 HydrophobicContact CB-CD2 3.63Å; R395-L397 HydrophobicContact CB-CD2 3.97Å; R395-L397 HydrophobicContact CB-CG 4.22Å; L397-P410 CarbonylContact O-C 3.49Å; L397-P410 WeakPolarHBondContact O-CA 3.19Å; L397-I411 HydrophobicContact CB-CB 4.19Å; L397-I411 PolarHBondContact N-O 3.25Å; L397-I411 PolarHBondContact O-N 3.35Å; L397-H413 HydrophobicContact CD1-CB 3.83Å; L397-H413 HydrophobicContact CG-CB 4.23Å
398	H	96.6	Very high	93.8	Very high	41 Å²	41	63 Å²	63	19%	0.19	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.2	170.7	-78.7	79.4	0	0	0	109.1	V381 S382 E384 S408 R409	V381-H398 CarbonylContact C-O 3.6Å; V381-H398 VanDerWaalsContact CA-O 3.24Å; V381-H398 WeakPolarHBondContact CA-O 3.43Å; S382-H398 PolarHBondContact N-O 2.91Å; S382-H398 PolarHBondContact O-N 3.09Å; E384-H398 IonicContact OE2-CE1 2.7Å; E384-H398 PolarHBondContact OE2-CE1 3.23Å; E384-H398 IonicContact OE2-ND1 3.75Å; E384-H398 IonicContact OE2-NE2 3.81Å; H398-S408 PolarHBondContact CD2-OG 3.21Å; H398-R409 WeakPolarHBondContact CA-O 3.31Å
399	I	96.6	Very high	93.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.1	173.8	-177.5	166.8	0	0	0	110	W338 W342 Y379 V380 V381 S408 R409 I411	W338-I399 HydrophobicContact CB-CD1 4.42Å; W338-I399 HydrophobicContact CD2-CD1 4.37Å; W338-I399 HydrophobicContact CE3-CD1 3.62Å; W338-I399 HydrophobicContact CZ3-CD1 4.23Å; W342-I399 HydrophobicContact CB-CD1 4.26Å; W342-I399 HydrophobicContact CE3-CD1 4.23Å; W342-I399 HydrophobicContact CE3-CG1 4.08Å; W342-I399 HydrophobicContact CE3-CG2 4.05Å; W342-I399 HydrophobicContact CZ3-CG2 4.28Å; Y379-I399 HydrophobicContact CD1-CD1 4.15Å; Y379-I399 HydrophobicContact CD1-CG1 4.27Å; Y379-I399 HydrophobicContact CG-CD1 3.96Å; Y379-I399 HydrophobicContact CG-CG1 4.31Å; V380-I399 WeakPolarHBondContact O-CA 3.45Å; V381-I399 HydrophobicContact CG2-CB 4.3Å; V381-I399 HydrophobicContact CG2-CD1 4.33Å; V381-I399 HydrophobicContact CG2-CG1 4.17Å; I399-S408 CarbonylContact O-C 3.51Å; I399-S408 WeakPolarHBondContact O-CA 3.38Å; I399-R409 HydrophobicContact CG2-CB 4.17Å; I399-R409 PolarHBondContact N-O 3.24Å; I399-R409 PolarHBondContact O-N 2.86Å; I399-I411 HydrophobicContact CB-CG1 4.46Å; I399-I411 HydrophobicContact CG2-CD1 3.94Å; I399-I411 HydrophobicContact CG2-CG1 3.66Å
400	A	96.3	Very high	94.2	Very high	11 Å²	11	57.1 Å²	57.1	9%	0.091	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	146.8	171.8	0	0	0	0	0	110.9	Y379 V380	Y379-A400 CarbonylContact C-O 3.47Å; Y379-A400 WeakPolarHBondContact CA-O 3.5Å; V380-A400 PolarHBondContact N-O 2.7Å; V380-A400 PolarHBondContact O-N 2.88Å
401	P	95.3	Very high	94.6	Very high	20 Å²	20	50.7 Å²	50.7	13%	0.13	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	138.8	169.2	-18.4	31.5	0	0	0	110.5	W342 A378 Y379 N403 Q404	W342-P401 VanDerWaalsContact CH2-CD 3.5Å; W342-P401 HydrophobicContact CH2-CG 3.69Å; W342-P401 HydrophobicContact CZ2-CG 3.49Å; W342-P401 VanDerWaalsContact CZ2-CG 3.49Å; W342-P401 HydrophobicContact CZ3-CG 4.34Å; A378-P401 WeakPolarHBondContact O-CA 3.38Å; Y379-P401 HydrophobicContact CD1-CB 4.41Å; Y379-P401 HydrophobicContact CD1-CG 4.42Å; Y379-P401 HydrophobicContact CE1-CG 4.38Å; P401-N403 PolarHBondContact O-N 3.46Å; P401-N403 VanDerWaalsContact O-N 3.17Å; P401-Q404 HydrophobicContact CB-CB 4.23Å; P401-Q404 HydrophobicContact CG-CB 4.4Å; P401-Q404 CarbonylContact O-C 3.53Å; P401-Q404 VanDerWaalsContact O-C 3.23Å; P401-Q404 PolarHBondContact O-N 3Å
402	V	93.4	Very high	95	Very high	56 Å²	56	50.7 Å²	50.7	34%	0.339	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-41.3	-179.8	-178	0	0	0	0	111.3	A378 V380 Q404	A378-V402 PolarHBondContact O-N 2.83Å; V380-V402 HydrophobicContact CG2-CB 4.41Å; V380-V402 HydrophobicContact CG2-CG2 3.79Å; V402-Q404 VanDerWaalsContact C-N 3.31Å; V402-Q404 PolarHBondContact O-N 2.85Å
403	N	92.1	Very high	95.1	Very high	152 Å²	152	49.3 Å²	49.3	81%	0.813	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-12.2	-178.2	-61.8	-25.7	0	0	0	113.7	P401	P401-N403 PolarHBondContact O-N 3.46Å; P401-N403 VanDerWaalsContact O-N 3.17Å
404	Q	92.3	Very high	95.2	Very high	108 Å²	108	47.9 Å²	47.9	51%	0.505	25%	0.25	S	S	.	.			trans	-141.4	64.9	-173.3	-61.1	-175.7	12.3	0	0	111.4	P401 V402 K406 L407	P401-Q404 HydrophobicContact CB-CB 4.23Å; P401-Q404 HydrophobicContact CG-CB 4.4Å; P401-Q404 CarbonylContact O-C 3.53Å; P401-Q404 VanDerWaalsContact O-C 3.23Å; P401-Q404 PolarHBondContact O-N 3Å; V402-Q404 VanDerWaalsContact C-N 3.31Å; V402-Q404 PolarHBondContact O-N 2.85Å; Q404-K406 PolarHBondContact O-N 3.27Å; Q404-L407 HydrophobicContact CB-CD1 4.33Å; Q404-L407 HydrophobicContact CB-CG 4.38Å; Q404-L407 PolarHBondContact O-N 2.66Å
405	P	88.8	Confident	95.3	Very high	93 Å²	93	47.1 Å²	47.1	60%	0.604	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.3	-175.2	24.4	-34.9	0	0	0	113.8	L407	P405-L407 VanDerWaalsContact C-N 3.29Å; P405-L407 PolarHBondContact O-N 3.1Å
406	K	89.6	Confident	95.2	Very high	204 Å²	204	47.1 Å²	47.1	89%	0.887	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-21.3	176.1	-66.4	-174.7	179.8	-179.6	0	113.6	Q404 S408	Q404-K406 PolarHBondContact O-N 3.27Å; K406-S408 PolarHBondContact O-N 2.89Å; K406-S408 VanDerWaalsContact O-N 3.17Å
407	L	91.8	Very high	95.1	Very high	92 Å²	92	47.4 Å²	47.4	48%	0.482	25%	0.247	S	C	.	.	S	Bend	trans	-86.5	39.7	175.5	-63.8	-174.3	0	0	0	111.6	W342 Q404 P405	W342-L407 HydrophobicContact CH2-CB 4.23Å; W342-L407 VanDerWaalsContact CH2-O 3.28Å; W342-L407 WeakPolarHBondContact CH2-O 3.26Å; Q404-L407 HydrophobicContact CB-CD1 4.33Å; Q404-L407 HydrophobicContact CB-CG 4.38Å; Q404-L407 PolarHBondContact O-N 2.66Å; P405-L407 VanDerWaalsContact C-N 3.29Å; P405-L407 PolarHBondContact O-N 3.1Å
408	S	93.7	Very high	94.8	Very high	60 Å²	60	49.6 Å²	49.6	42%	0.42	26%	0.263	S	S	.	.			trans	-67.9	137.8	177.8	-172.7	0	0	0	0	110.7	H398 I399 K406	H398-S408 PolarHBondContact CD2-OG 3.21Å; I399-S408 CarbonylContact O-C 3.51Å; I399-S408 WeakPolarHBondContact O-CA 3.38Å; K406-S408 PolarHBondContact O-N 2.89Å; K406-S408 VanDerWaalsContact O-N 3.17Å
409	R	94.9	Very high	94.4	Very high	30 Å²	30	48 Å²	48	11%	0.113	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.4	179.1	-168.8	174.7	72.7	-151	9	110.5	V341 W342 T346 H398 I399	V341-R409 PolarHBondContact O-NH2 3.21Å; W342-R409 HydrophobicContact CZ3-CB 4.39Å; W342-R409 PolarHBondContact O-NH1 3.06Å; T346-R409 PolarHBondContact O-NE 3.41Å; T346-R409 PolarHBondContact O-NH2 3.44Å; T346-R409 VanDerWaalsContact O-NH2 3.07Å; H398-R409 WeakPolarHBondContact CA-O 3.31Å; I399-R409 HydrophobicContact CG2-CB 4.17Å; I399-R409 PolarHBondContact N-O 3.24Å; I399-R409 PolarHBondContact O-N 2.86Å
410	P	96.8	Very high	93.8	Very high	34 Å²	34	50.1 Å²	50.1	22%	0.221	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	140.3	175	30.3	-34.2	0	0	0	110.7	L396 L397 Y445	L396-P410 HydrophobicContact CD1-CB 4.08Å; L397-P410 CarbonylContact O-C 3.49Å; L397-P410 WeakPolarHBondContact O-CA 3.19Å; P410-Y445 HydrophobicContact CG-CE1 4.22Å
411	I	98.1	Very high	92.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	117.5	176.6	-53.4	-66.7	0	0	0	108.1	W338 V341 T346 H347 I349 L397 I399	W338-I411 HydrophobicContact CZ3-CG1 4.5Å; V341-I411 HydrophobicContact CG1-CD1 3.89Å; V341-I411 HydrophobicContact CG1-CG1 4.44Å; T346-I411 WeakPolarHBondContact O-CD1 3.43Å; H347-I411 CarbonylContact O-C 3.55Å; H347-I411 WeakPolarHBondContact O-CA 3.31Å; I349-I411 HydrophobicContact CD1-CG2 3.56Å; I349-I411 HydrophobicContact CG1-CG2 3.88Å; L397-I411 HydrophobicContact CB-CB 4.19Å; L397-I411 PolarHBondContact N-O 3.25Å; L397-I411 PolarHBondContact O-N 3.35Å; I399-I411 HydrophobicContact CB-CG1 4.46Å; I399-I411 HydrophobicContact CG2-CD1 3.94Å; I399-I411 HydrophobicContact CG2-CG1 3.66Å
412	W	98.1	Very high	90.8	Very high	48 Å²	48	58.5 Å²	58.5	18%	0.182	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	110.4	175.7	-65.8	87.9	0	0	0	109.8	H347 V348 I349 V394 L396 Y414 K441 Y445	H347-W412 PolarHBondContact O-N 3.42Å; V348-W412 WeakPolarHBondContact CA-O 3.5Å; V348-W412 HydrophobicContact CG2-CB 4.48Å; I349-W412 PolarHBondContact N-O 3.39Å; V394-W412 HydrophobicContact CG1-CE3 3.95Å; V394-W412 HydrophobicContact CG1-CZ3 4.35Å; L396-W412 HydrophobicContact CD1-CD2 4.01Å; L396-W412 HydrophobicContact CD1-CE3 4.39Å; L396-W412 HydrophobicContact CD1-CH2 4.29Å; L396-W412 HydrophobicContact CD1-CZ2 3.9Å; L396-W412 HydrophobicContact CD2-CH2 4.33Å; L396-W412 HydrophobicContact CD2-CZ2 4.43Å; W412-Y414 HydrophobicContact CB-CD2 4.29Å; W412-Y414 HydrophobicContact CB-CE2 3.74Å; W412-K441 HydrophobicContact CB-CG 3.89Å; W412-K441 HydrophobicContact CD2-CD 3.68Å; W412-K441 HydrophobicContact CD2-CG 3.85Å; W412-K441 HydrophobicContact CE3-CD 4.31Å; W412-K441 HydrophobicContact CE3-CG 4.46Å; W412-K441 HydrophobicContact CG-CD 3.8Å; W412-K441 HydrophobicContact CG-CG 3.55Å; W412-K441 HydrophobicContact CZ2-CD 4.14Å; W412-Y445 AromaticContact CD1-CE2 3.74Å; W412-Y445 AromaticContact NE1-CE2 3.61Å; W412-Y445 AromaticContact NE1-CZ 3.66Å; W412-Y445 PolarHBondContact NE1-OH 2.98Å
413	H	98.3	Very high	90.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	107.4	-176.9	176.4	-82.2	0	0	0	110.8	Y366 W367 V394 R395 L397	Y366-H413 AromaticContact CE2-CD2 3.83Å; Y366-H413 AromaticContact CE2-NE2 3.81Å; Y366-H413 AromaticContact CZ-CD2 3.87Å; Y366-H413 AromaticContact CZ-NE2 3.45Å; Y366-H413 PolarHBondContact OH-CD2 3.02Å; Y366-H413 PolarHBondContact OH-NE2 2.91Å; W367-H413 AromaticContact CE3-NE2 3.87Å; W367-H413 AromaticContact CZ3-CE1 3.97Å; W367-H413 AromaticContact CZ3-NE2 3.86Å; V394-H413 CarbonylContact C-O 3.59Å; V394-H413 WeakPolarHBondContact CA-O 3.18Å; R395-H413 HydrophobicContact CB-CB 4.16Å; R395-H413 PolarHBondContact N-O 2.78Å; R395-H413 PolarHBondContact NH1-CE1 3.46Å; R395-H413 PolarHBondContact O-N 2.88Å; L397-H413 HydrophobicContact CD1-CB 3.83Å; L397-H413 HydrophobicContact CG-CB 4.23Å
414	Y	98.4	Very high	90	Very high	12 Å²	12	52.1 Å²	52.1	5%	0.047	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	118.1	179.5	-73.7	-92.9	0	0	0	110.4	V348 I349 V350 M351 Y392 V394 W412 F434 Q437 V438 K441	V348-Y414 HydrophobicContact CG1-CD2 3.97Å; V348-Y414 HydrophobicContact CG1-CE2 4.19Å; I349-Y414 PolarHBondContact O-N 3.44Å; V350-Y414 CarbonylContact C-O 3.54Å; V350-Y414 WeakPolarHBondContact CA-O 3.45Å; M351-Y414 PolarHBondContact N-O 3.04Å; Y392-Y414 HydrophobicContact CD2-CD1 4.32Å; Y392-Y414 HydrophobicContact CE2-CD1 4.35Å; Y392-Y414 HydrophobicContact CE2-CE1 4.46Å; V394-Y414 HydrophobicContact CG1-CD1 4.38Å; V394-Y414 HydrophobicContact CG1-CE1 4.08Å; V394-Y414 HydrophobicContact CG2-CD1 3.75Å; V394-Y414 HydrophobicContact CG2-CE1 3.67Å; W412-Y414 HydrophobicContact CB-CD2 4.29Å; W412-Y414 HydrophobicContact CB-CE2 3.74Å; Y414-F434 HydrophobicContact CD1-CE2 4Å; Y414-F434 HydrophobicContact CG-CE2 4.28Å; Y414-Q437 HydrophobicContact CE1-CB 4.35Å; Y414-V438 HydrophobicContact CD1-CG2 3.86Å; Y414-V438 HydrophobicContact CD2-CG2 4.06Å; Y414-V438 HydrophobicContact CE1-CG2 4.3Å; Y414-V438 HydrophobicContact CE2-CG2 4.48Å; Y414-V438 HydrophobicContact CG-CG2 3.74Å; Y414-K441 HydrophobicContact CE2-CB 4.15Å; Y414-K441 HydrophobicContact CE2-CG 4.12Å; Y414-K441 WeakPolarHBondContact OH-CB 3.38Å
415	Q	97.9	Very high	89.9	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	107.1	178.3	-174.4	-178.7	11.4	0	0	110.8	M351 T353 E355 Y392 K393 L417	M351-Q415 HydrophobicContact CB-CB 4.29Å; M351-Q415 HydrophobicContact CB-CG 4.19Å; M351-Q415 HydrophobicContact CG-CG 3.97Å; M351-Q415 CarbonylContact O-C 3.52Å; M351-Q415 WeakPolarHBondContact O-CA 3.37Å; M351-Q415 HydrophobicContact SD-CG 3.94Å; T353-Q415 PolarHBondContact O-NE2 3.24Å; E355-Q415 PolarHBondContact OE1-NE2 3.37Å; Y392-Q415 CarbonylContact C-O 3.46Å; Y392-Q415 WeakPolarHBondContact CA-O 3.33Å; Y392-Q415 VanDerWaalsContact CB-O 3.3Å; Y392-Q415 WeakPolarHBondContact CB-O 3.41Å; K393-Q415 HydrophobicContact CB-CB 4.45Å; K393-Q415 PolarHBondContact N-O 3.46Å; K393-Q415 PolarHBondContact O-N 2.87Å; Q415-L417 HydrophobicContact CG-CD2 3.78Å; Q415-L417 HydrophobicContact CG-CG 4.46Å
416	Y	96.3	Very high	89.7	Confident	8 Å²	8	51.9 Å²	51.9	3%	0.031	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	123.7	175.7	-162.6	-95.3	0	0	0	110.9	M351 D391 W419 V431 F434	M351-Y416 PolarHBondContact O-N 2.81Å; D391-Y416 HydrophobicContact CB-CD2 4.5Å; D391-Y416 HydrophobicContact CB-CE2 3.76Å; Y416-W419 HydrophobicContact CD1-CB 3.98Å; Y416-W419 HydrophobicContact CD1-CE3 4.46Å; Y416-W419 HydrophobicContact CE1-CB 4.17Å; Y416-V431 HydrophobicContact CE1-CG2 4.1Å; Y416-V431 HydrophobicContact CE2-CG2 4.35Å; Y416-F434 HydrophobicContact CD2-CB 3.9Å; Y416-F434 AromaticContact CD2-CD1 3.91Å; Y416-F434 HydrophobicContact CD2-CD1 3.91Å; Y416-F434 AromaticContact CD2-CD2 3.81Å; Y416-F434 HydrophobicContact CD2-CD2 3.81Å; Y416-F434 HydrophobicContact CD2-CE1 4.34Å; Y416-F434 HydrophobicContact CD2-CE2 4.21Å; Y416-F434 AromaticContact CD2-CG 3.6Å; Y416-F434 HydrophobicContact CD2-CG 3.6Å; Y416-F434 HydrophobicContact CD2-CZ 4.47Å; Y416-F434 HydrophobicContact CE2-CB 3.91Å; Y416-F434 HydrophobicContact CE2-CG 4.14Å
417	L	93.6	Very high	89.6	Confident	25 Å²	25	48.8 Å²	48.8	13%	0.131	26%	0.261	C	S	.	.			trans	-111.3	-19.5	-170.2	-64.5	-178.3	0	0	0	113.5	R354 D391 K393 Q415 W419	R354-L417 HydrophobicContact CG-CD2 3.9Å; R354-L417 VanDerWaalsContact CZ-O 3.25Å; R354-L417 PolarHBondContact NE-O 2.9Å; R354-L417 VanDerWaalsContact NE-O 3.08Å; R354-L417 PolarHBondContact NH2-O 3.4Å; D391-L417 PolarHBondContact O-N 3.31Å; K393-L417 HydrophobicContact CD-CD1 3.79Å; K393-L417 HydrophobicContact CG-CD1 3.67Å; Q415-L417 HydrophobicContact CG-CD2 3.78Å; Q415-L417 HydrophobicContact CG-CG 4.46Å; L417-W419 VanDerWaalsContact C-N 3.31Å; L417-W419 PolarHBondContact O-N 3.19Å
418	S	91.2	Very high	89.7	Confident	47 Å²	47	44.7 Å²	44.7	33%	0.329	24%	0.24	S	C	.	.			trans	-85	3.2	-177.4	-68.5	0	0	0	0	114.4	D391	D391-S418 VanDerWaalsContact CA-OG 3.32Å; D391-S418 WeakPolarHBondContact CA-OG 3.26Å; D391-S418 PolarHBondContact O-N 3.47Å; D391-S418 VanDerWaalsContact OD1-CB 3.23Å; D391-S418 WeakPolarHBondContact OD1-CB 3.26Å; D391-S418 PolarHBondContact OD1-OG 3.26Å
419	W	89.4	Confident	89.7	Confident	8 Å²	8	43 Å²	43	3%	0.03	23%	0.231	C	C	.	.			trans	-71.4	126.4	175.1	-159.7	-62.7	0	0	0	110.3	Y416 L417 G423 V424 P425 V431 R461 T464 I465 F509	Y416-W419 HydrophobicContact CD1-CB 3.98Å; Y416-W419 HydrophobicContact CD1-CE3 4.46Å; Y416-W419 HydrophobicContact CE1-CB 4.17Å; L417-W419 VanDerWaalsContact C-N 3.31Å; L417-W419 PolarHBondContact O-N 3.19Å; W419-G423 PolarHBondContact NE1-O 3.36Å; W419-V424 HydrophobicContact CZ2-CG1 4.26Å; W419-P425 HydrophobicContact CD2-CG 4.25Å; W419-P425 HydrophobicContact CE3-CG 4.28Å; W419-V431 HydrophobicContact CZ3-CG2 4.41Å; W419-R461 HydrophobicContact CD2-CB 4.42Å; W419-R461 HydrophobicContact CD2-CG 3.96Å; W419-R461 HydrophobicContact CG-CG 4.28Å; W419-R461 HydrophobicContact CH2-CB 4.41Å; W419-R461 HydrophobicContact CZ2-CB 4.25Å; W419-R461 HydrophobicContact CZ2-CG 3.9Å; W419-T464 HydrophobicContact CH2-CG2 3.8Å; W419-I465 HydrophobicContact CZ3-CD1 3.95Å; W419-I465 HydrophobicContact CZ3-CG1 4.15Å; W419-F509 HydrophobicContact CH2-CD1 4.48Å; W419-F509 HydrophobicContact CH2-CE1 4.35Å
420	P	83.6	Confident	89.6	Confident	44 Å²	44	42.4 Å²	42.4	29%	0.286	24%	0.235	S	C	.	.			trans	-71.4	151	-177.6	27.8	-34.4	0	0	0	113.5	H422 V424 R461	P420-H422 PolarHBondContact O-N 2.88Å; P420-V424 VanDerWaalsContact CG-C 3.4Å; P420-V424 WeakPolarHBondContact CG-O 3.45Å; P420-R461 PolarHBondContact O-NH2 3.27Å
421	D	63.6	Low	89.5	Confident	65 Å²	65	40.8 Å²	40.8	35%	0.348	22%	0.224	S	C	.	.	S	Bend	trans	-60.2	-31.2	178	-65.4	-19.2	0	0	0	113.1	E357 K358	E357-D421 WeakPolarHBondContact CB-OD1 3.47Å; E357-D421 WeakPolarHBondContact CG-OD1 3.37Å; K358-D421 HydrophobicContact CD-CB 4.29Å; K358-D421 VanDerWaalsContact CE-OD2 3.27Å; K358-D421 WeakPolarHBondContact CE-OD2 3.36Å; K358-D421 HydrophobicContact CG-CB 4.27Å; K358-D421 WeakPolarHBondContact CG-OD2 3.49Å
422	H	65.6	Low	89.4	Confident	142 Å²	142	41.4 Å²	41.4	66%	0.657	23%	0.227	S	C	*	.	S	Bend	trans	-124.4	136.9	173.8	-63.8	-50.2	0	0	0	110.7	K358 P420	K358-H422 PolarHBondContact NZ-CD2 3.48Å; K358-H422 PolarHBondContact NZ-NE2 3.24Å; P420-H422 PolarHBondContact O-N 2.88Å
423	G	78.9	Confident	89.2	Confident	39 Å²	39	42.3 Å²	42.3	40%	0.402	24%	0.241	S	C	.	.	S	Bend	trans	76.3	-137.3	178.2	0	0	0	0	0	113.1	W419	W419-G423 PolarHBondContact NE1-O 3.36Å
424	V	88.8	Confident	89.1	Confident	34 Å²	34	42.3 Å²	42.3	21%	0.206	24%	0.241	C	C	.	.			trans	-137.1	158	-170	-65.4	0	0	0	0	109.8	W419 P420 A505 Q506 F509	W419-V424 HydrophobicContact CZ2-CG1 4.26Å; P420-V424 VanDerWaalsContact CG-C 3.4Å; P420-V424 WeakPolarHBondContact CG-O 3.45Å; V424-A505 HydrophobicContact CG1-CB 4.24Å; V424-A505 WeakPolarHBondContact CG1-O 3.37Å; V424-A505 HydrophobicContact CG2-CB 4.33Å; V424-Q506 HydrophobicContact CG1-CB 4.32Å; V424-Q506 HydrophobicContact CG1-CG 3.72Å; V424-F509 HydrophobicContact CB-CB 3.98Å; V424-F509 HydrophobicContact CB-CD2 3.85Å; V424-F509 HydrophobicContact CB-CG 3.93Å; V424-F509 HydrophobicContact CG1-CB 3.86Å; V424-F509 HydrophobicContact CG1-CG 4.18Å; V424-F509 HydrophobicContact CG2-CB 4.07Å; V424-F509 HydrophobicContact CG2-CD2 3.99Å; V424-F509 HydrophobicContact CG2-CG 4.3Å
425	P	89.7	Confident	89	Confident	13 Å²	13	41.8 Å²	41.8	8%	0.084	24%	0.239	C	C	.	.			trans	-51.6	144.3	170.5	-24.8	34.8	0	0	0	111.5	W419 Q427 V431 F509	W419-P425 HydrophobicContact CD2-CG 4.25Å; W419-P425 HydrophobicContact CE3-CG 4.28Å; P425-Q427 VanDerWaalsContact C-N 3.29Å; P425-Q427 PolarHBondContact O-N 3.46Å; P425-V431 HydrophobicContact CG-CG2 4.07Å; P425-F509 HydrophobicContact CB-CE2 3.89Å; P425-F509 HydrophobicContact CB-CZ 4.08Å; P425-F509 HydrophobicContact CG-CE2 4.14Å; P425-F509 HydrophobicContact CG-CZ 3.95Å; P425-F509 WeakPolarHBondContact O-CE2 3.45Å
426	Q	84.5	Confident	88.8	Confident	184 Å²	184	45.5 Å²	45.5	86%	0.86	26%	0.262	S	S	*	.	S	Bend	trans	-67.3	-31.8	-179.2	-70	-173	3.2	0	0	112.6
427	Q	89	Confident	88.8	Confident	139 Å²	139	49.5 Å²	49.5	65%	0.65	28%	0.281	S	S	*	.			trans	-128.2	138.1	179.2	-61.6	-61.3	-27.8	0	0	109.4	P425	P425-Q427 VanDerWaalsContact C-N 3.29Å; P425-Q427 PolarHBondContact O-N 3.46Å
428	P	93.6	Very high	88.9	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.039	28%	0.275	C	S	.	.	S	Bend	trans	-77.8	-20.8	-179.4	13.7	-9.9	0	0	0	115.2	G430 V431 L432 F509 L512 A513 E516	P428-G430 VanDerWaalsContact C-N 3.28Å; P428-G430 PolarHBondContact O-N 3.21Å; P428-G430 VanDerWaalsContact O-N 3.08Å; P428-V431 WeakPolarHBondContact O-CA 3.42Å; P428-V431 WeakPolarHBondContact O-CB 3.47Å; P428-V431 PolarHBondContact O-N 3.37Å; P428-L432 HydrophobicContact CB-CD1 4.44Å; P428-L432 PolarHBondContact O-N 2.9Å; P428-F509 HydrophobicContact CB-CE2 4Å; P428-F509 HydrophobicContact CB-CZ 3.97Å; P428-L512 HydrophobicContact CG-CB 4.07Å; P428-A513 VanDerWaalsContact CB-CA 3.5Å; P428-A513 HydrophobicContact CB-CB 3.7Å; P428-A513 HydrophobicContact CG-CB 4.45Å; P428-E516 WeakPolarHBondContact CD-OE2 3.49Å; P428-E516 HydrophobicContact CG-CB 4.15Å; P428-E516 WeakPolarHBondContact CG-OE2 3.48Å
429	G	93.3	Very high	89.1	Confident	23 Å²	23	47.5 Å²	47.5	24%	0.237	27%	0.267	C	S	.	.	H	α-helix	trans	-47.3	-40.3	-177.5	0	0	0	0	0	116.2	V431 L432 S433 E516	G429-V431 PolarHBondContact O-N 2.97Å; G429-L432 PolarHBondContact O-N 2.79Å; G429-S433 WeakPolarHBondContact O-CB 3.48Å; G429-S433 PolarHBondContact O-N 3.26Å; G429-E516 WeakPolarHBondContact CA-OE1 3.27Å; G429-E516 PolarHBondContact N-OE1 2.72Å; G429-E516 PolarHBondContact N-OE2 3.2Å
430	G	93.1	Very high	89.4	Confident	18 Å²	18	49.5 Å²	49.5	19%	0.186	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-36.2	176.9	0	0	0	0	0	113.4	P428 F434	P428-G430 VanDerWaalsContact C-N 3.28Å; P428-G430 PolarHBondContact O-N 3.21Å; P428-G430 VanDerWaalsContact O-N 3.08Å; G430-F434 WeakPolarHBondContact O-CB 3.41Å; G430-F434 PolarHBondContact O-N 3.47Å
431	V	95	Very high	89.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-73.5	-39.4	174.8	173.3	0	0	0	0	110.8	Y416 W419 P425 P428 G429 F434 L435 I465 F509	Y416-V431 HydrophobicContact CE1-CG2 4.1Å; Y416-V431 HydrophobicContact CE2-CG2 4.35Å; W419-V431 HydrophobicContact CZ3-CG2 4.41Å; P425-V431 HydrophobicContact CG-CG2 4.07Å; P428-V431 WeakPolarHBondContact O-CA 3.42Å; P428-V431 WeakPolarHBondContact O-CB 3.47Å; P428-V431 PolarHBondContact O-N 3.37Å; G429-V431 PolarHBondContact O-N 2.97Å; V431-F434 WeakPolarHBondContact O-CB 3.42Å; V431-F434 PolarHBondContact O-N 3.17Å; V431-L435 HydrophobicContact CG1-CD1 4.3Å; V431-L435 PolarHBondContact O-N 2.73Å; V431-I465 HydrophobicContact CG1-CD1 3.41Å; V431-I465 VanDerWaalsContact CG1-CD1 3.41Å; V431-F509 HydrophobicContact CB-CE1 4.42Å; V431-F509 HydrophobicContact CB-CZ 4.21Å; V431-F509 HydrophobicContact CG1-CE1 4.42Å; V431-F509 HydrophobicContact CG2-CE1 4.18Å; V431-F509 HydrophobicContact CG2-CZ 3.85Å
432	L	95.6	Very high	91.4	Very high	13 Å²	13	47.4 Å²	47.4	7%	0.068	27%	0.268	C	S	.	.	H	α-helix	trans	-63.1	-48.1	177.1	-67.3	176.4	0	0	0	111.4	P428 G429 F434 L435 T436 I468 L472 A513 E516 Y517	P428-L432 HydrophobicContact CB-CD1 4.44Å; P428-L432 PolarHBondContact O-N 2.9Å; G429-L432 PolarHBondContact O-N 2.79Å; L432-F434 VanDerWaalsContact C-N 3.29Å; L432-F434 PolarHBondContact O-N 3.42Å; L432-L435 PolarHBondContact O-N 2.73Å; L432-T436 PolarHBondContact O-N 3.27Å; L432-T436 PolarHBondContact O-OG1 3.48Å; L432-I468 HydrophobicContact CD2-CG2 4.44Å; L432-L472 HydrophobicContact CD2-CD1 3.87Å; L432-A513 HydrophobicContact CD2-CB 4.22Å; L432-E516 HydrophobicContact CD1-CB 3.86Å; L432-E516 HydrophobicContact CD1-CG 3.9Å; L432-Y517 HydrophobicContact CD2-CD2 4.38Å
433	S	93.8	Very high	92.7	Very high	67 Å²	67	44.2 Å²	44.2	47%	0.469	27%	0.267	S	S	.	.	H	α-helix	trans	-58.7	-42	175.6	178.7	0	0	0	0	111.9	G429 T436 Q437	G429-S433 WeakPolarHBondContact O-CB 3.48Å; G429-S433 PolarHBondContact O-N 3.26Å; S433-T436 PolarHBondContact O-N 2.95Å; S433-Q437 WeakPolarHBondContact O-CG 3.31Å; S433-Q437 PolarHBondContact O-N 2.77Å
434	F	95.8	Very high	93.4	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-48.8	174.6	172.9	-106	0	0	0	112.4	V350 Y392 Y414 Y416 G430 V431 L432 T436 Q437 V438	V350-F434 HydrophobicContact CG1-CE1 3.68Å; V350-F434 HydrophobicContact CG1-CZ 3.83Å; Y392-F434 HydrophobicContact CD1-CB 4.29Å; Y392-F434 AromaticContact CD1-CD2 3.65Å; Y392-F434 HydrophobicContact CD1-CD2 3.65Å; Y392-F434 HydrophobicContact CD1-CE2 4.49Å; Y392-F434 HydrophobicContact CD1-CG 4.45Å; Y392-F434 AromaticContact CD2-CD2 3.98Å; Y392-F434 HydrophobicContact CD2-CD2 3.98Å; Y392-F434 HydrophobicContact CD2-CE2 4.17Å; Y392-F434 HydrophobicContact CE1-CD2 4.24Å; Y392-F434 AromaticContact CG-CD2 3.51Å; Y392-F434 HydrophobicContact CG-CD2 3.51Å; Y392-F434 AromaticContact CG-CE2 3.92Å; Y392-F434 HydrophobicContact CG-CE2 3.92Å; Y414-F434 HydrophobicContact CD1-CE2 4Å; Y414-F434 HydrophobicContact CG-CE2 4.28Å; Y416-F434 HydrophobicContact CD2-CB 3.9Å; Y416-F434 AromaticContact CD2-CD1 3.91Å; Y416-F434 HydrophobicContact CD2-CD1 3.91Å; Y416-F434 AromaticContact CD2-CD2 3.81Å; Y416-F434 HydrophobicContact CD2-CD2 3.81Å; Y416-F434 HydrophobicContact CD2-CE1 4.34Å; Y416-F434 HydrophobicContact CD2-CE2 4.21Å; Y416-F434 AromaticContact CD2-CG 3.6Å; Y416-F434 HydrophobicContact CD2-CG 3.6Å; Y416-F434 HydrophobicContact CD2-CZ 4.47Å; Y416-F434 HydrophobicContact CE2-CB 3.91Å; Y416-F434 HydrophobicContact CE2-CG 4.14Å; G430-F434 WeakPolarHBondContact O-CB 3.41Å; G430-F434 PolarHBondContact O-N 3.47Å; V431-F434 WeakPolarHBondContact O-CB 3.42Å; V431-F434 PolarHBondContact O-N 3.17Å; L432-F434 VanDerWaalsContact C-N 3.29Å; L432-F434 PolarHBondContact O-N 3.42Å; F434-T436 PolarHBondContact O-N 2.9Å; F434-Q437 PolarHBondContact O-N 2.82Å; F434-V438 HydrophobicContact CD1-CG2 4.39Å; F434-V438 HydrophobicContact CD2-CG2 4.47Å; F434-V438 HydrophobicContact CE1-CG2 4.04Å; F434-V438 HydrophobicContact CE2-CG2 4.17Å; F434-V438 HydrophobicContact CZ-CG2 3.94Å; F434-V438 WeakPolarHBondContact O-CG2 3.42Å; F434-V438 PolarHBondContact O-N 3.3Å
435	L	96.2	Very high	93.6	Very high	1 Å²	1	48 Å²	48	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-38.9	178.1	-81.6	177.9	0	0	0	112.5	V431 L432 Q437 V438 N439 I465 I468 D469 L472	V431-L435 HydrophobicContact CG1-CD1 4.3Å; V431-L435 PolarHBondContact O-N 2.73Å; L432-L435 PolarHBondContact O-N 2.73Å; L435-Q437 VanDerWaalsContact C-N 3.27Å; L435-Q437 PolarHBondContact O-N 2.77Å; L435-V438 PolarHBondContact O-N 3.01Å; L435-N439 VanDerWaalsContact O-CB 3.31Å; L435-N439 WeakPolarHBondContact O-CB 3.36Å; L435-N439 PolarHBondContact O-N 3.19Å; L435-N439 PolarHBondContact O-ND2 2.88Å; L435-I465 HydrophobicContact CD2-CG2 3.92Å; L435-I468 HydrophobicContact CD1-CB 4.2Å; L435-I468 HydrophobicContact CD1-CG2 3.58Å; L435-D469 HydrophobicContact CD2-CB 4.32Å; L435-L472 HydrophobicContact CD1-CD1 4.49Å
436	T	94.8	Very high	93.5	Very high	78 Å²	78	53 Å²	53	48%	0.479	31%	0.305	S	S	.	.	H	α-helix	trans	-55.5	-44	173.9	-57.3	0	0	0	0	111.4	L432 S433 F434 A440	L432-T436 PolarHBondContact O-N 3.27Å; L432-T436 PolarHBondContact O-OG1 3.48Å; S433-T436 PolarHBondContact O-N 2.95Å; F434-T436 PolarHBondContact O-N 2.9Å; T436-A440 WeakPolarHBondContact O-CB 3.3Å; T436-A440 PolarHBondContact O-N 3.42Å
437	Q	95.4	Very high	93.8	Very high	92 Å²	92	51.6 Å²	51.6	43%	0.43	30%	0.303	S	S	.	.	H	α-helix	trans	-71.3	-39.3	-179.8	-63.4	-72.8	60.6	0	0	112.7	Y414 S433 F434 L435 K441	Y414-Q437 HydrophobicContact CE1-CB 4.35Å; S433-Q437 WeakPolarHBondContact O-CG 3.31Å; S433-Q437 PolarHBondContact O-N 2.77Å; F434-Q437 PolarHBondContact O-N 2.82Å; L435-Q437 VanDerWaalsContact C-N 3.27Å; L435-Q437 PolarHBondContact O-N 2.77Å; Q437-K441 WeakPolarHBondContact O-CB 3.11Å; Q437-K441 PolarHBondContact O-N 2.82Å; Q437-K441 VanDerWaalsContact O-N 3.07Å
438	V	96.4	Very high	93.9	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-60.8	-46.4	174.4	167.3	0	0	0	0	110.5	V348 V350 Y414 F434 L435 K441 Q442 M451	V348-V438 HydrophobicContact CG1-CG1 3.98Å; V350-V438 HydrophobicContact CG2-CG1 3.67Å; V350-V438 HydrophobicContact CG2-CG2 4.12Å; Y414-V438 HydrophobicContact CD1-CG2 3.86Å; Y414-V438 HydrophobicContact CD2-CG2 4.06Å; Y414-V438 HydrophobicContact CE1-CG2 4.3Å; Y414-V438 HydrophobicContact CE2-CG2 4.48Å; Y414-V438 HydrophobicContact CG-CG2 3.74Å; F434-V438 HydrophobicContact CD1-CG2 4.39Å; F434-V438 HydrophobicContact CD2-CG2 4.47Å; F434-V438 HydrophobicContact CE1-CG2 4.04Å; F434-V438 HydrophobicContact CE2-CG2 4.17Å; F434-V438 HydrophobicContact CZ-CG2 3.94Å; F434-V438 WeakPolarHBondContact O-CG2 3.42Å; F434-V438 PolarHBondContact O-N 3.3Å; L435-V438 PolarHBondContact O-N 3.01Å; V438-K441 PolarHBondContact O-N 3.48Å; V438-Q442 PolarHBondContact O-N 3.47Å; V438-M451 HydrophobicContact CG1-SD 3.92Å
439	N	95	Very high	94	Very high	30 Å²	30	46.5 Å²	46.5	16%	0.16	29%	0.288	C	S	.	.	H	α-helix	trans	-68.6	-43.6	-178.4	-72.4	-22	0	0	0	112.9	K321 L435 K441 Q442 A443 D469	K321-N439 PolarHBondContact NZ-ND2 2.78Å; K321-N439 PolarHBondContact NZ-OD1 2.87Å; L435-N439 VanDerWaalsContact O-CB 3.31Å; L435-N439 WeakPolarHBondContact O-CB 3.36Å; L435-N439 PolarHBondContact O-N 3.19Å; L435-N439 PolarHBondContact O-ND2 2.88Å; N439-K441 PolarHBondContact O-N 2.92Å; N439-Q442 PolarHBondContact O-N 3.31Å; N439-A443 WeakPolarHBondContact O-CB 3.4Å; N439-A443 PolarHBondContact O-N 3.47Å; N439-D469 VanDerWaalsContact CG-OD1 3.31Å; N439-D469 PolarHBondContact ND2-OD1 2.75Å; N439-D469 PolarHBondContact OD1-OD1 2.8Å; N439-D469 VanDerWaalsContact OD1-OD1 3.1Å; N439-D469 PolarHBondContact OD1-OD2 2.76Å
440	A	94.9	Very high	94.2	Very high	49 Å²	49	46.1 Å²	46.1	41%	0.405	28%	0.281	S	S	.	.	H	α-helix	trans	-57	-41.5	172.9	0	0	0	0	0	110.7	T436 A443 D444	T436-A440 WeakPolarHBondContact O-CB 3.3Å; T436-A440 PolarHBondContact O-N 3.42Å; A440-A443 PolarHBondContact O-N 2.89Å; A440-D444 PolarHBondContact O-N 3.07Å
441	K	95.6	Very high	94.4	Very high	40 Å²	40	45.4 Å²	45.4	17%	0.174	27%	0.273	C	S	.	.	H	α-helix	trans	-69.6	-37.8	179	-168	52.7	58.4	-166.4	0	113.4	V348 W412 Y414 Q437 V438 N439 A443 D444 Y445	V348-K441 HydrophobicContact CG2-CG 4.24Å; W412-K441 HydrophobicContact CB-CG 3.89Å; W412-K441 HydrophobicContact CD2-CD 3.68Å; W412-K441 HydrophobicContact CD2-CG 3.85Å; W412-K441 HydrophobicContact CE3-CD 4.31Å; W412-K441 HydrophobicContact CE3-CG 4.46Å; W412-K441 HydrophobicContact CG-CD 3.8Å; W412-K441 HydrophobicContact CG-CG 3.55Å; W412-K441 HydrophobicContact CZ2-CD 4.14Å; Y414-K441 HydrophobicContact CE2-CB 4.15Å; Y414-K441 HydrophobicContact CE2-CG 4.12Å; Y414-K441 WeakPolarHBondContact OH-CB 3.38Å; Q437-K441 WeakPolarHBondContact O-CB 3.11Å; Q437-K441 PolarHBondContact O-N 2.82Å; Q437-K441 VanDerWaalsContact O-N 3.07Å; V438-K441 PolarHBondContact O-N 3.48Å; N439-K441 PolarHBondContact O-N 2.92Å; K441-A443 VanDerWaalsContact C-N 3.3Å; K441-D444 WeakPolarHBondContact CD-OD2 3.33Å; K441-D444 WeakPolarHBondContact CE-OD2 3.47Å; K441-D444 IonicContact NZ-OD2 3.78Å; K441-D444 PolarHBondContact NZ-OD2 2.81Å; K441-D444 WeakPolarHBondContact O-CB 3.44Å; K441-D444 PolarHBondContact O-N 3.27Å; K441-Y445 HydrophobicContact CD-CE2 4.14Å; K441-Y445 VanDerWaalsContact O-CD2 3.32Å; K441-Y445 WeakPolarHBondContact O-CD2 3.43Å
442	Q	94.3	Very high	94.5	Very high	25 Å²	25	45.4 Å²	45.4	12%	0.117	27%	0.273	C	S	.	.	H	α-helix	trans	-64	-38.5	173.9	-178.5	67.8	18.7	0	0	111	V348 V438 N439 D444 Y445 G449 M451	V348-Q442 HydrophobicContact CG2-CB 4.21Å; V348-Q442 VanDerWaalsContact CG2-OE1 3.29Å; V438-Q442 PolarHBondContact O-N 3.47Å; N439-Q442 PolarHBondContact O-N 3.31Å; Q442-D444 VanDerWaalsContact C-N 3.26Å; Q442-D444 PolarHBondContact O-N 3.25Å; Q442-Y445 PolarHBondContact O-N 3.23Å; Q442-Y445 VanDerWaalsContact O-N 3.11Å; Q442-G449 PolarHBondContact NE2-O 2.94Å; Q442-M451 HydrophobicContact CB-CG 4.41Å; Q442-M451 HydrophobicContact CB-SD 3.82Å; Q442-M451 HydrophobicContact CG-CG 3.92Å; Q442-M451 HydrophobicContact CG-SD 3.84Å; Q442-M451 VanDerWaalsContact OE1-CG 3.28Å
443	A	92.8	Very high	94.7	Very high	75 Å²	75	44.9 Å²	44.9	62%	0.62	27%	0.27	S	S	*	.	H	α-helix	trans	-65.5	-25.2	178.5	0	0	0	0	0	113.7	N439 A440 K441 Y445	N439-A443 WeakPolarHBondContact O-CB 3.4Å; N439-A443 PolarHBondContact O-N 3.47Å; A440-A443 PolarHBondContact O-N 2.89Å; K441-A443 VanDerWaalsContact C-N 3.3Å; A443-Y445 PolarHBondContact O-N 3.11Å; A443-Y445 VanDerWaalsContact O-N 3.16Å
444	D	94.8	Very high	94.9	Very high	96 Å²	96	41.7 Å²	41.7	51%	0.513	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-16	173.1	-68.6	-24.4	0	0	0	112.9	A440 K441 Q442	A440-D444 PolarHBondContact O-N 3.07Å; K441-D444 WeakPolarHBondContact CD-OD2 3.33Å; K441-D444 WeakPolarHBondContact CE-OD2 3.47Å; K441-D444 IonicContact NZ-OD2 3.78Å; K441-D444 PolarHBondContact NZ-OD2 2.81Å; K441-D444 WeakPolarHBondContact O-CB 3.44Å; K441-D444 PolarHBondContact O-N 3.27Å; Q442-D444 VanDerWaalsContact C-N 3.26Å; Q442-D444 PolarHBondContact O-N 3.25Å
445	Y	92.5	Very high	94.8	Very high	58 Å²	58	42 Å²	42	23%	0.227	25%	0.25	C	S	.	.			trans	-124.6	83.7	-177.6	-59	-83.7	0	0	0	111.5	H347 P410 W412 K441 Q442 A443 D447 A448	H347-Y445 HydrophobicContact CB-CD2 4.07Å; H347-Y445 HydrophobicContact CB-CG 4.17Å; H347-Y445 AromaticContact CD2-CD1 3.56Å; H347-Y445 AromaticContact CD2-CE1 3.83Å; H347-Y445 AromaticContact CD2-CG 3.88Å; H347-Y445 AromaticContact CG-CG 3.97Å; H347-Y445 AromaticContact NE2-CD1 3.94Å; P410-Y445 HydrophobicContact CG-CE1 4.22Å; W412-Y445 AromaticContact CD1-CE2 3.74Å; W412-Y445 AromaticContact NE1-CE2 3.61Å; W412-Y445 AromaticContact NE1-CZ 3.66Å; W412-Y445 PolarHBondContact NE1-OH 2.98Å; K441-Y445 HydrophobicContact CD-CE2 4.14Å; K441-Y445 VanDerWaalsContact O-CD2 3.32Å; K441-Y445 WeakPolarHBondContact O-CD2 3.43Å; Q442-Y445 PolarHBondContact O-N 3.23Å; Q442-Y445 VanDerWaalsContact O-N 3.11Å; A443-Y445 PolarHBondContact O-N 3.11Å; A443-Y445 VanDerWaalsContact O-N 3.16Å; Y445-D447 VanDerWaalsContact C-N 3.26Å; Y445-D447 PolarHBondContact O-N 2.81Å; Y445-A448 WeakPolarHBondContact O-CB 3.22Å; Y445-A448 PolarHBondContact O-N 2.96Å
446	P	87.8	Confident	94.5	Very high	118 Å²	118	42.5 Å²	42.5	77%	0.766	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-32.3	-177.4	-26.1	35.1	0	0	0	114.7	A448	P446-A448 VanDerWaalsContact C-N 3.31Å
447	D	89.3	Confident	94.1	Very high	153 Å²	153	39.4 Å²	39.4	82%	0.818	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	10	178.1	-60.6	-48.2	0	0	0	113.1	Y445	Y445-D447 VanDerWaalsContact C-N 3.26Å; Y445-D447 PolarHBondContact O-N 2.81Å
448	A	92.4	Very high	93.9	Very high	20 Å²	20	35 Å²	35	17%	0.165	22%	0.216	C	C	.	.			trans	-66.7	138.8	177.3	0	0	0	0	0	111	H347 Y445 P446	H347-A448 HydrophobicContact CB-CB 4.15Å; H347-A448 VanDerWaalsContact ND1-CB 3.34Å; H347-A448 WeakPolarHBondContact ND1-CB 3.34Å; Y445-A448 WeakPolarHBondContact O-CB 3.22Å; Y445-A448 PolarHBondContact O-N 2.96Å; P446-A448 VanDerWaalsContact C-N 3.31Å
449	G	95.1	Very high	93.5	Very high	19 Å²	19	35.4 Å²	35.4	20%	0.196	22%	0.218	C	C	.	.			trans	-77	-164.5	168	0	0	0	0	0	112.8	E344 K345 Q442	E344-G449 VanDerWaalsContact O-CA 3.31Å; E344-G449 WeakPolarHBondContact O-CA 3.48Å; K345-G449 PolarHBondContact O-N 3.02Å; Q442-G449 PolarHBondContact NE2-O 2.94Å
450	P	96.6	Very high	93.3	Very high	15 Å²	15	34.3 Å²	34.3	10%	0.097	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-59	141.8	-170.7	-25.1	33.8	0	0	0	114.3	Y309 V322 I324 E344 T346 I452	Y309-P450 HydrophobicContact CE1-CG 4.44Å; V322-P450 HydrophobicContact CB-CB 4.15Å; V322-P450 HydrophobicContact CB-CG 4.04Å; V322-P450 HydrophobicContact CG1-CB 3.99Å; V322-P450 HydrophobicContact CG1-CG 3.76Å; V322-P450 CarbonylContact O-C 3.57Å; V322-P450 WeakPolarHBondContact O-CA 3.36Å; V322-P450 WeakPolarHBondContact O-CB 3.39Å; I324-P450 HydrophobicContact CD1-CB 3.86Å; I324-P450 HydrophobicContact CD1-CG 4.16Å; I324-P450 HydrophobicContact CG1-CB 3.78Å; I324-P450 HydrophobicContact CG1-CG 4.34Å; E344-P450 WeakPolarHBondContact O-CD 3.35Å; T346-P450 WeakPolarHBondContact CB-O 3.12Å; T346-P450 WeakPolarHBondContact CG2-O 3.48Å; T346-P450 PolarHBondContact OG1-O 2.97Å; P450-I452 PolarHBondContact O-N 3.27Å
451	M	97.3	Very high	93.2	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	127.4	168.5	-68.9	-166.7	-61.6	0	0	109.9	K321 V322 Y323 I324 V348 V438 Q442	K321-M451 HydrophobicContact CD-CE 3.69Å; V322-M451 PolarHBondContact O-N 3.29Å; Y323-M451 CarbonylContact C-O 3.49Å; Y323-M451 WeakPolarHBondContact CA-O 3.23Å; Y323-M451 HydrophobicContact CD1-CB 4.46Å; Y323-M451 HydrophobicContact CD1-CE 3.85Å; Y323-M451 HydrophobicContact CE1-CE 3.38Å; I324-M451 PolarHBondContact N-O 2.99Å; V348-M451 HydrophobicContact CB-CG 4.29Å; V348-M451 HydrophobicContact CG1-SD 4.45Å; V438-M451 HydrophobicContact CG1-SD 3.92Å; Q442-M451 HydrophobicContact CB-CG 4.41Å; Q442-M451 HydrophobicContact CB-SD 3.82Å; Q442-M451 HydrophobicContact CG-CG 3.92Å; Q442-M451 HydrophobicContact CG-SD 3.84Å; Q442-M451 VanDerWaalsContact OE1-CG 3.28Å
452	I	98.7	Very high	93.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	120.5	176.6	-68.4	166.2	0	0	0	108.7	I324 T326 F337 M340 V341 T346 V348 I349 V350 P450	I324-I452 HydrophobicContact CB-CG1 3.97Å; I324-I452 HydrophobicContact CD1-CG1 4.2Å; I324-I452 HydrophobicContact CG2-CG1 4.27Å; T326-I452 HydrophobicContact CG2-CG2 3.83Å; F337-I452 HydrophobicContact CE2-CG2 3.95Å; F337-I452 HydrophobicContact CZ-CG2 4.18Å; M340-I452 HydrophobicContact CE-CD1 3.91Å; M340-I452 HydrophobicContact CE-CG1 4.34Å; M340-I452 HydrophobicContact CE-CG2 4.23Å; V341-I452 HydrophobicContact CB-CD1 4.27Å; V341-I452 HydrophobicContact CG2-CD1 3.54Å; T346-I452 HydrophobicContact CG2-CB 4.37Å; T346-I452 HydrophobicContact CG2-CD1 3.83Å; T346-I452 HydrophobicContact CG2-CG1 3.95Å; T346-I452 WeakPolarHBondContact OG1-CD1 3.43Å; V348-I452 PolarHBondContact O-N 3.02Å; I349-I452 CarbonylContact C-O 3.56Å; I349-I452 WeakPolarHBondContact CA-O 3.18Å; I349-I452 HydrophobicContact CG1-CB 4.41Å; I349-I452 HydrophobicContact CG2-CG2 4.46Å; V350-I452 PolarHBondContact N-O 2.84Å; P450-I452 PolarHBondContact O-N 3.27Å
453	I	98.6	Very high	93.3	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	126.2	178.1	-47.4	-164.1	0	0	0	109.5	Y323 I324 A325 T326 V350 T462 I465 V466	Y323-I453 HydrophobicContact CD1-CD1 3.83Å; Y323-I453 HydrophobicContact CD1-CG1 4.47Å; Y323-I453 HydrophobicContact CE1-CD1 4.36Å; I324-I453 PolarHBondContact O-N 3.23Å; A325-I453 WeakPolarHBondContact CA-O 3.36Å; T326-I453 PolarHBondContact N-O 2.88Å; T326-I453 VanDerWaalsContact N-O 3.16Å; V350-I453 HydrophobicContact CB-CB 4.34Å; V350-I453 HydrophobicContact CB-CD1 4.48Å; V350-I453 HydrophobicContact CB-CG1 4.03Å; V350-I453 HydrophobicContact CB-CG2 4.11Å; V350-I453 HydrophobicContact CG1-CG2 4.06Å; V350-I453 HydrophobicContact CG2-CG1 4.34Å; V350-I453 CarbonylContact O-C 3.52Å; V350-I453 WeakPolarHBondContact O-CA 3.31Å; I453-T462 HydrophobicContact CB-CG2 4.14Å; I453-T462 HydrophobicContact CG2-CG2 3.95Å; I453-T462 VanDerWaalsContact O-CG2 3.26Å; I453-T462 WeakPolarHBondContact O-CG2 3.29Å; I453-I465 HydrophobicContact CD1-CG2 4.01Å; I453-I465 HydrophobicContact CG2-CG2 4.17Å; I453-V466 HydrophobicContact CB-CG2 4.34Å; I453-V466 HydrophobicContact CD1-CG2 3.87Å; I453-V466 HydrophobicContact CG1-CG2 4.45Å
454	H	98.5	Very high	93.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	163.8	-178.8	79.7	87.8	0	0	0	113.7	T326 V350 M351 T352 Y366 T462	T326-H454 HydrophobicContact CG2-CB 3.53Å; T326-H454 WeakPolarHBondContact O-CA 3.34Å; T326-H454 WeakPolarHBondContact O-CB 3.39Å; V350-H454 PolarHBondContact O-N 2.75Å; M351-H454 VanDerWaalsContact CG-CE1 3.41Å; M351-H454 WeakPolarHBondContact CG-CE1 3.49Å; T352-H454 PolarHBondContact N-O 3.21Å; T352-H454 PolarHBondContact OG1-O 3.41Å; Y366-H454 AromaticContact CE1-CE1 3.75Å; Y366-H454 AromaticContact CE1-NE2 3.54Å; Y366-H454 AromaticContact CZ-NE2 3.56Å; Y366-H454 PolarHBondContact OH-NE2 3.08Å; H454-T462 VanDerWaalsContact C-OG1 3.27Å; H454-T462 WeakPolarHBondContact CA-OG1 3.31Å
455	C	93.5	Very high	93.6	Very high	8 Å²	8	22.2 Å²	22.2	5%	0.054	13%	0.132	C	C	.	.			trans	-141.8	-119.7	175.6	60.7	0	0	0	0	109.4	G328 T352 T353 G458 R461 T462	G328-C455 WeakPolarHBondContact CA-O 3.48Å; G328-C455 PolarHBondContact N-O 3.48Å; T352-C455 VanDerWaalsContact OG1-CB 3.23Å; T352-C455 WeakPolarHBondContact OG1-CB 3.46Å; T353-C455 WeakPolarHBondContact CG2-O 3.35Å; C455-G458 VanDerWaalsContact SG-CA 3.59Å; C455-G458 PolarHBondContact SG-N 2.76Å; C455-R461 HydrophobicContact CB-CB 4.09Å; C455-T462 PolarHBondContact N-OG1 3.08Å; C455-T462 PolarHBondContact SG-OG1 3.12Å
456	S	91.2	Very high	93.9	Very high	11 Å²	11	19.4 Å²	19.4	8%	0.077	12%	0.121	C	C	.	.	S	Bend	trans	-96.6	-64.8	169.5	-167	0	0	0	0	111.6	R278 Y279 Q327 G328 K362	R278-S456 WeakPolarHBondContact CD-O 3.12Å; Y279-S456 PolarHBondContact OH-OG 2.96Å; Q327-S456 WeakPolarHBondContact CB-O 3.28Å; G328-S456 PolarHBondContact N-O 2.93Å; K362-S456 WeakPolarHBondContact CD-OG 3.32Å; K362-S456 PolarHBondContact O-OG 2.79Å
457	A	85.9	Confident	94.3	Very high	14 Å²	14	13.8 Å²	13.8	12%	0.116	9%	0.085	C	C	.	.	S	Bend	trans	-86.9	-14.7	176.8	0	0	0	0	0	113.7	Y279 I282 I459 R497	Y279-A457 HydrophobicContact CD2-CB 3.7Å; Y279-A457 HydrophobicContact CE2-CB 3.63Å; I282-A457 HydrophobicContact CD1-CB 3.69Å; I282-A457 HydrophobicContact CG2-CB 4.43Å; A457-I459 HydrophobicContact CB-CD1 4.28Å; A457-I459 HydrophobicContact CB-CG1 3.93Å; A457-R497 PolarHBondContact O-NH2 3.35Å; A457-R497 VanDerWaalsContact O-NH2 3.12Å
458	G	89.8	Confident	94.7	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	5%	0.046	C	C	.	.	S	Bend	trans	74.3	29.7	-177.1	0	0	0	0	0	114.6	T326 C455 R497	T326-G458 WeakPolarHBondContact O-CA 3.12Å; C455-G458 VanDerWaalsContact SG-CA 3.59Å; C455-G458 PolarHBondContact SG-N 2.76Å; G458-R497 PolarHBondContact O-NE 3.37Å
459	I	89.7	Confident	94.9	Very high	8 Å²	8	5.6 Å²	5.6	4%	0.041	4%	0.038	C	C	.	.	S	Bend	trans	-134.1	-47.3	-175.3	63.8	176.6	0	0	0	113.8	I282 A457 G463 R497 S498 M500 V501 Q502	I282-I459 HydrophobicContact CD1-CD1 3.92Å; I282-I459 HydrophobicContact CG2-CD1 4.07Å; I282-I459 HydrophobicContact CG2-CG2 4.02Å; A457-I459 HydrophobicContact CB-CD1 4.28Å; A457-I459 HydrophobicContact CB-CG1 3.93Å; I459-G463 WeakPolarHBondContact O-CA 3.22Å; I459-G463 PolarHBondContact O-N 2.85Å; I459-R497 HydrophobicContact CG2-CG 4.39Å; I459-S498 VanDerWaalsContact CG2-O 3.29Å; I459-S498 WeakPolarHBondContact CG2-O 3.28Å; I459-M500 WeakPolarHBondContact O-CA 3.25Å; I459-V501 PolarHBondContact O-N 3.49Å; I459-Q502 HydrophobicContact CD1-CG 3.94Å; I459-Q502 HydrophobicContact CG1-CG 3.86Å
460	G	89.3	Confident	94.9	Very high	8 Å²	8	4.8 Å²	4.8	8%	0.082	3%	0.029	C	C	.	.	H	α-helix	trans	-73.7	-83.5	-176.2	0	0	0	0	0	112.2	T462 G463 T464	G460-T462 VanDerWaalsContact C-N 3.31Å; G460-T462 PolarHBondContact O-N 2.82Å; G460-G463 PolarHBondContact O-N 3Å; G460-G463 VanDerWaalsContact O-N 3.14Å; G460-T464 PolarHBondContact O-N 2.88Å; G460-T464 PolarHBondContact O-OG1 3.42Å; G460-T464 VanDerWaalsContact O-OG1 3.07Å
461	R	94.7	Very high	94.8	Very high	27 Å²	27	4 Å²	4	10%	0.102	3%	0.025	C	C	.	.	H	α-helix	trans	-58.1	-43.1	178.5	-56.4	-176	-176.9	157.3	0.2	112	T352 E357 W419 P420 C455 G463 T464 I465	T352-R461 WeakPolarHBondContact O-CD 3.31Å; T352-R461 PolarHBondContact O-NH1 3.3Å; E357-R461 IonicContact OE1-CZ 2.76Å; E357-R461 IonicContact OE1-NH1 2.81Å; E357-R461 PolarHBondContact OE1-NH1 3.44Å; E357-R461 IonicContact OE1-NH2 3.65Å; E357-R461 PolarHBondContact OE1-NH2 2.87Å; E357-R461 IonicContact OE2-CZ 3.97Å; E357-R461 IonicContact OE2-NH1 3.45Å; E357-R461 PolarHBondContact OE2-NH1 3.44Å; E357-R461 IonicContact OE2-NH2 3.4Å; E357-R461 PolarHBondContact OE2-NH2 2.68Å; W419-R461 HydrophobicContact CD2-CB 4.42Å; W419-R461 HydrophobicContact CD2-CG 3.96Å; W419-R461 HydrophobicContact CG-CG 4.28Å; W419-R461 HydrophobicContact CH2-CB 4.41Å; W419-R461 HydrophobicContact CZ2-CB 4.25Å; W419-R461 HydrophobicContact CZ2-CG 3.9Å; P420-R461 PolarHBondContact O-NH2 3.27Å; C455-R461 HydrophobicContact CB-CB 4.09Å; R461-G463 PolarHBondContact O-N 2.82Å; R461-T464 PolarHBondContact O-N 2.49Å; R461-I465 WeakPolarHBondContact O-CG1 3.25Å; R461-I465 PolarHBondContact O-N 3.4Å
462	T	95.8	Very high	94.6	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-55.3	-50.2	173.6	-60.2	0	0	0	0	111.7	A325 I453 H454 C455 G460 T464 I465 V466	A325-T462 HydrophobicContact CB-CG2 3.79Å; I453-T462 HydrophobicContact CB-CG2 4.14Å; I453-T462 HydrophobicContact CG2-CG2 3.95Å; I453-T462 VanDerWaalsContact O-CG2 3.26Å; I453-T462 WeakPolarHBondContact O-CG2 3.29Å; H454-T462 VanDerWaalsContact C-OG1 3.27Å; H454-T462 WeakPolarHBondContact CA-OG1 3.31Å; C455-T462 PolarHBondContact N-OG1 3.08Å; C455-T462 PolarHBondContact SG-OG1 3.12Å; G460-T462 VanDerWaalsContact C-N 3.31Å; G460-T462 PolarHBondContact O-N 2.82Å; T462-T464 PolarHBondContact O-N 3.29Å; T462-I465 PolarHBondContact O-N 2.84Å; T462-V466 HydrophobicContact CG2-CG2 4.43Å; T462-V466 VanDerWaalsContact O-CG2 3.25Å; T462-V466 WeakPolarHBondContact O-CG2 3.26Å; T462-V466 PolarHBondContact O-N 3.33Å
463	G	95.4	Very high	94.2	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-65.9	-37.8	179.1	0	0	0	0	0	113	I459 G460 R461 V466 V467	I459-G463 WeakPolarHBondContact O-CA 3.22Å; I459-G463 PolarHBondContact O-N 2.85Å; G460-G463 PolarHBondContact O-N 3Å; G460-G463 VanDerWaalsContact O-N 3.14Å; R461-G463 PolarHBondContact O-N 2.82Å; G463-V466 PolarHBondContact O-N 3.16Å; G463-V467 WeakPolarHBondContact O-CB 3.42Å; G463-V467 VanDerWaalsContact O-CG2 3.26Å; G463-V467 WeakPolarHBondContact O-CG2 3.42Å; G463-V467 PolarHBondContact O-N 3.27Å
464	T	96.8	Very high	93.8	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-60.1	-47.9	174.4	-57.2	0	0	0	0	111.7	W419 G460 R461 T462 I468 Q506 F509 I510	W419-T464 HydrophobicContact CH2-CG2 3.8Å; G460-T464 PolarHBondContact O-N 2.88Å; G460-T464 PolarHBondContact O-OG1 3.42Å; G460-T464 VanDerWaalsContact O-OG1 3.07Å; R461-T464 PolarHBondContact O-N 2.49Å; T462-T464 PolarHBondContact O-N 3.29Å; T464-I468 HydrophobicContact CG2-CD1 3.84Å; T464-I468 WeakPolarHBondContact O-CD1 3.3Å; T464-I468 VanDerWaalsContact O-CG1 3.23Å; T464-I468 WeakPolarHBondContact O-CG1 3.29Å; T464-I468 PolarHBondContact O-N 2.82Å; T464-Q506 WeakPolarHBondContact OG1-CB 3.35Å; T464-F509 HydrophobicContact CG2-CD1 3.91Å; T464-I510 HydrophobicContact CG2-CD1 4.43Å; T464-I510 HydrophobicContact CG2-CG1 3.86Å
465	I	97.5	Very high	93.3	Very high	3 Å²	3	5.8 Å²	5.8	2%	0.015	3%	0.033	C	C	.	.	H	α-helix	trans	-64.8	-46.4	178.8	-70.5	-60.4	0	0	0	111.6	T352 W419 V431 L435 I453 R461 T462 V467 I468 D469	T352-I465 HydrophobicContact CG2-CG1 3.9Å; W419-I465 HydrophobicContact CZ3-CD1 3.95Å; W419-I465 HydrophobicContact CZ3-CG1 4.15Å; V431-I465 HydrophobicContact CG1-CD1 3.41Å; V431-I465 VanDerWaalsContact CG1-CD1 3.41Å; L435-I465 HydrophobicContact CD2-CG2 3.92Å; I453-I465 HydrophobicContact CD1-CG2 4.01Å; I453-I465 HydrophobicContact CG2-CG2 4.17Å; R461-I465 WeakPolarHBondContact O-CG1 3.25Å; R461-I465 PolarHBondContact O-N 3.4Å; T462-I465 PolarHBondContact O-N 2.84Å; I465-V467 VanDerWaalsContact C-N 3.35Å; I465-V467 PolarHBondContact O-N 3.45Å; I465-I468 PolarHBondContact O-N 3.31Å; I465-D469 WeakPolarHBondContact O-CB 3.34Å; I465-D469 PolarHBondContact O-N 2.9Å
466	V	97.7	Very high	93.1	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-58.7	-46.4	178.4	170.5	0	0	0	0	111.1	V310 Y323 I453 T462 G463 D469 M470 V493 M500	V310-V466 HydrophobicContact CG1-CG1 4.11Å; Y323-V466 HydrophobicContact CD1-CG2 4.39Å; Y323-V466 HydrophobicContact CD2-CG1 4.33Å; Y323-V466 HydrophobicContact CG-CG1 4.27Å; I453-V466 HydrophobicContact CB-CG2 4.34Å; I453-V466 HydrophobicContact CD1-CG2 3.87Å; I453-V466 HydrophobicContact CG1-CG2 4.45Å; T462-V466 HydrophobicContact CG2-CG2 4.43Å; T462-V466 VanDerWaalsContact O-CG2 3.25Å; T462-V466 WeakPolarHBondContact O-CG2 3.26Å; T462-V466 PolarHBondContact O-N 3.33Å; G463-V466 PolarHBondContact O-N 3.16Å; V466-D469 PolarHBondContact O-N 3.22Å; V466-M470 HydrophobicContact CG1-CE 3.74Å; V466-M470 HydrophobicContact CG1-CG 4.46Å; V466-M470 HydrophobicContact CG1-SD 3.93Å; V466-M470 VanDerWaalsContact O-CG 3.28Å; V466-M470 WeakPolarHBondContact O-CG 3.4Å; V466-M470 PolarHBondContact O-N 2.85Å; V466-V493 HydrophobicContact CG1-CG1 4.34Å; V466-M500 HydrophobicContact CB-CE 4.36Å; V466-M500 HydrophobicContact CG2-CE 4.38Å
467	V	97.3	Very high	92.8	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-67.4	-41.6	-178.8	170.9	0	0	0	0	111.6	G463 I465 I471 I490 V493 V501 I510	G463-V467 WeakPolarHBondContact O-CB 3.42Å; G463-V467 VanDerWaalsContact O-CG2 3.26Å; G463-V467 WeakPolarHBondContact O-CG2 3.42Å; G463-V467 PolarHBondContact O-N 3.27Å; I465-V467 VanDerWaalsContact C-N 3.35Å; I465-V467 PolarHBondContact O-N 3.45Å; V467-I471 HydrophobicContact CG1-CD1 3.7Å; V467-I471 WeakPolarHBondContact O-CD1 3.32Å; V467-I471 VanDerWaalsContact O-CG1 3.27Å; V467-I471 WeakPolarHBondContact O-CG1 3.39Å; V467-I471 PolarHBondContact O-N 3.38Å; V467-I471 VanDerWaalsContact O-N 3.13Å; V467-I490 HydrophobicContact CG1-CG1 3.96Å; V467-I490 HydrophobicContact CG2-CG1 4.11Å; V467-V493 HydrophobicContact CG2-CG1 4.18Å; V467-V493 HydrophobicContact CG2-CG2 3.59Å; V467-V501 HydrophobicContact CG2-CG2 4.33Å; V467-I510 HydrophobicContact CB-CD1 4.25Å; V467-I510 HydrophobicContact CG1-CD1 4Å; V467-I510 HydrophobicContact CG1-CG2 3.99Å
468	I	97.6	Very high	92.6	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58.3	-52.7	174.1	-68.8	166	0	0	0	108.9	L432 L435 T464 I465 M470 I471 L472 F509 I510 A513	L432-I468 HydrophobicContact CD2-CG2 4.44Å; L435-I468 HydrophobicContact CD1-CB 4.2Å; L435-I468 HydrophobicContact CD1-CG2 3.58Å; T464-I468 HydrophobicContact CG2-CD1 3.84Å; T464-I468 WeakPolarHBondContact O-CD1 3.3Å; T464-I468 VanDerWaalsContact O-CG1 3.23Å; T464-I468 WeakPolarHBondContact O-CG1 3.29Å; T464-I468 PolarHBondContact O-N 2.82Å; I465-I468 PolarHBondContact O-N 3.31Å; I468-M470 VanDerWaalsContact C-N 3.34Å; I468-M470 PolarHBondContact O-N 3.46Å; I468-I471 PolarHBondContact O-N 3.15Å; I468-I471 VanDerWaalsContact O-N 3.1Å; I468-L472 HydrophobicContact CG2-CD1 3.97Å; I468-L472 HydrophobicContact CG2-CG 4.02Å; I468-L472 VanDerWaalsContact O-CG 3.3Å; I468-L472 WeakPolarHBondContact O-CG 3.05Å; I468-L472 PolarHBondContact O-N 2.83Å; I468-F509 HydrophobicContact CD1-CD1 4.05Å; I468-F509 HydrophobicContact CD1-CE1 4Å; I468-I510 HydrophobicContact CD1-CG1 4.36Å; I468-I510 HydrophobicContact CG1-CB 4.29Å; I468-I510 HydrophobicContact CG1-CG1 4.02Å; I468-I510 HydrophobicContact CG1-CG2 4.1Å; I468-A513 HydrophobicContact CD1-CB 3.83Å; I468-A513 HydrophobicContact CG1-CB 4.22Å; I468-A513 HydrophobicContact CG2-CB 4.35Å
469	D	96.8	Very high	92.2	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-58.2	-43.2	-176.3	-158.3	62	0	0	0	113.1	K321 Y323 L435 N439 I465 V466 I471 L472 E473	K321-D469 IonicContact NZ-OD1 3.44Å; K321-D469 IonicContact NZ-OD2 2.88Å; K321-D469 PolarHBondContact NZ-OD2 2.83Å; Y323-D469 HydrophobicContact CE1-CB 4.25Å; Y323-D469 WeakPolarHBondContact CE1-OD2 3.39Å; Y323-D469 PolarHBondContact OH-OD2 3Å; L435-D469 HydrophobicContact CD2-CB 4.32Å; N439-D469 VanDerWaalsContact CG-OD1 3.31Å; N439-D469 PolarHBondContact ND2-OD1 2.75Å; N439-D469 PolarHBondContact OD1-OD1 2.8Å; N439-D469 VanDerWaalsContact OD1-OD1 3.1Å; N439-D469 PolarHBondContact OD1-OD2 2.76Å; I465-D469 WeakPolarHBondContact O-CB 3.34Å; I465-D469 PolarHBondContact O-N 2.9Å; V466-D469 PolarHBondContact O-N 3.22Å; D469-I471 PolarHBondContact O-N 3.08Å; D469-L472 PolarHBondContact O-N 2.93Å; D469-E473 WeakPolarHBondContact O-CB 3.25Å; D469-E473 PolarHBondContact O-N 3.02Å
470	M	94.9	Very high	91.8	Very high	1 Å²	1	15 Å²	15	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-61.1	-42.1	175.9	-73.7	175.6	166.8	0	0	112.8	V310 Y323 V466 I468 T474 Y489 M492 V493	V310-M470 HydrophobicContact CG1-CE 3.87Å; Y323-M470 HydrophobicContact CD2-CE 3.53Å; Y323-M470 HydrophobicContact CE2-CE 3.5Å; Y323-M470 VanDerWaalsContact CE2-CE 3.5Å; Y323-M470 HydrophobicContact CE2-CG 3.78Å; V466-M470 HydrophobicContact CG1-CE 3.74Å; V466-M470 HydrophobicContact CG1-CG 4.46Å; V466-M470 HydrophobicContact CG1-SD 3.93Å; V466-M470 VanDerWaalsContact O-CG 3.28Å; V466-M470 WeakPolarHBondContact O-CG 3.4Å; V466-M470 PolarHBondContact O-N 2.85Å; I468-M470 VanDerWaalsContact C-N 3.34Å; I468-M470 PolarHBondContact O-N 3.46Å; M470-T474 WeakPolarHBondContact O-CB 3.13Å; M470-T474 PolarHBondContact O-N 3.42Å; M470-T474 PolarHBondContact O-OG1 3.22Å; M470-Y489 HydrophobicContact CB-CD1 4.18Å; M470-Y489 HydrophobicContact CB-CE1 4.17Å; M470-M492 HydrophobicContact CE-CE 4.4Å; M470-M492 HydrophobicContact SD-CE 3.8Å; M470-V493 HydrophobicContact CE-CG1 4.13Å; M470-V493 HydrophobicContact SD-CG1 3.73Å
471	I	94.1	Very high	91.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-69.2	-41.5	178.9	-66	162.8	0	0	0	110.1	V467 I468 D469 T474 I475 I484 I486 Y489 I510 V514	V467-I471 HydrophobicContact CG1-CD1 3.7Å; V467-I471 WeakPolarHBondContact O-CD1 3.32Å; V467-I471 VanDerWaalsContact O-CG1 3.27Å; V467-I471 WeakPolarHBondContact O-CG1 3.39Å; V467-I471 PolarHBondContact O-N 3.38Å; V467-I471 VanDerWaalsContact O-N 3.13Å; I468-I471 PolarHBondContact O-N 3.15Å; I468-I471 VanDerWaalsContact O-N 3.1Å; D469-I471 PolarHBondContact O-N 3.08Å; I471-T474 WeakPolarHBondContact O-CB 3.13Å; I471-T474 PolarHBondContact O-N 2.88Å; I471-I475 HydrophobicContact CG2-CD1 3.81Å; I471-I475 HydrophobicContact CG2-CG1 4.42Å; I471-I475 VanDerWaalsContact O-CG1 3.3Å; I471-I475 WeakPolarHBondContact O-CG1 3.33Å; I471-I475 PolarHBondContact O-N 2.96Å; I471-I484 HydrophobicContact CG2-CD1 3.85Å; I471-I484 HydrophobicContact CG2-CG1 4.49Å; I471-I484 HydrophobicContact CG2-CG2 3.97Å; I471-I486 HydrophobicContact CD1-CG1 3.88Å; I471-Y489 HydrophobicContact CD1-CD2 4.36Å; I471-Y489 HydrophobicContact CD1-CG 4.36Å; I471-Y489 HydrophobicContact CG1-CD1 4.09Å; I471-Y489 HydrophobicContact CG1-CD2 3.87Å; I471-Y489 HydrophobicContact CG1-CE1 4.26Å; I471-Y489 HydrophobicContact CG1-CE2 4.07Å; I471-Y489 HydrophobicContact CG1-CG 3.9Å; I471-I510 HydrophobicContact CD1-CG2 3.96Å; I471-V514 HydrophobicContact CB-CG2 4.21Å; I471-V514 HydrophobicContact CD1-CG2 4.23Å; I471-V514 HydrophobicContact CG2-CG1 4.04Å; I471-V514 HydrophobicContact CG2-CG2 3.66Å
472	L	93.5	Very high	90.4	Very high	4 Å²	4	14.2 Å²	14.2	2%	0.021	8%	0.083	C	C	.	.	H	α-helix	trans	-61.8	-45.6	176.8	-60.9	-167.1	0	0	0	111.2	L432 L435 I468 D469 T474 I475 D476 Y517	L432-L472 HydrophobicContact CD2-CD1 3.87Å; L435-L472 HydrophobicContact CD1-CD1 4.49Å; I468-L472 HydrophobicContact CG2-CD1 3.97Å; I468-L472 HydrophobicContact CG2-CG 4.02Å; I468-L472 VanDerWaalsContact O-CG 3.3Å; I468-L472 WeakPolarHBondContact O-CG 3.05Å; I468-L472 PolarHBondContact O-N 2.83Å; D469-L472 PolarHBondContact O-N 2.93Å; L472-T474 VanDerWaalsContact C-N 3.28Å; L472-T474 PolarHBondContact O-N 2.78Å; L472-I475 HydrophobicContact CD2-CD1 4.42Å; L472-I475 PolarHBondContact O-N 2.82Å; L472-I475 VanDerWaalsContact O-N 3.14Å; L472-D476 WeakPolarHBondContact O-CB 3.38Å; L472-D476 VanDerWaalsContact O-CG 3.24Å; L472-D476 PolarHBondContact O-N 3.12Å; L472-Y517 HydrophobicContact CD1-CD2 3.98Å; L472-Y517 HydrophobicContact CD1-CE2 4.19Å; L472-Y517 HydrophobicContact CD1-CG 4.32Å; L472-Y517 HydrophobicContact CD2-CD1 3.51Å; L472-Y517 HydrophobicContact CD2-CD2 3.97Å; L472-Y517 HydrophobicContact CD2-CE1 4.06Å; L472-Y517 HydrophobicContact CD2-CE2 4.49Å; L472-Y517 HydrophobicContact CD2-CG 3.44Å; L472-Y517 VanDerWaalsContact CD2-CG 3.44Å; L472-Y517 HydrophobicContact CG-CG 4.42Å
473	E	90.9	Very high	89.8	Confident	30 Å²	30	16.2 Å²	16.2	14%	0.14	9%	0.093	C	C	.	.	H	α-helix	trans	-59.4	-38.9	174.9	-178.1	177.7	-178	0	0	112.1	K321 Y323 D469 D476 T477	K321-E473 WeakPolarHBondContact CB-OE2 3.44Å; K321-E473 WeakPolarHBondContact CD-OE2 3.43Å; K321-E473 WeakPolarHBondContact CG-OE2 3.2Å; K321-E473 PolarHBondContact N-OE1 3.35Å; K321-E473 VanDerWaalsContact N-OE1 3.08Å; K321-E473 IonicContact NZ-OE2 3.6Å; Y323-E473 PolarHBondContact OH-OE2 3.26Å; D469-E473 WeakPolarHBondContact O-CB 3.25Å; D469-E473 PolarHBondContact O-N 3.02Å; E473-D476 PolarHBondContact O-N 3.4Å; E473-T477 WeakPolarHBondContact O-CB 3.17Å; E473-T477 PolarHBondContact O-N 3.19Å; E473-T477 PolarHBondContact O-OG1 2.8Å
474	T	88.7	Confident	89.4	Confident	3 Å²	3	16.2 Å²	16.2	2%	0.018	9%	0.093	C	C	.	.	H	α-helix	trans	-64.3	-44.3	175.2	-57.2	0	0	0	0	111.2	W315 M470 I471 L472 T477 L478 Y489	W315-T474 PolarHBondContact NE1-OG1 3.42Å; M470-T474 WeakPolarHBondContact O-CB 3.13Å; M470-T474 PolarHBondContact O-N 3.42Å; M470-T474 PolarHBondContact O-OG1 3.22Å; I471-T474 WeakPolarHBondContact O-CB 3.13Å; I471-T474 PolarHBondContact O-N 2.88Å; L472-T474 VanDerWaalsContact C-N 3.28Å; L472-T474 PolarHBondContact O-N 2.78Å; T474-T477 PolarHBondContact O-N 2.85Å; T474-L478 HydrophobicContact CG2-CD1 3.68Å; T474-L478 HydrophobicContact CG2-CG 4.29Å; T474-L478 VanDerWaalsContact O-CB 3.31Å; T474-L478 WeakPolarHBondContact O-CB 3.39Å; T474-L478 WeakPolarHBondContact O-CG 3.46Å; T474-L478 PolarHBondContact O-N 2.85Å; T474-Y489 WeakPolarHBondContact CB-OH 3.36Å; T474-Y489 WeakPolarHBondContact CG2-OH 3.44Å; T474-Y489 PolarHBondContact OG1-OH 3.05Å
475	I	89.1	Confident	89.1	Confident	3 Å²	3	17.4 Å²	17.4	2%	0.015	10%	0.1	C	C	.	.	H	α-helix	trans	-64.9	-43.7	177.2	-66.9	159.5	0	0	0	110.8	A218 I471 L472 T477 G479 L480 I484 V514 Y517 I518	A218-I475 HydrophobicContact CB-CG1 4.32Å; I471-I475 HydrophobicContact CG2-CD1 3.81Å; I471-I475 HydrophobicContact CG2-CG1 4.42Å; I471-I475 VanDerWaalsContact O-CG1 3.3Å; I471-I475 WeakPolarHBondContact O-CG1 3.33Å; I471-I475 PolarHBondContact O-N 2.96Å; L472-I475 HydrophobicContact CD2-CD1 4.42Å; L472-I475 PolarHBondContact O-N 2.82Å; L472-I475 VanDerWaalsContact O-N 3.14Å; I475-T477 VanDerWaalsContact C-N 3.26Å; I475-T477 PolarHBondContact O-N 3.37Å; I475-G479 CarbonylContact O-C 3.54Å; I475-G479 WeakPolarHBondContact O-CA 3.4Å; I475-G479 PolarHBondContact O-N 3.39Å; I475-L480 HydrophobicContact CG2-CD2 3.84Å; I475-I484 HydrophobicContact CD1-CD1 3.68Å; I475-I484 HydrophobicContact CG1-CD1 3.72Å; I475-V514 HydrophobicContact CD1-CG1 3.97Å; I475-Y517 HydrophobicContact CD1-CD1 4.47Å; I475-Y517 HydrophobicContact CG2-CE1 4.25Å; I475-I518 HydrophobicContact CD1-CD1 3.82Å; I475-I518 HydrophobicContact CD1-CG1 4.03Å
476	D	88.1	Confident	88.9	Confident	92 Å²	92	17.3 Å²	17.3	49%	0.492	10%	0.099	S	C	.	.	H	α-helix	trans	-64.9	-33.6	-179.9	-70.2	-16.5	0	0	0	111.8	L472 E473 Y517	L472-D476 WeakPolarHBondContact O-CB 3.38Å; L472-D476 VanDerWaalsContact O-CG 3.24Å; L472-D476 PolarHBondContact O-N 3.12Å; E473-D476 PolarHBondContact O-N 3.4Å; D476-Y517 WeakPolarHBondContact OD1-CE1 3.23Å; D476-Y517 PolarHBondContact OD1-OH 2.82Å; D476-Y517 PolarHBondContact OD2-OH 2.77Å; D476-Y517 VanDerWaalsContact OD2-OH 3.06Å
477	T	84.6	Confident	88.6	Confident	49 Å²	49	17.9 Å²	17.9	30%	0.301	10%	0.103	S	C	.	.	H	α-helix	trans	-83.8	-42.3	-179.8	-50.2	0	0	0	0	113	I23 W315 E473 T474 I475	I23-T477 WeakPolarHBondContact CD1-O 3.37Å; W315-T477 HydrophobicContact CH2-CG2 3.55Å; W315-T477 HydrophobicContact CZ3-CG2 3.94Å; E473-T477 WeakPolarHBondContact O-CB 3.17Å; E473-T477 PolarHBondContact O-N 3.19Å; E473-T477 PolarHBondContact O-OG1 2.8Å; T474-T477 PolarHBondContact O-N 2.85Å; I475-T477 VanDerWaalsContact C-N 3.26Å; I475-T477 PolarHBondContact O-N 3.37Å
478	L	82.1	Confident	88.2	Confident	54 Å²	54	22.2 Å²	22.2	28%	0.283	12%	0.122	S	C	.	.	H	α-helix	trans	-98.3	-12.5	-172.8	-57.4	-177.6	0	0	0	113.7	Y98 W315 T474 C482	Y98-L478 HydrophobicContact CD1-CD2 3.64Å; Y98-L478 HydrophobicContact CE1-CD2 3.9Å; W315-L478 HydrophobicContact CE3-CD2 4.23Å; W315-L478 HydrophobicContact CZ3-CD2 3.99Å; W315-L478 HydrophobicContact CZ3-CG 4.47Å; T474-L478 HydrophobicContact CG2-CD1 3.68Å; T474-L478 HydrophobicContact CG2-CG 4.29Å; T474-L478 VanDerWaalsContact O-CB 3.31Å; T474-L478 WeakPolarHBondContact O-CB 3.39Å; T474-L478 WeakPolarHBondContact O-CG 3.46Å; T474-L478 PolarHBondContact O-N 2.85Å; L478-C482 HydrophobicContact CB-CB 3.62Å; L478-C482 HydrophobicContact CD1-CB 4.14Å
479	G	82	Confident	88.1	Confident	23 Å²	23	22.7 Å²	22.7	24%	0.237	12%	0.124	C	C	.	.			trans	84.7	177.2	-175.8	0	0	0	0	0	114.4	I475 D481 C482	I475-G479 CarbonylContact O-C 3.54Å; I475-G479 WeakPolarHBondContact O-CA 3.4Å; I475-G479 PolarHBondContact O-N 3.39Å; G479-D481 VanDerWaalsContact C-N 3.25Å; G479-D481 PolarHBondContact O-N 2.89Å; G479-C482 WeakPolarHBondContact O-CB 3.38Å; G479-C482 PolarHBondContact O-N 3.37Å; G479-C482 PolarHBondContact O-SG 3.43Å
480	L	80.9	Confident	87.9	Confident	16 Å²	16	22.7 Å²	22.7	8%	0.084	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-9	-173.1	-65.4	179.7	0	0	0	115.2	A218 S219 I475 I518 T521 K522	A218-L480 WeakPolarHBondContact CB-O 3.17Å; S219-L480 VanDerWaalsContact CB-O 3.26Å; S219-L480 WeakPolarHBondContact CB-O 3.37Å; S219-L480 PolarHBondContact N-O 3.03Å; S219-L480 PolarHBondContact OG-O 2.8Å; I475-L480 HydrophobicContact CG2-CD2 3.84Å; L480-I518 HydrophobicContact CD2-CB 4.44Å; L480-I518 HydrophobicContact CD2-CG1 4.08Å; L480-I518 HydrophobicContact CD2-CG2 4.07Å; L480-T521 HydrophobicContact CD1-CG2 4.35Å; L480-T521 HydrophobicContact CD2-CG2 4.21Å; L480-T521 HydrophobicContact CG-CG2 4.5Å; L480-K522 HydrophobicContact CD1-CG 3.66Å
481	D	75.1	Confident	87.7	Confident	12 Å²	12	25.8 Å²	25.8	6%	0.064	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	7.6	178.6	-67.4	-34.2	0	0	0	112.2	R21 N101 S219 G479	R21-D481 IonicContact CZ-OD1 3.29Å; R21-D481 IonicContact CZ-OD2 3.16Å; R21-D481 IonicContact NE-OD1 3.89Å; R21-D481 IonicContact NE-OD2 3.58Å; R21-D481 PolarHBondContact NE-OD2 3.48Å; R21-D481 VanDerWaalsContact NH1-CG 3.29Å; R21-D481 IonicContact NH1-OD1 2.9Å; R21-D481 PolarHBondContact NH1-OD1 2.89Å; R21-D481 IonicContact NH1-OD2 3.27Å; R21-D481 PolarHBondContact NH1-OD2 2.61Å; R21-D481 IonicContact NH2-OD1 3.94Å; R21-D481 PolarHBondContact NH2-OD1 3.32Å; R21-D481 IonicContact NH2-OD2 3.84Å; N101-D481 WeakPolarHBondContact CB-O 3.38Å; N101-D481 PolarHBondContact ND2-O 2.81Å; S219-D481 PolarHBondContact OG-OD1 2.91Å; G479-D481 VanDerWaalsContact C-N 3.25Å; G479-D481 PolarHBondContact O-N 2.89Å
482	C	80.4	Confident	87.6	Confident	8 Å²	8	26.1 Å²	26.1	5%	0.054	14%	0.14	C	C	.	.	S	Bend	trans	-69.9	155.2	178.7	74.6	0	0	0	0	112.9	A218 L478 G479	A218-C482 PolarHBondContact N-O 2.97Å; L478-C482 HydrophobicContact CB-CB 3.62Å; L478-C482 HydrophobicContact CD1-CB 4.14Å; G479-C482 WeakPolarHBondContact O-CB 3.38Å; G479-C482 PolarHBondContact O-N 3.37Å; G479-C482 PolarHBondContact O-SG 3.43Å
483	D	81.8	Confident	87.7	Confident	41 Å²	41	26 Å²	26	22%	0.219	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	126.4	174	-83.7	-12.5	0	0	0	110.1	R3 R215	R3-D483 VanDerWaalsContact CD-OD1 3.3Å; R3-D483 WeakPolarHBondContact CD-OD1 3.39Å; R3-D483 IonicContact CZ-OD1 3.46Å; R3-D483 IonicContact NE-OD1 2.76Å; R3-D483 IonicContact NH1-OD1 3.5Å; R3-D483 PolarHBondContact NH1-OD1 2.93Å; R215-D483 WeakPolarHBondContact CD-OD2 3.36Å; R215-D483 HydrophobicContact CG-CB 4.32Å; R215-D483 IonicContact CZ-OD2 3.55Å; R215-D483 IonicContact NE-OD2 4Å; R215-D483 IonicContact NH1-OD2 2.74Å; R215-D483 PolarHBondContact NH1-OD2 2.96Å
484	I	88.2	Confident	87.8	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.1	173	-55.2	179.3	0	0	0	109.2	R215 V216 A218 I471 I475 I486 V514 I518	R215-I484 WeakPolarHBondContact CA-O 3.18Å; V216-I484 HydrophobicContact CG1-CB 4.47Å; V216-I484 PolarHBondContact N-O 2.9Å; V216-I484 PolarHBondContact O-N 3.5Å; V216-I484 VanDerWaalsContact O-O 3.13Å; A218-I484 HydrophobicContact CB-CD1 3.34Å; A218-I484 HydrophobicContact CB-CG1 3.88Å; I471-I484 HydrophobicContact CG2-CD1 3.85Å; I471-I484 HydrophobicContact CG2-CG1 4.49Å; I471-I484 HydrophobicContact CG2-CG2 3.97Å; I475-I484 HydrophobicContact CD1-CD1 3.68Å; I475-I484 HydrophobicContact CG1-CD1 3.72Å; I484-I486 HydrophobicContact CG2-CG1 3.87Å; I484-V514 HydrophobicContact CD1-CG1 4.1Å; I484-I518 HydrophobicContact CD1-CD1 4.46Å
485	D	90.3	Very high	87.9	Confident	25 Å²	25	28.2 Å²	28.2	13%	0.134	15%	0.148	C	C	.	.			trans	-134.8	86.7	174	-172.1	-15.7	0	0	0	109.1	T214 P487 K488 Y489	T214-D485 WeakPolarHBondContact CB-OD1 3.36Å; T214-D485 VanDerWaalsContact OG1-CG 3.31Å; T214-D485 PolarHBondContact OG1-OD1 2.84Å; T214-D485 PolarHBondContact OG1-OD2 2.97Å; D485-P487 WeakPolarHBondContact OD1-CD 3.35Å; D485-K488 HydrophobicContact CB-CB 3.81Å; D485-K488 VanDerWaalsContact CG-CB 3.41Å; D485-K488 WeakPolarHBondContact O-CA 3.34Å; D485-K488 WeakPolarHBondContact O-CB 3.37Å; D485-K488 PolarHBondContact O-N 2.68Å; D485-K488 PolarHBondContact OD1-N 3.45Å; D485-Y489 WeakPolarHBondContact O-CD2 3.36Å; D485-Y489 PolarHBondContact O-N 2.99Å
486	I	93.6	Very high	88.2	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-56.7	-47.3	-172.6	-67	175.2	0	0	0	111.7	I221 I471 I484 K488 Y489 I490 Y507 I510 Y511	I221-I486 HydrophobicContact CD1-CD1 4.21Å; I471-I486 HydrophobicContact CD1-CG1 3.88Å; I484-I486 HydrophobicContact CG2-CG1 3.87Å; I486-K488 VanDerWaalsContact C-N 3.26Å; I486-K488 PolarHBondContact O-N 2.83Å; I486-Y489 PolarHBondContact O-N 3.08Å; I486-I490 HydrophobicContact CG2-CD1 3.87Å; I486-I490 HydrophobicContact CG2-CG1 4.41Å; I486-I490 WeakPolarHBondContact O-CG1 3.34Å; I486-I490 PolarHBondContact O-N 3.21Å; I486-Y507 HydrophobicContact CG2-CE2 4.24Å; I486-I510 HydrophobicContact CD1-CG2 4.22Å; I486-I510 HydrophobicContact CG1-CG2 4.5Å; I486-I510 HydrophobicContact CG2-CB 4.42Å; I486-I510 HydrophobicContact CG2-CG2 3.82Å; I486-Y511 HydrophobicContact CB-CD2 4.38Å; I486-Y511 HydrophobicContact CB-CE2 3.75Å; I486-Y511 HydrophobicContact CD1-CD1 3.58Å; I486-Y511 HydrophobicContact CD1-CD2 3.59Å; I486-Y511 HydrophobicContact CD1-CE1 3.69Å; I486-Y511 HydrophobicContact CD1-CE2 3.71Å; I486-Y511 HydrophobicContact CD1-CG 3.53Å; I486-Y511 HydrophobicContact CG1-CE1 4.5Å; I486-Y511 HydrophobicContact CG1-CE2 4.28Å; I486-Y511 HydrophobicContact CG2-CD2 4.05Å; I486-Y511 HydrophobicContact CG2-CE2 3.64Å
487	P	90.1	Very high	88.5	Confident	12 Å²	12	23.9 Å²	23.9	8%	0.078	13%	0.125	C	C	.	.	H	α-helix	trans	-52.8	-41.4	171.9	-33.8	41.9	0	0	0	114.1	T214 L254 D485 I490 Q491 Y507	T214-P487 HydrophobicContact CG2-CB 4.21Å; T214-P487 HydrophobicContact CG2-CG 3.7Å; L254-P487 HydrophobicContact CD1-CB 4.5Å; D485-P487 WeakPolarHBondContact OD1-CD 3.35Å; P487-I490 PolarHBondContact O-N 2.9Å; P487-Q491 WeakPolarHBondContact O-CB 3.05Å; P487-Q491 PolarHBondContact O-N 3.21Å; P487-Y507 HydrophobicContact CG-CE2 4.12Å; P487-Y507 WeakPolarHBondContact CG-OH 3.35Å
488	K	90.2	Very high	88.6	Confident	91 Å²	91	22.3 Å²	22.3	40%	0.396	12%	0.116	S	C	.	.	H	α-helix	trans	-68.9	-39.3	179.6	-165.1	-176.5	-177.4	-165.2	0	112.3	L314 D485 I486 I490 Q491 M492	L314-K488 HydrophobicContact CD1-CD 4.48Å; L314-K488 HydrophobicContact CD1-CG 4.23Å; L314-K488 HydrophobicContact CD2-CD 4.04Å; L314-K488 HydrophobicContact CD2-CG 3.95Å; D485-K488 HydrophobicContact CB-CB 3.81Å; D485-K488 VanDerWaalsContact CG-CB 3.41Å; D485-K488 WeakPolarHBondContact O-CA 3.34Å; D485-K488 WeakPolarHBondContact O-CB 3.37Å; D485-K488 PolarHBondContact O-N 2.68Å; D485-K488 PolarHBondContact OD1-N 3.45Å; I486-K488 VanDerWaalsContact C-N 3.26Å; I486-K488 PolarHBondContact O-N 2.83Å; K488-I490 VanDerWaalsContact C-N 3.34Å; K488-Q491 PolarHBondContact O-N 2.74Å; K488-M492 VanDerWaalsContact O-CB 3.26Å; K488-M492 WeakPolarHBondContact O-CB 3.12Å; K488-M492 PolarHBondContact O-N 2.83Å
489	Y	94.4	Very high	88.6	Confident	10 Å²	10	20 Å²	20	4%	0.039	11%	0.105	C	C	.	.	H	α-helix	trans	-58.7	-46.8	170.4	-85.1	-86.5	0	0	0	111.1	L314 M470 I471 T474 D485 I486 M492 V493	L314-Y489 HydrophobicContact CD1-CD1 3.8Å; L314-Y489 HydrophobicContact CD1-CD2 3.78Å; L314-Y489 HydrophobicContact CD1-CE1 3.94Å; L314-Y489 HydrophobicContact CD1-CE2 3.9Å; L314-Y489 HydrophobicContact CD1-CG 3.71Å; M470-Y489 HydrophobicContact CB-CD1 4.18Å; M470-Y489 HydrophobicContact CB-CE1 4.17Å; I471-Y489 HydrophobicContact CD1-CD2 4.36Å; I471-Y489 HydrophobicContact CD1-CG 4.36Å; I471-Y489 HydrophobicContact CG1-CD1 4.09Å; I471-Y489 HydrophobicContact CG1-CD2 3.87Å; I471-Y489 HydrophobicContact CG1-CE1 4.26Å; I471-Y489 HydrophobicContact CG1-CE2 4.07Å; I471-Y489 HydrophobicContact CG1-CG 3.9Å; T474-Y489 WeakPolarHBondContact CB-OH 3.36Å; T474-Y489 WeakPolarHBondContact CG2-OH 3.44Å; T474-Y489 PolarHBondContact OG1-OH 3.05Å; D485-Y489 WeakPolarHBondContact O-CD2 3.36Å; D485-Y489 PolarHBondContact O-N 2.99Å; I486-Y489 PolarHBondContact O-N 3.08Å; Y489-M492 HydrophobicContact CD1-CE 4.22Å; Y489-M492 PolarHBondContact O-N 3.37Å; Y489-V493 PolarHBondContact O-N 3.06Å
490	I	93.6	Very high	89.1	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-65.2	-43.3	179.8	-59.2	169	0	0	0	110.8	L254 V467 I486 P487 K488 M492 V493 R494 V501 Y507 I510	L254-I490 HydrophobicContact CD2-CB 3.86Å; L254-I490 HydrophobicContact CD2-CD1 4.36Å; L254-I490 HydrophobicContact CD2-CG2 3.53Å; V467-I490 HydrophobicContact CG1-CG1 3.96Å; V467-I490 HydrophobicContact CG2-CG1 4.11Å; I486-I490 HydrophobicContact CG2-CD1 3.87Å; I486-I490 HydrophobicContact CG2-CG1 4.41Å; I486-I490 WeakPolarHBondContact O-CG1 3.34Å; I486-I490 PolarHBondContact O-N 3.21Å; P487-I490 PolarHBondContact O-N 2.9Å; K488-I490 VanDerWaalsContact C-N 3.34Å; I490-M492 VanDerWaalsContact C-N 3.33Å; I490-M492 PolarHBondContact O-N 3.06Å; I490-V493 WeakPolarHBondContact O-CG2 3.27Å; I490-V493 PolarHBondContact O-N 3.12Å; I490-R494 HydrophobicContact CG2-CG 4.21Å; I490-R494 VanDerWaalsContact O-CB 3.29Å; I490-R494 WeakPolarHBondContact O-CB 3.44Å; I490-R494 VanDerWaalsContact O-CG 3.23Å; I490-R494 WeakPolarHBondContact O-CG 3.45Å; I490-R494 PolarHBondContact O-N 3.31Å; I490-V501 HydrophobicContact CD1-CG1 4.39Å; I490-V501 HydrophobicContact CD1-CG2 4.32Å; I490-V501 HydrophobicContact CG1-CG2 4.16Å; I490-V501 HydrophobicContact CG2-CB 3.97Å; I490-V501 HydrophobicContact CG2-CG2 3.99Å; I490-Y507 HydrophobicContact CD1-CD2 3.41Å; I490-Y507 VanDerWaalsContact CD1-CD2 3.41Å; I490-Y507 HydrophobicContact CD1-CE2 3.7Å; I490-I510 HydrophobicContact CD1-CD1 3.86Å; I490-I510 HydrophobicContact CG1-CD1 4.3Å
491	Q	90.2	Very high	89.5	Confident	67 Å²	67	18.1 Å²	18.1	31%	0.313	9%	0.09	S	C	.	.	H	α-helix	trans	-58.5	-46.3	175.3	-175.5	178.5	-10.3	0	0	111.1	L254 P487 K488 V493 R494 E495	L254-Q491 HydrophobicContact CD1-CB 3.96Å; P487-Q491 WeakPolarHBondContact O-CB 3.05Å; P487-Q491 PolarHBondContact O-N 3.21Å; K488-Q491 PolarHBondContact O-N 2.74Å; Q491-V493 PolarHBondContact O-N 3.45Å; Q491-R494 CarbonylContact O-C 3.5Å; Q491-R494 WeakPolarHBondContact O-CB 3.33Å; Q491-R494 PolarHBondContact O-N 2.85Å; Q491-R494 VanDerWaalsContact O-N 3.13Å; Q491-E495 WeakPolarHBondContact O-CG 3.32Å; Q491-E495 PolarHBondContact O-N 3.15Å
492	M	92.9	Very high	89.9	Confident	7 Å²	7	21.8 Å²	21.8	3%	0.034	11%	0.106	C	C	.	.	H	α-helix	trans	-60.8	-42.2	179.4	177.1	-79.5	-68.5	0	0	112.3	D312 K313 L314 M470 K488 Y489 I490 E495 Q496	D312-M492 HydrophobicContact CB-CE 4.44Å; K313-M492 HydrophobicContact CB-CG 3.99Å; K313-M492 HydrophobicContact CB-SD 4.38Å; K313-M492 HydrophobicContact CG-SD 4.46Å; L314-M492 HydrophobicContact CD1-CB 4.49Å; L314-M492 HydrophobicContact CD2-CB 4.11Å; L314-M492 HydrophobicContact CD2-CG 4.15Å; L314-M492 HydrophobicContact CG-CB 4.26Å; L314-M492 HydrophobicContact CG-CE 4.37Å; L314-M492 HydrophobicContact CG-CG 4.12Å; M470-M492 HydrophobicContact CE-CE 4.4Å; M470-M492 HydrophobicContact SD-CE 3.8Å; K488-M492 VanDerWaalsContact O-CB 3.26Å; K488-M492 WeakPolarHBondContact O-CB 3.12Å; K488-M492 PolarHBondContact O-N 2.83Å; Y489-M492 HydrophobicContact CD1-CE 4.22Å; Y489-M492 PolarHBondContact O-N 3.37Å; I490-M492 VanDerWaalsContact C-N 3.33Å; I490-M492 PolarHBondContact O-N 3.06Å; M492-E495 PolarHBondContact O-N 3.42Å; M492-Q496 PolarHBondContact O-NE2 3.36Å; M492-Q496 PolarHBondContact SD-NE2 2.58Å
493	V	94.7	Very high	89.9	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-73	-31.9	174.5	-58.8	0	0	0	0	112.1	V310 V466 V467 M470 Y489 I490 Q491 E495 Q496 R497 M500	V310-V493 HydrophobicContact CG1-CB 3.97Å; V310-V493 HydrophobicContact CG1-CG1 3.7Å; V466-V493 HydrophobicContact CG1-CG1 4.34Å; V467-V493 HydrophobicContact CG2-CG1 4.18Å; V467-V493 HydrophobicContact CG2-CG2 3.59Å; M470-V493 HydrophobicContact CE-CG1 4.13Å; M470-V493 HydrophobicContact SD-CG1 3.73Å; Y489-V493 PolarHBondContact O-N 3.06Å; I490-V493 WeakPolarHBondContact O-CG2 3.27Å; I490-V493 PolarHBondContact O-N 3.12Å; Q491-V493 PolarHBondContact O-N 3.45Å; V493-E495 PolarHBondContact O-N 3.07Å; V493-Q496 PolarHBondContact O-N 3.39Å; V493-R497 PolarHBondContact O-N 2.84Å; V493-M500 HydrophobicContact CB-CB 4.43Å; V493-M500 HydrophobicContact CB-CG 4.5Å; V493-M500 HydrophobicContact CG2-CB 3.71Å; V493-M500 HydrophobicContact CG2-CG 4.28Å
494	R	92.3	Very high	90	Very high	12 Å²	12	25.7 Å²	25.7	5%	0.045	13%	0.127	C	C	.	.	H	α-helix	trans	-65.9	-25.4	174.2	-79.9	179.4	179	-165	-0.7	113.1	E258 F285 I490 Q491 R497 M500 V501	E258-R494 IonicContact OE2-NH1 3.25Å; F285-R494 VanDerWaalsContact CE2-O 3.31Å; F285-R494 WeakPolarHBondContact CE2-O 3.4Å; I490-R494 HydrophobicContact CG2-CG 4.21Å; I490-R494 VanDerWaalsContact O-CB 3.29Å; I490-R494 WeakPolarHBondContact O-CB 3.44Å; I490-R494 VanDerWaalsContact O-CG 3.23Å; I490-R494 WeakPolarHBondContact O-CG 3.45Å; I490-R494 PolarHBondContact O-N 3.31Å; Q491-R494 CarbonylContact O-C 3.5Å; Q491-R494 WeakPolarHBondContact O-CB 3.33Å; Q491-R494 PolarHBondContact O-N 2.85Å; Q491-R494 VanDerWaalsContact O-N 3.13Å; R494-R497 CarbonylContact C-O 3.51Å; R494-R497 WeakPolarHBondContact CA-O 3.42Å; R494-M500 HydrophobicContact CG-CB 4Å; R494-M500 WeakPolarHBondContact CG-O 3.47Å; R494-M500 PolarHBondContact NE-O 3.44Å; R494-V501 PolarHBondContact NH2-O 2.9Å
495	E	91.9	Very high	89.9	Confident	68 Å²	68	27.7 Å²	27.7	32%	0.318	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-19	171	-72.2	172.5	-171.9	0	0	112.3	K263 Q491 M492 V493	K263-E495 WeakPolarHBondContact CD-O 3.4Å; K263-E495 WeakPolarHBondContact CE-O 3.32Å; K263-E495 PolarHBondContact NZ-O 2.77Å; Q491-E495 WeakPolarHBondContact O-CG 3.32Å; Q491-E495 PolarHBondContact O-N 3.15Å; M492-E495 PolarHBondContact O-N 3.42Å; V493-E495 PolarHBondContact O-N 3.07Å
496	Q	94.4	Very high	89.8	Confident	3 Å²	3	27.3 Å²	27.3	1%	0.014	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-26.4	-178.8	-64.6	177.8	89.4	0	0	112.9	T288 N308 V310 K311 M492 V493	T288-Q496 HydrophobicContact CG2-CB 4.39Å; T288-Q496 HydrophobicContact CG2-CG 4.39Å; T288-Q496 PolarHBondContact OG1-O 3.26Å; N308-Q496 WeakPolarHBondContact CB-O 3.47Å; V310-Q496 HydrophobicContact CG1-CB 4.47Å; V310-Q496 HydrophobicContact CG2-CB 4.35Å; K311-Q496 PolarHBondContact O-NE2 3.16Å; M492-Q496 PolarHBondContact O-NE2 3.36Å; M492-Q496 PolarHBondContact SD-NE2 2.58Å; V493-Q496 PolarHBondContact O-N 3.39Å
497	R	94.6	Very high	89.6	Confident	1 Å²	1	27.2 Å²	27.2	0%	0.004	14%	0.14	C	C	.	.	S	Bend	trans	-148.9	132.3	169.5	-176.2	169.3	177.4	83.1	-2.7	109.9	N306 N308 A457 G458 I459 V493 R494 M500	N306-R497 PolarHBondContact OD1-NH1 3.45Å; N306-R497 VanDerWaalsContact OD1-NH1 3.17Å; N306-R497 PolarHBondContact OD1-NH2 3.13Å; N308-R497 HydrophobicContact CB-CB 4.03Å; N308-R497 HydrophobicContact CB-CG 4.35Å; N308-R497 WeakPolarHBondContact OD1-CG 3.48Å; N308-R497 PolarHBondContact OD1-NH1 2.79Å; A457-R497 PolarHBondContact O-NH2 3.35Å; A457-R497 VanDerWaalsContact O-NH2 3.12Å; G458-R497 PolarHBondContact O-NE 3.37Å; I459-R497 HydrophobicContact CG2-CG 4.39Å; V493-R497 PolarHBondContact O-N 2.84Å; R494-R497 CarbonylContact C-O 3.51Å; R494-R497 WeakPolarHBondContact CA-O 3.42Å; R497-M500 HydrophobicContact CB-CG 3.95Å; R497-M500 HydrophobicContact CB-SD 4.19Å; R497-M500 HydrophobicContact CG-CG 4.42Å; R497-M500 HydrophobicContact CG-SD 4.27Å; R497-M500 VanDerWaalsContact O-CG 3.22Å; R497-M500 WeakPolarHBondContact O-CG 3.35Å
498	S	87.6	Confident	89.7	Confident	17 Å²	17	29.6 Å²	29.6	12%	0.119	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	142.2	-176	60.2	0	0	0	0	112.6	F285 I459 M500	F285-S498 VanDerWaalsContact CE2-N 3.29Å; I459-S498 VanDerWaalsContact CG2-O 3.29Å; I459-S498 WeakPolarHBondContact CG2-O 3.28Å; S498-M500 VanDerWaalsContact C-N 3.29Å; S498-M500 PolarHBondContact O-N 2.79Å
499	G	81.8	Confident	89.9	Confident	4 Å²	4	25.4 Å²	25.4	4%	0.041	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	17.5	170.1	0	0	0	0	0	115.9	E258 V501 Q502	E258-G499 WeakPolarHBondContact OE1-CA 3.26Å; E258-G499 PolarHBondContact OE1-N 2.81Å; G499-V501 PolarHBondContact O-N 2.77Å; G499-Q502 PolarHBondContact O-NE2 2.88Å
500	M	91.3	Very high	90	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.129	C	C	.	.			trans	-57.4	127.9	173.5	-67.7	-69.9	-86.9	0	0	110.2	V310 A325 I459 V466 V493 R494 R497 S498	V310-M500 HydrophobicContact CG2-CE 4.5Å; A325-M500 HydrophobicContact CB-CE 4.06Å; A325-M500 HydrophobicContact CB-SD 4.42Å; I459-M500 WeakPolarHBondContact O-CA 3.25Å; V466-M500 HydrophobicContact CB-CE 4.36Å; V466-M500 HydrophobicContact CG2-CE 4.38Å; V493-M500 HydrophobicContact CB-CB 4.43Å; V493-M500 HydrophobicContact CB-CG 4.5Å; V493-M500 HydrophobicContact CG2-CB 3.71Å; V493-M500 HydrophobicContact CG2-CG 4.28Å; R494-M500 HydrophobicContact CG-CB 4Å; R494-M500 WeakPolarHBondContact CG-O 3.47Å; R494-M500 PolarHBondContact NE-O 3.44Å; R497-M500 HydrophobicContact CB-CG 3.95Å; R497-M500 HydrophobicContact CB-SD 4.19Å; R497-M500 HydrophobicContact CG-CG 4.42Å; R497-M500 HydrophobicContact CG-SD 4.27Å; R497-M500 VanDerWaalsContact O-CG 3.22Å; R497-M500 WeakPolarHBondContact O-CG 3.35Å; S498-M500 VanDerWaalsContact C-N 3.29Å; S498-M500 PolarHBondContact O-N 2.79Å
501	V	90.5	Very high	90.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	62.6	107.9	-168	-171.6	0	0	0	0	111.5	I459 V467 I490 R494 G499 Q506 I510	I459-V501 PolarHBondContact O-N 3.49Å; V467-V501 HydrophobicContact CG2-CG2 4.33Å; I490-V501 HydrophobicContact CD1-CG1 4.39Å; I490-V501 HydrophobicContact CD1-CG2 4.32Å; I490-V501 HydrophobicContact CG1-CG2 4.16Å; I490-V501 HydrophobicContact CG2-CB 3.97Å; I490-V501 HydrophobicContact CG2-CG2 3.99Å; R494-V501 PolarHBondContact NH2-O 2.9Å; G499-V501 PolarHBondContact O-N 2.77Å; V501-Q506 HydrophobicContact CG1-CB 3.87Å; V501-I510 HydrophobicContact CG1-CD1 4.08Å; V501-I510 HydrophobicContact CG2-CD1 3.8Å
502	Q	83.1	Confident	90.3	Very high	89 Å²	89	24.4 Å²	24.4	42%	0.416	13%	0.129	S	C	.	.			trans	-100.2	-22.6	-165.6	-77.7	-76.5	-78.2	0	0	115.1	I459 G499	I459-Q502 HydrophobicContact CD1-CG 3.94Å; I459-Q502 HydrophobicContact CG1-CG 3.86Å; G499-Q502 PolarHBondContact O-NE2 2.88Å
503	T	81.1	Confident	90.5	Very high	59 Å²	59	24.1 Å²	24.1	36%	0.362	13%	0.127	S	C	.	.	S	Bend	trans	-135.6	153.8	-170.9	61.7	0	0	0	0	111.3	A505 Q506 Y507	T503-A505 PolarHBondContact O-N 3.23Å; T503-Q506 WeakPolarHBondContact O-CB 3.27Å; T503-Q506 PolarHBondContact O-N 2.62Å; T503-Q506 VanDerWaalsContact O-N 3.07Å; T503-Q506 WeakPolarHBondContact OG1-CG 3.22Å; T503-Q506 PolarHBondContact OG1-N 2.85Å; T503-Y507 PolarHBondContact O-N 2.78Å
504	E	84.3	Confident	90.6	Very high	73 Å²	73	24.1 Å²	24.1	34%	0.341	13%	0.127	S	C	.	.	H	α-helix	trans	-56.4	-37.9	172.3	-173	-164.2	160.1	0	0	111.6	F247 W248 F251 Q506 Y507 K508	F247-E504 HydrophobicContact CB-CG 4.42Å; W248-E504 PolarHBondContact N-OE1 2.94Å; F251-E504 HydrophobicContact CD1-CB 3.97Å; F251-E504 HydrophobicContact CE1-CB 4.45Å; F251-E504 HydrophobicContact CG-CB 4.38Å; E504-Q506 VanDerWaalsContact C-N 3.3Å; E504-Q506 PolarHBondContact O-N 3.3Å; E504-Y507 CarbonylContact O-C 3.5Å; E504-Y507 WeakPolarHBondContact O-CA 3.4Å; E504-Y507 WeakPolarHBondContact O-CB 3.35Å; E504-Y507 PolarHBondContact O-N 2.9Å; E504-Y507 VanDerWaalsContact O-N 3.1Å; E504-K508 WeakPolarHBondContact O-CB 3.33Å; E504-K508 PolarHBondContact O-N 2.91Å
505	A	85.8	Confident	90.7	Very high	43 Å²	43	23.8 Å²	23.8	36%	0.355	13%	0.127	S	C	.	.	H	α-helix	trans	-59.5	-40.6	176.6	0	0	0	0	0	112.2	V424 T503 F509	V424-A505 HydrophobicContact CG1-CB 4.24Å; V424-A505 WeakPolarHBondContact CG1-O 3.37Å; V424-A505 HydrophobicContact CG2-CB 4.33Å; T503-A505 PolarHBondContact O-N 3.23Å; A505-F509 VanDerWaalsContact O-CB 3.26Å; A505-F509 WeakPolarHBondContact O-CB 3.36Å; A505-F509 PolarHBondContact O-N 3.48Å
506	Q	88.2	Confident	90.8	Very high	16 Å²	16	23.2 Å²	23.2	8%	0.075	12%	0.124	C	C	.	.	H	α-helix	trans	-68	-40.5	173.6	-74.9	165.8	-6.2	0	0	112	V424 T464 V501 T503 E504 F509 I510	V424-Q506 HydrophobicContact CG1-CB 4.32Å; V424-Q506 HydrophobicContact CG1-CG 3.72Å; T464-Q506 WeakPolarHBondContact OG1-CB 3.35Å; V501-Q506 HydrophobicContact CG1-CB 3.87Å; T503-Q506 WeakPolarHBondContact O-CB 3.27Å; T503-Q506 PolarHBondContact O-N 2.62Å; T503-Q506 VanDerWaalsContact O-N 3.07Å; T503-Q506 WeakPolarHBondContact OG1-CG 3.22Å; T503-Q506 PolarHBondContact OG1-N 2.85Å; E504-Q506 VanDerWaalsContact C-N 3.3Å; E504-Q506 PolarHBondContact O-N 3.3Å; Q506-F509 WeakPolarHBondContact O-CB 3.43Å; Q506-F509 PolarHBondContact O-N 3.24Å; Q506-I510 WeakPolarHBondContact O-CG1 3.37Å; Q506-I510 PolarHBondContact O-N 3.07Å; Q506-I510 VanDerWaalsContact O-N 3.12Å
507	Y	89.8	Confident	90.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.6	-51.2	175.7	178.4	-98.5	0	0	0	111.6	F247 E250 F251 I486 P487 I490 T503 E504 F509 I510 Y511	F247-Y507 AromaticContact CD1-CD1 3.95Å; F247-Y507 HydrophobicContact CD1-CD1 3.95Å; F247-Y507 AromaticContact CD1-CE1 3.85Å; F247-Y507 HydrophobicContact CD1-CE1 3.85Å; E250-Y507 HydrophobicContact CB-CE1 4.05Å; E250-Y507 VanDerWaalsContact CB-OH 3.26Å; E250-Y507 WeakPolarHBondContact CB-OH 3.14Å; E250-Y507 PolarHBondContact OE2-OH 2.99Å; F251-Y507 HydrophobicContact CB-CD1 4.02Å; F251-Y507 HydrophobicContact CB-CE1 4.39Å; F251-Y507 HydrophobicContact CB-CG 4.15Å; F251-Y507 HydrophobicContact CD2-CD1 4.44Å; F251-Y507 AromaticContact CD2-CD2 3.87Å; F251-Y507 HydrophobicContact CD2-CD2 3.87Å; F251-Y507 AromaticContact CD2-CG 3.73Å; F251-Y507 HydrophobicContact CD2-CG 3.73Å; F251-Y507 HydrophobicContact CG-CG 4.29Å; I486-Y507 HydrophobicContact CG2-CE2 4.24Å; P487-Y507 HydrophobicContact CG-CE2 4.12Å; P487-Y507 WeakPolarHBondContact CG-OH 3.35Å; I490-Y507 HydrophobicContact CD1-CD2 3.41Å; I490-Y507 VanDerWaalsContact CD1-CD2 3.41Å; I490-Y507 HydrophobicContact CD1-CE2 3.7Å; T503-Y507 PolarHBondContact O-N 2.78Å; E504-Y507 CarbonylContact O-C 3.5Å; E504-Y507 WeakPolarHBondContact O-CA 3.4Å; E504-Y507 WeakPolarHBondContact O-CB 3.35Å; E504-Y507 PolarHBondContact O-N 2.9Å; E504-Y507 VanDerWaalsContact O-N 3.1Å; Y507-F509 VanDerWaalsContact C-N 3.31Å; Y507-F509 PolarHBondContact O-N 2.83Å; Y507-I510 WeakPolarHBondContact O-CB 3.36Å; Y507-I510 PolarHBondContact O-N 3.32Å; Y507-Y511 HydrophobicContact CD1-CE2 4.38Å; Y507-Y511 HydrophobicContact CE1-CD2 4.27Å; Y507-Y511 AromaticContact CE1-CE2 3.66Å; Y507-Y511 HydrophobicContact CE1-CE2 3.66Å; Y507-Y511 HydrophobicContact CE2-CE2 4.04Å; Y507-Y511 AromaticContact CZ-CE2 3.44Å; Y507-Y511 VanDerWaalsContact CZ-CE2 3.44Å; Y507-Y511 WeakPolarHBondContact OH-CE2 3.38Å; Y507-Y511 PolarHBondContact OH-OH 2.96Å; Y507-Y511 VanDerWaalsContact OH-OH 3.1Å
508	K	91.3	Very high	90.7	Very high	62 Å²	62	24.9 Å²	24.9	27%	0.27	13%	0.131	S	C	.	.	H	α-helix	trans	-59.2	-40.7	173.5	177.8	169.5	177.3	164.3	0	112	D229 F247 E504 I510 Y511 L512	D229-K508 VanDerWaalsContact CG-NZ 3.3Å; D229-K508 WeakPolarHBondContact OD1-CE 3.41Å; D229-K508 IonicContact OD1-NZ 2.71Å; D229-K508 PolarHBondContact OD1-NZ 3.05Å; D229-K508 IonicContact OD2-NZ 2.81Å; D229-K508 PolarHBondContact OD2-NZ 2.92Å; F247-K508 HydrophobicContact CD1-CB 4.03Å; F247-K508 HydrophobicContact CD1-CG 4.3Å; F247-K508 HydrophobicContact CD2-CD 3.93Å; F247-K508 HydrophobicContact CD2-CG 4.16Å; F247-K508 HydrophobicContact CE1-CB 4.25Å; F247-K508 HydrophobicContact CE1-CG 4.16Å; F247-K508 HydrophobicContact CE2-CD 3.99Å; F247-K508 HydrophobicContact CE2-CG 4.01Å; F247-K508 HydrophobicContact CG-CB 4.18Å; F247-K508 HydrophobicContact CG-CD 4.39Å; F247-K508 HydrophobicContact CG-CG 4.3Å; F247-K508 HydrophobicContact CZ-CD 4.5Å; F247-K508 HydrophobicContact CZ-CG 4.01Å; E504-K508 WeakPolarHBondContact O-CB 3.33Å; E504-K508 PolarHBondContact O-N 2.91Å; K508-I510 VanDerWaalsContact C-N 3.28Å; K508-I510 PolarHBondContact O-N 3.17Å; K508-Y511 WeakPolarHBondContact O-CB 3.49Å; K508-Y511 PolarHBondContact O-N 3.41Å; K508-Y511 VanDerWaalsContact O-N 3.15Å; K508-L512 HydrophobicContact CG-CD1 4.16Å; K508-L512 HydrophobicContact CG-CG 4.32Å; K508-L512 WeakPolarHBondContact O-CG 3.2Å; K508-L512 PolarHBondContact O-N 3.45Å
509	F	94.7	Very high	90.8	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.009	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-34.8	178.5	-174.1	-99.4	0	0	0	113.1	W419 V424 P425 P428 V431 T464 I468 A505 Q506 Y507 L512 A513	W419-F509 HydrophobicContact CH2-CD1 4.48Å; W419-F509 HydrophobicContact CH2-CE1 4.35Å; V424-F509 HydrophobicContact CB-CB 3.98Å; V424-F509 HydrophobicContact CB-CD2 3.85Å; V424-F509 HydrophobicContact CB-CG 3.93Å; V424-F509 HydrophobicContact CG1-CB 3.86Å; V424-F509 HydrophobicContact CG1-CG 4.18Å; V424-F509 HydrophobicContact CG2-CB 4.07Å; V424-F509 HydrophobicContact CG2-CD2 3.99Å; V424-F509 HydrophobicContact CG2-CG 4.3Å; P425-F509 HydrophobicContact CB-CE2 3.89Å; P425-F509 HydrophobicContact CB-CZ 4.08Å; P425-F509 HydrophobicContact CG-CE2 4.14Å; P425-F509 HydrophobicContact CG-CZ 3.95Å; P425-F509 WeakPolarHBondContact O-CE2 3.45Å; P428-F509 HydrophobicContact CB-CE2 4Å; P428-F509 HydrophobicContact CB-CZ 3.97Å; V431-F509 HydrophobicContact CB-CE1 4.42Å; V431-F509 HydrophobicContact CB-CZ 4.21Å; V431-F509 HydrophobicContact CG1-CE1 4.42Å; V431-F509 HydrophobicContact CG2-CE1 4.18Å; V431-F509 HydrophobicContact CG2-CZ 3.85Å; T464-F509 HydrophobicContact CG2-CD1 3.91Å; I468-F509 HydrophobicContact CD1-CD1 4.05Å; I468-F509 HydrophobicContact CD1-CE1 4Å; A505-F509 VanDerWaalsContact O-CB 3.26Å; A505-F509 WeakPolarHBondContact O-CB 3.36Å; A505-F509 PolarHBondContact O-N 3.48Å; Q506-F509 WeakPolarHBondContact O-CB 3.43Å; Q506-F509 PolarHBondContact O-N 3.24Å; Y507-F509 VanDerWaalsContact C-N 3.31Å; Y507-F509 PolarHBondContact O-N 2.83Å; F509-L512 PolarHBondContact O-N 2.83Å; F509-A513 WeakPolarHBondContact O-CB 3.32Å; F509-A513 PolarHBondContact O-N 3.13Å
510	I	96.7	Very high	91.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61	-47.4	174.7	-63.5	162.8	0	0	0	110.1	T464 V467 I468 I471 I486 I490 V501 Q506 Y507 K508 L512 A513 V514	T464-I510 HydrophobicContact CG2-CD1 4.43Å; T464-I510 HydrophobicContact CG2-CG1 3.86Å; V467-I510 HydrophobicContact CB-CD1 4.25Å; V467-I510 HydrophobicContact CG1-CD1 4Å; V467-I510 HydrophobicContact CG1-CG2 3.99Å; I468-I510 HydrophobicContact CD1-CG1 4.36Å; I468-I510 HydrophobicContact CG1-CB 4.29Å; I468-I510 HydrophobicContact CG1-CG1 4.02Å; I468-I510 HydrophobicContact CG1-CG2 4.1Å; I471-I510 HydrophobicContact CD1-CG2 3.96Å; I486-I510 HydrophobicContact CD1-CG2 4.22Å; I486-I510 HydrophobicContact CG1-CG2 4.5Å; I486-I510 HydrophobicContact CG2-CB 4.42Å; I486-I510 HydrophobicContact CG2-CG2 3.82Å; I490-I510 HydrophobicContact CD1-CD1 3.86Å; I490-I510 HydrophobicContact CG1-CD1 4.3Å; V501-I510 HydrophobicContact CG1-CD1 4.08Å; V501-I510 HydrophobicContact CG2-CD1 3.8Å; Q506-I510 WeakPolarHBondContact O-CG1 3.37Å; Q506-I510 PolarHBondContact O-N 3.07Å; Q506-I510 VanDerWaalsContact O-N 3.12Å; Y507-I510 WeakPolarHBondContact O-CB 3.36Å; Y507-I510 PolarHBondContact O-N 3.32Å; K508-I510 VanDerWaalsContact C-N 3.28Å; K508-I510 PolarHBondContact O-N 3.17Å; I510-L512 PolarHBondContact O-N 3.17Å; I510-A513 PolarHBondContact O-N 3.49Å; I510-V514 HydrophobicContact CG2-CG2 4.45Å; I510-V514 VanDerWaalsContact O-CG2 3.29Å; I510-V514 WeakPolarHBondContact O-CG2 3.48Å; I510-V514 PolarHBondContact O-N 3.24Å
511	Y	95.3	Very high	90.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.3	-45.8	176.4	-84	-98.5	0	0	0	112.2	I221 R224 V225 L228 F247 E250 I486 Y507 K508 A513 V514 S515	I221-Y511 HydrophobicContact CD1-CD1 3.75Å; I221-Y511 HydrophobicContact CD1-CE1 4.04Å; R224-Y511 HydrophobicContact CG-CD1 4.49Å; R224-Y511 HydrophobicContact CG-CE1 3.95Å; V225-Y511 HydrophobicContact CG2-CD1 4.32Å; L228-Y511 HydrophobicContact CD1-CD1 4.24Å; L228-Y511 HydrophobicContact CD1-CE1 3.78Å; F247-Y511 HydrophobicContact CD1-CD2 4.31Å; F247-Y511 HydrophobicContact CE1-CD1 4.15Å; F247-Y511 AromaticContact CE1-CD2 3.68Å; F247-Y511 HydrophobicContact CE1-CD2 3.68Å; F247-Y511 HydrophobicContact CE1-CE2 4.21Å; F247-Y511 AromaticContact CE1-CG 3.64Å; F247-Y511 HydrophobicContact CE1-CG 3.64Å; F247-Y511 HydrophobicContact CZ-CG 4.34Å; E250-Y511 PolarHBondContact OE2-OH 3.22Å; I486-Y511 HydrophobicContact CB-CD2 4.38Å; I486-Y511 HydrophobicContact CB-CE2 3.75Å; I486-Y511 HydrophobicContact CD1-CD1 3.58Å; I486-Y511 HydrophobicContact CD1-CD2 3.59Å; I486-Y511 HydrophobicContact CD1-CE1 3.69Å; I486-Y511 HydrophobicContact CD1-CE2 3.71Å; I486-Y511 HydrophobicContact CD1-CG 3.53Å; I486-Y511 HydrophobicContact CG1-CE1 4.5Å; I486-Y511 HydrophobicContact CG1-CE2 4.28Å; I486-Y511 HydrophobicContact CG2-CD2 4.05Å; I486-Y511 HydrophobicContact CG2-CE2 3.64Å; Y507-Y511 HydrophobicContact CD1-CE2 4.38Å; Y507-Y511 HydrophobicContact CE1-CD2 4.27Å; Y507-Y511 AromaticContact CE1-CE2 3.66Å; Y507-Y511 HydrophobicContact CE1-CE2 3.66Å; Y507-Y511 HydrophobicContact CE2-CE2 4.04Å; Y507-Y511 AromaticContact CZ-CE2 3.44Å; Y507-Y511 VanDerWaalsContact CZ-CE2 3.44Å; Y507-Y511 WeakPolarHBondContact OH-CE2 3.38Å; Y507-Y511 PolarHBondContact OH-OH 2.96Å; Y507-Y511 VanDerWaalsContact OH-OH 3.1Å; K508-Y511 WeakPolarHBondContact O-CB 3.49Å; K508-Y511 PolarHBondContact O-N 3.41Å; K508-Y511 VanDerWaalsContact O-N 3.15Å; Y511-A513 PolarHBondContact O-N 3.12Å; Y511-V514 PolarHBondContact O-N 3.23Å; Y511-S515 WeakPolarHBondContact O-CB 3.34Å; Y511-S515 PolarHBondContact O-N 3.23Å
512	L	95.1	Very high	90.5	Very high	57 Å²	57	36.1 Å²	36.1	30%	0.298	19%	0.185	S	C	.	.	H	α-helix	trans	-63.3	-41.9	178.8	-64.9	177.4	0	0	0	111.9	V225 P428 K508 F509 I510 S515 E516	V225-L512 HydrophobicContact CG1-CD2 3.73Å; P428-L512 HydrophobicContact CG-CB 4.07Å; K508-L512 HydrophobicContact CG-CD1 4.16Å; K508-L512 HydrophobicContact CG-CG 4.32Å; K508-L512 WeakPolarHBondContact O-CG 3.2Å; K508-L512 PolarHBondContact O-N 3.45Å; F509-L512 PolarHBondContact O-N 2.83Å; I510-L512 PolarHBondContact O-N 3.17Å; L512-S515 PolarHBondContact O-N 3.1Å; L512-E516 PolarHBondContact O-N 3.44Å
513	A	96.8	Very high	90.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.2	-45.2	177.8	0	0	0	0	0	112.2	P428 L432 I468 F509 I510 Y511 S515 E516 Y517	P428-A513 VanDerWaalsContact CB-CA 3.5Å; P428-A513 HydrophobicContact CB-CB 3.7Å; P428-A513 HydrophobicContact CG-CB 4.45Å; L432-A513 HydrophobicContact CD2-CB 4.22Å; I468-A513 HydrophobicContact CD1-CB 3.83Å; I468-A513 HydrophobicContact CG1-CB 4.22Å; I468-A513 HydrophobicContact CG2-CB 4.35Å; F509-A513 WeakPolarHBondContact O-CB 3.32Å; F509-A513 PolarHBondContact O-N 3.13Å; I510-A513 PolarHBondContact O-N 3.49Å; Y511-A513 PolarHBondContact O-N 3.12Å; A513-S515 VanDerWaalsContact C-N 3.31Å; A513-S515 PolarHBondContact O-N 3.47Å; A513-E516 PolarHBondContact O-N 3.1Å; A513-Y517 WeakPolarHBondContact O-CB 3.45Å; A513-Y517 PolarHBondContact O-N 3.31Å
514	V	95.8	Very high	90.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.3	-40	176.1	174	0	0	0	0	110.8	I221 I471 I475 I484 I510 Y511 Y517 I518	I221-V514 HydrophobicContact CG1-CG1 4.2Å; I471-V514 HydrophobicContact CB-CG2 4.21Å; I471-V514 HydrophobicContact CD1-CG2 4.23Å; I471-V514 HydrophobicContact CG2-CG1 4.04Å; I471-V514 HydrophobicContact CG2-CG2 3.66Å; I475-V514 HydrophobicContact CD1-CG1 3.97Å; I484-V514 HydrophobicContact CD1-CG1 4.1Å; I510-V514 HydrophobicContact CG2-CG2 4.45Å; I510-V514 VanDerWaalsContact O-CG2 3.29Å; I510-V514 WeakPolarHBondContact O-CG2 3.48Å; I510-V514 PolarHBondContact O-N 3.24Å; Y511-V514 PolarHBondContact O-N 3.23Å; V514-Y517 PolarHBondContact O-N 2.8Å; V514-I518 HydrophobicContact CG1-CD1 3.84Å; V514-I518 WeakPolarHBondContact O-CB 3.48Å; V514-I518 WeakPolarHBondContact O-CG1 3.35Å; V514-I518 PolarHBondContact O-N 3.47Å
515	S	94.5	Very high	90.3	Very high	6 Å²	6	38.9 Å²	38.9	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-63	-48.9	176.7	-168	0	0	0	0	112.9	Y511 L512 A513 Y517 I518 Q519	Y511-S515 WeakPolarHBondContact O-CB 3.34Å; Y511-S515 PolarHBondContact O-N 3.23Å; L512-S515 PolarHBondContact O-N 3.1Å; A513-S515 VanDerWaalsContact C-N 3.31Å; A513-S515 PolarHBondContact O-N 3.47Å; S515-Y517 VanDerWaalsContact C-N 3.31Å; S515-Y517 PolarHBondContact O-N 2.89Å; S515-I518 PolarHBondContact O-N 3.18Å; S515-Q519 VanDerWaalsContact O-CG 3.32Å; S515-Q519 WeakPolarHBondContact O-CG 3.45Å; S515-Q519 PolarHBondContact O-N 3.23Å
516	E	95	Very high	89.8	Confident	55 Å²	55	40 Å²	40	26%	0.257	21%	0.207	S	C	.	.	H	α-helix	trans	-63.5	-38.5	177.8	-176.3	178.2	169.4	0	0	111.5	P428 G429 L432 L512 A513 Q519 T520	P428-E516 WeakPolarHBondContact CD-OE2 3.49Å; P428-E516 HydrophobicContact CG-CB 4.15Å; P428-E516 WeakPolarHBondContact CG-OE2 3.48Å; G429-E516 WeakPolarHBondContact CA-OE1 3.27Å; G429-E516 PolarHBondContact N-OE1 2.72Å; G429-E516 PolarHBondContact N-OE2 3.2Å; L432-E516 HydrophobicContact CD1-CB 3.86Å; L432-E516 HydrophobicContact CD1-CG 3.9Å; L512-E516 PolarHBondContact O-N 3.44Å; A513-E516 PolarHBondContact O-N 3.1Å; E516-Q519 PolarHBondContact O-N 3.38Å; E516-T520 WeakPolarHBondContact O-CB 3.49Å; E516-T520 PolarHBondContact O-N 2.77Å; E516-T520 PolarHBondContact O-OG1 3.5Å
517	Y	94.5	Very high	89.2	Confident	36 Å²	36	41.7 Å²	41.7	14%	0.141	22%	0.224	C	C	.	.	H	α-helix	trans	-58.6	-50.9	174.9	-174	-101.9	0	0	0	111.7	L432 L472 I475 D476 A513 V514 S515 Q519 T520 T521	L432-Y517 HydrophobicContact CD2-CD2 4.38Å; L472-Y517 HydrophobicContact CD1-CD2 3.98Å; L472-Y517 HydrophobicContact CD1-CE2 4.19Å; L472-Y517 HydrophobicContact CD1-CG 4.32Å; L472-Y517 HydrophobicContact CD2-CD1 3.51Å; L472-Y517 HydrophobicContact CD2-CD2 3.97Å; L472-Y517 HydrophobicContact CD2-CE1 4.06Å; L472-Y517 HydrophobicContact CD2-CE2 4.49Å; L472-Y517 HydrophobicContact CD2-CG 3.44Å; L472-Y517 VanDerWaalsContact CD2-CG 3.44Å; L472-Y517 HydrophobicContact CG-CG 4.42Å; I475-Y517 HydrophobicContact CD1-CD1 4.47Å; I475-Y517 HydrophobicContact CG2-CE1 4.25Å; D476-Y517 WeakPolarHBondContact OD1-CE1 3.23Å; D476-Y517 PolarHBondContact OD1-OH 2.82Å; D476-Y517 PolarHBondContact OD2-OH 2.77Å; D476-Y517 VanDerWaalsContact OD2-OH 3.06Å; A513-Y517 WeakPolarHBondContact O-CB 3.45Å; A513-Y517 PolarHBondContact O-N 3.31Å; V514-Y517 PolarHBondContact O-N 2.8Å; S515-Y517 VanDerWaalsContact C-N 3.31Å; S515-Y517 PolarHBondContact O-N 2.89Å; Y517-Q519 PolarHBondContact O-N 3.39Å; Y517-T520 WeakPolarHBondContact O-CB 3.27Å; Y517-T520 PolarHBondContact O-N 2.87Å; Y517-T520 VanDerWaalsContact O-N 3.15Å; Y517-T521 PolarHBondContact O-N 2.77Å; Y517-T521 PolarHBondContact O-OG1 2.92Å; Y517-T521 VanDerWaalsContact O-OG1 3.11Å
518	I	90.8	Very high	88.1	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.015	24%	0.243	C	C	.	.	H	α-helix	trans	-64.3	-40.6	-178.3	-72.8	173.6	0	0	0	111.7	A218 I221 I475 L480 I484 V514 S515 T520 T521 K522	A218-I518 HydrophobicContact CB-CD1 3.74Å; A218-I518 WeakPolarHBondContact O-CD1 3.45Å; I221-I518 HydrophobicContact CB-CD1 4.5Å; I221-I518 HydrophobicContact CG2-CB 4.48Å; I221-I518 HydrophobicContact CG2-CD1 3.83Å; I475-I518 HydrophobicContact CD1-CD1 3.82Å; I475-I518 HydrophobicContact CD1-CG1 4.03Å; L480-I518 HydrophobicContact CD2-CB 4.44Å; L480-I518 HydrophobicContact CD2-CG1 4.08Å; L480-I518 HydrophobicContact CD2-CG2 4.07Å; I484-I518 HydrophobicContact CD1-CD1 4.46Å; V514-I518 HydrophobicContact CG1-CD1 3.84Å; V514-I518 WeakPolarHBondContact O-CB 3.48Å; V514-I518 WeakPolarHBondContact O-CG1 3.35Å; V514-I518 PolarHBondContact O-N 3.47Å; S515-I518 PolarHBondContact O-N 3.18Å; I518-T520 VanDerWaalsContact C-N 3.32Å; I518-T520 PolarHBondContact O-N 2.83Å; I518-T521 PolarHBondContact O-N 3.02Å; I518-K522 HydrophobicContact CG2-CD 4.32Å; I518-K522 WeakPolarHBondContact O-CG 3.44Å; I518-K522 PolarHBondContact O-N 3.19Å
519	Q	89.8	Confident	86.6	Confident	96 Å²	96	46.4 Å²	46.4	45%	0.449	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-43	174.2	-71.6	175.3	6.8	0	0	111.5	D222 S515 E516 Y517 K522 A523	D222-Q519 PolarHBondContact OD1-NE2 2.91Å; S515-Q519 VanDerWaalsContact O-CG 3.32Å; S515-Q519 WeakPolarHBondContact O-CG 3.45Å; S515-Q519 PolarHBondContact O-N 3.23Å; E516-Q519 PolarHBondContact O-N 3.38Å; Y517-Q519 PolarHBondContact O-N 3.39Å; Q519-K522 PolarHBondContact O-N 3.45Å; Q519-A523 WeakPolarHBondContact O-CB 3.48Å; Q519-A523 PolarHBondContact O-N 2.88Å
520	T	88.8	Confident	84.7	Confident	59 Å²	59	52.7 Å²	52.7	36%	0.362	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-41.4	177.5	-57.3	0	0	0	0	111.6	E516 Y517 I518 A523 K524	E516-T520 WeakPolarHBondContact O-CB 3.49Å; E516-T520 PolarHBondContact O-N 2.77Å; E516-T520 PolarHBondContact O-OG1 3.5Å; Y517-T520 WeakPolarHBondContact O-CB 3.27Å; Y517-T520 PolarHBondContact O-N 2.87Å; Y517-T520 VanDerWaalsContact O-N 3.15Å; I518-T520 VanDerWaalsContact C-N 3.32Å; I518-T520 PolarHBondContact O-N 2.83Å; T520-A523 PolarHBondContact O-N 3.46Å; T520-K524 HydrophobicContact CG2-CD 4.41Å; T520-K524 WeakPolarHBondContact O-CG 3.43Å; T520-K524 PolarHBondContact O-N 3.4Å
521	T	85.9	Confident	82.4	Confident	25 Å²	25	56.2 Å²	56.2	15%	0.153	30%	0.303	C	S	.	.	H	α-helix	trans	-64.7	-46.3	176.5	-58.2	0	0	0	0	111.5	L480 Y517 I518 A523 K524 E525	L480-T521 HydrophobicContact CD1-CG2 4.35Å; L480-T521 HydrophobicContact CD2-CG2 4.21Å; L480-T521 HydrophobicContact CG-CG2 4.5Å; Y517-T521 PolarHBondContact O-N 2.77Å; Y517-T521 PolarHBondContact O-OG1 2.92Å; Y517-T521 VanDerWaalsContact O-OG1 3.11Å; I518-T521 PolarHBondContact O-N 3.02Å; T521-A523 VanDerWaalsContact C-N 3.3Å; T521-A523 PolarHBondContact O-N 2.82Å; T521-K524 PolarHBondContact O-N 2.95Å; T521-E525 WeakPolarHBondContact O-CG 3.44Å; T521-E525 PolarHBondContact O-N 2.83Å
522	K	84.1	Confident	80.1	Confident	77 Å²	77	62.6 Å²	62.6	34%	0.335	34%	0.337	S	S	.	.	H	α-helix	trans	-58.7	-40.1	174.9	-73.5	179.6	-177.9	-178.6	0	112.6	S219 L480 I518 Q519 S526	S219-K522 PolarHBondContact O-NZ 2.85Å; L480-K522 HydrophobicContact CD1-CG 3.66Å; I518-K522 HydrophobicContact CG2-CD 4.32Å; I518-K522 WeakPolarHBondContact O-CG 3.44Å; I518-K522 PolarHBondContact O-N 3.19Å; Q519-K522 PolarHBondContact O-N 3.45Å; K522-S526 WeakPolarHBondContact O-CB 3.31Å; K522-S526 PolarHBondContact O-N 3.37Å; K522-S526 VanDerWaalsContact O-N 3.08Å; K522-S526 PolarHBondContact O-OG 2.87Å
523	A	85.2	Confident	77.7	Confident	62 Å²	62	64.9 Å²	64.9	51%	0.512	35%	0.354	S	S	.	.	H	α-helix	trans	-66.4	-41.9	177.6	0	0	0	0	0	111.8	Q519 T520 T521 S526 A527	Q519-A523 WeakPolarHBondContact O-CB 3.48Å; Q519-A523 PolarHBondContact O-N 2.88Å; T520-A523 PolarHBondContact O-N 3.46Å; T521-A523 VanDerWaalsContact C-N 3.3Å; T521-A523 PolarHBondContact O-N 2.82Å; A523-S526 PolarHBondContact O-N 3.19Å; A523-A527 WeakPolarHBondContact O-CB 3.49Å; A523-A527 PolarHBondContact O-N 3.49Å
524	K	82.3	Confident	74.9	Confident	141 Å²	141	72.5 Å²	72.5	61%	0.613	39%	0.389	S	S	*	.	H	α-helix	trans	-62.1	-44.4	175.1	-73.6	172.6	179.5	175.6	0	112.2	T520 T521 S526 A527 S528	T520-K524 HydrophobicContact CG2-CD 4.41Å; T520-K524 WeakPolarHBondContact O-CG 3.43Å; T520-K524 PolarHBondContact O-N 3.4Å; T521-K524 PolarHBondContact O-N 2.95Å; K524-S526 VanDerWaalsContact C-N 3.3Å; K524-S526 PolarHBondContact O-N 3.45Å; K524-A527 PolarHBondContact O-N 3.18Å; K524-S528 PolarHBondContact O-N 2.94Å; K524-S528 PolarHBondContact O-OG 3.39Å
525	E	76.2	Confident	72.3	Confident	76 Å²	76	81.9 Å²	81.9	36%	0.355	43%	0.426	S	S	.	.	H	α-helix	trans	-64.5	-34.3	177.9	-73.3	178.7	-180	0	0	112.9	T521 S528 K529	T521-E525 WeakPolarHBondContact O-CG 3.44Å; T521-E525 PolarHBondContact O-N 2.83Å; E525-S528 WeakPolarHBondContact CA-OG 3.24Å; E525-S528 PolarHBondContact O-OG 2.99Å; E525-K529 VanDerWaalsContact O-CG 3.31Å; E525-K529 WeakPolarHBondContact O-CG 3.4Å; E525-K529 PolarHBondContact O-N 3.26Å
526	S	76	Confident	69.3	Low	67 Å²	67	84.4 Å²	84.4	47%	0.469	45%	0.453	S	S	.	.	H	α-helix	trans	-72.6	-43.4	178.6	-56.2	0	0	0	0	110.7	K522 A523 K524 S528 K529 E530	K522-S526 WeakPolarHBondContact O-CB 3.31Å; K522-S526 PolarHBondContact O-N 3.37Å; K522-S526 VanDerWaalsContact O-N 3.08Å; K522-S526 PolarHBondContact O-OG 2.87Å; A523-S526 PolarHBondContact O-N 3.19Å; K524-S526 VanDerWaalsContact C-N 3.3Å; K524-S526 PolarHBondContact O-N 3.45Å; S526-S528 PolarHBondContact O-N 3.45Å; S526-K529 PolarHBondContact O-N 3.16Å; S526-E530 PolarHBondContact O-N 2.8Å
527	A	73.9	Confident	66.5	Low	52 Å²	52	89 Å²	89	43%	0.43	48%	0.479	S	S	.	.	H	α-helix	trans	-63.4	-38.8	176	0	0	0	0	0	112.8	A523 K524 K529 E530 T531	A523-A527 WeakPolarHBondContact O-CB 3.49Å; A523-A527 PolarHBondContact O-N 3.49Å; K524-A527 PolarHBondContact O-N 3.18Å; A527-K529 VanDerWaalsContact C-N 3.33Å; A527-K529 PolarHBondContact O-N 2.92Å; A527-E530 PolarHBondContact O-N 2.99Å; A527-T531 PolarHBondContact O-N 2.8Å; A527-T531 PolarHBondContact O-OG1 3.47Å
528	S	67.1	Low	63.5	Low	57 Å²	57	94.6 Å²	94.6	40%	0.399	51%	0.511	S	S	.	.	H	α-helix	trans	-66	-34.4	176.2	54.7	0	0	0	0	112.8	K524 E525 S526 T531 D532	K524-S528 PolarHBondContact O-N 2.94Å; K524-S528 PolarHBondContact O-OG 3.39Å; E525-S528 WeakPolarHBondContact CA-OG 3.24Å; E525-S528 PolarHBondContact O-OG 2.99Å; S526-S528 PolarHBondContact O-N 3.45Å; S528-T531 WeakPolarHBondContact CA-OG1 3.4Å; S528-T531 PolarHBondContact O-OG1 3.3Å; S528-D532 PolarHBondContact O-N 3.49Å
529	K	59.6	Low	60.5	Low	103 Å²	103	103.1 Å²	103.1	45%	0.448	55%	0.551	S	S	.	*	H	α-helix	trans	-69.9	-35.3	177.4	-75.1	171.6	-178.1	170.1	0	112.2	E525 S526 A527 T533	E525-K529 VanDerWaalsContact O-CG 3.31Å; E525-K529 WeakPolarHBondContact O-CG 3.4Å; E525-K529 PolarHBondContact O-N 3.26Å; S526-K529 PolarHBondContact O-N 3.16Å; A527-K529 VanDerWaalsContact C-N 3.33Å; A527-K529 PolarHBondContact O-N 2.92Å; K529-T533 PolarHBondContact O-N 3.31Å; K529-T533 PolarHBondContact O-OG1 3.46Å
530	E	54.6	Low	57.7	Low	134 Å²	134	105.6 Å²	105.6	63%	0.626	57%	0.566	S	S	*	*	H	α-helix	trans	-67.5	-40.4	175.5	-71.9	178.3	175.3	0	0	111.9	S526 A527 D532 T533 E534	S526-E530 PolarHBondContact O-N 2.8Å; A527-E530 PolarHBondContact O-N 2.99Å; E530-D532 PolarHBondContact O-N 2.81Å; E530-T533 PolarHBondContact O-N 3.44Å; E530-T533 PolarHBondContact O-OG1 2.94Å; E530-E534 PolarHBondContact O-N 3.08Å
531	T	49	Very low	55	Low	74 Å²	74	111.8 Å²	111.8	45%	0.454	59%	0.588	S	S	.	*	H	α-helix	trans	-67.8	-33.1	178.3	50.3	0	0	0	0	113.8	A527 S528 T533 E534	A527-T531 PolarHBondContact O-N 2.8Å; A527-T531 PolarHBondContact O-OG1 3.47Å; S528-T531 WeakPolarHBondContact CA-OG1 3.4Å; S528-T531 PolarHBondContact O-OG1 3.3Å; T531-T533 VanDerWaalsContact C-N 3.28Å; T531-T533 PolarHBondContact O-N 2.64Å; T531-E534 PolarHBondContact O-N 3.25Å
532	D	47	Very low	52.4	Low	134 Å²	134	118.8 Å²	118.8	72%	0.717	62%	0.619	S	S	*	*	H	α-helix	trans	-69.9	-26.7	174.8	-85	-16.1	0	0	0	112.3	S528 E530	S528-D532 PolarHBondContact O-N 3.49Å; E530-D532 PolarHBondContact O-N 2.81Å
533	T	45.4	Very low	49.7	Very low	106 Å²	106	123.8 Å²	123.8	65%	0.65	64%	0.644	S	S	*	*	H	α-helix	trans	-80.2	-24.3	174.6	52.9	0	0	0	0	114	K529 E530 T531	K529-T533 PolarHBondContact O-N 3.31Å; K529-T533 PolarHBondContact O-OG1 3.46Å; E530-T533 PolarHBondContact O-N 3.44Å; E530-T533 PolarHBondContact O-OG1 2.94Å; T531-T533 VanDerWaalsContact C-N 3.28Å; T531-T533 PolarHBondContact O-N 2.64Å
534	E	38.5	Very low	47.2	Very low	159 Å²	159	127 Å²	127	74%	0.743	66%	0.659	S	S	*	*	H	α-helix	trans	-82.2	-24.9	-178.6	-109.3	-175.5	165.5	0	0	114.1	E530 T531	E530-E534 PolarHBondContact O-N 3.08Å; T531-E534 PolarHBondContact O-N 3.25Å
535	Y	39.4	Very low	44.6	Very low	197 Å²	197	125.1 Å²	125.1	77%	0.773	67%	0.67	S	S	*	*	S	Bend	trans	-98.3	-0.5	-179.2	-81.7	-86.3	0	0	0	115.2	N537	Y535-N537 VanDerWaalsContact C-N 3.3Å; Y535-N537 PolarHBondContact O-N 3.1Å
536	G	33	Very low	42.4	Very low	60 Å²	60	126.8 Å²	126.8	62%	0.619	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-5.8	-179.7	0	0	0	0	0	116.4
537	N	35.5	Very low	40.1	Very low	150 Å²	150	133.8 Å²	133.8	80%	0.802	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.1	38.9	-168.9	-79.4	-35.4	0	0	0	115.8	Y535	Y535-N537 VanDerWaalsContact C-N 3.3Å; Y535-N537 PolarHBondContact O-N 3.1Å
538	L	31.6	Very low	37.9	Very low	155 Å²	155	140.2 Å²	140.2	81%	0.812	73%	0.725	S	S	*	*			trans	-124.8	89.9	163.5	-81.1	162.7	0	0	0	110.9	L540	L538-L540 PolarHBondContact O-N 2.92Å
539	Q	28.7	Very low	36.2	Very low	181 Å²	181	144.1 Å²	144.1	85%	0.846	75%	0.745	S	S	*	*			trans	-66	97.5	165.1	-80.6	-179	-5.9	0	0	110.2	K541	Q539-K541 PolarHBondContact O-N 3.33Å
540	L	30.8	Very low	34.6	Very low	149 Å²	149	144.9 Å²	144.9	78%	0.78	76%	0.764	S	S	*	*			trans	-75.8	98.1	159.8	-94.8	149.9	0	0	0	108.9	L538 H542	L538-L540 PolarHBondContact O-N 2.92Å; L540-H542 PolarHBondContact O-N 3.15Å
541	K	31.5	Very low	33.5	Very low	189 Å²	189	147.1 Å²	147.1	82%	0.822	77%	0.772	S	S	*	*			trans	-66	99	167.9	-78.4	-177.5	176.7	176.2	0	109.7	Q539	Q539-K541 PolarHBondContact O-N 3.33Å
542	H	31.1	Very low	32.4	Very low	171 Å²	171	150.1 Å²	150.1	79%	0.792	79%	0.785	S	S	*	*			trans	-85.3	115.2	160.8	-95.8	-83.5	0	0	0	109.9	L540	L540-H542 PolarHBondContact O-N 3.15Å
543	Q	27.7	Very low	31.5	Very low	183 Å²	183	151.8 Å²	151.8	86%	0.855	79%	0.786	S	S	*	*			trans	-72.9	143.3	162.9	-83.8	-174.9	-12.7	0	0	110.1
544	P	32.7	Very low	30.5	Very low	128 Å²	128	153.9 Å²	153.9	83%	0.831	79%	0.788	S	S	*	*			trans	-89.6	130.8	177	34.1	-28.6	0	0	0	110.5
545	A	27.9	Very low	29.9	Very low	103 Å²	103	152.7 Å²	152.7	85%	0.851	79%	0.787	S	S	*	*			trans	-131.9	113.9	163.4	0	0	0	0	0	110.2
546	S	29.6	Very low	29.2	Very low	111 Å²	111	148.3 Å²	148.3	78%	0.776	78%	0.781	S	S	*	*			trans	-65.5	142.5	171	164.6	0	0	0	0	111.9
547	R	27.3	Very low	28.9	Very low	213 Å²	213	154.5 Å²	154.5	80%	0.804	79%	0.787	S	S	*	*				175.9	129.6	115.7	-96.2	174.6	176.4	177	1.3	115
548	K	27.9	Very low	28.4	Very low	188 Å²	188	154.6 Å²	154.6	82%	0.817	78%	0.782	S	S	*	*			trans	79.2	125.9	135.1	-71.1	-175.9	177.2	-172.5	0	121.5
549	V	31.6	Very low	28.1	Very low	138 Å²	138	152.7 Å²	152.7	84%	0.836	77%	0.773	S	S	*	*			trans	-73.1	142.2	170.4	174.8	0	0	0	0	111.6
550	S	26.9	Very low	27.9	Very low	120 Å²	120	151.2 Å²	151.2	84%	0.839	77%	0.77	S	S	*	*			trans	-157.5	144.5	140.3	55.4	0	0	0	0	112.6
551	K	29.7	Very low	27.6	Very low	181 Å²	181	149.9 Å²	149.9	79%	0.787	77%	0.773	S	S	*	*			trans	-73.7	157.4	-166.2	-83.1	171.4	168.4	173.9	0	116.5
552	N	26.8	Very low	27.5	Very low	137 Å²	137	151 Å²	151	73%	0.733	78%	0.778	S	S	*	*			trans	88.6	124.8	135.3	-77.4	0.7	0	0	0	122.4
553	K	27.2	Very low	27.3	Very low	169 Å²	169	146.1 Å²	146.1	74%	0.735	77%	0.774	S	S	*	*			trans	84.6	115	132.9	-84.5	-168.4	165.3	-162.3	0	121.5
554	E	25.7	Very low	27.4	Very low	149 Å²	149	147 Å²	147	70%	0.696	77%	0.774	S	S	*	*				51	136	122	-79.8	173.3	163.3	0	0	122
555	D	25.8	Very low	27.4	Very low	135 Å²	135	148.7 Å²	148.7	72%	0.722	77%	0.769	S	S	*	*			trans	97	105.4	143.7	-65.6	-16.9	0	0	0	122.5
556	V	24.9	Very low	27.4	Very low	105 Å²	105	150.6 Å²	150.6	64%	0.636	77%	0.765	S	S	*	*				44.8	141.7	121	-138.5	0	0	0	0	122.6
557	Y	26.3	Very low	27.6	Very low	190 Å²	190	150.7 Å²	150.7	75%	0.745	76%	0.76	S	S	*	*			trans	101.4	108.1	148.1	-75.8	-69.5	0	0	0	120
558	E	25.3	Very low	27.8	Very low	151 Å²	151	149.4 Å²	149.4	71%	0.706	76%	0.76	S	S	*	*				70.1	121.4	121.1	-89.5	-173.5	167.1	0	0	123.8
559	N	25.4	Very low	28	Very low	116 Å²	116	149.5 Å²	149.5	62%	0.62	76%	0.761	S	S	*	*				83.4	126.4	123.6	-78.3	-29.6	0	0	0	123.2
560	L	24.9	Very low	27.9	Very low	150 Å²	150	149 Å²	149	79%	0.785	76%	0.763	S	S	*	*			trans	67.4	116.4	135.8	-70.1	158.6	0	0	0	119
561	S	24	Very low	28.1	Very low	120 Å²	120	153.1 Å²	153.1	84%	0.839	77%	0.766	S	S	*	*				168.7	160.4	92.1	54.1	0	0	0	0	114.4
562	K	28.4	Very low	28.2	Very low	214 Å²	214	149.9 Å²	149.9	93%	0.93	77%	0.766	S	S	*	*			trans	-63.2	151.5	-171.4	-67.6	160.1	170.2	169.9	0	116.1
563	G	27.1	Very low	28.4	Very low	68 Å²	68	150.4 Å²	150.4	70%	0.701	76%	0.764	S	S	*	*				132.3	133.5	107.6	0	0	0	0	0	120
564	K	31	Very low	28.7	Very low	200 Å²	200	150 Å²	150	87%	0.87	76%	0.763	S	S	*	*			trans	75.3	148	145.8	-78.4	-179.4	-176.8	173.2	0	118
565	K	31.1	Very low	29.1	Very low	165 Å²	165	151.1 Å²	151.1	72%	0.717	77%	0.765	S	S	*	*			cis	-174.7	-179.6	-10.5	-134.7	-176.5	-176.6	-174.5	0	107.6
566	D	29.6	Very low	29.4	Very low	143 Å²	143	151 Å²	151	77%	0.765	77%	0.769	S	S	*	*			trans	102.2	117.2	160.9	-57.8	-31.1	0	0	0	115.7
567	V	32	Very low	29.7	Very low	113 Å²	113	149.6 Å²	149.6	69%	0.685	78%	0.777	S	S	*	*			cis	113.1	111.8	24.7	168.8	0	0	0	0	111.4
568	K	32.5	Very low	30.2	Very low	185 Å²	185	146 Å²	146	80%	0.804	78%	0.779	S	S	*	*			trans	50.9	147.9	147.6	-75.1	178.2	175.2	169	0	118.7
569	K	31.6	Very low	30.8	Very low	191 Å²	191	144.4 Å²	144.4	83%	0.83	78%	0.78	S	S	*	*			cis	179.6	149.3	31.9	-137.5	175.6	-179.4	179.8	0	107.4
570	S	29.2	Very low	31.3	Very low	126 Å²	126	146.9 Å²	146.9	88%	0.881	79%	0.785	S	S	*	*				-170.8	153.2	128.4	63.8	0	0	0	0	110.6
571	K	32.2	Very low	32.2	Very low	207 Å²	207	148.6 Å²	148.6	90%	0.9	79%	0.786	S	S	*	*			trans	-121.7	143.5	-166.9	-111.8	-173.5	176.2	-177.6	0	109
572	S	30.6	Very low	33.2	Very low	113 Å²	113	156.3 Å²	156.3	79%	0.79	80%	0.804	S	S	*	*			trans	174.9	154.2	139.9	56.1	0	0	0	0	107.6
573	E	32.3	Very low	33.5	Very low	148 Å²	148	153.5 Å²	153.5	69%	0.692	80%	0.798	S	S	*	*			cis	-157.5	152.4	-18.1	-109.7	-170.6	128.5	0	0	105.8
574	K	33	Very low	33.8	Very low	161 Å²	161	157.9 Å²	157.9	70%	0.7	80%	0.803	S	S	*	*			trans	34.1	136.4	142.7	-70.6	168.4	-173.7	151.4	0	118.9
575	K	33.3	Very low	34	Very low	173 Å²	173	155.6 Å²	155.6	75%	0.752	80%	0.799	S	S	*	*			cis	-177.8	141.5	36	-128.5	174	-176.3	-176.4	0	107.9
576	T	32.3	Very low	34.1	Very low	131 Å²	131	155.1 Å²	155.1	80%	0.804	80%	0.804	S	S	*	*			trans	32.3	133.5	135	60.9	0	0	0	0	119.5
577	G	31.7	Very low	34.4	Very low	77 Å²	77	155.8 Å²	155.8	79%	0.794	81%	0.807	S	S	*	*			cis	-178.3	169.4	16.4	0	0	0	0	0	112.3
578	S	36.7	Very low	34.6	Very low	113 Å²	113	158.7 Å²	158.7	79%	0.79	82%	0.815	S	S	*	*			trans	-61.1	156.4	179.4	-166.4	0	0	0	0	112.9
579	V	37.8	Very low	34.7	Very low	119 Å²	119	156.8 Å²	156.8	72%	0.721	82%	0.816	S	S	*	*				174.8	118.1	115.5	158.4	0	0	0	0	111.7
580	K	36.8	Very low	35	Very low	167 Å²	167	154.2 Å²	154.2	73%	0.726	82%	0.815	S	S	*	*			trans	59.9	128.9	138.7	-70.4	178.5	179.8	168.3	0	123.2
581	K	43.4	Very low	35.5	Very low	187 Å²	187	156.5 Å²	156.5	81%	0.813	81%	0.809	S	S	*	*				62.6	116.1	128.7	-70.1	-175.7	171.9	-172.2	0	117.4
582	K	45.3	Very low	35.7	Very low	282 Å²	282	151.9 Å²	151.9	100%	1.226	80%	0.801	S	S	*	*				-155.8	0	81.3	-121.2	178.8	-179.7	-179.5	0	110.1

Retrieved 582 of 582 residues in 160.9 ms (Link to these results)

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