A0A087XQN4_POEFO Loading...

tRNA selenocysteine 1-associated protein 1

Involved in the early steps of selenocysteine biosynthesis and tRNA(Sec) charging to the later steps resulting in the cotranslational incorporation of selenocysteine into selenoproteins.

AlphaFold DB , UniProt , Accession A0A087XQN4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 308 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	69.5	Low	86.2	Confident	185 Å²	185	51.2 Å²	51.2	91%	0.911	27%	0.268	S	S	*	.				0	125.8	0	-57.6	175.6	-163.2	0	0	107.7	S52	M1-S52 WeakPolarHBondContact CA-O 3.26Å; M1-S52 PolarHBondContact N-O 3.41Å
2	S	86.2	Confident	86	Confident	21 Å²	21	54.9 Å²	54.9	15%	0.147	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	140.5	-179.9	-178.6	0	0	0	0	108.6	M51	S2-M51 PolarHBondContact N-O 3.08Å; S2-M51 WeakPolarHBondContact O-CB 3.49Å; S2-M51 PolarHBondContact O-N 2.98Å
3	T	90.1	Very high	86.1	Confident	34 Å²	34	50.8 Å²	50.8	21%	0.209	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	135.8	-177.7	-49.6	0	0	0	0	110.6	F48 V49 A83 F85	T3-F48 HydrophobicContact CG2-CB 3.86Å; T3-F48 HydrophobicContact CG2-CD1 4.12Å; T3-F48 HydrophobicContact CG2-CG 4.44Å; T3-V49 CarbonylContact C-O 3.4Å; T3-V49 WeakPolarHBondContact CA-O 3.46Å; T3-A83 HydrophobicContact CG2-CB 3.89Å; T3-A83 VanDerWaalsContact O-CB 3.24Å; T3-A83 WeakPolarHBondContact O-CB 3.36Å; T3-A83 PolarHBondContact O-N 2.92Å; T3-F85 HydrophobicContact CG2-CE2 3.8Å; T3-F85 HydrophobicContact CG2-CZ 4.14Å
4	L	90.6	Very high	86.3	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	139	173	-64	179	0	0	0	109.8	F48 V49 M51 A57 C60 L61 N81	L4-F48 CarbonylContact O-C 3.53Å; L4-F48 WeakPolarHBondContact O-CA 3.21Å; L4-V49 HydrophobicContact CB-CB 4.5Å; L4-V49 PolarHBondContact N-O 3.34Å; L4-V49 PolarHBondContact O-N 3.11Å; L4-M51 HydrophobicContact CD1-CG 4.1Å; L4-M51 HydrophobicContact CD1-SD 4.34Å; L4-M51 HydrophobicContact CG-CG 4.22Å; L4-A57 HydrophobicContact CD1-CB 4.26Å; L4-A57 HydrophobicContact CD2-CB 4.05Å; L4-A57 HydrophobicContact CG-CB 4.11Å; L4-C60 HydrophobicContact CD1-CB 3.69Å; L4-L61 HydrophobicContact CD2-CD1 3.72Å; L4-L61 HydrophobicContact CD2-CD2 3.98Å; L4-L61 HydrophobicContact CD2-CG 3.76Å; L4-N81 CarbonylContact C-O 3.37Å; L4-N81 WeakPolarHBondContact CA-O 3.36Å
5	W	90.8	Very high	86.6	Confident	59 Å²	59	53.8 Å²	53.8	22%	0.223	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	131.1	165.9	176.2	87.8	0	0	0	108	Y46 F48 K79 L80 N81 A83	W5-Y46 AromaticContact CD1-CD2 3.79Å; W5-Y46 AromaticContact NE1-CD2 3.29Å; W5-Y46 VanDerWaalsContact NE1-CD2 3.29Å; W5-Y46 AromaticContact NE1-CG 3.59Å; W5-F48 HydrophobicContact CB-CD1 4.34Å; W5-F48 HydrophobicContact CB-CE1 4.13Å; W5-F48 AromaticContact CD1-CE1 3.73Å; W5-F48 AromaticContact CD1-CZ 3.94Å; W5-F48 HydrophobicContact CG-CE1 4.36Å; W5-K79 HydrophobicContact CH2-CD 4.16Å; W5-K79 HydrophobicContact CZ3-CD 4.1Å; W5-K79 HydrophobicContact CZ3-CG 4.04Å; W5-L80 CarbonylContact O-C 3.49Å; W5-L80 WeakPolarHBondContact O-CA 3.47Å; W5-N81 HydrophobicContact CB-CB 4.44Å; W5-N81 HydrophobicContact CE3-CB 3.87Å; W5-N81 WeakPolarHBondContact CZ3-ND2 3.42Å; W5-N81 PolarHBondContact N-O 3.07Å; W5-N81 PolarHBondContact O-N 2.91Å; W5-A83 HydrophobicContact CB-CB 4.22Å
6	M	90.2	Very high	86.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	120.5	176.6	175.2	174.8	176.7	0	0	109.7	L9 I18 F22 Y46 C47 V49 M69 F78 K79 L80	M6-L9 HydrophobicContact CE-CD1 3.93Å; M6-L9 HydrophobicContact CG-CD1 4.11Å; M6-L9 HydrophobicContact SD-CD1 4.26Å; M6-I18 HydrophobicContact CE-CD1 3.9Å; M6-I18 HydrophobicContact SD-CD1 4.38Å; M6-I18 HydrophobicContact SD-CG2 3.93Å; M6-F22 HydrophobicContact CE-CE2 4.49Å; M6-F22 HydrophobicContact SD-CE2 3.51Å; M6-F22 VanDerWaalsContact SD-CE2 3.51Å; M6-F22 HydrophobicContact SD-CZ 3.86Å; M6-Y46 CarbonylContact O-C 3.46Å; M6-Y46 WeakPolarHBondContact O-CA 3.46Å; M6-Y46 WeakPolarHBondContact O-CB 3.26Å; M6-C47 PolarHBondContact N-O 3.39Å; M6-C47 PolarHBondContact O-N 3.38Å; M6-V49 HydrophobicContact CB-CG2 4.15Å; M6-V49 HydrophobicContact SD-CG2 4.31Å; M6-M69 HydrophobicContact CE-CE 3.11Å; M6-M69 HydrophobicContact CE-SD 4.05Å; M6-F78 HydrophobicContact CE-CD1 3.59Å; M6-F78 HydrophobicContact CE-CE1 3.88Å; M6-F78 HydrophobicContact SD-CD1 4.27Å; M6-K79 CarbonylContact C-O 3.57Å; M6-K79 VanDerWaalsContact CA-O 3.28Å; M6-K79 WeakPolarHBondContact CA-O 3.39Å; M6-L80 HydrophobicContact CB-CD2 3.71Å; M6-L80 HydrophobicContact CG-CD2 3.73Å; M6-L80 HydrophobicContact SD-CD2 4.06Å
7	G	88.4	Confident	87.2	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-175.6	176.5	0	0	0	0	0	113.2	L9 K79	G7-L9 VanDerWaalsContact C-N 3.32Å; G7-K79 PolarHBondContact N-O 2.92Å
8	N	86.6	Confident	87.4	Confident	81 Å²	81	56.9 Å²	56.9	43%	0.433	28%	0.279	S	S	.	.			trans	60.3	39.7	-179.4	-64	22.3	0	0	0	112.6	G45 K79	N8-G45 PolarHBondContact N-O 3.35Å; N8-G45 VanDerWaalsContact N-O 3.16Å; N8-K79 HydrophobicContact CB-CB 4.48Å; N8-K79 WeakPolarHBondContact OD1-CD 3.3Å
9	L	87.4	Confident	87.6	Confident	12 Å²	12	57 Å²	57	6%	0.063	28%	0.283	C	S	.	.			trans	-81.8	135.6	172.5	-116.9	75	0	0	0	110.8	M6 G7 M13 I18 I34 G45 C47	M6-L9 HydrophobicContact CE-CD1 3.93Å; M6-L9 HydrophobicContact CG-CD1 4.11Å; M6-L9 HydrophobicContact SD-CD1 4.26Å; G7-L9 VanDerWaalsContact C-N 3.32Å; L9-M13 HydrophobicContact CD2-CB 4.44Å; L9-M13 HydrophobicContact CG-CB 4.13Å; L9-M13 HydrophobicContact CG-SD 4.21Å; L9-I18 HydrophobicContact CD1-CD1 3.66Å; L9-I18 HydrophobicContact CD1-CG1 4.45Å; L9-I18 HydrophobicContact CD2-CD1 4.32Å; L9-I18 HydrophobicContact CD2-CG1 4.45Å; L9-I18 HydrophobicContact CG-CD1 4.07Å; L9-I34 HydrophobicContact CD2-CD1 4Å; L9-I34 HydrophobicContact CD2-CG1 4.1Å; L9-I34 HydrophobicContact CD2-CG2 4.16Å; L9-G45 PolarHBondContact N-O 3.44Å; L9-G45 WeakPolarHBondContact O-CA 3.44Å; L9-C47 HydrophobicContact CD2-CB 3.96Å
10	E	85.3	Confident	87.8	Confident	64 Å²	64	62.9 Å²	62.9	30%	0.299	30%	0.302	S	S	.	.			trans	-85.7	159.7	169.5	-65.7	-63.7	159.4	0	0	111.3	Y12 M13 T76	E10-Y12 VanDerWaalsContact C-N 3.25Å; E10-Y12 HydrophobicContact CB-CD1 3.66Å; E10-Y12 HydrophobicContact CB-CE1 3.31Å; E10-Y12 HydrophobicContact CG-CE1 3.78Å; E10-Y12 PolarHBondContact O-N 3.18Å; E10-M13 HydrophobicContact CB-CE 3.97Å; E10-M13 HydrophobicContact CB-CG 3.99Å; E10-M13 HydrophobicContact CB-SD 4.05Å; E10-M13 HydrophobicContact CG-CE 3.83Å; E10-M13 HydrophobicContact CG-SD 4.39Å; E10-M13 PolarHBondContact N-SD 3.23Å; E10-M13 VanDerWaalsContact N-SD 3.43Å; E10-M13 WeakPolarHBondContact O-CB 3.35Å; E10-M13 PolarHBondContact O-N 2.95Å; E10-M13 VanDerWaalsContact O-N 3.09Å; E10-T76 HydrophobicContact CG-CG2 4.26Å
11	T	83.1	Confident	87.9	Confident	105 Å²	105	60 Å²	60	64%	0.644	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.3	-175.4	52.2	0	0	0	0	114.2
12	Y	84.4	Confident	88.9	Confident	96 Å²	96	51.2 Å²	51.2	38%	0.376	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-8.7	177.3	71.4	-92.4	0	0	0	113.5	E10 D14 A72 S73	E10-Y12 VanDerWaalsContact C-N 3.25Å; E10-Y12 HydrophobicContact CB-CD1 3.66Å; E10-Y12 HydrophobicContact CB-CE1 3.31Å; E10-Y12 HydrophobicContact CG-CE1 3.78Å; E10-Y12 PolarHBondContact O-N 3.18Å; Y12-D14 PolarHBondContact O-N 3.26Å; Y12-A72 WeakPolarHBondContact OH-CA 3.42Å; Y12-S73 WeakPolarHBondContact CE1-O 3.47Å; Y12-S73 VanDerWaalsContact CZ-O 3.3Å; Y12-S73 PolarHBondContact OH-N 2.67Å; Y12-S73 PolarHBondContact OH-O 2.89Å
13	M	86.7	Confident	89.1	Confident	1 Å²	1	54 Å²	54	1%	0.005	26%	0.264	C	S	.	.			trans	-79.7	102.5	-176.7	-69.3	179.9	179.8	0	0	110.5	L9 E10 F17 I18 I34 M69 A72 T76	L9-M13 HydrophobicContact CD2-CB 4.44Å; L9-M13 HydrophobicContact CG-CB 4.13Å; L9-M13 HydrophobicContact CG-SD 4.21Å; E10-M13 HydrophobicContact CB-CE 3.97Å; E10-M13 HydrophobicContact CB-CG 3.99Å; E10-M13 HydrophobicContact CB-SD 4.05Å; E10-M13 HydrophobicContact CG-CE 3.83Å; E10-M13 HydrophobicContact CG-SD 4.39Å; E10-M13 PolarHBondContact N-SD 3.23Å; E10-M13 VanDerWaalsContact N-SD 3.43Å; E10-M13 WeakPolarHBondContact O-CB 3.35Å; E10-M13 PolarHBondContact O-N 2.95Å; E10-M13 VanDerWaalsContact O-N 3.09Å; M13-F17 HydrophobicContact CB-CD1 3.92Å; M13-F17 HydrophobicContact CB-CE1 4.4Å; M13-F17 HydrophobicContact CE-CE1 3.89Å; M13-F17 HydrophobicContact CE-CZ 4.32Å; M13-F17 HydrophobicContact CG-CD1 3.68Å; M13-F17 HydrophobicContact CG-CE1 3.67Å; M13-F17 HydrophobicContact CG-CZ 4.49Å; M13-F17 HydrophobicContact SD-CD1 4.26Å; M13-F17 HydrophobicContact SD-CE1 3.85Å; M13-I18 HydrophobicContact CB-CD1 4.31Å; M13-I34 VanDerWaalsContact O-CD1 3.22Å; M13-I34 WeakPolarHBondContact O-CD1 3.43Å; M13-M69 HydrophobicContact CE-SD 3.8Å; M13-M69 HydrophobicContact SD-SD 3.83Å; M13-A72 HydrophobicContact CE-CB 3.54Å; M13-T76 HydrophobicContact CE-CG2 4.45Å
14	D	89.5	Confident	89.1	Confident	78 Å²	78	56.8 Å²	56.8	42%	0.417	28%	0.282	S	S	.	.			trans	-87.6	169.2	176.2	-67.8	-36.8	0	0	0	113	Y12 K16 F17 I18 R36	Y12-D14 PolarHBondContact O-N 3.26Å; D14-K16 PolarHBondContact O-N 2.89Å; D14-K16 VanDerWaalsContact O-N 3.17Å; D14-F17 WeakPolarHBondContact O-CA 3.38Å; D14-F17 VanDerWaalsContact O-CB 3.3Å; D14-F17 WeakPolarHBondContact O-CB 3.44Å; D14-F17 PolarHBondContact O-N 3.08Å; D14-I18 PolarHBondContact O-N 2.96Å; D14-I18 VanDerWaalsContact O-N 3.08Å; D14-R36 IonicContact OD1-NH2 3.1Å; D14-R36 PolarHBondContact OD1-NH2 2.81Å; D14-R36 VanDerWaalsContact OD1-NH2 3.1Å
15	E	90.7	Very high	88.9	Confident	69 Å²	69	59.3 Å²	59.3	32%	0.322	29%	0.294	S	S	.	.	H	α-helix	trans	-54	-40.8	-179.1	-64.1	75.5	-167.4	0	0	111.3	F17 I18 T19 V32 I34 R36	E15-F17 VanDerWaalsContact C-N 3.32Å; E15-F17 PolarHBondContact O-N 3.25Å; E15-I18 PolarHBondContact O-N 2.83Å; E15-T19 PolarHBondContact O-N 2.62Å; E15-T19 PolarHBondContact O-OG1 2.93Å; E15-T19 VanDerWaalsContact O-OG1 3.06Å; E15-V32 HydrophobicContact CB-CB 4.16Å; E15-V32 HydrophobicContact CB-CG1 4.38Å; E15-V32 HydrophobicContact CG-CB 4.28Å; E15-V32 HydrophobicContact CG-CG1 4.29Å; E15-V32 WeakPolarHBondContact CG-O 3.31Å; E15-I34 HydrophobicContact CG-CD1 4Å; E15-I34 HydrophobicContact CG-CG1 4.03Å; E15-R36 IonicContact OE1-NH2 3.85Å
16	K	91.3	Very high	88.7	Confident	177 Å²	177	59.5 Å²	59.5	77%	0.77	31%	0.314	S	S	*	.	H	α-helix	trans	-63.5	-36.9	176.9	-65.5	-179.6	-178.1	175.1	0	112.6	D14 R20	D14-K16 PolarHBondContact O-N 2.89Å; D14-K16 VanDerWaalsContact O-N 3.17Å; K16-R20 WeakPolarHBondContact O-CB 3.49Å; K16-R20 PolarHBondContact O-N 2.74Å
17	F	90.9	Very high	88.7	Confident	41 Å²	41	60.3 Å²	60.3	18%	0.18	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-46.1	177.4	177	-90.7	0	0	0	109.9	M13 D14 E15 R20 A21 M69 G71 A72	M13-F17 HydrophobicContact CB-CD1 3.92Å; M13-F17 HydrophobicContact CB-CE1 4.4Å; M13-F17 HydrophobicContact CE-CE1 3.89Å; M13-F17 HydrophobicContact CE-CZ 4.32Å; M13-F17 HydrophobicContact CG-CD1 3.68Å; M13-F17 HydrophobicContact CG-CE1 3.67Å; M13-F17 HydrophobicContact CG-CZ 4.49Å; M13-F17 HydrophobicContact SD-CD1 4.26Å; M13-F17 HydrophobicContact SD-CE1 3.85Å; D14-F17 WeakPolarHBondContact O-CA 3.38Å; D14-F17 VanDerWaalsContact O-CB 3.3Å; D14-F17 WeakPolarHBondContact O-CB 3.44Å; D14-F17 PolarHBondContact O-N 3.08Å; E15-F17 VanDerWaalsContact C-N 3.32Å; E15-F17 PolarHBondContact O-N 3.25Å; F17-R20 PolarHBondContact O-N 3.05Å; F17-A21 WeakPolarHBondContact O-CB 3.49Å; F17-A21 PolarHBondContact O-N 3.18Å; F17-M69 HydrophobicContact CE1-CG 4.35Å; F17-M69 HydrophobicContact CE1-SD 3.69Å; F17-M69 HydrophobicContact CZ-SD 4.44Å; F17-G71 WeakPolarHBondContact CE2-O 3.33Å; F17-A72 HydrophobicContact CZ-CB 4.46Å
18	I	90.8	Very high	88.7	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-61.2	-49.4	177	-56.8	-56.9	0	0	0	110.9	M6 L9 M13 D14 E15 R20 A21 F22 V32 V49	M6-I18 HydrophobicContact CE-CD1 3.9Å; M6-I18 HydrophobicContact SD-CD1 4.38Å; M6-I18 HydrophobicContact SD-CG2 3.93Å; L9-I18 HydrophobicContact CD1-CD1 3.66Å; L9-I18 HydrophobicContact CD1-CG1 4.45Å; L9-I18 HydrophobicContact CD2-CD1 4.32Å; L9-I18 HydrophobicContact CD2-CG1 4.45Å; L9-I18 HydrophobicContact CG-CD1 4.07Å; M13-I18 HydrophobicContact CB-CD1 4.31Å; D14-I18 PolarHBondContact O-N 2.96Å; D14-I18 VanDerWaalsContact O-N 3.08Å; E15-I18 PolarHBondContact O-N 2.83Å; I18-R20 VanDerWaalsContact C-N 3.29Å; I18-R20 PolarHBondContact O-N 3.27Å; I18-A21 WeakPolarHBondContact O-CB 3.13Å; I18-A21 PolarHBondContact O-N 3.01Å; I18-F22 HydrophobicContact CG2-CD2 3.7Å; I18-F22 HydrophobicContact CG2-CE2 3.59Å; I18-F22 VanDerWaalsContact O-CD2 3.31Å; I18-F22 WeakPolarHBondContact O-CD2 3.48Å; I18-F22 PolarHBondContact O-N 3.4Å; I18-V32 HydrophobicContact CB-CG1 4.1Å; I18-V32 HydrophobicContact CB-CG2 4.39Å; I18-V32 HydrophobicContact CG1-CG1 4.45Å; I18-V32 HydrophobicContact CG2-CG1 4.02Å; I18-V32 HydrophobicContact CG2-CG2 4.1Å; I18-V49 HydrophobicContact CG2-CG2 4.23Å
19	T	91.7	Very high	88.9	Confident	58 Å²	58	65.3 Å²	65.3	36%	0.356	34%	0.34	S	S	.	.	H	α-helix	trans	-57.5	-41.8	177	-58.2	0	0	0	0	112	E15 S23	E15-T19 PolarHBondContact O-N 2.62Å; E15-T19 PolarHBondContact O-OG1 2.93Å; E15-T19 VanDerWaalsContact O-OG1 3.06Å; T19-S23 VanDerWaalsContact O-CB 3.3Å; T19-S23 WeakPolarHBondContact O-CB 3.23Å; T19-S23 PolarHBondContact O-N 2.77Å
20	R	91.2	Very high	89.1	Confident	175 Å²	175	69.1 Å²	69.1	66%	0.66	36%	0.364	S	S	*	.	H	α-helix	trans	-64.9	-41.7	175.2	-172.5	-176.6	-63.2	163.7	0.4	111.7	K16 F17 I18 S23 T24	K16-R20 WeakPolarHBondContact O-CB 3.49Å; K16-R20 PolarHBondContact O-N 2.74Å; F17-R20 PolarHBondContact O-N 3.05Å; I18-R20 VanDerWaalsContact C-N 3.29Å; I18-R20 PolarHBondContact O-N 3.27Å; R20-S23 PolarHBondContact O-N 3.28Å; R20-T24 PolarHBondContact O-N 3.15Å; R20-T24 PolarHBondContact O-OG1 3.31Å; R20-T24 VanDerWaalsContact O-OG1 3.04Å
21	A	90.6	Very high	89.4	Confident	3 Å²	3	70.3 Å²	70.3	3%	0.025	37%	0.372	C	S	.	.	H	α-helix	trans	-62.4	-43.7	179.6	0	0	0	0	0	111.6	F17 I18 T24 M25 M69 P70 F78	F17-A21 WeakPolarHBondContact O-CB 3.49Å; F17-A21 PolarHBondContact O-N 3.18Å; I18-A21 WeakPolarHBondContact O-CB 3.13Å; I18-A21 PolarHBondContact O-N 3.01Å; A21-T24 PolarHBondContact O-N 3.06Å; A21-M25 WeakPolarHBondContact O-CG 3.32Å; A21-M25 PolarHBondContact O-N 3.29Å; A21-M69 HydrophobicContact CB-CG 4.21Å; A21-P70 HydrophobicContact CB-CG 4.15Å; A21-F78 HydrophobicContact CB-CE1 4.16Å; A21-F78 HydrophobicContact CB-CZ 3.78Å
22	F	90.4	Very high	89.8	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.9	-38.5	172.4	-82	-85.4	0	0	0	112.7	M6 I18 T24 M25 G26 E27 V29 V49 V64 F78 L80	M6-F22 HydrophobicContact CE-CE2 4.49Å; M6-F22 HydrophobicContact SD-CE2 3.51Å; M6-F22 VanDerWaalsContact SD-CE2 3.51Å; M6-F22 HydrophobicContact SD-CZ 3.86Å; I18-F22 HydrophobicContact CG2-CD2 3.7Å; I18-F22 HydrophobicContact CG2-CE2 3.59Å; I18-F22 VanDerWaalsContact O-CD2 3.31Å; I18-F22 WeakPolarHBondContact O-CD2 3.48Å; I18-F22 PolarHBondContact O-N 3.4Å; F22-T24 PolarHBondContact O-N 2.82Å; F22-M25 CarbonylContact O-C 3.48Å; F22-M25 WeakPolarHBondContact O-CA 3.27Å; F22-M25 WeakPolarHBondContact O-CB 3.42Å; F22-M25 PolarHBondContact O-N 3.31Å; F22-G26 PolarHBondContact O-N 2.98Å; F22-E27 CarbonylContact C-O 3.55Å; F22-E27 HydrophobicContact CD1-CB 4.48Å; F22-E27 PolarHBondContact O-N 3.45Å; F22-V29 HydrophobicContact CB-CG2 3.53Å; F22-V29 HydrophobicContact CD1-CG2 4.18Å; F22-V29 HydrophobicContact CD2-CG2 3.98Å; F22-V29 HydrophobicContact CG-CG2 3.64Å; F22-V49 HydrophobicContact CD2-CG1 4.44Å; F22-V49 HydrophobicContact CE2-CG1 4.05Å; F22-V49 HydrophobicContact CE2-CG2 3.86Å; F22-V49 HydrophobicContact CZ-CB 4.49Å; F22-V49 HydrophobicContact CZ-CG1 4.15Å; F22-V49 HydrophobicContact CZ-CG2 4.12Å; F22-V64 HydrophobicContact CD1-CG1 4.47Å; F22-V64 HydrophobicContact CE1-CG1 4.22Å; F22-F78 HydrophobicContact CD2-CE1 4.29Å; F22-F78 HydrophobicContact CE2-CE1 4.13Å; F22-F78 HydrophobicContact CZ-CD1 4.35Å; F22-F78 HydrophobicContact CZ-CE1 4.31Å; F22-L80 HydrophobicContact CE1-CD1 4.06Å; F22-L80 HydrophobicContact CE1-CD2 4.4Å; F22-L80 HydrophobicContact CZ-CD1 4.27Å; F22-L80 HydrophobicContact CZ-CD2 3.78Å
23	S	90.6	Very high	90.2	Very high	79 Å²	79	67.7 Å²	67.7	55%	0.552	35%	0.351	S	S	*	.	H	α-helix	trans	-64	-38.5	177.4	-178.3	0	0	0	0	112.4	T19 R20 M25 G26	T19-S23 VanDerWaalsContact O-CB 3.3Å; T19-S23 WeakPolarHBondContact O-CB 3.23Å; T19-S23 PolarHBondContact O-N 2.77Å; R20-S23 PolarHBondContact O-N 3.28Å; S23-M25 PolarHBondContact O-N 3.3Å; S23-G26 WeakPolarHBondContact O-CA 3.32Å; S23-G26 PolarHBondContact O-N 2.84Å
24	T	89.1	Confident	90.3	Very high	93 Å²	93	68.3 Å²	68.3	57%	0.571	35%	0.354	S	S	*	.	H	α-helix	trans	-60.6	-30.5	172.1	-58.2	0	0	0	0	112	R20 A21 F22 G26 P70	R20-T24 PolarHBondContact O-N 3.15Å; R20-T24 PolarHBondContact O-OG1 3.31Å; R20-T24 VanDerWaalsContact O-OG1 3.04Å; A21-T24 PolarHBondContact O-N 3.06Å; F22-T24 PolarHBondContact O-N 2.82Å; T24-G26 VanDerWaalsContact C-N 3.25Å; T24-G26 PolarHBondContact O-N 3.49Å; T24-P70 HydrophobicContact CG2-CB 4.12Å; T24-P70 HydrophobicContact CG2-CG 3.97Å
25	M	87.3	Confident	90.3	Very high	54 Å²	54	66.2 Å²	66.2	27%	0.266	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-2.2	174.6	-60.9	-57.2	-60.3	0	0	113.4	A21 F22 S23 V64 K67 F78	A21-M25 WeakPolarHBondContact O-CG 3.32Å; A21-M25 PolarHBondContact O-N 3.29Å; F22-M25 CarbonylContact O-C 3.48Å; F22-M25 WeakPolarHBondContact O-CA 3.27Å; F22-M25 WeakPolarHBondContact O-CB 3.42Å; F22-M25 PolarHBondContact O-N 3.31Å; S23-M25 PolarHBondContact O-N 3.3Å; M25-V64 HydrophobicContact CB-CG2 3.92Å; M25-V64 HydrophobicContact CE-CG2 4.39Å; M25-V64 HydrophobicContact CG-CG1 4.19Å; M25-V64 HydrophobicContact CG-CG2 4.34Å; M25-K67 HydrophobicContact CE-CB 4.48Å; M25-K67 HydrophobicContact CE-CD 3.49Å; M25-K67 VanDerWaalsContact CE-CD 3.49Å; M25-F78 HydrophobicContact CG-CE2 3.98Å; M25-F78 HydrophobicContact CG-CZ 4.15Å; M25-F78 HydrophobicContact SD-CE2 4.42Å
26	G	87.6	Confident	90	Very high	62 Å²	62	67.2 Å²	67.2	64%	0.639	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	14.3	179.4	0	0	0	0	0	114.8	F22 S23 T24	F22-G26 PolarHBondContact O-N 2.98Å; S23-G26 WeakPolarHBondContact O-CA 3.32Å; S23-G26 PolarHBondContact O-N 2.84Å; T24-G26 VanDerWaalsContact C-N 3.25Å; T24-G26 PolarHBondContact O-N 3.49Å
27	E	88.8	Confident	89.6	Confident	18 Å²	18	61.7 Å²	61.7	8%	0.084	32%	0.322	C	S	.	.			trans	-109.9	139.1	-175.9	-59.5	-71.1	-176.5	0	0	110.9	F22 T56 R59 C60 V64	F22-E27 CarbonylContact C-O 3.55Å; F22-E27 HydrophobicContact CD1-CB 4.48Å; F22-E27 PolarHBondContact O-N 3.45Å; E27-T56 VanDerWaalsContact OE2-CG2 3.26Å; E27-T56 WeakPolarHBondContact OE2-CG2 3.43Å; E27-R59 IonicContact OE2-NH2 2.67Å; E27-C60 WeakPolarHBondContact CG-SG 3.17Å; E27-V64 HydrophobicContact CG-CG2 4.12Å
28	Q	88.3	Confident	88.9	Confident	160 Å²	160	69.9 Å²	69.9	75%	0.748	36%	0.357	S	S	*	.			trans	-97.7	123.3	-178.8	-67	-176.3	38.2	0	0	110.8	M51	Q28-M51 WeakPolarHBondContact O-CE 3.44Å
29	V	91.2	Very high	88	Confident	27 Å²	27	78.2 Å²	78.2	16%	0.164	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.2	178.7	177.8	0	0	0	0	109.1	F22 N31 V32 V49 M51	F22-V29 HydrophobicContact CB-CG2 3.53Å; F22-V29 HydrophobicContact CD1-CG2 4.18Å; F22-V29 HydrophobicContact CD2-CG2 3.98Å; F22-V29 HydrophobicContact CG-CG2 3.64Å; V29-N31 WeakPolarHBondContact CG1-O 3.34Å; V29-V32 HydrophobicContact CG1-CG2 3.58Å; V29-V49 HydrophobicContact CB-CG1 4.21Å; V29-V49 HydrophobicContact CG1-CG1 3.44Å; V29-V49 VanDerWaalsContact CG1-CG1 3.44Å; V29-V49 HydrophobicContact CG2-CG1 3.69Å; V29-M51 HydrophobicContact CG2-CE 4.45Å; V29-M51 HydrophobicContact CG2-SD 4.24Å
30	V	92.3	Very high	87.1	Confident	92 Å²	92	80.5 Å²	80.5	56%	0.558	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	-48.1	177.4	177.7	0	0	0	0	110.3	E50	V30-E50 HydrophobicContact CB-CG 4.42Å; V30-E50 WeakPolarHBondContact CB-O 3.33Å; V30-E50 PolarHBondContact N-O 3.18Å
31	N	91.1	Very high	86	Confident	89 Å²	89	74.4 Å²	74.4	48%	0.476	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	147.7	-177.6	-161.2	-14.1	0	0	0	110.9	V29 E50	V29-N31 WeakPolarHBondContact CG1-O 3.34Å; N31-E50 HydrophobicContact CB-CB 3.93Å; N31-E50 PolarHBondContact N-O 3.05Å; N31-E50 PolarHBondContact O-N 3.43Å
32	V	92.3	Very high	85.1	Confident	10 Å²	10	75.8 Å²	75.8	6%	0.061	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121.3	172.9	-178.4	0	0	0	0	108	E15 I18 V29 I34 C47 F48 V49	E15-V32 HydrophobicContact CB-CB 4.16Å; E15-V32 HydrophobicContact CB-CG1 4.38Å; E15-V32 HydrophobicContact CG-CB 4.28Å; E15-V32 HydrophobicContact CG-CG1 4.29Å; E15-V32 WeakPolarHBondContact CG-O 3.31Å; I18-V32 HydrophobicContact CB-CG1 4.1Å; I18-V32 HydrophobicContact CB-CG2 4.39Å; I18-V32 HydrophobicContact CG1-CG1 4.45Å; I18-V32 HydrophobicContact CG2-CG1 4.02Å; I18-V32 HydrophobicContact CG2-CG2 4.1Å; V29-V32 HydrophobicContact CG1-CG2 3.58Å; V32-I34 HydrophobicContact CG1-CG1 4.22Å; V32-C47 HydrophobicContact CG1-CB 4.3Å; V32-F48 WeakPolarHBondContact CA-O 3.28Å; V32-V49 HydrophobicContact CG2-CG1 4.47Å
33	R	91	Very high	84.4	Confident	136 Å²	136	76.8 Å²	76.8	51%	0.513	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	100.6	176.2	-164.4	179	85	179	6.3	110.3	I35 C47 F48	R33-I35 HydrophobicContact CG-CD1 4.28Å; R33-C47 WeakPolarHBondContact O-CA 3.24Å; R33-F48 PolarHBondContact N-O 3.45Å; R33-F48 PolarHBondContact O-N 2.84Å
34	I	90.4	Very high	83.7	Confident	14 Å²	14	77.1 Å²	77.1	7%	0.072	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	129	174	-58.6	-179.4	0	0	0	109	L9 M13 E15 V32 R36 A43 C47	L9-I34 HydrophobicContact CD2-CD1 4Å; L9-I34 HydrophobicContact CD2-CG1 4.1Å; L9-I34 HydrophobicContact CD2-CG2 4.16Å; M13-I34 VanDerWaalsContact O-CD1 3.22Å; M13-I34 WeakPolarHBondContact O-CD1 3.43Å; E15-I34 HydrophobicContact CG-CD1 4Å; E15-I34 HydrophobicContact CG-CG1 4.03Å; V32-I34 HydrophobicContact CG1-CG1 4.22Å; I34-R36 HydrophobicContact CG2-CG 4.04Å; I34-A43 HydrophobicContact CG2-CB 4.24Å; I34-C47 HydrophobicContact CB-CB 4.27Å; I34-C47 HydrophobicContact CG1-CB 3.81Å
35	I	88.3	Confident	83.5	Confident	34 Å²	34	73.8 Å²	73.8	17%	0.174	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	120	175.1	-50	-55.3	0	0	0	108.6	R33 L44 Y46 F48	R33-I35 HydrophobicContact CG-CD1 4.28Å; I35-L44 HydrophobicContact CB-CD1 4.49Å; I35-L44 HydrophobicContact CG2-CD1 3.71Å; I35-L44 PolarHBondContact O-N 3.32Å; I35-Y46 HydrophobicContact CB-CD2 4.44Å; I35-Y46 HydrophobicContact CB-CE1 4.43Å; I35-Y46 HydrophobicContact CB-CE2 3.82Å; I35-Y46 HydrophobicContact CG1-CD2 4.18Å; I35-Y46 HydrophobicContact CG1-CE2 3.53Å; I35-Y46 HydrophobicContact CG2-CE2 4.44Å; I35-Y46 PolarHBondContact N-O 3.02Å; I35-F48 HydrophobicContact CD1-CD2 3.95Å; I35-F48 HydrophobicContact CD1-CE2 4.13Å; I35-F48 HydrophobicContact CG1-CD2 3.82Å; I35-F48 HydrophobicContact CG1-CE2 3.77Å
36	R	85.8	Confident	83.6	Confident	90 Å²	90	74.4 Å²	74.4	34%	0.34	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	148.5	178	-54	-175.4	-174.8	-117.8	3.8	109.4	D14 E15 I34 K38 G42	D14-R36 IonicContact OD1-NH2 3.1Å; D14-R36 PolarHBondContact OD1-NH2 2.81Å; D14-R36 VanDerWaalsContact OD1-NH2 3.1Å; E15-R36 IonicContact OE1-NH2 3.85Å; I34-R36 HydrophobicContact CG2-CG 4.04Å; R36-K38 PolarHBondContact O-N 3.37Å; R36-G42 CarbonylContact C-O 3.6Å; R36-G42 VanDerWaalsContact CA-O 3.27Å; R36-G42 WeakPolarHBondContact CA-O 3.36Å
37	N	81.8	Confident	83.8	Confident	60 Å²	60	71.4 Å²	71.4	32%	0.321	38%	0.376	S	S	.	.			trans	-63.1	127	175.6	-172.6	-30.1	0	0	0	108.9	M39 T40 G41 G42 L44	N37-M39 PolarHBondContact O-N 3.49Å; N37-M39 PolarHBondContact OD1-N 3.41Å; N37-T40 WeakPolarHBondContact CB-OG1 3.25Å; N37-G41 VanDerWaalsContact O-CA 3.29Å; N37-G41 WeakPolarHBondContact O-CA 3.48Å; N37-G41 PolarHBondContact O-N 2.86Å; N37-G42 PolarHBondContact N-O 3.43Å; N37-L44 HydrophobicContact CB-CD2 3.78Å; N37-L44 HydrophobicContact CB-CG 4.42Å
38	K	75.3	Confident	83.9	Confident	213 Å²	213	72.2 Å²	72.2	93%	0.926	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-24.2	-178.6	-65.1	-176.3	178.2	-178.4	0	113.4	R36	R36-K38 PolarHBondContact O-N 3.37Å
39	M	71.9	Confident	84.1	Confident	176 Å²	176	64.6 Å²	64.6	87%	0.867	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-39.4	179.3	-87.8	163.9	57.5	0	0	113.3	N37	N37-M39 PolarHBondContact O-N 3.49Å; N37-M39 PolarHBondContact OD1-N 3.41Å
40	T	74.3	Confident	84.2	Confident	105 Å²	105	65.9 Å²	65.9	64%	0.644	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-8	-173.3	60.4	0	0	0	0	114.1	N37 G42	N37-T40 WeakPolarHBondContact CB-OG1 3.25Å; T40-G42 PolarHBondContact O-N 3.37Å
41	G	68.1	Low	84.1	Confident	48 Å²	48	61.5 Å²	61.5	50%	0.495	32%	0.321	S	S	.	.			trans	68.3	-7.2	-177.6	0	0	0	0	0	115	N37	N37-G41 VanDerWaalsContact O-CA 3.29Å; N37-G41 WeakPolarHBondContact O-CA 3.48Å; N37-G41 PolarHBondContact O-N 2.86Å
42	G	71.4	Confident	84.1	Confident	32 Å²	32	60 Å²	60	33%	0.33	32%	0.317	S	S	.	.			trans	-71.8	144.2	179.2	0	0	0	0	0	112.4	R36 N37 T40 L44	R36-G42 CarbonylContact C-O 3.6Å; R36-G42 VanDerWaalsContact CA-O 3.27Å; R36-G42 WeakPolarHBondContact CA-O 3.36Å; N37-G42 PolarHBondContact N-O 3.43Å; T40-G42 PolarHBondContact O-N 3.37Å; G42-L44 PolarHBondContact O-N 3.49Å
43	A	74.8	Confident	84	Confident	21 Å²	21	62.1 Å²	62.1	17%	0.174	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	134.7	173.8	0	0	0	0	0	110.7	I34 G45	I34-A43 HydrophobicContact CG2-CB 4.24Å; A43-G45 PolarHBondContact O-N 2.83Å; A43-G45 VanDerWaalsContact O-N 3.16Å
44	L	77.1	Confident	83.8	Confident	85 Å²	85	60.4 Å²	60.4	45%	0.445	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	9	176	-66.6	178.7	0	0	0	112.7	I35 N37 G42 Y46	I35-L44 HydrophobicContact CB-CD1 4.49Å; I35-L44 HydrophobicContact CG2-CD1 3.71Å; I35-L44 PolarHBondContact O-N 3.32Å; N37-L44 HydrophobicContact CB-CD2 3.78Å; N37-L44 HydrophobicContact CB-CG 4.42Å; G42-L44 PolarHBondContact O-N 3.49Å; L44-Y46 VanDerWaalsContact C-N 3.33Å; L44-Y46 HydrophobicContact CB-CD1 3.84Å; L44-Y46 HydrophobicContact CB-CE1 3.53Å; L44-Y46 HydrophobicContact CD1-CE1 3.95Å; L44-Y46 HydrophobicContact CG-CE1 4.41Å; L44-Y46 WeakPolarHBondContact O-CD1 3.22Å; L44-Y46 PolarHBondContact O-N 3.44Å
45	G	84.1	Confident	83.7	Confident	23 Å²	23	62 Å²	62	24%	0.237	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	76.4	15.4	179.8	0	0	0	0	0	114.9	N8 L9 A43	N8-G45 PolarHBondContact N-O 3.35Å; N8-G45 VanDerWaalsContact N-O 3.16Å; L9-G45 PolarHBondContact N-O 3.44Å; L9-G45 WeakPolarHBondContact O-CA 3.44Å; A43-G45 PolarHBondContact O-N 2.83Å; A43-G45 VanDerWaalsContact O-N 3.16Å
46	Y	89.8	Confident	83.7	Confident	67 Å²	67	60.8 Å²	60.8	26%	0.263	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	156.2	172.7	71.8	-85.3	0	0	0	112.8	W5 M6 I35 L44 F48	W5-Y46 AromaticContact CD1-CD2 3.79Å; W5-Y46 AromaticContact NE1-CD2 3.29Å; W5-Y46 VanDerWaalsContact NE1-CD2 3.29Å; W5-Y46 AromaticContact NE1-CG 3.59Å; M6-Y46 CarbonylContact O-C 3.46Å; M6-Y46 WeakPolarHBondContact O-CA 3.46Å; M6-Y46 WeakPolarHBondContact O-CB 3.26Å; I35-Y46 HydrophobicContact CB-CD2 4.44Å; I35-Y46 HydrophobicContact CB-CE1 4.43Å; I35-Y46 HydrophobicContact CB-CE2 3.82Å; I35-Y46 HydrophobicContact CG1-CD2 4.18Å; I35-Y46 HydrophobicContact CG1-CE2 3.53Å; I35-Y46 HydrophobicContact CG2-CE2 4.44Å; I35-Y46 PolarHBondContact N-O 3.02Å; L44-Y46 VanDerWaalsContact C-N 3.33Å; L44-Y46 HydrophobicContact CB-CD1 3.84Å; L44-Y46 HydrophobicContact CB-CE1 3.53Å; L44-Y46 HydrophobicContact CD1-CE1 3.95Å; L44-Y46 HydrophobicContact CG-CE1 4.41Å; L44-Y46 WeakPolarHBondContact O-CD1 3.22Å; L44-Y46 PolarHBondContact O-N 3.44Å; Y46-F48 HydrophobicContact CD2-CE2 4.16Å; Y46-F48 HydrophobicContact CD2-CZ 4.49Å; Y46-F48 HydrophobicContact CE2-CD2 4.48Å; Y46-F48 AromaticContact CE2-CE2 3.68Å; Y46-F48 HydrophobicContact CE2-CE2 3.68Å; Y46-F48 HydrophobicContact CE2-CZ 4.1Å
47	C	91.2	Very high	83.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	164.8	175.4	67.8	0	0	0	0	111.5	M6 L9 V32 R33 I34	M6-C47 PolarHBondContact N-O 3.39Å; M6-C47 PolarHBondContact O-N 3.38Å; L9-C47 HydrophobicContact CD2-CB 3.96Å; V32-C47 HydrophobicContact CG1-CB 4.3Å; R33-C47 WeakPolarHBondContact O-CA 3.24Å; I34-C47 HydrophobicContact CB-CB 4.27Å; I34-C47 HydrophobicContact CG1-CB 3.81Å
48	F	92.3	Very high	84	Confident	35 Å²	35	55.7 Å²	55.7	15%	0.154	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.1	170.8	-68.3	-80.4	0	0	0	109.2	T3 L4 W5 V32 R33 I35 Y46 A83 F85	T3-F48 HydrophobicContact CG2-CB 3.86Å; T3-F48 HydrophobicContact CG2-CD1 4.12Å; T3-F48 HydrophobicContact CG2-CG 4.44Å; L4-F48 CarbonylContact O-C 3.53Å; L4-F48 WeakPolarHBondContact O-CA 3.21Å; W5-F48 HydrophobicContact CB-CD1 4.34Å; W5-F48 HydrophobicContact CB-CE1 4.13Å; W5-F48 AromaticContact CD1-CE1 3.73Å; W5-F48 AromaticContact CD1-CZ 3.94Å; W5-F48 HydrophobicContact CG-CE1 4.36Å; V32-F48 WeakPolarHBondContact CA-O 3.28Å; R33-F48 PolarHBondContact N-O 3.45Å; R33-F48 PolarHBondContact O-N 2.84Å; I35-F48 HydrophobicContact CD1-CD2 3.95Å; I35-F48 HydrophobicContact CD1-CE2 4.13Å; I35-F48 HydrophobicContact CG1-CD2 3.82Å; I35-F48 HydrophobicContact CG1-CE2 3.77Å; Y46-F48 HydrophobicContact CD2-CE2 4.16Å; Y46-F48 HydrophobicContact CD2-CZ 4.49Å; Y46-F48 HydrophobicContact CE2-CD2 4.48Å; Y46-F48 AromaticContact CE2-CE2 3.68Å; Y46-F48 HydrophobicContact CE2-CE2 3.68Å; Y46-F48 HydrophobicContact CE2-CZ 4.1Å; F48-A83 HydrophobicContact CD1-CB 3.68Å; F48-A83 HydrophobicContact CE1-CB 3.78Å; F48-F85 HydrophobicContact CD1-CZ 4.24Å; F48-F85 HydrophobicContact CG-CZ 4.38Å
49	V	92.3	Very high	84.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	114.6	-177.1	-175	0	0	0	0	107.4	T3 L4 M6 I18 F22 V29 V32 M51	T3-V49 CarbonylContact C-O 3.4Å; T3-V49 WeakPolarHBondContact CA-O 3.46Å; L4-V49 HydrophobicContact CB-CB 4.5Å; L4-V49 PolarHBondContact N-O 3.34Å; L4-V49 PolarHBondContact O-N 3.11Å; M6-V49 HydrophobicContact CB-CG2 4.15Å; M6-V49 HydrophobicContact SD-CG2 4.31Å; I18-V49 HydrophobicContact CG2-CG2 4.23Å; F22-V49 HydrophobicContact CD2-CG1 4.44Å; F22-V49 HydrophobicContact CE2-CG1 4.05Å; F22-V49 HydrophobicContact CE2-CG2 3.86Å; F22-V49 HydrophobicContact CZ-CB 4.49Å; F22-V49 HydrophobicContact CZ-CG1 4.15Å; F22-V49 HydrophobicContact CZ-CG2 4.12Å; V29-V49 HydrophobicContact CB-CG1 4.21Å; V29-V49 HydrophobicContact CG1-CG1 3.44Å; V29-V49 VanDerWaalsContact CG1-CG1 3.44Å; V29-V49 HydrophobicContact CG2-CG1 3.69Å; V32-V49 HydrophobicContact CG2-CG1 4.47Å; V49-M51 HydrophobicContact CG1-SD 3.7Å
50	E	92	Very high	85.4	Confident	54 Å²	54	41.2 Å²	41.2	25%	0.252	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	124.2	177	-170.6	178.7	173.3	0	0	110	V30 N31	V30-E50 HydrophobicContact CB-CG 4.42Å; V30-E50 WeakPolarHBondContact CB-O 3.33Å; V30-E50 PolarHBondContact N-O 3.18Å; N31-E50 HydrophobicContact CB-CB 3.93Å; N31-E50 PolarHBondContact N-O 3.05Å; N31-E50 PolarHBondContact O-N 3.43Å
51	M	91.6	Very high	85.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	150.7	179	-49.4	-55.9	-63.5	0	0	109.9	S2 L4 Q28 V29 V49 D53 T56 A57 C60	S2-M51 PolarHBondContact N-O 3.08Å; S2-M51 WeakPolarHBondContact O-CB 3.49Å; S2-M51 PolarHBondContact O-N 2.98Å; L4-M51 HydrophobicContact CD1-CG 4.1Å; L4-M51 HydrophobicContact CD1-SD 4.34Å; L4-M51 HydrophobicContact CG-CG 4.22Å; Q28-M51 WeakPolarHBondContact O-CE 3.44Å; V29-M51 HydrophobicContact CG2-CE 4.45Å; V29-M51 HydrophobicContact CG2-SD 4.24Å; V49-M51 HydrophobicContact CG1-SD 3.7Å; M51-D53 VanDerWaalsContact C-N 3.29Å; M51-D53 PolarHBondContact O-N 3.29Å; M51-T56 HydrophobicContact CE-CG2 3.42Å; M51-T56 VanDerWaalsContact CE-CG2 3.42Å; M51-A57 HydrophobicContact CB-CB 4.14Å; M51-A57 HydrophobicContact CG-CB 3.86Å; M51-C60 WeakPolarHBondContact CE-SG 3.12Å
52	S	90.1	Very high	86.7	Confident	57 Å²	57	36.9 Å²	36.9	40%	0.399	20%	0.202	S	C	.	.	S	Bend	trans	-55.4	-45.7	176.9	40.6	0	0	0	0	112	M1	M1-S52 WeakPolarHBondContact CA-O 3.26Å; M1-S52 PolarHBondContact N-O 3.41Å
53	D	90	Very high	87.3	Confident	55 Å²	55	40.6 Å²	40.6	29%	0.294	21%	0.209	S	C	.	.	S	Bend	trans	-143.1	157.5	-169.6	59	-55.9	0	0	0	110.9	M51 A55 T56 A57	M51-D53 VanDerWaalsContact C-N 3.29Å; M51-D53 PolarHBondContact O-N 3.29Å; D53-A55 VanDerWaalsContact C-N 3.3Å; D53-A55 PolarHBondContact O-N 3.26Å; D53-A55 WeakPolarHBondContact OD2-CB 3.46Å; D53-T56 PolarHBondContact O-N 3.38Å; D53-T56 WeakPolarHBondContact OD1-CB 3.39Å; D53-T56 PolarHBondContact OD1-OG1 2.91Å; D53-T56 PolarHBondContact OD2-N 3.06Å; D53-T56 PolarHBondContact OD2-OG1 3.45Å; D53-A57 PolarHBondContact O-N 3.42Å
54	E	87.1	Confident	87.8	Confident	99 Å²	99	39.7 Å²	39.7	46%	0.463	20%	0.201	S	C	.	.	H	α-helix	trans	-66	-34.8	177.6	-175.8	167.2	-165.5	0	0	111.8	T56 A57 E58 R82	E54-T56 PolarHBondContact O-N 3.24Å; E54-A57 WeakPolarHBondContact O-CB 3.12Å; E54-A57 PolarHBondContact O-N 2.94Å; E54-A57 VanDerWaalsContact O-N 3.11Å; E54-E58 HydrophobicContact CG-CG 4.41Å; E54-E58 WeakPolarHBondContact O-CG 3.42Å; E54-E58 PolarHBondContact O-N 3.27Å; E54-R82 IonicContact OE1-CZ 2.74Å; E54-R82 IonicContact OE1-NH1 3.05Å; E54-R82 PolarHBondContact OE1-NH1 3.04Å; E54-R82 IonicContact OE1-NH2 3.33Å; E54-R82 PolarHBondContact OE1-NH2 3.49Å
55	A	88.1	Confident	88.4	Confident	49 Å²	49	36.6 Å²	36.6	41%	0.405	19%	0.185	S	C	.	.	H	α-helix	trans	-63.3	-40.5	178.5	0	0	0	0	0	111.8	D53 E58 R59	D53-A55 VanDerWaalsContact C-N 3.3Å; D53-A55 PolarHBondContact O-N 3.26Å; D53-A55 WeakPolarHBondContact OD2-CB 3.46Å; A55-E58 PolarHBondContact O-N 3.08Å; A55-R59 WeakPolarHBondContact O-CG 3.24Å; A55-R59 PolarHBondContact O-N 2.73Å
56	T	89.3	Confident	88.2	Confident	8 Å²	8	35.6 Å²	35.6	5%	0.049	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-40.9	171.7	-57.2	0	0	0	0	111.9	E27 M51 D53 E54 E58 R59 C60	E27-T56 VanDerWaalsContact OE2-CG2 3.26Å; E27-T56 WeakPolarHBondContact OE2-CG2 3.43Å; M51-T56 HydrophobicContact CE-CG2 3.42Å; M51-T56 VanDerWaalsContact CE-CG2 3.42Å; D53-T56 PolarHBondContact O-N 3.38Å; D53-T56 WeakPolarHBondContact OD1-CB 3.39Å; D53-T56 PolarHBondContact OD1-OG1 2.91Å; D53-T56 PolarHBondContact OD2-N 3.06Å; D53-T56 PolarHBondContact OD2-OG1 3.45Å; E54-T56 PolarHBondContact O-N 3.24Å; T56-E58 VanDerWaalsContact C-N 3.35Å; T56-E58 PolarHBondContact O-N 2.72Å; T56-R59 PolarHBondContact O-N 2.96Å; T56-R59 PolarHBondContact OG1-NH2 3.49Å; T56-C60 PolarHBondContact O-N 3.36Å; T56-C60 PolarHBondContact O-SG 3.25Å
57	A	88.1	Confident	88	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-61.3	-42.2	175.6	0	0	0	0	0	112.3	L4 M51 D53 E54 C60 L61	L4-A57 HydrophobicContact CD1-CB 4.26Å; L4-A57 HydrophobicContact CD2-CB 4.05Å; L4-A57 HydrophobicContact CG-CB 4.11Å; M51-A57 HydrophobicContact CB-CB 4.14Å; M51-A57 HydrophobicContact CG-CB 3.86Å; D53-A57 PolarHBondContact O-N 3.42Å; E54-A57 WeakPolarHBondContact O-CB 3.12Å; E54-A57 PolarHBondContact O-N 2.94Å; E54-A57 VanDerWaalsContact O-N 3.11Å; A57-C60 WeakPolarHBondContact O-CB 3.48Å; A57-C60 PolarHBondContact O-N 2.98Å; A57-L61 WeakPolarHBondContact O-CG 3.04Å; A57-L61 PolarHBondContact O-N 3.06Å
58	E	85.6	Confident	87.7	Confident	42 Å²	42	40 Å²	40	20%	0.196	21%	0.205	C	C	.	.	H	α-helix	trans	-67.7	-37.5	175.4	-70.1	-164.3	152.1	0	0	113.2	E54 A55 T56 C60 L61 R62 R82 Y115	E54-E58 HydrophobicContact CG-CG 4.41Å; E54-E58 WeakPolarHBondContact O-CG 3.42Å; E54-E58 PolarHBondContact O-N 3.27Å; A55-E58 PolarHBondContact O-N 3.08Å; T56-E58 VanDerWaalsContact C-N 3.35Å; T56-E58 PolarHBondContact O-N 2.72Å; E58-C60 VanDerWaalsContact C-N 3.33Å; E58-L61 PolarHBondContact O-N 3.41Å; E58-R62 WeakPolarHBondContact O-CG 3.34Å; E58-R62 PolarHBondContact O-N 2.87Å; E58-R62 VanDerWaalsContact O-N 3.08Å; E58-R82 IonicContact OE1-CZ 3.34Å; E58-R82 IonicContact OE1-NH2 2.83Å; E58-R82 PolarHBondContact OE1-NH2 3.11Å; E58-Y115 PolarHBondContact OE2-OH 2.79Å; E58-Y115 VanDerWaalsContact OE2-OH 3.06Å
59	R	87.3	Confident	87.4	Confident	85 Å²	85	38.8 Å²	38.8	32%	0.321	20%	0.2	S	C	.	.	H	α-helix	trans	-63.1	-41.1	172.9	-73.6	-168	-49.8	-89.2	3.5	111.2	E27 A55 T56 R62 K63	E27-R59 IonicContact OE2-NH2 2.67Å; A55-R59 WeakPolarHBondContact O-CG 3.24Å; A55-R59 PolarHBondContact O-N 2.73Å; T56-R59 PolarHBondContact O-N 2.96Å; T56-R59 PolarHBondContact OG1-NH2 3.49Å; R59-R62 PolarHBondContact O-N 2.5Å; R59-K63 WeakPolarHBondContact O-CB 3.35Å; R59-K63 PolarHBondContact O-N 2.99Å
60	C	88.4	Confident	87	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-45.4	174.6	-69.8	0	0	0	0	111.9	L4 E27 M51 T56 A57 E58 R62 V64 N65 L80	L4-C60 HydrophobicContact CD1-CB 3.69Å; E27-C60 WeakPolarHBondContact CG-SG 3.17Å; M51-C60 WeakPolarHBondContact CE-SG 3.12Å; T56-C60 PolarHBondContact O-N 3.36Å; T56-C60 PolarHBondContact O-SG 3.25Å; A57-C60 WeakPolarHBondContact O-CB 3.48Å; A57-C60 PolarHBondContact O-N 2.98Å; E58-C60 VanDerWaalsContact C-N 3.33Å; C60-R62 VanDerWaalsContact C-N 3.26Å; C60-R62 PolarHBondContact O-N 3.03Å; C60-V64 HydrophobicContact CB-CG2 4.42Å; C60-V64 WeakPolarHBondContact O-CA 3.49Å; C60-V64 VanDerWaalsContact O-CB 3.23Å; C60-V64 WeakPolarHBondContact O-CB 3.43Å; C60-V64 PolarHBondContact O-N 3.32Å; C60-N65 PolarHBondContact O-N 2.9Å; C60-L80 HydrophobicContact CB-CD1 4.25Å
61	L	86.4	Confident	86.5	Confident	10 Å²	10	41.5 Å²	41.5	5%	0.052	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-33.5	178	-72.6	167.1	0	0	0	112.8	L4 A57 E58 N65 L80 R82 Y111	L4-L61 HydrophobicContact CD2-CD1 3.72Å; L4-L61 HydrophobicContact CD2-CD2 3.98Å; L4-L61 HydrophobicContact CD2-CG 3.76Å; A57-L61 WeakPolarHBondContact O-CG 3.04Å; A57-L61 PolarHBondContact O-N 3.06Å; E58-L61 PolarHBondContact O-N 3.41Å; L61-N65 WeakPolarHBondContact O-CB 3.34Å; L61-L80 HydrophobicContact CD2-CB 3.8Å; L61-R82 HydrophobicContact CD1-CG 3.55Å; L61-Y111 HydrophobicContact CB-CE1 4.1Å
62	R	83.4	Confident	86.1	Confident	52 Å²	52	42.2 Å²	42.2	20%	0.196	24%	0.241	C	C	.	.	H	α-helix	trans	-79.7	-47.6	176.3	-71.7	-175.7	-69.3	168.7	-5.9	113.7	E58 R59 C60 G108 Y111	E58-R62 WeakPolarHBondContact O-CG 3.34Å; E58-R62 PolarHBondContact O-N 2.87Å; E58-R62 VanDerWaalsContact O-N 3.08Å; R59-R62 PolarHBondContact O-N 2.5Å; C60-R62 VanDerWaalsContact C-N 3.26Å; C60-R62 PolarHBondContact O-N 3.03Å; R62-G108 WeakPolarHBondContact O-CA 3.05Å; R62-Y111 HydrophobicContact CB-CD1 4.16Å; R62-Y111 HydrophobicContact CB-CE1 4.28Å; R62-Y111 HydrophobicContact CG-CD1 3.46Å; R62-Y111 VanDerWaalsContact CG-CD1 3.46Å; R62-Y111 HydrophobicContact CG-CE1 3.25Å; R62-Y111 HydrophobicContact CG-CG 4.4Å
63	K	84.3	Confident	85.6	Confident	110 Å²	110	43.9 Å²	43.9	48%	0.478	25%	0.252	S	S	.	.	H	α-helix	trans	-97.3	-26.7	-167.9	-68	-173.5	175	-175.3	0	114.2	R59 K67	R59-K63 WeakPolarHBondContact O-CB 3.35Å; R59-K63 PolarHBondContact O-N 2.99Å; K63-K67 WeakPolarHBondContact O-CD 3.45Å; K63-K67 WeakPolarHBondContact O-CE 3.36Å; K63-K67 PolarHBondContact O-NZ 3.47Å
64	V	86.5	Confident	85.1	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-35.1	-172.4	-176.9	0	0	0	0	111	F22 M25 E27 C60 G66 K67 F78 L80	F22-V64 HydrophobicContact CD1-CG1 4.47Å; F22-V64 HydrophobicContact CE1-CG1 4.22Å; M25-V64 HydrophobicContact CB-CG2 3.92Å; M25-V64 HydrophobicContact CE-CG2 4.39Å; M25-V64 HydrophobicContact CG-CG1 4.19Å; M25-V64 HydrophobicContact CG-CG2 4.34Å; E27-V64 HydrophobicContact CG-CG2 4.12Å; C60-V64 HydrophobicContact CB-CG2 4.42Å; C60-V64 WeakPolarHBondContact O-CA 3.49Å; C60-V64 VanDerWaalsContact O-CB 3.23Å; C60-V64 WeakPolarHBondContact O-CB 3.43Å; C60-V64 PolarHBondContact O-N 3.32Å; V64-G66 PolarHBondContact O-N 3.41Å; V64-K67 WeakPolarHBondContact O-CB 2.97Å; V64-K67 PolarHBondContact O-N 2.96Å; V64-F78 HydrophobicContact CG1-CB 4.03Å; V64-F78 HydrophobicContact CG1-CD1 3.73Å; V64-F78 HydrophobicContact CG1-CD2 3.68Å; V64-F78 HydrophobicContact CG1-CE1 4.01Å; V64-F78 HydrophobicContact CG1-CE2 3.95Å; V64-F78 HydrophobicContact CG1-CG 3.55Å; V64-F78 HydrophobicContact CG1-CZ 4.1Å; V64-F78 VanDerWaalsContact O-CB 3.26Å; V64-F78 WeakPolarHBondContact O-CB 3.4Å; V64-L80 HydrophobicContact CB-CD1 3.89Å; V64-L80 HydrophobicContact CG1-CD1 3.9Å
65	N	87.8	Confident	84.8	Confident	21 Å²	21	46.1 Å²	46.1	11%	0.112	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	134.5	179.4	-163.3	24.9	0	0	0	112.4	C60 L61 K67 F78 L80	C60-N65 PolarHBondContact O-N 2.9Å; L61-N65 WeakPolarHBondContact O-CB 3.34Å; N65-K67 PolarHBondContact O-N 3.09Å; N65-F78 PolarHBondContact OD1-O 2.84Å; N65-L80 HydrophobicContact CB-CB 4.18Å; N65-L80 HydrophobicContact CB-CD1 4.5Å; N65-L80 HydrophobicContact CB-CG 4.47Å; N65-L80 PolarHBondContact ND2-O 3.12Å; N65-L80 PolarHBondContact OD1-N 2.73Å; N65-L80 PolarHBondContact OD1-O 3.47Å
66	G	81.4	Confident	84.6	Confident	2 Å²	2	44.5 Å²	44.5	2%	0.021	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	-10	-178.2	0	0	0	0	0	115.8	V64 R77 F78 D107	V64-G66 PolarHBondContact O-N 3.41Å; G66-R77 WeakPolarHBondContact O-CD 3.02Å; G66-R77 PolarHBondContact O-NH1 3.17Å; G66-F78 PolarHBondContact N-O 2.8Å; G66-D107 VanDerWaalsContact CA-OD2 3.27Å; G66-D107 WeakPolarHBondContact CA-OD2 3.43Å
67	K	84.9	Confident	84.5	Confident	81 Å²	81	47.9 Å²	47.9	35%	0.352	28%	0.275	S	S	.	.	S	Bend	trans	-77.2	153.7	178.2	-70.5	-166.1	176.6	163.2	0	112.4	M25 K63 V64 N65 M69 R77 F78	M25-K67 HydrophobicContact CE-CB 4.48Å; M25-K67 HydrophobicContact CE-CD 3.49Å; M25-K67 VanDerWaalsContact CE-CD 3.49Å; K63-K67 WeakPolarHBondContact O-CD 3.45Å; K63-K67 WeakPolarHBondContact O-CE 3.36Å; K63-K67 PolarHBondContact O-NZ 3.47Å; V64-K67 WeakPolarHBondContact O-CB 2.97Å; V64-K67 PolarHBondContact O-N 2.96Å; N65-K67 PolarHBondContact O-N 3.09Å; K67-M69 PolarHBondContact O-N 3.05Å; K67-R77 CarbonylContact O-C 3.46Å; K67-R77 WeakPolarHBondContact O-CA 3.1Å; K67-R77 WeakPolarHBondContact O-CB 3.46Å; K67-F78 HydrophobicContact CB-CD2 4.47Å; K67-F78 WeakPolarHBondContact O-CD2 3.03Å; K67-F78 PolarHBondContact O-N 2.87Å
68	S	84.8	Confident	84.5	Confident	79 Å²	79	47.9 Å²	47.9	55%	0.552	28%	0.275	S	S	*	.	B	Isolated β-bridge	trans	-60.5	131.3	174.1	-57.7	0	0	0	0	110.8	P70	S68-P70 WeakPolarHBondContact O-CD 3.12Å
69	M	87	Confident	84.6	Confident	9 Å²	9	49.8 Å²	49.8	4%	0.044	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-78	120.7	178.1	-169.9	177.8	-51.9	0	0	109.5	M6 M13 F17 A21 K67 G71 A72 T76 F78	M6-M69 HydrophobicContact CE-CE 3.11Å; M6-M69 HydrophobicContact CE-SD 4.05Å; M13-M69 HydrophobicContact CE-SD 3.8Å; M13-M69 HydrophobicContact SD-SD 3.83Å; F17-M69 HydrophobicContact CE1-CG 4.35Å; F17-M69 HydrophobicContact CE1-SD 3.69Å; F17-M69 HydrophobicContact CZ-SD 4.44Å; A21-M69 HydrophobicContact CB-CG 4.21Å; K67-M69 PolarHBondContact O-N 3.05Å; M69-G71 PolarHBondContact O-N 3.17Å; M69-A72 HydrophobicContact CB-CB 3.92Å; M69-A72 HydrophobicContact CG-CB 4.18Å; M69-A72 PolarHBondContact O-N 2.87Å; M69-A72 HydrophobicContact SD-CB 4.31Å; M69-T76 WeakPolarHBondContact CB-O 3.23Å; M69-T76 PolarHBondContact N-O 3.07Å; M69-F78 HydrophobicContact CB-CD2 4.32Å; M69-F78 HydrophobicContact CB-CE2 4.17Å; M69-F78 HydrophobicContact CB-CZ 4.48Å; M69-F78 HydrophobicContact CE-CD1 4.21Å; M69-F78 HydrophobicContact CE-CE1 4.43Å; M69-F78 HydrophobicContact CG-CE1 4.26Å; M69-F78 HydrophobicContact CG-CE2 4.15Å; M69-F78 HydrophobicContact CG-CZ 3.96Å
70	P	83.9	Confident	84.7	Confident	43 Å²	43	45.8 Å²	45.8	28%	0.279	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	128.7	-178	26.9	-33.4	0	0	0	110.4	A21 T24 S68 A72	A21-P70 HydrophobicContact CB-CG 4.15Å; T24-P70 HydrophobicContact CG2-CB 4.12Å; T24-P70 HydrophobicContact CG2-CG 3.97Å; S68-P70 WeakPolarHBondContact O-CD 3.12Å; P70-A72 VanDerWaalsContact C-N 3.32Å
71	G	80.8	Confident	84.6	Confident	67 Å²	67	49.7 Å²	49.7	69%	0.691	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	6	178.1	0	0	0	0	0	115.2	F17 M69	F17-G71 WeakPolarHBondContact CE2-O 3.33Å; M69-G71 PolarHBondContact O-N 3.17Å
72	A	82.9	Confident	84.5	Confident	16 Å²	16	53.8 Å²	53.8	13%	0.132	30%	0.303	C	S	.	.			trans	-78.6	127.6	173.9	0	0	0	0	0	111.3	Y12 M13 F17 M69 P70 P74 T76	Y12-A72 WeakPolarHBondContact OH-CA 3.42Å; M13-A72 HydrophobicContact CE-CB 3.54Å; F17-A72 HydrophobicContact CZ-CB 4.46Å; M69-A72 HydrophobicContact CB-CB 3.92Å; M69-A72 HydrophobicContact CG-CB 4.18Å; M69-A72 PolarHBondContact O-N 2.87Å; M69-A72 HydrophobicContact SD-CB 4.31Å; P70-A72 VanDerWaalsContact C-N 3.32Å; A72-P74 CarbonylContact C-O 3.56Å; A72-P74 CarbonylContact O-C 3.55Å; A72-T76 VanDerWaalsContact CB-OG1 3.26Å; A72-T76 WeakPolarHBondContact CB-OG1 3.38Å
73	S	79	Confident	84.4	Confident	92 Å²	92	52.2 Å²	52.2	64%	0.643	30%	0.302	S	S	*	.	S	Bend	trans	-127	113.2	168.5	178	0	0	0	0	109	Y12	Y12-S73 WeakPolarHBondContact CE1-O 3.47Å; Y12-S73 VanDerWaalsContact CZ-O 3.3Å; Y12-S73 PolarHBondContact OH-N 2.67Å; Y12-S73 PolarHBondContact OH-O 2.89Å
74	P	81.2	Confident	83.6	Confident	72 Å²	72	50.9 Å²	50.9	47%	0.468	30%	0.303	S	S	.	.	S	Bend	cis	-66.6	164.7	2.3	29.6	-35.8	0	0	0	113	A72 T76	A72-P74 CarbonylContact C-O 3.56Å; A72-P74 CarbonylContact O-C 3.55Å; P74-T76 WeakPolarHBondContact O-CG2 3.42Å; P74-T76 PolarHBondContact O-N 3.3Å
75	P	79.4	Confident	82.1	Confident	129 Å²	129	56.8 Å²	56.8	84%	0.838	33%	0.329	S	S	*	.			trans	-58.6	106.8	176.7	-22.2	32.8	0	0	0	111
76	T	84.9	Confident	80.1	Confident	15 Å²	15	58.7 Å²	58.7	9%	0.092	35%	0.353	C	S	.	.			trans	-106.3	159.9	174.3	65	0	0	0	0	110.4	E10 M13 M69 A72 P74	E10-T76 HydrophobicContact CG-CG2 4.26Å; M13-T76 HydrophobicContact CE-CG2 4.45Å; M69-T76 WeakPolarHBondContact CB-O 3.23Å; M69-T76 PolarHBondContact N-O 3.07Å; A72-T76 VanDerWaalsContact CB-OG1 3.26Å; A72-T76 WeakPolarHBondContact CB-OG1 3.38Å; P74-T76 WeakPolarHBondContact O-CG2 3.42Å; P74-T76 PolarHBondContact O-N 3.3Å
77	R	86.4	Confident	78.3	Confident	78 Å²	78	68.7 Å²	68.7	29%	0.294	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-109.9	148.8	174.1	-68.5	172.4	179.2	-98.5	6.2	109.6	G66 K67 K79 D106	G66-R77 WeakPolarHBondContact O-CD 3.02Å; G66-R77 PolarHBondContact O-NH1 3.17Å; K67-R77 CarbonylContact O-C 3.46Å; K67-R77 WeakPolarHBondContact O-CA 3.1Å; K67-R77 WeakPolarHBondContact O-CB 3.46Å; R77-K79 PolarHBondContact O-N 2.97Å; R77-D106 IonicContact NH1-OD1 2.87Å; R77-D106 PolarHBondContact NH1-OD1 2.87Å
78	F	88	Confident	76.4	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.009	41%	0.407	C	S	.	.			trans	-61.3	120.7	170.6	-74.3	-82.4	0	0	0	109.6	M6 A21 F22 M25 V64 N65 G66 K67 M69 L80	M6-F78 HydrophobicContact CE-CD1 3.59Å; M6-F78 HydrophobicContact CE-CE1 3.88Å; M6-F78 HydrophobicContact SD-CD1 4.27Å; A21-F78 HydrophobicContact CB-CE1 4.16Å; A21-F78 HydrophobicContact CB-CZ 3.78Å; F22-F78 HydrophobicContact CD2-CE1 4.29Å; F22-F78 HydrophobicContact CE2-CE1 4.13Å; F22-F78 HydrophobicContact CZ-CD1 4.35Å; F22-F78 HydrophobicContact CZ-CE1 4.31Å; M25-F78 HydrophobicContact CG-CE2 3.98Å; M25-F78 HydrophobicContact CG-CZ 4.15Å; M25-F78 HydrophobicContact SD-CE2 4.42Å; V64-F78 HydrophobicContact CG1-CB 4.03Å; V64-F78 HydrophobicContact CG1-CD1 3.73Å; V64-F78 HydrophobicContact CG1-CD2 3.68Å; V64-F78 HydrophobicContact CG1-CE1 4.01Å; V64-F78 HydrophobicContact CG1-CE2 3.95Å; V64-F78 HydrophobicContact CG1-CG 3.55Å; V64-F78 HydrophobicContact CG1-CZ 4.1Å; V64-F78 VanDerWaalsContact O-CB 3.26Å; V64-F78 WeakPolarHBondContact O-CB 3.4Å; N65-F78 PolarHBondContact OD1-O 2.84Å; G66-F78 PolarHBondContact N-O 2.8Å; K67-F78 HydrophobicContact CB-CD2 4.47Å; K67-F78 WeakPolarHBondContact O-CD2 3.03Å; K67-F78 PolarHBondContact O-N 2.87Å; M69-F78 HydrophobicContact CB-CD2 4.32Å; M69-F78 HydrophobicContact CB-CE2 4.17Å; M69-F78 HydrophobicContact CB-CZ 4.48Å; M69-F78 HydrophobicContact CE-CD1 4.21Å; M69-F78 HydrophobicContact CE-CE1 4.43Å; M69-F78 HydrophobicContact CG-CE1 4.26Å; M69-F78 HydrophobicContact CG-CE2 4.15Å; M69-F78 HydrophobicContact CG-CZ 3.96Å; F78-L80 HydrophobicContact CB-CG 4.32Å
79	K	88.1	Confident	74.6	Confident	82 Å²	82	75.5 Å²	75.5	36%	0.357	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	93	174.6	-174.7	-176.5	177.5	178.6	0	108.8	W5 M6 G7 N8 R77	W5-K79 HydrophobicContact CH2-CD 4.16Å; W5-K79 HydrophobicContact CZ3-CD 4.1Å; W5-K79 HydrophobicContact CZ3-CG 4.04Å; M6-K79 CarbonylContact C-O 3.57Å; M6-K79 VanDerWaalsContact CA-O 3.28Å; M6-K79 WeakPolarHBondContact CA-O 3.39Å; G7-K79 PolarHBondContact N-O 2.92Å; N8-K79 HydrophobicContact CB-CB 4.48Å; N8-K79 WeakPolarHBondContact OD1-CD 3.3Å; R77-K79 PolarHBondContact O-N 2.97Å
80	L	88.4	Confident	73	Confident	0 Å²	0	79 Å²	79	0%	0	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	138.8	-173.7	-53.5	-178.2	0	0	0	110.9	W5 M6 F22 C60 L61 V64 N65 F78	W5-L80 CarbonylContact O-C 3.49Å; W5-L80 WeakPolarHBondContact O-CA 3.47Å; M6-L80 HydrophobicContact CB-CD2 3.71Å; M6-L80 HydrophobicContact CG-CD2 3.73Å; M6-L80 HydrophobicContact SD-CD2 4.06Å; F22-L80 HydrophobicContact CE1-CD1 4.06Å; F22-L80 HydrophobicContact CE1-CD2 4.4Å; F22-L80 HydrophobicContact CZ-CD1 4.27Å; F22-L80 HydrophobicContact CZ-CD2 3.78Å; C60-L80 HydrophobicContact CB-CD1 4.25Å; L61-L80 HydrophobicContact CD2-CB 3.8Å; V64-L80 HydrophobicContact CB-CD1 3.89Å; V64-L80 HydrophobicContact CG1-CD1 3.9Å; N65-L80 HydrophobicContact CB-CB 4.18Å; N65-L80 HydrophobicContact CB-CD1 4.5Å; N65-L80 HydrophobicContact CB-CG 4.47Å; N65-L80 PolarHBondContact ND2-O 3.12Å; N65-L80 PolarHBondContact OD1-N 2.73Å; N65-L80 PolarHBondContact OD1-O 3.47Å; F78-L80 HydrophobicContact CB-CG 4.32Å
81	N	87.5	Confident	71.8	Confident	82 Å²	82	79.2 Å²	79.2	44%	0.439	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	158.3	169.8	-69.3	-54	0	0	0	109.7	L4 W5 A83	L4-N81 CarbonylContact C-O 3.37Å; L4-N81 WeakPolarHBondContact CA-O 3.36Å; W5-N81 HydrophobicContact CB-CB 4.44Å; W5-N81 HydrophobicContact CE3-CB 3.87Å; W5-N81 WeakPolarHBondContact CZ3-ND2 3.42Å; W5-N81 PolarHBondContact N-O 3.07Å; W5-N81 PolarHBondContact O-N 2.91Å; N81-A83 PolarHBondContact O-N 3.2Å
82	R	84.8	Confident	71.1	Confident	96 Å²	96	83.1 Å²	83.1	36%	0.362	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	128.1	168.9	-73.4	-175.3	160.4	-121.6	0.9	109.2	E54 E58 L61 T84	E54-R82 IonicContact OE1-CZ 2.74Å; E54-R82 IonicContact OE1-NH1 3.05Å; E54-R82 PolarHBondContact OE1-NH1 3.04Å; E54-R82 IonicContact OE1-NH2 3.33Å; E54-R82 PolarHBondContact OE1-NH2 3.49Å; E58-R82 IonicContact OE1-CZ 3.34Å; E58-R82 IonicContact OE1-NH2 2.83Å; E58-R82 PolarHBondContact OE1-NH2 3.11Å; L61-R82 HydrophobicContact CD1-CG 3.55Å; R82-T84 PolarHBondContact O-N 3.4Å
83	A	79.4	Confident	70.9	Confident	20 Å²	20	85.3 Å²	85.3	17%	0.165	47%	0.469	C	S	.	.			trans	-83.1	107.7	175.8	0	0	0	0	0	109.8	T3 W5 F48 N81 F85	T3-A83 HydrophobicContact CG2-CB 3.89Å; T3-A83 VanDerWaalsContact O-CB 3.24Å; T3-A83 WeakPolarHBondContact O-CB 3.36Å; T3-A83 PolarHBondContact O-N 2.92Å; W5-A83 HydrophobicContact CB-CB 4.22Å; F48-A83 HydrophobicContact CD1-CB 3.68Å; F48-A83 HydrophobicContact CE1-CB 3.78Å; N81-A83 PolarHBondContact O-N 3.2Å; A83-F85 HydrophobicContact CB-CE2 4.48Å
84	T	67.3	Low	71.2	Confident	81 Å²	81	82.6 Å²	82.6	50%	0.497	45%	0.445	S	S	.	.			trans	-92.1	106	167	51.6	0	0	0	0	108.5	R82 G86	R82-T84 PolarHBondContact O-N 3.4Å; T84-G86 PolarHBondContact O-N 3.23Å
85	F	56.6	Low	71.6	Confident	126 Å²	126	79.8 Å²	79.8	55%	0.553	43%	0.428	S	S	*	.			trans	-71.5	95.5	172.9	-77.1	-83.8	0	0	0	109.6	T3 F48 A83	T3-F85 HydrophobicContact CG2-CE2 3.8Å; T3-F85 HydrophobicContact CG2-CZ 4.14Å; F48-F85 HydrophobicContact CD1-CZ 4.24Å; F48-F85 HydrophobicContact CG-CZ 4.38Å; A83-F85 HydrophobicContact CB-CE2 4.48Å
86	G	44.6	Very low	72.1	Confident	60 Å²	60	73.7 Å²	73.7	62%	0.619	39%	0.388	S	S	*	.	S	Bend	trans	86.3	128.1	170.9	0	0	0	0	0	114.5	T84 Q88	T84-G86 PolarHBondContact O-N 3.23Å; G86-Q88 VanDerWaalsContact C-N 3.3Å; G86-Q88 PolarHBondContact O-N 3.29Å
87	K	44	Very low	72.5	Confident	213 Å²	213	75.5 Å²	75.5	93%	0.926	40%	0.395	S	S	*	.			trans	27.2	52.9	160.6	-69.4	-173.4	173.8	-174.2	0	116.8	E89	K87-E89 PolarHBondContact O-N 3.03Å
88	Q	45.3	Very low	72.8	Confident	127 Å²	127	71.8 Å²	71.8	59%	0.593	38%	0.381	S	S	*	.			trans	-75.4	116	139	-89.9	-178.1	6.7	0	0	104.4	G86 A90	G86-Q88 VanDerWaalsContact C-N 3.3Å; G86-Q88 PolarHBondContact O-N 3.29Å; Q88-A90 PolarHBondContact O-N 3.39Å
89	E	46.2	Very low	72.9	Confident	175 Å²	175	71.9 Å²	71.9	82%	0.818	38%	0.382	S	S	*	.			trans	-31.7	117.1	149.2	-65.1	-81.1	136.1	0	0	105.5	K87 G91	K87-E89 PolarHBondContact O-N 3.03Å; E89-G91 PolarHBondContact O-N 3.48Å
90	A	54.4	Low	73	Confident	84 Å²	84	71.5 Å²	71.5	69%	0.694	38%	0.384	S	S	*	.			trans	-63.8	77.1	158.9	0	0	0	0	0	104.1	Q88 Q92	Q88-A90 PolarHBondContact O-N 3.39Å; A90-Q92 PolarHBondContact O-N 3.46Å
91	G	58.6	Low	73	Confident	46 Å²	46	71.8 Å²	71.8	47%	0.474	39%	0.386	S	S	.	.			trans	-48.5	140.6	174.8	0	0	0	0	0	105.7	E89 M93	E89-G91 PolarHBondContact O-N 3.48Å; G91-M93 WeakPolarHBondContact O-CG 3.47Å; G91-M93 PolarHBondContact O-N 2.89Å
92	Q	66.9	Low	73	Confident	149 Å²	149	69 Å²	69	70%	0.696	37%	0.372	S	S	*	.			trans	-42.2	107	-168.8	-63.8	-173.4	17.5	0	0	109.7	A90 F94	A90-Q92 PolarHBondContact O-N 3.46Å; Q92-F94 HydrophobicContact CB-CE2 4.22Å; Q92-F94 HydrophobicContact CB-CZ 4.05Å; Q92-F94 WeakPolarHBondContact O-CD2 3.46Å; Q92-F94 WeakPolarHBondContact O-CE2 3.37Å
93	M	77.4	Confident	73.1	Confident	62 Å²	62	69.2 Å²	69.2	31%	0.305	39%	0.385	S	S	.	.			trans	-83	130.6	-179.5	-72.5	-172.9	167.7	0	0	107.2	G91 S95 N173	G91-M93 WeakPolarHBondContact O-CG 3.47Å; G91-M93 PolarHBondContact O-N 2.89Å; M93-S95 PolarHBondContact O-N 3.32Å; M93-N173 PolarHBondContact O-ND2 3.05Å; M93-N173 PolarHBondContact O-OD1 2.63Å; M93-N173 VanDerWaalsContact O-OD1 3.08Å
94	F	86.1	Confident	73.4	Confident	35 Å²	35	76 Å²	76	15%	0.154	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	100.5	-177.5	-68	-77.7	0	0	0	108.3	Q92 F142 E145 Q148	Q92-F94 HydrophobicContact CB-CE2 4.22Å; Q92-F94 HydrophobicContact CB-CZ 4.05Å; Q92-F94 WeakPolarHBondContact O-CD2 3.46Å; Q92-F94 WeakPolarHBondContact O-CE2 3.37Å; F94-F142 HydrophobicContact CB-CB 4.49Å; F94-F142 PolarHBondContact N-O 2.85Å; F94-F142 PolarHBondContact O-N 3.37Å; F94-E145 HydrophobicContact CD1-CB 3.65Å; F94-E145 HydrophobicContact CD1-CG 3.68Å; F94-E145 HydrophobicContact CD2-CB 4.07Å; F94-E145 HydrophobicContact CE1-CB 3.46Å; F94-E145 VanDerWaalsContact CE1-CB 3.46Å; F94-E145 HydrophobicContact CE1-CG 3.58Å; F94-E145 HydrophobicContact CE2-CB 3.88Å; F94-E145 HydrophobicContact CG-CB 3.96Å; F94-E145 HydrophobicContact CG-CG 4.39Å; F94-E145 HydrophobicContact CZ-CB 3.58Å; F94-E145 HydrophobicContact CZ-CG 4.2Å; F94-Q148 HydrophobicContact CB-CB 3.84Å; F94-Q148 HydrophobicContact CB-CG 4.12Å
95	S	89	Confident	74.4	Confident	14 Å²	14	72.2 Å²	72.2	10%	0.098	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	128.6	-175.8	-56.3	0	0	0	0	110.7	M93 V140 Q148 A171 N173	M93-S95 PolarHBondContact O-N 3.32Å; S95-V140 CarbonylContact C-O 3.51Å; S95-V140 WeakPolarHBondContact CA-O 3.43Å; S95-Q148 VanDerWaalsContact C-NE2 3.27Å; S95-Q148 PolarHBondContact O-NE2 3.15Å; S95-A171 WeakPolarHBondContact O-CB 3.29Å; S95-A171 PolarHBondContact O-N 3.17Å; S95-N173 PolarHBondContact OG-OD1 2.91Å
96	L	90.9	Very high	75.8	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.6	175.3	-169.3	102.3	0	0	0	109.1	V98 F114 F139 V140 F142 Q148 L152 L168	L96-V98 HydrophobicContact CD2-CG2 4.21Å; L96-F114 HydrophobicContact CD2-CE1 4.49Å; L96-F139 CarbonylContact O-C 3.2Å; L96-F139 VanDerWaalsContact O-CA 3.27Å; L96-F139 WeakPolarHBondContact O-CA 3.42Å; L96-V140 PolarHBondContact N-O 2.81Å; L96-V140 PolarHBondContact O-N 3.36Å; L96-F142 HydrophobicContact CB-CE2 4.21Å; L96-Q148 HydrophobicContact CB-CG 4.31Å; L96-Q148 HydrophobicContact CD1-CG 4Å; L96-L152 HydrophobicContact CD1-CB 3.76Å; L96-L152 HydrophobicContact CD1-CD1 3.96Å; L96-L152 HydrophobicContact CD1-CG 4.37Å; L96-L168 HydrophobicContact CD2-CB 4.02Å; L96-L168 HydrophobicContact CD2-CD1 3.93Å; L96-L168 HydrophobicContact CD2-CD2 3.73Å; L96-L168 HydrophobicContact CD2-CG 4.09Å
97	F	92.6	Very high	77.8	Confident	54 Å²	54	67.1 Å²	67.1	24%	0.237	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	133	170.9	177.8	-98.4	0	0	0	109.6	C137 F139 L168 S169 A171	F97-C137 HydrophobicContact CE2-CB 3.61Å; F97-C137 HydrophobicContact CZ-CB 3.46Å; F97-C137 VanDerWaalsContact CZ-CB 3.46Å; F97-F139 HydrophobicContact CB-CD1 4.4Å; F97-F139 HydrophobicContact CB-CE1 4.27Å; F97-F139 HydrophobicContact CD2-CD1 4.17Å; F97-F139 AromaticContact CD2-CE1 3.62Å; F97-F139 HydrophobicContact CD2-CE1 3.62Å; F97-F139 AromaticContact CD2-CZ 3.84Å; F97-F139 HydrophobicContact CD2-CZ 3.84Å; F97-F139 HydrophobicContact CE2-CZ 4.32Å; F97-F139 HydrophobicContact CG-CE1 4.44Å; F97-L168 CarbonylContact O-C 3.5Å; F97-L168 WeakPolarHBondContact O-CA 3.35Å; F97-S169 PolarHBondContact N-O 3.34Å; F97-S169 PolarHBondContact O-N 3.01Å; F97-A171 HydrophobicContact CB-CB 4.22Å
98	V	91.9	Very high	79.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	111.3	176.7	-171.3	0	0	0	0	107.8	L96 L101 L110 F114 C137 G138 V140 L166 L168	L96-V98 HydrophobicContact CD2-CG2 4.21Å; V98-L101 HydrophobicContact CG1-CD1 4.29Å; V98-L101 HydrophobicContact CG1-CD2 3.74Å; V98-L101 HydrophobicContact CG1-CG 4.09Å; V98-L110 HydrophobicContact CB-CD1 4.44Å; V98-L110 HydrophobicContact CG1-CD1 4.1Å; V98-L110 HydrophobicContact CG2-CD1 4.37Å; V98-F114 HydrophobicContact CG2-CE2 4.1Å; V98-F114 HydrophobicContact CG2-CZ 4.07Å; V98-C137 CarbonylContact O-C 3.56Å; V98-C137 WeakPolarHBondContact O-CA 3.4Å; V98-G138 PolarHBondContact N-O 3.01Å; V98-G138 PolarHBondContact O-N 3.27Å; V98-V140 HydrophobicContact CG2-CB 4.46Å; V98-V140 HydrophobicContact CG2-CG2 3.7Å; V98-L166 HydrophobicContact CG1-CD2 3.89Å; V98-L168 HydrophobicContact CB-CD2 4.07Å; V98-L168 HydrophobicContact CG1-CD2 3.75Å; V98-L168 HydrophobicContact CG2-CD2 3.79Å
99	G	90.9	Very high	81.9	Confident	4 Å²	4	55.5 Å²	55.5	4%	0.041	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	174.3	175.2	0	0	0	0	0	112.4	L101 R167	G99-L101 PolarHBondContact O-N 2.93Å; G99-R167 PolarHBondContact N-O 3.06Å; G99-R167 PolarHBondContact O-N 3.24Å; G99-R167 VanDerWaalsContact O-N 3.12Å
100	D	89.7	Confident	83.9	Confident	73 Å²	73	47.2 Å²	47.2	39%	0.39	27%	0.268	S	S	.	.	S	Bend	trans	60.8	28.1	178.5	-62.7	-49.6	0	0	0	114.4	G136 K164 R167	D100-G136 PolarHBondContact N-O 3.33Å; D100-G136 VanDerWaalsContact N-O 3.09Å; D100-K164 HydrophobicContact CB-CB 4.47Å; D100-R167 HydrophobicContact CB-CB 4.43Å; D100-R167 VanDerWaalsContact OD2-CB 3.24Å; D100-R167 WeakPolarHBondContact OD2-CB 3.19Å
101	L	89.5	Confident	85.6	Confident	7 Å²	7	43.5 Å²	43.5	4%	0.037	24%	0.236	C	C	.	.			trans	-69.3	140.2	170.8	-60.1	176.2	0	0	0	110.2	V98 G99 V105 L110 V126 G136 L166	V98-L101 HydrophobicContact CG1-CD1 4.29Å; V98-L101 HydrophobicContact CG1-CD2 3.74Å; V98-L101 HydrophobicContact CG1-CG 4.09Å; G99-L101 PolarHBondContact O-N 2.93Å; L101-V105 HydrophobicContact CD2-CG1 4.34Å; L101-L110 HydrophobicContact CD1-CD1 4.28Å; L101-L110 HydrophobicContact CD1-CD2 4.36Å; L101-L110 HydrophobicContact CD2-CD1 4.16Å; L101-V126 HydrophobicContact CD1-CG2 4.2Å; L101-G136 PolarHBondContact N-O 3.22Å; L101-G136 WeakPolarHBondContact O-CA 3.46Å; L101-L166 HydrophobicContact CD2-CD2 3.35Å
102	T	87.3	Confident	86.9	Confident	24 Å²	24	45.1 Å²	45.1	15%	0.147	23%	0.231	C	C	.	.			trans	-71.4	151.3	168.7	49.9	0	0	0	0	110.3	E104 V105 G162 G163	T102-E104 PolarHBondContact O-N 3.45Å; T102-V105 WeakPolarHBondContact O-CB 3.48Å; T102-V105 PolarHBondContact O-N 3.19Å; T102-V105 WeakPolarHBondContact OG1-CG2 3.19Å; T102-G162 WeakPolarHBondContact OG1-CA 3.05Å; T102-G163 VanDerWaalsContact CG2-N 3.31Å
103	P	86.1	Confident	88	Confident	99 Å²	99	39.1 Å²	39.1	64%	0.643	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.5	-177.8	25.3	-34.8	0	0	0	113.8	V105	P103-V105 VanDerWaalsContact C-N 3.32Å
104	E	85.9	Confident	88.5	Confident	162 Å²	162	36.2 Å²	36.2	76%	0.757	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-13.4	175.4	-60.9	175	-176.9	0	0	113.7	T102 D106	T102-E104 PolarHBondContact O-N 3.45Å; E104-D106 PolarHBondContact O-N 2.83Å
105	V	87.6	Confident	88.6	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.018	19%	0.188	C	C	.	.			trans	-79.1	118.1	-179.7	174.5	0	0	0	0	109.8	L101 T102 P103 M109 L110 V126 L161	L101-V105 HydrophobicContact CD2-CG1 4.34Å; T102-V105 WeakPolarHBondContact O-CB 3.48Å; T102-V105 PolarHBondContact O-N 3.19Å; T102-V105 WeakPolarHBondContact OG1-CG2 3.19Å; P103-V105 VanDerWaalsContact C-N 3.32Å; V105-M109 HydrophobicContact CG1-CB 4.28Å; V105-L110 HydrophobicContact CG1-CB 4.3Å; V105-V126 HydrophobicContact CG1-CG2 4.48Å; V105-L161 HydrophobicContact CG1-CD2 3.82Å; V105-L161 HydrophobicContact CG2-CD2 4.32Å
106	D	86.3	Confident	88.5	Confident	56 Å²	56	41 Å²	41	30%	0.299	21%	0.212	S	C	.	.			trans	-91.1	163.6	171.6	-74.8	-42.5	0	0	0	112.4	R77 E104 G108 M109 L110	R77-D106 IonicContact NH1-OD1 2.87Å; R77-D106 PolarHBondContact NH1-OD1 2.87Å; E104-D106 PolarHBondContact O-N 2.83Å; D106-G108 PolarHBondContact O-N 3.28Å; D106-M109 PolarHBondContact O-N 3.39Å; D106-M109 VanDerWaalsContact O-N 3.07Å; D106-L110 PolarHBondContact O-N 3.3Å
107	D	87.9	Confident	88.3	Confident	22 Å²	22	47.1 Å²	47.1	12%	0.118	24%	0.235	C	C	.	.	H	α-helix	trans	-49.6	-41.7	175.4	-60.8	-15.2	0	0	0	112.7	G66 L110 Y111 V126	G66-D107 VanDerWaalsContact CA-OD2 3.27Å; G66-D107 WeakPolarHBondContact CA-OD2 3.43Å; D107-L110 PolarHBondContact O-N 3.41Å; D107-Y111 WeakPolarHBondContact O-CB 3.4Å; D107-Y111 PolarHBondContact O-N 3.44Å; D107-V126 WeakPolarHBondContact OD1-CA 3.47Å; D107-V126 WeakPolarHBondContact OD1-CB 3.34Å; D107-V126 WeakPolarHBondContact OD1-CG2 3.37Å; D107-V126 PolarHBondContact OD1-N 3.48Å
108	G	85.2	Confident	88.2	Confident	7 Å²	7	45.2 Å²	45.2	7%	0.072	23%	0.226	C	C	.	.	H	α-helix	trans	-65.6	-42.6	179.6	0	0	0	0	0	113.3	R62 D106 Y111 E112	R62-G108 WeakPolarHBondContact O-CA 3.05Å; D106-G108 PolarHBondContact O-N 3.28Å; G108-Y111 PolarHBondContact O-N 3.32Å; G108-E112 VanDerWaalsContact O-CB 3.28Å; G108-E112 WeakPolarHBondContact O-CB 3.17Å; G108-E112 PolarHBondContact O-N 3.38Å
109	M	88.4	Confident	87.7	Confident	90 Å²	90	49.6 Å²	49.6	44%	0.443	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-45	176.5	-67.1	-179.7	71.8	0	0	110.7	V105 D106 Y111 E112 F113 L161	V105-M109 HydrophobicContact CG1-CB 4.28Å; D106-M109 PolarHBondContact O-N 3.39Å; D106-M109 VanDerWaalsContact O-N 3.07Å; M109-Y111 PolarHBondContact O-N 2.78Å; M109-E112 PolarHBondContact O-N 3.23Å; M109-F113 PolarHBondContact O-N 2.76Å; M109-L161 HydrophobicContact CB-CD2 4.09Å
110	L	89.4	Confident	87.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.7	-50.7	175.9	-176.8	66.4	0	0	0	110.2	V98 L101 V105 D106 D107 E112 F113 F114 V126 V140 L161	V98-L110 HydrophobicContact CB-CD1 4.44Å; V98-L110 HydrophobicContact CG1-CD1 4.1Å; V98-L110 HydrophobicContact CG2-CD1 4.37Å; L101-L110 HydrophobicContact CD1-CD1 4.28Å; L101-L110 HydrophobicContact CD1-CD2 4.36Å; L101-L110 HydrophobicContact CD2-CD1 4.16Å; V105-L110 HydrophobicContact CG1-CB 4.3Å; D106-L110 PolarHBondContact O-N 3.3Å; D107-L110 PolarHBondContact O-N 3.41Å; L110-E112 PolarHBondContact O-N 2.89Å; L110-F113 PolarHBondContact O-N 2.74Å; L110-F114 HydrophobicContact CD1-CD2 4.09Å; L110-F114 HydrophobicContact CD1-CE2 3.69Å; L110-F114 HydrophobicContact CG-CD2 4.47Å; L110-F114 HydrophobicContact CG-CE2 4.48Å; L110-F114 VanDerWaalsContact O-CD2 3.31Å; L110-F114 WeakPolarHBondContact O-CD2 3.27Å; L110-F114 PolarHBondContact O-N 2.75Å; L110-V126 HydrophobicContact CB-CG2 4.4Å; L110-V126 HydrophobicContact CD2-CG2 4.03Å; L110-V140 HydrophobicContact CD1-CG2 4.24Å; L110-V140 HydrophobicContact CD2-CG2 4Å; L110-V140 HydrophobicContact CG-CG2 3.97Å; L110-L161 HydrophobicContact CD1-CD1 3.78Å
111	Y	89	Confident	87.2	Confident	7 Å²	7	49 Å²	49	3%	0.027	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-43.9	-179.5	-179.4	-143.5	0	0	0	112.6	L61 R62 D107 G108 M109 F113 F114 Y115 C121	L61-Y111 HydrophobicContact CB-CE1 4.1Å; R62-Y111 HydrophobicContact CB-CD1 4.16Å; R62-Y111 HydrophobicContact CB-CE1 4.28Å; R62-Y111 HydrophobicContact CG-CD1 3.46Å; R62-Y111 VanDerWaalsContact CG-CD1 3.46Å; R62-Y111 HydrophobicContact CG-CE1 3.25Å; R62-Y111 HydrophobicContact CG-CG 4.4Å; D107-Y111 WeakPolarHBondContact O-CB 3.4Å; D107-Y111 PolarHBondContact O-N 3.44Å; G108-Y111 PolarHBondContact O-N 3.32Å; M109-Y111 PolarHBondContact O-N 2.78Å; Y111-F113 PolarHBondContact O-N 2.81Å; Y111-F114 PolarHBondContact O-N 2.79Å; Y111-Y115 HydrophobicContact CE2-CD2 4.01Å; Y111-Y115 AromaticContact CZ-CD2 3.88Å; Y111-Y115 VanDerWaalsContact O-CB 3.22Å; Y111-Y115 WeakPolarHBondContact O-CB 3.27Å; Y111-Y115 PolarHBondContact O-N 3.03Å; Y111-C121 HydrophobicContact CE2-CB 4.04Å; Y111-C121 WeakPolarHBondContact CE2-O 3.33Å; Y111-C121 PolarHBondContact OH-O 3.23Å
112	E	87.7	Confident	86.8	Confident	79 Å²	79	54.3 Å²	54.3	37%	0.369	28%	0.275	S	S	.	.	H	α-helix	trans	-60.8	-42.1	179.5	-176.6	165.4	-161.6	0	0	112.5	G108 M109 L110 F114 Y115 N116	G108-E112 VanDerWaalsContact O-CB 3.28Å; G108-E112 WeakPolarHBondContact O-CB 3.17Å; G108-E112 PolarHBondContact O-N 3.38Å; M109-E112 PolarHBondContact O-N 3.23Å; L110-E112 PolarHBondContact O-N 2.89Å; E112-F114 PolarHBondContact O-N 3.24Å; E112-Y115 PolarHBondContact O-N 2.9Å; E112-N116 WeakPolarHBondContact O-CB 3.48Å; E112-N116 PolarHBondContact O-N 2.79Å; E112-N116 PolarHBondContact O-ND2 3.44Å
113	F	88.9	Confident	86.6	Confident	24 Å²	24	54 Å²	54	11%	0.105	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-45.5	177.2	179.6	-88.1	0	0	0	112.7	M109 L110 Y111 A158 L161 L166	M109-F113 PolarHBondContact O-N 2.76Å; L110-F113 PolarHBondContact O-N 2.74Å; Y111-F113 PolarHBondContact O-N 2.81Å; F113-A158 HydrophobicContact CE1-CB 4.45Å; F113-A158 HydrophobicContact CZ-CB 3.87Å; F113-L161 HydrophobicContact CB-CD1 3.48Å; F113-L161 VanDerWaalsContact CB-CD1 3.48Å; F113-L161 HydrophobicContact CB-CD2 4.11Å; F113-L161 HydrophobicContact CB-CG 3.78Å; F113-L161 HydrophobicContact CD1-CD1 3.48Å; F113-L161 VanDerWaalsContact CD1-CD1 3.48Å; F113-L161 HydrophobicContact CD1-CG 4.29Å; F113-L161 HydrophobicContact CD2-CD1 3.85Å; F113-L161 HydrophobicContact CD2-CG 3.71Å; F113-L161 HydrophobicContact CE1-CD1 4.09Å; F113-L161 HydrophobicContact CE2-CD1 4.38Å; F113-L161 HydrophobicContact CE2-CG 4.28Å; F113-L161 HydrophobicContact CG-CD1 3.33Å; F113-L161 HydrophobicContact CG-CG 3.68Å; F113-L161 HydrophobicContact CZ-CD1 4.49Å; F113-L166 HydrophobicContact CD1-CD1 4.43Å; F113-L166 HydrophobicContact CE1-CD1 3.8Å; F113-L166 HydrophobicContact CZ-CD1 3.99Å
114	F	88.9	Confident	86.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-75.9	-37.3	179.5	-78.3	-81.5	0	0	0	112	L96 V98 L110 Y111 E112 N116 R117 Y118 V140 F142 C155 L161 L168	L96-F114 HydrophobicContact CD2-CE1 4.49Å; V98-F114 HydrophobicContact CG2-CE2 4.1Å; V98-F114 HydrophobicContact CG2-CZ 4.07Å; L110-F114 HydrophobicContact CD1-CD2 4.09Å; L110-F114 HydrophobicContact CD1-CE2 3.69Å; L110-F114 HydrophobicContact CG-CD2 4.47Å; L110-F114 HydrophobicContact CG-CE2 4.48Å; L110-F114 VanDerWaalsContact O-CD2 3.31Å; L110-F114 WeakPolarHBondContact O-CD2 3.27Å; L110-F114 PolarHBondContact O-N 2.75Å; Y111-F114 PolarHBondContact O-N 2.79Å; E112-F114 PolarHBondContact O-N 3.24Å; F114-N116 VanDerWaalsContact C-N 3.3Å; F114-N116 PolarHBondContact O-N 2.89Å; F114-R117 PolarHBondContact O-N 2.75Å; F114-Y118 HydrophobicContact CD1-CD2 4.38Å; F114-Y118 WeakPolarHBondContact O-CA 3.42Å; F114-Y118 PolarHBondContact O-N 3.42Å; F114-V140 HydrophobicContact CB-CG1 4.16Å; F114-V140 HydrophobicContact CD1-CG1 4.36Å; F114-V140 HydrophobicContact CD2-CB 4.46Å; F114-V140 HydrophobicContact CD2-CG1 4.19Å; F114-V140 HydrophobicContact CD2-CG2 3.63Å; F114-V140 HydrophobicContact CE2-CG2 3.68Å; F114-V140 HydrophobicContact CG-CG1 3.97Å; F114-V140 HydrophobicContact CG-CG2 4.25Å; F114-V140 HydrophobicContact CZ-CG2 4.3Å; F114-F142 AromaticContact CD1-CZ 3.91Å; F114-F142 HydrophobicContact CD1-CZ 3.91Å; F114-C155 HydrophobicContact CE1-CB 4.23Å; F114-L161 HydrophobicContact CE2-CD1 4.34Å; F114-L168 HydrophobicContact CZ-CD2 4.1Å
115	Y	87.3	Confident	86.8	Confident	39 Å²	39	47.9 Å²	47.9	15%	0.153	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-38.5	177.4	-175.2	-89	0	0	0	112.1	E58 Y111 E112 R117 Y118 P119	E58-Y115 PolarHBondContact OE2-OH 2.79Å; E58-Y115 VanDerWaalsContact OE2-OH 3.06Å; Y111-Y115 HydrophobicContact CE2-CD2 4.01Å; Y111-Y115 AromaticContact CZ-CD2 3.88Å; Y111-Y115 VanDerWaalsContact O-CB 3.22Å; Y111-Y115 WeakPolarHBondContact O-CB 3.27Å; Y111-Y115 PolarHBondContact O-N 3.03Å; E112-Y115 PolarHBondContact O-N 2.9Å; Y115-R117 PolarHBondContact O-N 3.47Å; Y115-Y118 CarbonylContact O-C 3.32Å; Y115-Y118 VanDerWaalsContact O-C 3.32Å; Y115-Y118 PolarHBondContact O-N 2.68Å; Y115-P119 WeakPolarHBondContact CE2-O 3.44Å
116	N	87.3	Confident	86.9	Confident	112 Å²	112	47.9 Å²	47.9	60%	0.599	24%	0.239	S	C	*	.	H	α-helix	trans	-65	-24.4	178.3	-71.2	-16.9	0	0	0	113.5	E112 F114	E112-N116 WeakPolarHBondContact O-CB 3.48Å; E112-N116 PolarHBondContact O-N 2.79Å; E112-N116 PolarHBondContact O-ND2 3.44Å; F114-N116 VanDerWaalsContact C-N 3.3Å; F114-N116 PolarHBondContact O-N 2.89Å
117	R	87.5	Confident	87.1	Confident	128 Å²	128	47.1 Å²	47.1	48%	0.483	24%	0.236	S	C	.	.	H	α-helix	trans	-97.7	-36.2	176.1	-62.2	175.4	-155.3	-89.6	-4.2	112.1	F114 Y115 C155	F114-R117 PolarHBondContact O-N 2.75Å; Y115-R117 PolarHBondContact O-N 3.47Å; R117-C155 VanDerWaalsContact CD-SG 3.56Å
118	Y	88.7	Confident	87.1	Confident	13 Å²	13	48.9 Å²	48.9	5%	0.051	25%	0.245	C	C	.	.			trans	-132.1	91.8	-175.7	-51.4	-72	0	0	0	109.5	F114 Y115 S120 C121 F142 L147 A151 E154	F114-Y118 HydrophobicContact CD1-CD2 4.38Å; F114-Y118 WeakPolarHBondContact O-CA 3.42Å; F114-Y118 PolarHBondContact O-N 3.42Å; Y115-Y118 CarbonylContact O-C 3.32Å; Y115-Y118 VanDerWaalsContact O-C 3.32Å; Y115-Y118 PolarHBondContact O-N 2.68Å; Y118-S120 PolarHBondContact O-N 2.79Å; Y118-S120 VanDerWaalsContact O-N 3.08Å; Y118-C121 VanDerWaalsContact O-CB 3.24Å; Y118-C121 WeakPolarHBondContact O-CB 3.17Å; Y118-C121 PolarHBondContact O-N 2.82Å; Y118-F142 HydrophobicContact CD2-CE1 4.16Å; Y118-F142 HydrophobicContact CD2-CZ 4.47Å; Y118-F142 HydrophobicContact CG-CE1 4.24Å; Y118-L147 HydrophobicContact CD1-CD2 4.41Å; Y118-A151 HydrophobicContact CD2-CB 4.07Å; Y118-A151 HydrophobicContact CE2-CB 3.53Å; Y118-A151 WeakPolarHBondContact OH-CA 3.16Å; Y118-E154 WeakPolarHBondContact OH-CB 3.26Å; Y118-E154 PolarHBondContact OH-OE2 3.37Å
119	P	82.8	Confident	87.3	Confident	93 Å²	93	52 Å²	52	60%	0.604	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-26.1	-179.7	-27.5	35.8	0	0	0	113.9	Y115 C121	Y115-P119 WeakPolarHBondContact CE2-O 3.44Å; P119-C121 PolarHBondContact O-N 2.78Å
120	S	84.5	Confident	87.1	Confident	60 Å²	60	53.3 Å²	53.3	42%	0.42	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-1.5	177.2	-49.3	0	0	0	0	114.4	Y118 R122 P143	Y118-S120 PolarHBondContact O-N 2.79Å; Y118-S120 VanDerWaalsContact O-N 3.08Å; S120-R122 PolarHBondContact O-N 3.2Å; S120-P143 WeakPolarHBondContact O-CD 3.09Å; S120-P143 WeakPolarHBondContact O-CG 3.26Å
121	C	85.9	Confident	86.7	Confident	4 Å²	4	60.6 Å²	60.6	3%	0.027	31%	0.314	C	S	.	.			trans	-59	126.8	177.9	-178.2	0	0	0	0	111.1	Y111 Y118 P119 V140 F142	Y111-C121 HydrophobicContact CE2-CB 4.04Å; Y111-C121 WeakPolarHBondContact CE2-O 3.33Å; Y111-C121 PolarHBondContact OH-O 3.23Å; Y118-C121 VanDerWaalsContact O-CB 3.24Å; Y118-C121 WeakPolarHBondContact O-CB 3.17Å; Y118-C121 PolarHBondContact O-N 2.82Å; P119-C121 PolarHBondContact O-N 2.78Å; C121-V140 WeakPolarHBondContact SG-CG1 3.22Å; C121-F142 HydrophobicContact CB-CD1 4.45Å; C121-F142 HydrophobicContact CB-CE1 4.11Å
122	R	81.2	Confident	86.2	Confident	119 Å²	119	61.8 Å²	61.8	45%	0.449	33%	0.328	S	S	.	.			trans	-82.3	-28	-177.5	-68.4	-64.7	-173.1	111.3	-1.3	113	S120 Q141	S120-R122 PolarHBondContact O-N 3.2Å; R122-Q141 HydrophobicContact CB-CB 4.31Å; R122-Q141 PolarHBondContact N-O 2.99Å
123	G	83.1	Confident	86.1	Confident	17 Å²	17	62.9 Å²	62.9	18%	0.175	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.3	160.8	179.3	0	0	0	0	0	113.1	V140 Q141	G123-V140 WeakPolarHBondContact O-CA 3.24Å; G123-Q141 PolarHBondContact O-N 3.44Å
124	G	87.8	Confident	86.1	Confident	4 Å²	4	62.9 Å²	62.9	4%	0.041	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	142.7	170.5	0	0	0	0	0	110.4	F139	G124-F139 CarbonylContact C-O 3.6Å; G124-F139 WeakPolarHBondContact CA-O 3.41Å
125	K	88.1	Confident	86.1	Confident	128 Å²	128	69.1 Å²	69.1	56%	0.557	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	120.3	176.7	-177.8	-176.9	178.3	-169.4	0	110.6	G138 F139	K125-G138 CarbonylContact O-C 3.49Å; K125-G138 WeakPolarHBondContact O-CA 3.49Å; K125-F139 PolarHBondContact N-O 2.77Å; K125-F139 PolarHBondContact O-N 2.91Å
126	V	90.2	Very high	86.1	Confident	4 Å²	4	68 Å²	68	2%	0.024	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	140.7	171.6	-177.4	0	0	0	0	109.2	L101 V105 D107 L110 L128 S134 C137	L101-V126 HydrophobicContact CD1-CG2 4.2Å; V105-V126 HydrophobicContact CG1-CG2 4.48Å; D107-V126 WeakPolarHBondContact OD1-CA 3.47Å; D107-V126 WeakPolarHBondContact OD1-CB 3.34Å; D107-V126 WeakPolarHBondContact OD1-CG2 3.37Å; D107-V126 PolarHBondContact OD1-N 3.48Å; L110-V126 HydrophobicContact CB-CG2 4.4Å; L110-V126 HydrophobicContact CD2-CG2 4.03Å; V126-L128 HydrophobicContact CG1-CD2 4.18Å; V126-S134 WeakPolarHBondContact CG1-OG 3.16Å; V126-C137 WeakPolarHBondContact CG1-O 3.41Å
127	V	88.9	Confident	86.3	Confident	40 Å²	40	63.8 Å²	63.8	24%	0.242	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	119.9	175.4	-172.8	0	0	0	0	108	K135 C137 F139	V127-K135 HydrophobicContact CG1-CD 3.77Å; V127-K135 HydrophobicContact CG1-CG 4.32Å; V127-K135 WeakPolarHBondContact O-CB 3.49Å; V127-K135 PolarHBondContact O-N 3.05Å; V127-C137 PolarHBondContact N-O 2.86Å; V127-F139 HydrophobicContact CG2-CD2 3.86Å; V127-F139 HydrophobicContact CG2-CE2 3.49Å; V127-F139 VanDerWaalsContact CG2-CE2 3.49Å
128	L	88.5	Confident	86.5	Confident	59 Å²	59	57.7 Å²	57.7	31%	0.309	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	150.4	174.5	-52.2	-179.2	0	0	0	109.9	V126 N133	V126-L128 HydrophobicContact CG1-CD2 4.18Å; L128-N133 CarbonylContact C-O 3.52Å; L128-N133 VanDerWaalsContact CA-O 3.32Å; L128-N133 WeakPolarHBondContact CA-O 3.42Å
129	D	88.7	Confident	86.6	Confident	73 Å²	73	61 Å²	61	39%	0.39	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-75.8	170.1	170.9	-167	24.8	0	0	0	111.2	M131 G132 N133 K135	D129-M131 PolarHBondContact O-N 3.36Å; D129-M131 VanDerWaalsContact O-N 3.17Å; D129-G132 WeakPolarHBondContact O-CA 3.31Å; D129-G132 PolarHBondContact O-N 2.84Å; D129-N133 PolarHBondContact N-O 2.86Å; D129-K135 HydrophobicContact CB-CD 4.44Å; D129-K135 HydrophobicContact CB-CG 4.09Å
130	S	84.1	Confident	87	Confident	116 Å²	116	56.5 Å²	56.5	81%	0.811	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-29	176.4	61.3	0	0	0	0	112.9	G132	S130-G132 VanDerWaalsContact C-N 3.27Å; S130-G132 PolarHBondContact O-N 2.96Å
131	M	80.9	Confident	87.2	Confident	154 Å²	154	57.3 Å²	57.3	76%	0.759	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	1.3	174.8	-60.5	-168.3	169.6	0	0	113.9	D129 N133	D129-M131 PolarHBondContact O-N 3.36Å; D129-M131 VanDerWaalsContact O-N 3.17Å; M131-N133 VanDerWaalsContact C-N 3.32Å; M131-N133 PolarHBondContact O-N 2.94Å
132	G	80.1	Confident	87.3	Confident	31 Å²	31	57.1 Å²	57.1	32%	0.32	31%	0.305	S	S	.	.	S	Bend	trans	81.2	5.3	179.8	0	0	0	0	0	115.3	D129 S130	D129-G132 WeakPolarHBondContact O-CA 3.31Å; D129-G132 PolarHBondContact O-N 2.84Å; S130-G132 VanDerWaalsContact C-N 3.27Å; S130-G132 PolarHBondContact O-N 2.96Å
133	N	85.3	Confident	87.5	Confident	102 Å²	102	53.2 Å²	53.2	55%	0.545	30%	0.295	S	S	.	.			trans	-82.1	142.6	176.6	-62.9	-46.1	0	0	0	111.1	L128 D129 M131 K135	L128-N133 CarbonylContact C-O 3.52Å; L128-N133 VanDerWaalsContact CA-O 3.32Å; L128-N133 WeakPolarHBondContact CA-O 3.42Å; D129-N133 PolarHBondContact N-O 2.86Å; M131-N133 VanDerWaalsContact C-N 3.32Å; M131-N133 PolarHBondContact O-N 2.94Å; N133-K135 PolarHBondContact O-N 3.21Å
134	S	87.8	Confident	87.7	Confident	25 Å²	25	56.3 Å²	56.3	18%	0.175	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	131	176.6	173	0	0	0	0	111.4	V126 G136	V126-S134 WeakPolarHBondContact CG1-OG 3.16Å; S134-G136 PolarHBondContact O-N 2.79Å; S134-G136 PolarHBondContact OG-N 3.3Å
135	K	88.9	Confident	87.7	Confident	130 Å²	130	60.2 Å²	60.2	57%	0.565	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	3.6	175.4	-59.2	-169.9	77.7	167.9	0	112.7	V127 D129 N133 C137	V127-K135 HydrophobicContact CG1-CD 3.77Å; V127-K135 HydrophobicContact CG1-CG 4.32Å; V127-K135 WeakPolarHBondContact O-CB 3.49Å; V127-K135 PolarHBondContact O-N 3.05Å; D129-K135 HydrophobicContact CB-CD 4.44Å; D129-K135 HydrophobicContact CB-CG 4.09Å; N133-K135 PolarHBondContact O-N 3.21Å; K135-C137 PolarHBondContact O-N 2.83Å
136	G	88.7	Confident	87.8	Confident	16 Å²	16	64.4 Å²	64.4	17%	0.165	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	69.9	21.5	-176.4	0	0	0	0	0	113.5	D100 L101 S134	D100-G136 PolarHBondContact N-O 3.33Å; D100-G136 VanDerWaalsContact N-O 3.09Å; L101-G136 PolarHBondContact N-O 3.22Å; L101-G136 WeakPolarHBondContact O-CA 3.46Å; S134-G136 PolarHBondContact O-N 2.79Å; S134-G136 PolarHBondContact OG-N 3.3Å
137	C	90.8	Very high	87.7	Confident	23 Å²	23	65.9 Å²	65.9	16%	0.155	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	159.6	176.5	62.9	0	0	0	0	111.8	F97 V98 V126 V127 K135	F97-C137 HydrophobicContact CE2-CB 3.61Å; F97-C137 HydrophobicContact CZ-CB 3.46Å; F97-C137 VanDerWaalsContact CZ-CB 3.46Å; V98-C137 CarbonylContact O-C 3.56Å; V98-C137 WeakPolarHBondContact O-CA 3.4Å; V126-C137 WeakPolarHBondContact CG1-O 3.41Å; V127-C137 PolarHBondContact N-O 2.86Å; K135-C137 PolarHBondContact O-N 2.83Å
138	G	91.4	Very high	87.8	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	177.5	-176.2	0	0	0	0	0	112.2	V98 K125	V98-G138 PolarHBondContact N-O 3.01Å; V98-G138 PolarHBondContact O-N 3.27Å; K125-G138 CarbonylContact O-C 3.49Å; K125-G138 WeakPolarHBondContact O-CA 3.49Å
139	F	91.5	Very high	87.9	Confident	82 Å²	82	66.3 Å²	66.3	36%	0.36	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.4	179.1	-61.7	-85.3	0	0	0	109.7	L96 F97 G124 K125 V127 A171	L96-F139 CarbonylContact O-C 3.2Å; L96-F139 VanDerWaalsContact O-CA 3.27Å; L96-F139 WeakPolarHBondContact O-CA 3.42Å; F97-F139 HydrophobicContact CB-CD1 4.4Å; F97-F139 HydrophobicContact CB-CE1 4.27Å; F97-F139 HydrophobicContact CD2-CD1 4.17Å; F97-F139 AromaticContact CD2-CE1 3.62Å; F97-F139 HydrophobicContact CD2-CE1 3.62Å; F97-F139 AromaticContact CD2-CZ 3.84Å; F97-F139 HydrophobicContact CD2-CZ 3.84Å; F97-F139 HydrophobicContact CE2-CZ 4.32Å; F97-F139 HydrophobicContact CG-CE1 4.44Å; G124-F139 CarbonylContact C-O 3.6Å; G124-F139 WeakPolarHBondContact CA-O 3.41Å; K125-F139 PolarHBondContact N-O 2.77Å; K125-F139 PolarHBondContact O-N 2.91Å; V127-F139 HydrophobicContact CG2-CD2 3.86Å; V127-F139 HydrophobicContact CG2-CE2 3.49Å; V127-F139 VanDerWaalsContact CG2-CE2 3.49Å; F139-A171 HydrophobicContact CD1-CB 3.9Å; F139-A171 HydrophobicContact CE1-CB 3.96Å
140	V	90.8	Very high	88.1	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.6	174.8	-179	0	0	0	0	108.4	S95 L96 V98 L110 F114 C121 G123 F142	S95-V140 CarbonylContact C-O 3.51Å; S95-V140 WeakPolarHBondContact CA-O 3.43Å; L96-V140 PolarHBondContact N-O 2.81Å; L96-V140 PolarHBondContact O-N 3.36Å; V98-V140 HydrophobicContact CG2-CB 4.46Å; V98-V140 HydrophobicContact CG2-CG2 3.7Å; L110-V140 HydrophobicContact CD1-CG2 4.24Å; L110-V140 HydrophobicContact CD2-CG2 4Å; L110-V140 HydrophobicContact CG-CG2 3.97Å; F114-V140 HydrophobicContact CB-CG1 4.16Å; F114-V140 HydrophobicContact CD1-CG1 4.36Å; F114-V140 HydrophobicContact CD2-CB 4.46Å; F114-V140 HydrophobicContact CD2-CG1 4.19Å; F114-V140 HydrophobicContact CD2-CG2 3.63Å; F114-V140 HydrophobicContact CE2-CG2 3.68Å; F114-V140 HydrophobicContact CG-CG1 3.97Å; F114-V140 HydrophobicContact CG-CG2 4.25Å; F114-V140 HydrophobicContact CZ-CG2 4.3Å; C121-V140 WeakPolarHBondContact SG-CG1 3.22Å; G123-V140 WeakPolarHBondContact O-CA 3.24Å; V140-F142 HydrophobicContact CB-CE2 4.18Å; V140-F142 HydrophobicContact CG1-CD2 4.41Å; V140-F142 HydrophobicContact CG1-CE1 4.39Å; V140-F142 HydrophobicContact CG1-CE2 3.63Å; V140-F142 HydrophobicContact CG1-CZ 3.62Å
141	Q	88.3	Confident	88.4	Confident	76 Å²	76	63.9 Å²	63.9	36%	0.355	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	130.8	-176.7	-74.5	-176.3	-22.2	0	0	111.9	R122 G123	R122-Q141 HydrophobicContact CB-CB 4.31Å; R122-Q141 PolarHBondContact N-O 2.99Å; G123-Q141 PolarHBondContact O-N 3.44Å
142	F	88.8	Confident	88.9	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	147.2	175	-61.3	-83	0	0	0	110.6	F94 L96 F114 Y118 C121 V140 D144 L147 Q148 A151	F94-F142 HydrophobicContact CB-CB 4.49Å; F94-F142 PolarHBondContact N-O 2.85Å; F94-F142 PolarHBondContact O-N 3.37Å; L96-F142 HydrophobicContact CB-CE2 4.21Å; F114-F142 AromaticContact CD1-CZ 3.91Å; F114-F142 HydrophobicContact CD1-CZ 3.91Å; Y118-F142 HydrophobicContact CD2-CE1 4.16Å; Y118-F142 HydrophobicContact CD2-CZ 4.47Å; Y118-F142 HydrophobicContact CG-CE1 4.24Å; C121-F142 HydrophobicContact CB-CD1 4.45Å; C121-F142 HydrophobicContact CB-CE1 4.11Å; V140-F142 HydrophobicContact CB-CE2 4.18Å; V140-F142 HydrophobicContact CG1-CD2 4.41Å; V140-F142 HydrophobicContact CG1-CE1 4.39Å; V140-F142 HydrophobicContact CG1-CE2 3.63Å; V140-F142 HydrophobicContact CG1-CZ 3.62Å; F142-D144 VanDerWaalsContact C-N 3.3Å; F142-L147 HydrophobicContact CD1-CB 4.38Å; F142-Q148 HydrophobicContact CB-CB 4.34Å; F142-Q148 HydrophobicContact CD2-CB 4.11Å; F142-Q148 HydrophobicContact CD2-CG 4.26Å; F142-Q148 HydrophobicContact CG-CB 4.46Å; F142-A151 HydrophobicContact CE1-CB 4.39Å; F142-A151 HydrophobicContact CE2-CB 4.14Å; F142-A151 HydrophobicContact CZ-CB 3.8Å
143	P	85.4	Confident	89.4	Confident	37 Å²	37	62.5 Å²	62.5	24%	0.24	30%	0.296	C	S	.	.	S	Bend	trans	-74.9	-23.1	174	30.4	-32.8	0	0	0	112.2	S120	S120-P143 WeakPolarHBondContact O-CD 3.09Å; S120-P143 WeakPolarHBondContact O-CG 3.26Å
144	D	87.1	Confident	89.6	Confident	83 Å²	83	62.6 Å²	62.6	44%	0.444	29%	0.294	S	S	.	.			trans	-124.1	136.7	-174.4	-59.3	-57.2	0	0	0	112.2	F142 R146 L147 Q148	F142-D144 VanDerWaalsContact C-N 3.3Å; D144-R146 VanDerWaalsContact C-N 3.29Å; D144-R146 PolarHBondContact O-N 2.96Å; D144-L147 HydrophobicContact CB-CB 4.23Å; D144-L147 HydrophobicContact CB-CD1 4.11Å; D144-L147 HydrophobicContact CB-CG 4.07Å; D144-L147 PolarHBondContact O-N 3.29Å; D144-Q148 PolarHBondContact O-N 2.85Å; D144-Q148 VanDerWaalsContact O-N 3.07Å
145	E	87.6	Confident	89.7	Confident	86 Å²	86	61.5 Å²	61.5	40%	0.402	29%	0.286	S	S	.	.	H	α-helix	trans	-62.7	-37.7	175.6	-163.6	-173.8	169	0	0	111.7	F94 L147 Q148 K149	F94-E145 HydrophobicContact CD1-CB 3.65Å; F94-E145 HydrophobicContact CD1-CG 3.68Å; F94-E145 HydrophobicContact CD2-CB 4.07Å; F94-E145 HydrophobicContact CE1-CB 3.46Å; F94-E145 VanDerWaalsContact CE1-CB 3.46Å; F94-E145 HydrophobicContact CE1-CG 3.58Å; F94-E145 HydrophobicContact CE2-CB 3.88Å; F94-E145 HydrophobicContact CG-CB 3.96Å; F94-E145 HydrophobicContact CG-CG 4.39Å; F94-E145 HydrophobicContact CZ-CB 3.58Å; F94-E145 HydrophobicContact CZ-CG 4.2Å; E145-L147 VanDerWaalsContact C-N 3.3Å; E145-L147 PolarHBondContact O-N 2.78Å; E145-Q148 WeakPolarHBondContact O-CB 3.48Å; E145-Q148 PolarHBondContact O-N 2.82Å; E145-K149 HydrophobicContact CG-CD 4.46Å; E145-K149 PolarHBondContact O-N 3.1Å; E145-K149 WeakPolarHBondContact OE1-CE 3.4Å; E145-K149 IonicContact OE1-NZ 3.87Å; E145-K149 PolarHBondContact OE1-NZ 3.28Å
146	R	89.8	Confident	89.7	Confident	215 Å²	215	59.9 Å²	59.9	81%	0.811	28%	0.281	S	S	*	.	H	α-helix	trans	-61.6	-41.6	179.6	-65	-179.3	-179.8	177.1	-0.3	111	D144 R150	D144-R146 VanDerWaalsContact C-N 3.29Å; D144-R146 PolarHBondContact O-N 2.96Å; R146-R150 WeakPolarHBondContact O-CB 3.32Å; R146-R150 WeakPolarHBondContact O-CG 3.48Å; R146-R150 PolarHBondContact O-N 3.14Å
147	L	89.3	Confident	89.6	Confident	35 Å²	35	60.8 Å²	60.8	18%	0.183	29%	0.29	C	S	.	.	H	α-helix	trans	-69	-39.9	176	-69.1	177.6	0	0	0	111.3	Y118 F142 D144 E145 R150 A151	Y118-L147 HydrophobicContact CD1-CD2 4.41Å; F142-L147 HydrophobicContact CD1-CB 4.38Å; D144-L147 HydrophobicContact CB-CB 4.23Å; D144-L147 HydrophobicContact CB-CD1 4.11Å; D144-L147 HydrophobicContact CB-CG 4.07Å; D144-L147 PolarHBondContact O-N 3.29Å; E145-L147 VanDerWaalsContact C-N 3.3Å; E145-L147 PolarHBondContact O-N 2.78Å; L147-R150 PolarHBondContact O-N 3.39Å; L147-A151 VanDerWaalsContact O-CB 3.25Å; L147-A151 WeakPolarHBondContact O-CB 3.48Å; L147-A151 PolarHBondContact O-N 2.95Å
148	Q	90.3	Very high	89.3	Confident	10 Å²	10	60.5 Å²	60.5	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-59.6	-47.3	174.7	-174.5	-159.6	25.1	0	0	111.9	F94 S95 L96 F142 D144 E145 A151 L152 L170	F94-Q148 HydrophobicContact CB-CB 3.84Å; F94-Q148 HydrophobicContact CB-CG 4.12Å; S95-Q148 VanDerWaalsContact C-NE2 3.27Å; S95-Q148 PolarHBondContact O-NE2 3.15Å; L96-Q148 HydrophobicContact CB-CG 4.31Å; L96-Q148 HydrophobicContact CD1-CG 4Å; F142-Q148 HydrophobicContact CB-CB 4.34Å; F142-Q148 HydrophobicContact CD2-CB 4.11Å; F142-Q148 HydrophobicContact CD2-CG 4.26Å; F142-Q148 HydrophobicContact CG-CB 4.46Å; D144-Q148 PolarHBondContact O-N 2.85Å; D144-Q148 VanDerWaalsContact O-N 3.07Å; E145-Q148 WeakPolarHBondContact O-CB 3.48Å; E145-Q148 PolarHBondContact O-N 2.82Å; Q148-A151 PolarHBondContact O-N 2.84Å; Q148-L152 WeakPolarHBondContact O-CB 3.45Å; Q148-L152 PolarHBondContact O-N 2.76Å; Q148-L170 HydrophobicContact CG-CD2 4.43Å
149	K	90.7	Very high	88.9	Confident	99 Å²	99	65.6 Å²	65.6	43%	0.43	32%	0.32	S	S	.	.	H	α-helix	trans	-64	-44.8	178	-73.8	179.6	-178.6	166.4	0	111.8	E145 A151 L152 D153	E145-K149 HydrophobicContact CG-CD 4.46Å; E145-K149 PolarHBondContact O-N 3.1Å; E145-K149 WeakPolarHBondContact OE1-CE 3.4Å; E145-K149 IonicContact OE1-NZ 3.87Å; E145-K149 PolarHBondContact OE1-NZ 3.28Å; K149-A151 VanDerWaalsContact C-N 3.34Å; K149-A151 PolarHBondContact O-N 3.48Å; K149-L152 WeakPolarHBondContact O-CB 3.5Å; K149-L152 PolarHBondContact O-N 3.47Å; K149-D153 PolarHBondContact O-N 2.96Å
150	R	92.3	Very high	88.2	Confident	137 Å²	137	64.5 Å²	64.5	52%	0.517	33%	0.331	S	S	.	.	H	α-helix	trans	-60.6	-43.1	174.2	-75.8	-170.6	65.9	-169.9	-1.7	112.4	R146 L147 L152 D153 E154	R146-R150 WeakPolarHBondContact O-CB 3.32Å; R146-R150 WeakPolarHBondContact O-CG 3.48Å; R146-R150 PolarHBondContact O-N 3.14Å; L147-R150 PolarHBondContact O-N 3.39Å; R150-L152 VanDerWaalsContact C-N 3.32Å; R150-L152 PolarHBondContact O-N 2.85Å; R150-D153 PolarHBondContact O-N 3.08Å; R150-E154 IonicContact CZ-OE1 2.73Å; R150-E154 IonicContact NE-OE1 3.47Å; R150-E154 PolarHBondContact NE-OE1 3.31Å; R150-E154 IonicContact NH2-OE1 3.94Å; R150-E154 PolarHBondContact NH2-OE1 3.37Å; R150-E154 IonicContact NH2-OE2 3.93Å; R150-E154 VanDerWaalsContact O-CB 3.26Å; R150-E154 WeakPolarHBondContact O-CB 3.5Å; R150-E154 WeakPolarHBondContact O-CG 3.37Å; R150-E154 PolarHBondContact O-N 2.99Å
151	A	90.6	Very high	87.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-38.7	175.6	0	0	0	0	0	111.8	Y118 F142 L147 Q148 K149 C155 L168	Y118-A151 HydrophobicContact CD2-CB 4.07Å; Y118-A151 HydrophobicContact CE2-CB 3.53Å; Y118-A151 WeakPolarHBondContact OH-CA 3.16Å; F142-A151 HydrophobicContact CE1-CB 4.39Å; F142-A151 HydrophobicContact CE2-CB 4.14Å; F142-A151 HydrophobicContact CZ-CB 3.8Å; L147-A151 VanDerWaalsContact O-CB 3.25Å; L147-A151 WeakPolarHBondContact O-CB 3.48Å; L147-A151 PolarHBondContact O-N 2.95Å; Q148-A151 PolarHBondContact O-N 2.84Å; K149-A151 VanDerWaalsContact C-N 3.34Å; K149-A151 PolarHBondContact O-N 3.48Å; A151-C155 WeakPolarHBondContact O-CA 3.18Å; A151-C155 WeakPolarHBondContact O-CB 3.28Å; A151-C155 PolarHBondContact O-N 3.23Å; A151-L168 VanDerWaalsContact O-CD1 3.32Å; A151-L168 WeakPolarHBondContact O-CD1 3.38Å
152	L	91.1	Very high	87.1	Confident	30 Å²	30	62.7 Å²	62.7	16%	0.157	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-48	173.9	179.4	62.8	0	0	0	110.8	L96 Q148 K149 R150 Q156 L168 L170	L96-L152 HydrophobicContact CD1-CB 3.76Å; L96-L152 HydrophobicContact CD1-CD1 3.96Å; L96-L152 HydrophobicContact CD1-CG 4.37Å; Q148-L152 WeakPolarHBondContact O-CB 3.45Å; Q148-L152 PolarHBondContact O-N 2.76Å; K149-L152 WeakPolarHBondContact O-CB 3.5Å; K149-L152 PolarHBondContact O-N 3.47Å; R150-L152 VanDerWaalsContact C-N 3.32Å; R150-L152 PolarHBondContact O-N 2.85Å; L152-Q156 VanDerWaalsContact O-CB 3.27Å; L152-Q156 WeakPolarHBondContact O-CB 3.33Å; L152-Q156 PolarHBondContact O-N 2.88Å; L152-L168 VanDerWaalsContact CD1-C 3.49Å; L152-L168 HydrophobicContact CD1-CB 3.59Å; L152-L170 HydrophobicContact CD2-CD2 4.05Å; L152-L170 HydrophobicContact CD2-CG 4.08Å
153	D	90.8	Very high	86.6	Confident	126 Å²	126	66 Å²	66	67%	0.674	37%	0.367	S	S	*	.	H	α-helix	trans	-76	-44.6	-175.7	-63.7	-25.4	0	0	0	112.7	K149 R150	K149-D153 PolarHBondContact O-N 2.96Å; R150-D153 PolarHBondContact O-N 3.08Å
154	E	90.4	Very high	86.6	Confident	104 Å²	104	70 Å²	70	49%	0.486	38%	0.38	S	S	.	.	H	α-helix	trans	-79.3	-32.2	-175	-67.8	172.9	-170.2	0	0	112.9	Y118 R150	Y118-E154 WeakPolarHBondContact OH-CB 3.26Å; Y118-E154 PolarHBondContact OH-OE2 3.37Å; R150-E154 IonicContact CZ-OE1 2.73Å; R150-E154 IonicContact NE-OE1 3.47Å; R150-E154 PolarHBondContact NE-OE1 3.31Å; R150-E154 IonicContact NH2-OE1 3.94Å; R150-E154 PolarHBondContact NH2-OE1 3.37Å; R150-E154 IonicContact NH2-OE2 3.93Å; R150-E154 VanDerWaalsContact O-CB 3.26Å; R150-E154 WeakPolarHBondContact O-CB 3.5Å; R150-E154 WeakPolarHBondContact O-CG 3.37Å; R150-E154 PolarHBondContact O-N 2.99Å
155	C	88.7	Confident	86.6	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.014	38%	0.382	C	S	.	.	S	Bend	trans	-99.4	2.6	-178.6	-60.9	0	0	0	0	113.2	F114 R117 A151 G157 A158 L168	F114-C155 HydrophobicContact CE1-CB 4.23Å; R117-C155 VanDerWaalsContact CD-SG 3.56Å; A151-C155 WeakPolarHBondContact O-CA 3.18Å; A151-C155 WeakPolarHBondContact O-CB 3.28Å; A151-C155 PolarHBondContact O-N 3.23Å; C155-G157 PolarHBondContact O-N 3.42Å; C155-A158 HydrophobicContact CB-CB 4.32Å; C155-A158 WeakPolarHBondContact O-CB 3.18Å; C155-A158 PolarHBondContact O-N 3.3Å; C155-A158 VanDerWaalsContact O-N 3.08Å; C155-L168 HydrophobicContact CB-CD1 3.42Å; C155-L168 VanDerWaalsContact CB-CD1 3.42Å; C155-L168 WeakPolarHBondContact O-CD1 3.48Å
156	Q	89.3	Confident	86.8	Confident	97 Å²	97	65.6 Å²	65.6	45%	0.453	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	126.9	172.7	-173.6	70.1	-59.3	0	0	109.9	L152 A158 L168	L152-Q156 VanDerWaalsContact O-CB 3.27Å; L152-Q156 WeakPolarHBondContact O-CB 3.33Å; L152-Q156 PolarHBondContact O-N 2.88Å; Q156-A158 PolarHBondContact O-N 3.08Å; Q156-L168 PolarHBondContact NE2-O 2.83Å
157	G	86.3	Confident	86.8	Confident	35 Å²	35	61.9 Å²	61.9	36%	0.361	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	11.6	-178	0	0	0	0	0	114.1	C155 P165 L166	C155-G157 PolarHBondContact O-N 3.42Å; G157-P165 WeakPolarHBondContact O-CB 3.3Å; G157-L166 VanDerWaalsContact CA-O 3.23Å; G157-L166 WeakPolarHBondContact CA-O 3.44Å; G157-L166 PolarHBondContact N-O 2.9Å
158	A	85.5	Confident	86.9	Confident	17 Å²	17	60.3 Å²	60.3	14%	0.14	34%	0.341	C	S	.	.			trans	-62.6	141.1	179.6	0	0	0	0	0	111	F113 C155 Q156 L166	F113-A158 HydrophobicContact CE1-CB 4.45Å; F113-A158 HydrophobicContact CZ-CB 3.87Å; C155-A158 HydrophobicContact CB-CB 4.32Å; C155-A158 WeakPolarHBondContact O-CB 3.18Å; C155-A158 PolarHBondContact O-N 3.3Å; C155-A158 VanDerWaalsContact O-N 3.08Å; Q156-A158 PolarHBondContact O-N 3.08Å; A158-L166 HydrophobicContact CB-CD1 4.33Å; A158-L166 WeakPolarHBondContact O-CG 3.18Å; A158-L166 PolarHBondContact O-N 3.43Å
159	V	81.9	Confident	86.9	Confident	107 Å²	107	61.6 Å²	61.6	65%	0.648	35%	0.352	S	S	*	.			trans	-106.9	147	178.5	-113.6	0	0	0	0	109.2
160	G	76.7	Confident	86.8	Confident	58 Å²	58	61.7 Å²	61.7	60%	0.598	36%	0.357	S	S	*	.	S	Bend	trans	125.2	-6.9	-179.3	0	0	0	0	0	115
161	L	79.6	Confident	86.4	Confident	4 Å²	4	56 Å²	56	2%	0.021	34%	0.339	C	S	.	.	S	Bend	trans	-109.7	79	166.5	-88.6	168.2	0	0	0	108.9	V105 M109 L110 F113 F114 L166	V105-L161 HydrophobicContact CG1-CD2 3.82Å; V105-L161 HydrophobicContact CG2-CD2 4.32Å; M109-L161 HydrophobicContact CB-CD2 4.09Å; L110-L161 HydrophobicContact CD1-CD1 3.78Å; F113-L161 HydrophobicContact CB-CD1 3.48Å; F113-L161 VanDerWaalsContact CB-CD1 3.48Å; F113-L161 HydrophobicContact CB-CD2 4.11Å; F113-L161 HydrophobicContact CB-CG 3.78Å; F113-L161 HydrophobicContact CD1-CD1 3.48Å; F113-L161 VanDerWaalsContact CD1-CD1 3.48Å; F113-L161 HydrophobicContact CD1-CG 4.29Å; F113-L161 HydrophobicContact CD2-CD1 3.85Å; F113-L161 HydrophobicContact CD2-CG 3.71Å; F113-L161 HydrophobicContact CE1-CD1 4.09Å; F113-L161 HydrophobicContact CE2-CD1 4.38Å; F113-L161 HydrophobicContact CE2-CG 4.28Å; F113-L161 HydrophobicContact CG-CD1 3.33Å; F113-L161 HydrophobicContact CG-CG 3.68Å; F113-L161 HydrophobicContact CZ-CD1 4.49Å; F114-L161 HydrophobicContact CE2-CD1 4.34Å; L161-L166 HydrophobicContact CB-CD1 4.15Å; L161-L166 HydrophobicContact CB-CD2 3.84Å; L161-L166 HydrophobicContact CB-CG 4.3Å; L161-L166 HydrophobicContact CD1-CD1 3.72Å; L161-L166 HydrophobicContact CD1-CD2 4.31Å
162	G	76.9	Confident	85.3	Confident	34 Å²	34	60.5 Å²	60.5	35%	0.351	38%	0.376	S	S	.	.	S	Bend	trans	88.8	-162.3	-174	0	0	0	0	0	113.9	T102	T102-G162 WeakPolarHBondContact OG1-CA 3.05Å
163	G	77.8	Confident	83.6	Confident	71 Å²	71	62.5 Å²	62.5	73%	0.732	39%	0.386	S	S	*	.	S	Bend	trans	-95.3	-4.7	-176.3	0	0	0	0	0	115.5	T102	T102-G163 VanDerWaalsContact CG2-N 3.31Å
164	K	85.4	Confident	81.9	Confident	119 Å²	119	62.7 Å²	62.7	52%	0.517	39%	0.388	S	S	.	.	S	Bend	trans	-113.2	149.3	180	-67.1	-177.7	-178.1	-179	0	110.5	D100	D100-K164 HydrophobicContact CB-CB 4.47Å
165	P	87.7	Confident	80	Confident	75 Å²	75	63.1 Å²	63.1	49%	0.487	39%	0.392	S	S	.	.			trans	-65.9	137.5	171.9	28.6	-33.9	0	0	0	110	G157	G157-P165 WeakPolarHBondContact O-CB 3.3Å
166	L	91.1	Very high	77.9	Confident	3 Å²	3	72.4 Å²	72.4	2%	0.016	43%	0.427	C	S	.	.			trans	-66.8	137.7	-179	-66.3	177.1	0	0	0	111.7	V98 L101 F113 G157 A158 L161 L168	V98-L166 HydrophobicContact CG1-CD2 3.89Å; L101-L166 HydrophobicContact CD2-CD2 3.35Å; F113-L166 HydrophobicContact CD1-CD1 4.43Å; F113-L166 HydrophobicContact CE1-CD1 3.8Å; F113-L166 HydrophobicContact CZ-CD1 3.99Å; G157-L166 VanDerWaalsContact CA-O 3.23Å; G157-L166 WeakPolarHBondContact CA-O 3.44Å; G157-L166 PolarHBondContact N-O 2.9Å; A158-L166 HydrophobicContact CB-CD1 4.33Å; A158-L166 WeakPolarHBondContact O-CG 3.18Å; A158-L166 PolarHBondContact O-N 3.43Å; L161-L166 HydrophobicContact CB-CD1 4.15Å; L161-L166 HydrophobicContact CB-CD2 3.84Å; L161-L166 HydrophobicContact CB-CG 4.3Å; L161-L166 HydrophobicContact CD1-CD1 3.72Å; L161-L166 HydrophobicContact CD1-CD2 4.31Å; L166-L168 HydrophobicContact CB-CD2 4.31Å
167	R	89.8	Confident	76	Confident	137 Å²	137	73.3 Å²	73.3	52%	0.517	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	107.5	172.8	-175.3	173.2	-179.2	-94.2	-3.1	110.8	G99 D100	G99-R167 PolarHBondContact N-O 3.06Å; G99-R167 PolarHBondContact O-N 3.24Å; G99-R167 VanDerWaalsContact O-N 3.12Å; D100-R167 HydrophobicContact CB-CB 4.43Å; D100-R167 VanDerWaalsContact OD2-CB 3.24Å; D100-R167 WeakPolarHBondContact OD2-CB 3.19Å
168	L	91.8	Very high	74.1	Confident	1 Å²	1	79.6 Å²	79.6	1%	0.005	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	141.9	-178.1	-54.9	-172.9	0	0	0	111	L96 F97 V98 F114 A151 L152 C155 Q156 L166	L96-L168 HydrophobicContact CD2-CB 4.02Å; L96-L168 HydrophobicContact CD2-CD1 3.93Å; L96-L168 HydrophobicContact CD2-CD2 3.73Å; L96-L168 HydrophobicContact CD2-CG 4.09Å; F97-L168 CarbonylContact O-C 3.5Å; F97-L168 WeakPolarHBondContact O-CA 3.35Å; V98-L168 HydrophobicContact CB-CD2 4.07Å; V98-L168 HydrophobicContact CG1-CD2 3.75Å; V98-L168 HydrophobicContact CG2-CD2 3.79Å; F114-L168 HydrophobicContact CZ-CD2 4.1Å; A151-L168 VanDerWaalsContact O-CD1 3.32Å; A151-L168 WeakPolarHBondContact O-CD1 3.38Å; L152-L168 VanDerWaalsContact CD1-C 3.49Å; L152-L168 HydrophobicContact CD1-CB 3.59Å; C155-L168 HydrophobicContact CB-CD1 3.42Å; C155-L168 VanDerWaalsContact CB-CD1 3.42Å; C155-L168 WeakPolarHBondContact O-CD1 3.48Å; Q156-L168 PolarHBondContact NE2-O 2.83Å; L166-L168 HydrophobicContact CB-CD2 4.31Å
169	S	90.5	Very high	72.3	Confident	37 Å²	37	84.5 Å²	84.5	26%	0.259	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	154.2	174.9	-62.6	0	0	0	0	110.2	F97 A171	F97-S169 PolarHBondContact N-O 3.34Å; F97-S169 PolarHBondContact O-N 3.01Å; S169-A171 PolarHBondContact O-N 2.86Å
170	L	89.8	Confident	70.6	Confident	102 Å²	102	85.6 Å²	85.6	53%	0.534	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	124.2	171.2	-64.2	175	0	0	0	108.7	Q148 L152	Q148-L170 HydrophobicContact CG-CD2 4.43Å; L152-L170 HydrophobicContact CD2-CD2 4.05Å; L152-L170 HydrophobicContact CD2-CG 4.08Å
171	A	83.4	Confident	69.3	Low	17 Å²	17	90.3 Å²	90.3	14%	0.14	48%	0.481	C	S	.	.			trans	-78.9	134.5	172	0	0	0	0	0	108.3	S95 F97 F139 S169 N173	S95-A171 WeakPolarHBondContact O-CB 3.29Å; S95-A171 PolarHBondContact O-N 3.17Å; F97-A171 HydrophobicContact CB-CB 4.22Å; F139-A171 HydrophobicContact CD1-CB 3.9Å; F139-A171 HydrophobicContact CE1-CB 3.96Å; S169-A171 PolarHBondContact O-N 2.86Å; A171-N173 PolarHBondContact O-N 2.82Å
172	A	66.1	Low	67.6	Low	94 Å²	94	98.1 Å²	98.1	78%	0.777	52%	0.517	S	S	*	.			trans	-60.5	110.9	164.5	0	0	0	0	0	107	N174	A172-N174 PolarHBondContact O-N 2.85Å
173	N	57	Low	66	Low	72 Å²	72	103.6 Å²	103.6	39%	0.385	53%	0.533	S	S	.	.			trans	-52	136	173.2	-89.5	-7.8	0	0	0	108.2	M93 S95 A171 L175	M93-N173 PolarHBondContact O-ND2 3.05Å; M93-N173 PolarHBondContact O-OD1 2.63Å; M93-N173 VanDerWaalsContact O-OD1 3.08Å; S95-N173 PolarHBondContact OG-OD1 2.91Å; A171-N173 PolarHBondContact O-N 2.82Å; N173-L175 PolarHBondContact O-N 2.99Å
174	N	53.6	Low	64.5	Low	131 Å²	131	104.7 Å²	104.7	70%	0.701	53%	0.53	S	S	*	.	S	Bend	trans	-68.9	46.7	178.5	-75.2	-48	0	0	0	112.3	A172 R176 N177	A172-N174 PolarHBondContact O-N 2.85Å; N174-R176 PolarHBondContact O-N 3.42Å; N174-N177 PolarHBondContact O-N 3.18Å
175	L	51	Low	62.5	Low	112 Å²	112	107.8 Å²	107.8	59%	0.586	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.9	166.6	-154.7	73.5	0	0	0	111.3	N173 N177 K178 L179	N173-L175 PolarHBondContact O-N 2.99Å; L175-N177 PolarHBondContact O-N 3.3Å; L175-K178 PolarHBondContact O-N 3.44Å; L175-K178 VanDerWaalsContact O-N 3.13Å; L175-L179 PolarHBondContact O-N 3.33Å
176	R	45.1	Very low	60.3	Low	197 Å²	197	108.5 Å²	108.5	74%	0.743	55%	0.553	S	S	*	*	H	α-helix	trans	-63.8	-26.5	175.1	-159.6	167.9	169.2	-176.5	-3.7	113.3	N174 Q180	N174-R176 PolarHBondContact O-N 3.42Å; R176-Q180 PolarHBondContact O-N 3.09Å
177	N	48.2	Very low	58	Low	117 Å²	117	117.4 Å²	117.4	63%	0.626	59%	0.592	S	S	*	*	H	α-helix	trans	-80.4	-17.1	174.9	-78.5	-8.1	0	0	0	113.8	N174 L175	N174-N177 PolarHBondContact O-N 3.18Å; L175-N177 PolarHBondContact O-N 3.3Å
178	K	47.3	Very low	55.8	Low	166 Å²	166	120 Å²	120	72%	0.722	61%	0.609	S	S	*	*	H	α-helix	trans	-84.4	-36.1	171.7	-84.1	-171.4	174.8	-176.1	0	112.3	L175	L175-K178 PolarHBondContact O-N 3.44Å; L175-K178 VanDerWaalsContact O-N 3.13Å
179	L	47.4	Very low	53.1	Low	120 Å²	120	124.2 Å²	124.2	63%	0.628	64%	0.639	S	S	*	*	H	α-helix	trans	-73.4	-27.9	179.9	-79.2	153.2	0	0	0	113.4	L175	L175-L179 PolarHBondContact O-N 3.33Å
180	Q	47.4	Very low	50.2	Low	131 Å²	131	133.8 Å²	133.8	61%	0.612	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-14.8	-177.1	-158.3	144.9	41.2	0	0	114.2	R176	R176-Q180 PolarHBondContact O-N 3.09Å
181	Q	47.7	Very low	47.4	Very low	157 Å²	157	137.6 Å²	137.6	73%	0.734	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-13.7	176.4	-159.8	161.2	40.7	0	0	113.2
182	Q	45.2	Very low	44.7	Very low	167 Å²	167	142.7 Å²	142.7	78%	0.78	72%	0.719	S	S	*	*	S	Bend	trans	-93.8	-8	176.6	-133.4	172.9	32.8	0	0	113.4
183	Q	43.4	Very low	43	Very low	150 Å²	150	143.9 Å²	143.9	70%	0.701	72%	0.722	S	S	*	*	S	Bend	trans	-104.7	8.5	-178.9	-151	176.8	45.3	0	0	113.8
184	S	45.5	Very low	41.7	Very low	93 Å²	93	146.4 Å²	146.4	65%	0.65	75%	0.745	S	S	*	*	S	Bend	trans	-103	0.1	175.3	56.5	0	0	0	0	114.5
185	E	43.7	Very low	40.4	Very low	184 Å²	184	143.1 Å²	143.1	86%	0.86	74%	0.742	S	S	*	*	S	Bend	trans	-105.6	0.6	178.5	-96.8	-179.4	158.9	0	0	114.9
186	S	41.7	Very low	39.2	Very low	91 Å²	91	149.1 Å²	149.1	64%	0.636	76%	0.759	S	S	*	*	S	Bend	trans	-114.4	11.2	-179.2	50.9	0	0	0	0	115.2
187	K	43.2	Very low	38.4	Very low	190 Å²	190	152 Å²	152	83%	0.826	77%	0.77	S	S	*	*			trans	-110.5	51.4	171.9	-71.7	-169.3	178.6	-176.5	0	112.6
188	Q	42.8	Very low	37.3	Very low	190 Å²	190	157.6 Å²	157.6	89%	0.888	78%	0.784	S	S	*	*			trans	-140.9	70.6	158.2	-79.2	-167.2	-21.7	0	0	109.7
189	S	34.6	Very low	36.4	Very low	90 Å²	90	152.9 Å²	152.9	63%	0.629	78%	0.782	S	S	*	*	S	Bend	trans	-160.7	139	145	69.6	0	0	0	0	111.4
190	W	29.7	Very low	35.4	Very low	239 Å²	239	156.9 Å²	156.9	91%	0.905	79%	0.79	S	S	*	*			trans	83	92.3	165	-47.5	111.1	0	0	0	118.9
191	Q	30.9	Very low	34.5	Very low	182 Å²	182	158 Å²	158	85%	0.85	80%	0.8	S	S	*	*			trans	-69.6	150.7	145.9	-71.9	162.1	6.9	0	0	110.4
192	S	27.6	Very low	33.5	Very low	123 Å²	123	157.8 Å²	157.8	86%	0.86	80%	0.799	S	S	*	*			trans	76	133.8	168.5	-53.5	0	0	0	0	114.9
193	S	29.7	Very low	32.6	Very low	120 Å²	120	158.1 Å²	158.1	84%	0.839	80%	0.795	S	S	*	*			cis	-152.3	165.7	27.6	65.4	0	0	0	0	111.9
194	S	29.7	Very low	32	Very low	124 Å²	124	157.8 Å²	157.8	87%	0.867	80%	0.798	S	S	*	*			trans	-65.2	149.1	174.8	-56.6	0	0	0	0	113.9
195	G	26.6	Very low	31	Very low	62 Å²	62	159.5 Å²	159.5	64%	0.639	80%	0.795	S	S	*	*			trans	173.2	99.3	161	0	0	0	0	0	116.1
196	Y	26.8	Very low	30.4	Very low	239 Å²	239	160.9 Å²	160.9	94%	0.937	79%	0.794	S	S	*	*			trans	44.6	118.8	149.3	-56.2	-78.7	0	0	0	121.8
197	R	27.6	Very low	30.1	Very low	258 Å²	258	165.4 Å²	165.4	97%	0.974	81%	0.805	S	S	*	*			trans	-136.3	126.4	148.3	-125	-172.1	-169.2	-151.3	3.6	109.3
198	Y	25.7	Very low	29.4	Very low	234 Å²	234	165.3 Å²	165.3	92%	0.918	81%	0.807	S	S	*	*			trans	-120.6	143.2	171.8	-127.3	-75.9	0	0	0	109.5
199	G	28.3	Very low	28.7	Very low	66 Å²	66	165.6 Å²	165.6	68%	0.68	81%	0.809	S	S	*	*			trans	84.5	136.8	159.8	0	0	0	0	0	116
200	Y	25.6	Very low	28.2	Very low	205 Å²	205	166.3 Å²	166.3	80%	0.804	82%	0.82	S	S	*	*			cis	-160.4	175.2	-1.5	-149.7	-99	0	0	0	107.1
201	D	29.4	Very low	28.2	Very low	154 Å²	154	165.7 Å²	165.7	82%	0.824	82%	0.819	S	S	*	*			trans	113.8	135.7	162.2	-65.5	-45.6	0	0	0	119.1
202	Q	26.4	Very low	28.3	Very low	153 Å²	153	162.2 Å²	162.2	72%	0.715	81%	0.812	S	S	*	*			trans	-140.9	147.7	-141	-175.6	-163.6	28	0	0	106
203	Y	26.7	Very low	28.3	Very low	174 Å²	174	160.4 Å²	160.4	68%	0.682	81%	0.813	S	S	*	*			trans	71.8	110.8	174	-97	-91.5	0	0	0	116.4
204	D	29.4	Very low	28.2	Very low	143 Å²	143	165.4 Å²	165.4	77%	0.765	82%	0.815	S	S	*	*				-160.9	149.3	80.3	-130.3	-45.7	0	0	0	112.8
205	Q	25.3	Very low	28	Very low	128 Å²	128	170 Å²	170	60%	0.598	82%	0.815	S	S	*	*			trans	-96.5	134.9	-173.3	162.1	-175.7	39	0	0	106.9
206	Y	30.6	Very low	28.1	Very low	214 Å²	214	171.9 Å²	171.9	84%	0.839	82%	0.818	S	S	*	*			trans	-172.5	151.9	139.2	-91.6	-62.9	0	0	0	111.2
207	Q	35.6	Very low	28	Very low	185 Å²	185	166.1 Å²	166.1	86%	0.864	81%	0.813	S	S	*	*			trans	-76.8	147.8	-149.2	-71.7	178.2	-26.3	0	0	116.5
208	Q	28.6	Very low	28	Very low	188 Å²	188	165.5 Å²	165.5	88%	0.879	81%	0.811	S	S	*	*			trans	-67.5	141.3	161.6	-65.6	171.1	22.9	0	0	111.8
209	Q	27.5	Very low	28.2	Very low	196 Å²	196	157.6 Å²	157.6	92%	0.916	80%	0.801	S	S	*	*			trans	-161.1	106.5	142	-113.2	174.6	4.5	0	0	110.6
210	A	25.6	Very low	28.2	Very low	105 Å²	105	165.7 Å²	165.7	87%	0.868	81%	0.812	S	S	*	*			trans	166.3	118.5	134.9	0	0	0	0	0	112.2
211	Y	27.9	Very low	28.1	Very low	227 Å²	227	161.9 Å²	161.9	89%	0.89	81%	0.806	S	S	*	*			trans	-73.2	175	164.2	-97.9	-102.9	0	0	0	111.2
212	P	34	Very low	28.1	Very low	108 Å²	108	163.3 Å²	163.3	70%	0.701	81%	0.808	S	S	*	*				-134.9	145.4	-54.9	36.9	-19.3	0	0	0	112.7
213	G	27.3	Very low	28.1	Very low	85 Å²	85	161.7 Å²	161.7	88%	0.876	81%	0.808	S	S	*	*			trans	-84.2	129.4	168.2	0	0	0	0	0	111.9
214	Y	27.3	Very low	28.2	Very low	226 Å²	226	158.1 Å²	158.1	89%	0.886	82%	0.815	S	S	*	*			trans	-95.3	106.3	-177.5	-159	-92.9	0	0	0	109.7
215	Y	26.4	Very low	28.2	Very low	220 Å²	220	154.7 Å²	154.7	86%	0.863	81%	0.813	S	S	*	*			trans	-169.5	114.4	140.2	-131.1	-97.3	0	0	0	111.1
216	S	29	Very low	28.2	Very low	101 Å²	101	157.4 Å²	157.4	71%	0.706	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-81.7	134.9	175	-61.6	0	0	0	0	111.4
217	S	24.8	Very low	28.1	Very low	119 Å²	119	157.9 Å²	157.9	83%	0.832	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-78.1	119.1	168.1	178.7	0	0	0	0	109.5
218	W	27.8	Very low	27.5	Very low	244 Å²	244	152.3 Å²	152.3	92%	0.924	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-75	123.2	171.4	-79.9	91.4	0	0	0	110.4
219	G	29.6	Very low	27.5	Very low	68 Å²	68	154.2 Å²	154.2	70%	0.701	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-81.4	151.5	175.2	0	0	0	0	0	112.3
220	Y	27	Very low	27.2	Very low	236 Å²	236	150.9 Å²	150.9	93%	0.925	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-79.9	131.5	168.4	-120.5	-95	0	0	0	109.6
221	D	24.8	Very low	27.1	Very low	126 Å²	126	156.5 Å²	156.5	67%	0.674	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-69.3	132	168.2	177.8	32.6	0	0	0	110.5
222	Q	28.2	Very low	27.4	Very low	184 Å²	184	150.4 Å²	150.4	86%	0.86	81%	0.805	S	S	*	*			trans	-138.2	97.1	162	-90.4	-171.2	48.6	0	0	109.1	A224	Q222-A224 PolarHBondContact O-N 3.08Å
223	T	26	Very low	26.9	Very low	118 Å²	118	153.2 Å²	153.2	72%	0.724	81%	0.809	S	S	*	*			trans	-65.6	112.9	160	52.6	0	0	0	0	110.8
224	A	29.6	Very low	26.8	Very low	100 Å²	100	159.8 Å²	159.8	83%	0.826	81%	0.809	S	S	*	*			trans	-170.8	119.7	146	0	0	0	0	0	109.5	Q222	Q222-A224 PolarHBondContact O-N 3.08Å
225	G	30.3	Very low	26.8	Very low	70 Å²	70	155.1 Å²	155.1	72%	0.722	80%	0.799	S	S	*	*			trans	-71.6	158.7	-167.4	0	0	0	0	0	115.9
226	M	24	Very low	26.8	Very low	185 Å²	185	154.8 Å²	154.8	91%	0.911	80%	0.798	S	S	*	*			trans	-147.5	131.1	157.5	-98.3	-59.9	159.4	0	0	110.3
227	Y	28.5	Very low	26.9	Very low	224 Å²	224	154 Å²	154	88%	0.878	79%	0.792	S	S	*	*			trans	-69.7	135.3	-176.5	-71.2	-96.8	0	0	0	111.8
228	G	23.8	Very low	27.1	Very low	69 Å²	69	156.7 Å²	156.7	71%	0.711	79%	0.792	S	S	*	*			trans	-93.6	143.2	170.2	0	0	0	0	0	111.9
229	Y	27.2	Very low	27	Very low	228 Å²	228	155.6 Å²	155.6	89%	0.894	79%	0.789	S	S	*	*			trans	-132.3	131.1	160.2	-93.6	-79.8	0	0	0	110.9
230	T	23.1	Very low	26.9	Very low	126 Å²	126	157.1 Å²	157.1	77%	0.773	80%	0.795	S	S	*	*			trans	-68.6	148.3	-178.1	-58.1	0	0	0	0	113.3
231	Y	23.4	Very low	26.8	Very low	222 Å²	222	154.4 Å²	154.4	87%	0.871	79%	0.791	S	S	*	*			trans	-130.4	144.9	154.5	-101.3	-88.8	0	0	0	111.7
232	P	32.6	Very low	27	Very low	99 Å²	99	154.3 Å²	154.3	64%	0.643	79%	0.794	S	S	*	*			trans	-88.7	148.5	-171.7	6.2	13.6	0	0	0	113.5
233	Q	24.1	Very low	26.9	Very low	168 Å²	168	154.9 Å²	154.9	79%	0.785	80%	0.797	S	S	*	*			trans	-62.8	136.3	167.1	-89.1	-88.2	-17.5	0	0	112.7
234	Y	26.1	Very low	27.1	Very low	223 Å²	223	157.8 Å²	157.8	88%	0.875	80%	0.803	S	S	*	*			trans	-141.2	127.5	151.9	-82.2	-77.6	0	0	0	110
235	D	27.7	Very low	27.1	Very low	127 Å²	127	158.1 Å²	158.1	68%	0.679	80%	0.799	S	S	*	*			trans	-106.1	140.9	167.6	176.7	23.8	0	0	0	107.5
236	Y	24.8	Very low	27.2	Very low	214 Å²	214	163.7 Å²	163.7	84%	0.839	81%	0.806	S	S	*	*			trans	-170.6	122.6	139.5	-121.7	-88.4	0	0	0	111.2
237	S	31.5	Very low	27.8	Very low	84 Å²	84	159.5 Å²	159.5	59%	0.587	80%	0.801	S	S	*	*			trans	-49.3	141.7	166.1	51	0	0	0	0	116.4
238	Q	28.6	Very low	28.3	Very low	176 Å²	176	155.4 Å²	155.4	82%	0.822	80%	0.799	S	S	*	*			trans	-169	145.4	135.2	-135.2	140	15	0	0	114.7
239	Y	25.4	Very low	29.3	Very low	220 Å²	220	157.4 Å²	157.4	86%	0.863	80%	0.799	S	S	*	*			trans	-34.1	160.8	177.5	-53.5	-89.9	0	0	0	117.8
240	A	28	Very low	30	Very low	101 Å²	101	153.9 Å²	153.9	84%	0.835	80%	0.796	S	S	*	*			cis	-171.2	172.9	48.7	0	0	0	0	0	112.8
241	Q	25.8	Very low	30.8	Very low	178 Å²	178	156.6 Å²	156.6	83%	0.832	80%	0.8	S	S	*	*			trans	-81.5	161.9	-172.3	-60.4	-168.7	-61.9	0	0	117.1
242	V	28.1	Very low	31.7	Very low	124 Å²	124	154 Å²	154	75%	0.752	80%	0.796	S	S	*	*			trans	58.7	125.4	149.7	-77	0	0	0	0	121.6
243	Q	27.2	Very low	32.5	Very low	196 Å²	196	154.3 Å²	154.3	92%	0.916	81%	0.806	S	S	*	*				-168.4	159.4	116.4	-107.1	171.4	20.4	0	0	114.1
244	E	30.1	Very low	33.9	Very low	180 Å²	180	152.7 Å²	152.7	84%	0.841	81%	0.807	S	S	*	*			trans	-84.4	179.7	-163.8	-179.5	174.6	-167.8	0	0	114.6
245	S	29.2	Very low	35.2	Very low	106 Å²	106	150.7 Å²	150.7	74%	0.741	81%	0.806	S	S	*	*			trans	90.7	138.1	173.5	76.5	0	0	0	0	115.5
246	E	31.5	Very low	36.1	Very low	187 Å²	187	150.2 Å²	150.2	87%	0.874	80%	0.804	S	S	*	*			cis	-163.1	158.4	12.4	-132.2	171.9	-167.1	0	0	108.8
247	A	36.3	Very low	37.7	Very low	97 Å²	97	146 Å²	146	80%	0.802	80%	0.803	S	S	*	*			trans	-79.6	147.9	-176.4	0	0	0	0	0	113.7
248	V	39.5	Very low	38.7	Very low	139 Å²	139	145.4 Å²	145.4	84%	0.842	80%	0.798	S	S	*	*			trans	-134.9	131.5	162.9	-173.1	0	0	0	0	108.4
249	P	44.1	Very low	40	Very low	110 Å²	110	144.8 Å²	144.8	71%	0.714	80%	0.8	S	S	*	*			trans	-93.1	155.1	-172.2	36.4	-32.8	0	0	0	113.9
250	D	42.1	Very low	41.5	Very low	155 Å²	155	140.7 Å²	140.7	83%	0.829	80%	0.797	S	S	*	*			trans	36.2	120	156.6	-67.9	-30.2	0	0	0	119.7
251	E	40	Very low	42.8	Very low	183 Å²	183	140.5 Å²	140.5	86%	0.855	79%	0.786	S	S	*	*				-158.5	132.2	125.3	-75.5	-147.5	153.5	0	0	111.7
252	E	42.5	Very low	44.5	Very low	168 Å²	168	135.8 Å²	135.8	79%	0.785	77%	0.766	S	S	*	*			trans	51.1	107.9	155	-68.1	-174.9	150.4	0	0	120.5	V254	E252-V254 PolarHBondContact O-N 3.15Å
253	A	49.4	Very low	45.9	Very low	104 Å²	104	134.4 Å²	134.4	86%	0.86	76%	0.758	S	S	*	*			trans	-58.9	95.7	160.2	0	0	0	0	0	110.7	E255	A253-E255 PolarHBondContact O-N 2.79Å
254	V	53.1	Low	47.9	Very low	134 Å²	134	130.5 Å²	130.5	81%	0.812	75%	0.747	S	S	*	*			trans	-79.9	96.2	162.2	-174.3	0	0	0	0	106.9	E252 D256	E252-V254 PolarHBondContact O-N 3.15Å; V254-D256 PolarHBondContact O-N 3.01Å
255	E	54	Low	49.8	Very low	182 Å²	182	127.9 Å²	127.9	85%	0.85	73%	0.734	S	S	*	*			trans	-59.6	117.2	176.2	-149.5	168.3	-150.6	0	0	109.2	A253 P257	A253-E255 PolarHBondContact O-N 2.79Å; E255-P257 WeakPolarHBondContact O-CD 3.47Å
256	D	46.5	Very low	51.5	Low	117 Å²	117	126.3 Å²	126.3	63%	0.626	72%	0.72	S	S	*	*			trans	-59.3	117.8	179.3	-176.8	-12.6	0	0	0	109.5	V254 S258	V254-D256 PolarHBondContact O-N 3.01Å; D256-S258 VanDerWaalsContact CG-OG 3.26Å; D256-S258 PolarHBondContact O-N 3.17Å; D256-S258 WeakPolarHBondContact OD1-CB 3.14Å; D256-S258 PolarHBondContact OD1-N 3.27Å; D256-S258 PolarHBondContact OD1-OG 2.69Å; D256-S258 PolarHBondContact OD2-OG 2.85Å
257	P	59.1	Low	53	Low	126 Å²	126	121.8 Å²	121.8	82%	0.818	70%	0.703	S	S	*	*	S	Bend	trans	-76.6	23.4	-179.1	32.2	-34	0	0	0	113.1	E255 L259	E255-P257 WeakPolarHBondContact O-CD 3.47Å; P257-L259 PolarHBondContact O-N 2.86Å
258	S	51.9	Low	54.6	Low	70 Å²	70	125 Å²	125	49%	0.49	69%	0.694	S	S	.	*			trans	-94.2	83.1	166.9	67.4	0	0	0	0	110.2	D256 V260	D256-S258 VanDerWaalsContact CG-OG 3.26Å; D256-S258 PolarHBondContact O-N 3.17Å; D256-S258 WeakPolarHBondContact OD1-CB 3.14Å; D256-S258 PolarHBondContact OD1-N 3.27Å; D256-S258 PolarHBondContact OD1-OG 2.69Å; D256-S258 PolarHBondContact OD2-OG 2.85Å; S258-V260 PolarHBondContact O-N 2.84Å
259	L	55.9	Low	56.1	Low	164 Å²	164	121.6 Å²	121.6	86%	0.859	68%	0.676	S	S	*	*			trans	-52.9	107.2	164.6	-76.1	169	0	0	0	107.9	P257 V261	P257-L259 PolarHBondContact O-N 2.86Å; L259-V261 VanDerWaalsContact C-N 3.29Å; L259-V261 PolarHBondContact O-N 3.09Å
260	V	56.8	Low	57.3	Low	134 Å²	134	123.7 Å²	123.7	81%	0.812	67%	0.674	S	S	*	*			trans	-64.8	98.9	168.2	179.1	0	0	0	0	105.4	S258 D262	S258-V260 PolarHBondContact O-N 2.84Å; V260-D262 PolarHBondContact O-N 3.19Å
261	V	56	Low	58.5	Low	97 Å²	97	120.5 Å²	120.5	59%	0.588	66%	0.656	S	S	*	*			trans	-59.9	108.8	174	174.3	0	0	0	0	106.5	L259 V263 T266	L259-V261 VanDerWaalsContact C-N 3.29Å; L259-V261 PolarHBondContact O-N 3.09Å; V261-V263 VanDerWaalsContact C-N 3.34Å; V261-V263 PolarHBondContact O-N 3.01Å; V261-T266 WeakPolarHBondContact CG1-OG1 3.22Å
262	D	61	Low	59.9	Low	79 Å²	79	115 Å²	115	42%	0.422	63%	0.633	S	S	.	*			trans	-67.7	100.1	173.4	-172.2	-25.7	0	0	0	107.4	V260 V264 E265 T266	V260-D262 PolarHBondContact O-N 3.19Å; D262-V264 PolarHBondContact O-N 3.16Å; D262-V264 WeakPolarHBondContact OD1-CA 3.44Å; D262-V264 WeakPolarHBondContact OD1-CB 3.41Å; D262-V264 PolarHBondContact OD1-N 2.64Å; D262-E265 HydrophobicContact CB-CB 3.8Å; D262-E265 PolarHBondContact O-N 3.26Å; D262-E265 PolarHBondContact OD1-N 2.87Å; D262-T266 WeakPolarHBondContact O-CB 3.27Å; D262-T266 PolarHBondContact O-N 3.43Å; D262-T266 PolarHBondContact O-OG1 3.49Å
263	V	58.5	Low	61	Low	95 Å²	95	112.6 Å²	112.6	58%	0.576	63%	0.625	S	S	*	*	H	α-helix	trans	-61.3	-28.4	-179.9	-178.5	0	0	0	0	110.4	V261 N267	V261-V263 VanDerWaalsContact C-N 3.34Å; V261-V263 PolarHBondContact O-N 3.01Å; V263-N267 WeakPolarHBondContact O-CB 3.4Å; V263-N267 PolarHBondContact O-N 3.41Å; V263-N267 PolarHBondContact O-ND2 3.06Å; V263-N267 VanDerWaalsContact O-ND2 3.11Å
264	V	68.3	Low	61.6	Low	113 Å²	113	109.8 Å²	109.8	69%	0.685	60%	0.599	S	S	*	*	H	α-helix	trans	-73.4	-44.9	177.4	-175.6	0	0	0	0	109.9	D262 R268	D262-V264 PolarHBondContact O-N 3.16Å; D262-V264 WeakPolarHBondContact OD1-CA 3.44Å; D262-V264 WeakPolarHBondContact OD1-CB 3.41Å; D262-V264 PolarHBondContact OD1-N 2.64Å; V264-R268 VanDerWaalsContact O-CB 3.31Å; V264-R268 WeakPolarHBondContact O-CB 3.19Å; V264-R268 PolarHBondContact O-N 3.1Å
265	E	70.1	Confident	62	Low	125 Å²	125	108.5 Å²	108.5	58%	0.584	58%	0.584	S	S	*	*	H	α-helix	trans	-65.5	-44.3	176.6	-168.3	171.3	-162.8	0	0	111.6	D262 N267 R268 S269	D262-E265 HydrophobicContact CB-CB 3.8Å; D262-E265 PolarHBondContact O-N 3.26Å; D262-E265 PolarHBondContact OD1-N 2.87Å; E265-N267 PolarHBondContact O-N 3.11Å; E265-R268 WeakPolarHBondContact O-CB 3.31Å; E265-R268 PolarHBondContact O-N 3.29Å; E265-R268 VanDerWaalsContact O-N 3.1Å; E265-S269 PolarHBondContact O-N 3.34Å; E265-S269 PolarHBondContact O-OG 3.33Å
266	T	65.1	Low	62.6	Low	73 Å²	73	106.5 Å²	106.5	45%	0.448	58%	0.575	S	S	.	*	H	α-helix	trans	-64	-40.8	179.1	-46.2	0	0	0	0	111.6	V261 D262 R268 F270	V261-T266 WeakPolarHBondContact CG1-OG1 3.22Å; D262-T266 WeakPolarHBondContact O-CB 3.27Å; D262-T266 PolarHBondContact O-N 3.43Å; D262-T266 PolarHBondContact O-OG1 3.49Å; T266-R268 VanDerWaalsContact C-N 3.33Å; T266-F270 WeakPolarHBondContact O-CB 3.37Å; T266-F270 PolarHBondContact O-N 3.06Å
267	N	61.9	Low	63.4	Low	93 Å²	93	106.2 Å²	106.2	50%	0.497	57%	0.573	S	S	.	*	H	α-helix	trans	-67.2	-35.2	174.3	-75.5	-19.6	0	0	0	111.8	V263 E265 F270 I271	V263-N267 WeakPolarHBondContact O-CB 3.4Å; V263-N267 PolarHBondContact O-N 3.41Å; V263-N267 PolarHBondContact O-ND2 3.06Å; V263-N267 VanDerWaalsContact O-ND2 3.11Å; E265-N267 PolarHBondContact O-N 3.11Å; N267-F270 PolarHBondContact O-N 3.08Å; N267-I271 VanDerWaalsContact O-CG1 3.27Å; N267-I271 WeakPolarHBondContact O-CG1 3.5Å; N267-I271 PolarHBondContact O-N 3.13Å
268	R	71.8	Confident	63.4	Low	164 Å²	164	107.9 Å²	107.9	62%	0.619	56%	0.564	S	S	*	*	H	α-helix	trans	-66.9	-47.7	175.7	-173.7	173.8	176.5	-111.1	-11.2	111.3	V264 E265 T266 F270 I271 D272	V264-R268 VanDerWaalsContact O-CB 3.31Å; V264-R268 WeakPolarHBondContact O-CB 3.19Å; V264-R268 PolarHBondContact O-N 3.1Å; E265-R268 WeakPolarHBondContact O-CB 3.31Å; E265-R268 PolarHBondContact O-N 3.29Å; E265-R268 VanDerWaalsContact O-N 3.1Å; T266-R268 VanDerWaalsContact C-N 3.33Å; R268-F270 VanDerWaalsContact C-N 3.26Å; R268-F270 PolarHBondContact O-N 3.38Å; R268-I271 PolarHBondContact O-N 2.93Å; R268-I271 VanDerWaalsContact O-N 3.08Å; R268-D272 PolarHBondContact O-N 3.45Å
269	S	69.1	Low	64	Low	68 Å²	68	109.6 Å²	109.6	48%	0.476	57%	0.567	S	S	.	*	H	α-helix	trans	-61.7	-33.9	175	-57.2	0	0	0	0	112.7	E265 L273	E265-S269 PolarHBondContact O-N 3.34Å; E265-S269 PolarHBondContact O-OG 3.33Å; S269-L273 WeakPolarHBondContact O-CB 3.43Å; S269-L273 PolarHBondContact O-N 3.32Å
270	F	70.4	Confident	64.6	Low	153 Å²	153	104.5 Å²	104.5	67%	0.671	55%	0.549	S	S	*	.	H	α-helix	trans	-65	-40.5	173.5	-179.3	-92.9	0	0	0	112.1	T266 N267 R268 S274	T266-F270 WeakPolarHBondContact O-CB 3.37Å; T266-F270 PolarHBondContact O-N 3.06Å; N267-F270 PolarHBondContact O-N 3.08Å; R268-F270 VanDerWaalsContact C-N 3.26Å; R268-F270 PolarHBondContact O-N 3.38Å; F270-S274 PolarHBondContact O-N 3.27Å
271	I	68	Low	65.1	Low	88 Å²	88	103.2 Å²	103.2	45%	0.451	54%	0.536	S	S	.	.	H	α-helix	trans	-67.1	-47.8	175.6	-68	165.3	0	0	0	110	N267 R268 L273 S274 E275	N267-I271 VanDerWaalsContact O-CG1 3.27Å; N267-I271 WeakPolarHBondContact O-CG1 3.5Å; N267-I271 PolarHBondContact O-N 3.13Å; R268-I271 PolarHBondContact O-N 2.93Å; R268-I271 VanDerWaalsContact O-N 3.08Å; I271-L273 PolarHBondContact O-N 3.1Å; I271-S274 WeakPolarHBondContact O-CB 3.38Å; I271-S274 PolarHBondContact O-N 3.24Å; I271-S274 PolarHBondContact O-OG 3.33Å; I271-E275 PolarHBondContact O-N 3.16Å; I271-E275 VanDerWaalsContact O-N 3.11Å
272	D	68.4	Low	65.6	Low	69 Å²	69	104.6 Å²	104.6	37%	0.369	54%	0.539	S	S	.	.	H	α-helix	trans	-61	-43	-179	-67.2	-13.8	0	0	0	112	R268 S274 E275 E276	R268-D272 PolarHBondContact O-N 3.45Å; D272-S274 VanDerWaalsContact C-N 3.26Å; D272-S274 PolarHBondContact O-N 2.98Å; D272-E275 PolarHBondContact O-N 3Å; D272-E275 VanDerWaalsContact O-N 3.15Å; D272-E276 PolarHBondContact O-N 2.83Å; D272-E276 VanDerWaalsContact O-N 3.08Å
273	L	65.4	Low	65.7	Low	117 Å²	117	106.8 Å²	106.8	61%	0.613	55%	0.551	S	S	*	*	H	α-helix	trans	-64.6	-32.1	176.2	-171.9	72.1	0	0	0	112.3	S269 I271 E275 L277	S269-L273 WeakPolarHBondContact O-CB 3.43Å; S269-L273 PolarHBondContact O-N 3.32Å; I271-L273 PolarHBondContact O-N 3.1Å; L273-E275 VanDerWaalsContact C-N 3.33Å; L273-L277 PolarHBondContact O-N 2.93Å
274	S	62.1	Low	65.8	Low	44 Å²	44	106.1 Å²	106.1	31%	0.308	55%	0.549	S	S	.	.	H	α-helix	trans	-68.6	-35.8	176	80.6	0	0	0	0	111.3	F270 I271 D272 L277 Y278	F270-S274 PolarHBondContact O-N 3.27Å; I271-S274 WeakPolarHBondContact O-CB 3.38Å; I271-S274 PolarHBondContact O-N 3.24Å; I271-S274 PolarHBondContact O-OG 3.33Å; D272-S274 VanDerWaalsContact C-N 3.26Å; D272-S274 PolarHBondContact O-N 2.98Å; S274-L277 PolarHBondContact O-N 3.47Å; S274-Y278 WeakPolarHBondContact O-CD2 3.38Å; S274-Y278 PolarHBondContact O-N 3.02Å
275	E	60.9	Low	65.2	Low	108 Å²	108	107.8 Å²	107.8	51%	0.505	55%	0.549	S	S	.	.	H	α-helix	trans	-70.7	-40.2	177.4	-68.3	-175.7	176.5	0	0	111.9	I271 D272 L273 L277 Y278 D279	I271-E275 PolarHBondContact O-N 3.16Å; I271-E275 VanDerWaalsContact O-N 3.11Å; D272-E275 PolarHBondContact O-N 3Å; D272-E275 VanDerWaalsContact O-N 3.15Å; L273-E275 VanDerWaalsContact C-N 3.33Å; E275-L277 VanDerWaalsContact C-N 3.27Å; E275-L277 PolarHBondContact O-N 3.11Å; E275-Y278 PolarHBondContact O-N 3.43Å; E275-Y278 VanDerWaalsContact O-N 3.09Å; E275-D279 PolarHBondContact O-N 2.83Å
276	E	67.8	Low	64.7	Low	139 Å²	139	113.1 Å²	113.1	65%	0.65	56%	0.564	S	S	*	*	H	α-helix	trans	-60	-35.8	173.7	-76.9	-171.3	164.9	0	0	113	D272 A280	D272-E276 PolarHBondContact O-N 2.83Å; D272-E276 VanDerWaalsContact O-N 3.08Å; E276-A280 VanDerWaalsContact O-CB 3.29Å; E276-A280 WeakPolarHBondContact O-CB 3.22Å; E276-A280 PolarHBondContact O-N 3.27Å
277	L	62.4	Low	63.9	Low	112 Å²	112	116.8 Å²	116.8	59%	0.586	58%	0.576	S	S	*	*	H	α-helix	trans	-67.8	-42	174.6	-173.6	80.5	0	0	0	111.3	L273 S274 E275 I281	L273-L277 PolarHBondContact O-N 2.93Å; S274-L277 PolarHBondContact O-N 3.47Å; E275-L277 VanDerWaalsContact C-N 3.27Å; E275-L277 PolarHBondContact O-N 3.11Å; L277-I281 HydrophobicContact CD2-CD1 4.49Å; L277-I281 HydrophobicContact CG-CD1 4.03Å; L277-I281 WeakPolarHBondContact O-CB 3.35Å; L277-I281 WeakPolarHBondContact O-CD1 3.35Å; L277-I281 WeakPolarHBondContact O-CG1 3.27Å; L277-I281 PolarHBondContact O-N 2.78Å; L277-I281 VanDerWaalsContact O-N 3.1Å
278	Y	60.2	Low	63.4	Low	160 Å²	160	117.4 Å²	117.4	63%	0.627	59%	0.585	S	S	*	*	H	α-helix	trans	-65.3	-42.1	177	-81.7	-69.3	0	0	0	111.4	S274 E275 I281 I282	S274-Y278 WeakPolarHBondContact O-CD2 3.38Å; S274-Y278 PolarHBondContact O-N 3.02Å; E275-Y278 PolarHBondContact O-N 3.43Å; E275-Y278 VanDerWaalsContact O-N 3.09Å; Y278-I281 PolarHBondContact O-N 3.04Å; Y278-I282 WeakPolarHBondContact O-CB 3.29Å; Y278-I282 WeakPolarHBondContact O-CG1 3.44Å; Y278-I282 PolarHBondContact O-N 3.21Å
279	D	65.1	Low	62.4	Low	107 Å²	107	115.6 Å²	115.6	57%	0.572	59%	0.594	S	S	*	*	H	α-helix	trans	-64.9	-44.2	176.5	-76	-15.3	0	0	0	111.5	E275 I281 I282 D283	E275-D279 PolarHBondContact O-N 2.83Å; D279-I281 VanDerWaalsContact C-N 3.25Å; D279-I281 PolarHBondContact O-N 2.99Å; D279-I282 PolarHBondContact O-N 2.86Å; D279-I282 VanDerWaalsContact O-N 3.15Å; D279-D283 WeakPolarHBondContact O-CB 3.47Å; D279-D283 PolarHBondContact O-N 3.36Å
280	A	68.2	Low	61.2	Low	57 Å²	57	121.1 Å²	121.1	47%	0.471	61%	0.613	S	S	.	*	H	α-helix	trans	-62	-31.5	176.1	0	0	0	0	0	113.2	E276 C284	E276-A280 VanDerWaalsContact O-CB 3.29Å; E276-A280 WeakPolarHBondContact O-CB 3.22Å; E276-A280 PolarHBondContact O-N 3.27Å; A280-C284 PolarHBondContact O-N 2.92Å; A280-C284 PolarHBondContact O-SG 3.17Å
281	I	67.2	Low	59.8	Low	106 Å²	106	123.9 Å²	123.9	54%	0.544	63%	0.625	S	S	.	*	H	α-helix	trans	-77.2	-35.2	176.2	-70.8	168.5	0	0	0	111.4	L277 Y278 D279 C284	L277-I281 HydrophobicContact CD2-CD1 4.49Å; L277-I281 HydrophobicContact CG-CD1 4.03Å; L277-I281 WeakPolarHBondContact O-CB 3.35Å; L277-I281 WeakPolarHBondContact O-CD1 3.35Å; L277-I281 WeakPolarHBondContact O-CG1 3.27Å; L277-I281 PolarHBondContact O-N 2.78Å; L277-I281 VanDerWaalsContact O-N 3.1Å; Y278-I281 PolarHBondContact O-N 3.04Å; D279-I281 VanDerWaalsContact C-N 3.25Å; D279-I281 PolarHBondContact O-N 2.99Å; I281-C284 WeakPolarHBondContact O-CB 3.44Å
282	I	64.8	Low	58.5	Low	126 Å²	126	124 Å²	124	65%	0.646	63%	0.633	S	S	*	*	H	α-helix	trans	-73.3	-38.7	177.7	-67.1	-85.1	0	0	0	110.7	Y278 D279 C284	Y278-I282 WeakPolarHBondContact O-CB 3.29Å; Y278-I282 WeakPolarHBondContact O-CG1 3.44Å; Y278-I282 PolarHBondContact O-N 3.21Å; D279-I282 PolarHBondContact O-N 2.86Å; D279-I282 VanDerWaalsContact O-N 3.15Å; I282-C284 PolarHBondContact O-N 3.32Å
283	D	64.6	Low	57.6	Low	126 Å²	126	124.9 Å²	124.9	67%	0.674	65%	0.651	S	S	*	*	S	Bend	trans	-75.4	-8.8	176.1	-93.2	8.7	0	0	0	113.5	D279 H285	D279-D283 WeakPolarHBondContact O-CB 3.47Å; D279-D283 PolarHBondContact O-N 3.36Å; D283-H285 PolarHBondContact O-N 2.91Å
284	C	60.7	Low	56.3	Low	80 Å²	80	125.9 Å²	125.9	54%	0.541	66%	0.657	S	S	.	*			trans	-68.8	77.1	169.2	-83.4	0	0	0	0	111.3	A280 I281 I282 W286	A280-C284 PolarHBondContact O-N 2.92Å; A280-C284 PolarHBondContact O-SG 3.17Å; I281-C284 WeakPolarHBondContact O-CB 3.44Å; I282-C284 PolarHBondContact O-N 3.32Å; C284-W286 PolarHBondContact O-N 2.85Å
285	H	56.1	Low	55.7	Low	148 Å²	148	131.3 Å²	131.3	69%	0.685	68%	0.677	S	S	*	*			trans	-71.3	91.1	166.5	-81.7	-75.7	0	0	0	110.7	D283 H287	D283-H285 PolarHBondContact O-N 2.91Å; H285-H287 PolarHBondContact O-N 2.75Å; H285-H287 PolarHBondContact O-ND1 2.96Å
286	W	57.8	Low	54.6	Low	238 Å²	238	133.4 Å²	133.4	90%	0.902	69%	0.692	S	S	*	*			trans	-64.9	98.6	163.4	-82.2	89.7	0	0	0	109.5	C284 P288	C284-W286 PolarHBondContact O-N 2.85Å; W286-P288 WeakPolarHBondContact O-CD 3.35Å
287	H	49.7	Very low	53.7	Low	150 Å²	150	136 Å²	136	69%	0.694	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-72.6	122.8	166.1	-72.5	75.3	0	0	0	108.2	H285	H285-H287 PolarHBondContact O-N 2.75Å; H285-H287 PolarHBondContact O-ND1 2.96Å
288	P	51.3	Low	52.8	Low	106 Å²	106	138.5 Å²	138.5	69%	0.688	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-62.5	140.9	167.7	7.2	0.1	0	0	0	108.5	W286 E290	W286-P288 WeakPolarHBondContact O-CD 3.35Å; P288-E290 PolarHBondContact O-N 2.89Å
289	P	50.9	Low	52.1	Low	125 Å²	125	136.2 Å²	136.2	81%	0.812	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-57.7	120.1	171.6	22.4	-29.8	0	0	0	108.3	F291	P289-F291 PolarHBondContact O-N 2.87Å; P289-F291 VanDerWaalsContact O-N 3.15Å
290	E	42.4	Very low	50.9	Low	184 Å²	184	136.2 Å²	136.2	86%	0.86	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-55	121.6	179.9	-61.4	-158.9	173.9	0	0	109.6	P288 S292	P288-E290 PolarHBondContact O-N 2.89Å; E290-S292 PolarHBondContact O-N 3.46Å
291	F	41.7	Very low	50	Low	211 Å²	211	140.6 Å²	140.6	93%	0.925	74%	0.736	S	S	*	*			trans	-67.8	81.4	164.6	-134.2	-90.8	0	0	0	106.5	P289 A293	P289-F291 PolarHBondContact O-N 2.87Å; P289-F291 VanDerWaalsContact O-N 3.15Å; F291-A293 PolarHBondContact O-N 3.47Å
292	S	40.8	Very low	49.2	Very low	90 Å²	90	142.9 Å²	142.9	63%	0.629	75%	0.748	S	S	*	*			trans	-62.4	103.7	167.7	179.1	0	0	0	0	106.8	E290 N294	E290-S292 PolarHBondContact O-N 3.46Å; S292-N294 VanDerWaalsContact C-N 3.26Å; S292-N294 PolarHBondContact O-N 2.94Å
293	A	48.5	Very low	48.8	Very low	89 Å²	89	142.6 Å²	142.6	74%	0.736	76%	0.755	S	S	*	*			trans	-63.3	90.7	168.4	0	0	0	0	0	108.4	F291	F291-A293 PolarHBondContact O-N 3.47Å
294	N	38.6	Very low	48.5	Very low	138 Å²	138	143.8 Å²	143.8	74%	0.738	76%	0.761	S	S	*	*			trans	-128.2	108.7	152.1	-87.3	-48.4	0	0	0	108	S292 D296	S292-N294 VanDerWaalsContact C-N 3.26Å; S292-N294 PolarHBondContact O-N 2.94Å; N294-D296 PolarHBondContact O-N 3.07Å
295	Q	49.1	Very low	48.2	Very low	157 Å²	157	145.3 Å²	145.3	73%	0.734	77%	0.77	S	S	*	*			trans	-54.7	112.6	166.3	-84.1	169.5	-28.5	0	0	109.5	Y297	Q295-Y297 HydrophobicContact CB-CE2 4.43Å
296	D	39.7	Very low	47.9	Very low	153 Å²	153	146.3 Å²	146.3	82%	0.818	78%	0.779	S	S	*	*			trans	-123.9	111	149	-85.1	-42	0	0	0	108	N294 I298	N294-D296 PolarHBondContact O-N 3.07Å; D296-I298 PolarHBondContact O-N 2.98Å
297	Y	48.6	Very low	47.4	Very low	194 Å²	194	140 Å²	140	76%	0.761	77%	0.771	S	S	*	*			trans	-63	109.6	177.9	-73.3	-101.2	0	0	0	109.6	Q295	Q295-Y297 HydrophobicContact CB-CE2 4.43Å
298	I	43.8	Very low	47.3	Very low	164 Å²	164	144.2 Å²	144.2	84%	0.841	80%	0.796	S	S	*	*			trans	-111	105	159.2	-59.4	-170.1	0	0	0	108.2	D296 S300	D296-I298 PolarHBondContact O-N 2.98Å; I298-S300 PolarHBondContact O-N 3.23Å
299	V	44	Very low	47.1	Very low	111 Å²	111	146.2 Å²	146.2	67%	0.673	80%	0.801	S	S	*	*			trans	-56.6	120	176	179.5	0	0	0	0	109.8	N301	V299-N301 PolarHBondContact O-N 3.23Å
300	S	41.2	Very low	46.9	Very low	107 Å²	107	147.3 Å²	147.3	75%	0.748	80%	0.801	S	S	*	*			trans	-77.1	98.6	169.2	42.6	0	0	0	0	109.9	I298 L302	I298-S300 PolarHBondContact O-N 3.23Å; S300-L302 PolarHBondContact O-N 3.25Å; S300-L302 VanDerWaalsContact O-N 3.11Å
301	N	48.4	Very low	47.2	Very low	150 Å²	150	145.2 Å²	145.2	80%	0.802	80%	0.797	S	S	*	*			trans	-74.9	96.7	167.7	-74.2	-31.1	0	0	0	109.3	V299	V299-N301 PolarHBondContact O-N 3.23Å
302	L	50.8	Low	47.5	Very low	153 Å²	153	141.4 Å²	141.4	80%	0.801	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-74.4	133.9	161	-126.5	91	0	0	0	108.2	S300	S300-L302 PolarHBondContact O-N 3.25Å; S300-L302 VanDerWaalsContact O-N 3.11Å
303	P	56.3	Low	47.9	Very low	121 Å²	121	144.6 Å²	144.6	79%	0.786	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-73.8	137.2	173.7	27.6	-30.2	0	0	0	111.2
304	D	59.1	Low	47.9	Very low	151 Å²	151	148.3 Å²	148.3	81%	0.807	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-63.8	147.2	-176.9	-72.8	-43.1	0	0	0	113.4
305	P	53.1	Low	48.5	Very low	112 Å²	112	149 Å²	149	73%	0.727	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-74.7	130.2	176.7	29.4	-32	0	0	0	111.7	S307	P305-S307 PolarHBondContact O-N 2.93Å
306	I	50.8	Low	48.5	Very low	169 Å²	169	148.4 Å²	148.4	87%	0.867	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-63.8	123.5	173.1	-58.4	170.9	0	0	0	108.8
307	S	47.6	Very low	49.2	Very low	105 Å²	105	148 Å²	148	73%	0.734	81%	0.814	S	S	*	*			trans	-107.8	128	170.2	-72.1	0	0	0	0	111	P305	P305-S307 PolarHBondContact O-N 2.93Å
308	I	47.2	Very low	49.3	Very low	239 Å²	239	143.8 Å²	143.8	100%	1.226	82%	0.819	S	S	*	*			trans	76.7	0	171.4	-38.8	178.3	0	0	0	116

Retrieved 308 of 308 residues in 422.1 ms (Link to these results)

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