A0A087XYZ8_POEFO Loading...

protein-tyrosine-phosphatase

AlphaFold DB , UniProt , Accession A0A087XYZ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 537 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	55.1	Low	56.5	Low	24 Å²	24	65.5 Å²	65.5	12%	0.118	31%	0.306	C	S	.	.				0	143.4	0	179	171.8	69.4	0	0	108.5	L3 L46 V64 V65 L68 V85	M1-L3 HydrophobicContact CE-CD1 3.92Å; M1-L3 HydrophobicContact CE-CG 4.21Å; M1-L46 HydrophobicContact CE-CD1 4.07Å; M1-L46 HydrophobicContact CE-CD2 4.28Å; M1-L46 HydrophobicContact CE-CG 4.4Å; M1-L46 PolarHBondContact N-O 3.48Å; M1-L46 PolarHBondContact O-N 3.42Å; M1-L46 VanDerWaalsContact O-N 3.16Å; M1-V64 HydrophobicContact CE-CG1 4.29Å; M1-V64 HydrophobicContact SD-CG1 4.11Å; M1-V65 HydrophobicContact CG-CG2 3.97Å; M1-V65 HydrophobicContact SD-CG2 3.66Å; M1-L68 HydrophobicContact CE-CD1 4.38Å; M1-L68 HydrophobicContact CE-CD2 4.17Å; M1-L68 HydrophobicContact SD-CD2 3.89Å; M1-V85 HydrophobicContact CG-CG1 4.23Å; M1-V85 HydrophobicContact SD-CG1 3.81Å
2	Y	55.1	Low	57.2	Low	40 Å²	40	71.3 Å²	71.3	16%	0.157	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.3	176.5	-173.3	-84	0	0	0	111.2	A4 N39 R41 K86	Y2-A4 HydrophobicContact CE1-CB 4.22Å; Y2-N39 HydrophobicContact CE2-CB 4.17Å; Y2-R41 PolarHBondContact OH-O 2.95Å; Y2-K86 PolarHBondContact N-O 3.28Å; Y2-K86 PolarHBondContact O-N 2.94Å
3	L	55.6	Low	58.1	Low	0 Å²	0	72 Å²	72	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.7	171.4	-75.1	169.6	0	0	0	110	M1 F18 V22 G43 I44 L46 L73 I82 V85	M1-L3 HydrophobicContact CE-CD1 3.92Å; M1-L3 HydrophobicContact CE-CG 4.21Å; L3-F18 HydrophobicContact CB-CZ 4.29Å; L3-F18 HydrophobicContact CD1-CE2 4.1Å; L3-F18 HydrophobicContact CD1-CZ 3.62Å; L3-V22 HydrophobicContact CD1-CG2 3.86Å; L3-G43 CarbonylContact O-C 3.12Å; L3-G43 WeakPolarHBondContact O-CA 3.26Å; L3-I44 PolarHBondContact N-O 3.34Å; L3-I44 PolarHBondContact O-N 2.9Å; L3-L46 HydrophobicContact CD1-CD2 3.95Å; L3-L73 HydrophobicContact CD2-CD2 4.12Å; L3-I82 HydrophobicContact CD2-CG2 4.22Å; L3-V85 HydrophobicContact CD2-CB 4.07Å; L3-V85 HydrophobicContact CD2-CG1 3.84Å; L3-V85 HydrophobicContact CD2-CG2 3.63Å
4	A	51.8	Low	58.9	Low	18 Å²	18	72.1 Å²	72.1	15%	0.149	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	121.9	176	0	0	0	0	0	110.9	Y2 N42 A84	Y2-A4 HydrophobicContact CE1-CB 4.22Å; A4-N42 WeakPolarHBondContact CA-O 3.46Å; A4-A84 PolarHBondContact N-O 3.01Å
5	V	59.1	Low	59.6	Low	6 Å²	6	70.3 Å²	70.3	4%	0.036	35%	0.347	C	S	.	.			trans	-148.4	143.7	-174.1	176.1	0	0	0	0	109.8	V7 L10 F18 N42 I44 F80 I82	V5-V7 VanDerWaalsContact C-N 3.3Å; V5-V7 PolarHBondContact O-N 3.48Å; V5-L10 HydrophobicContact CG1-CD1 4.39Å; V5-L10 HydrophobicContact CG1-CD2 4.27Å; V5-F18 HydrophobicContact CG2-CD2 4.44Å; V5-F18 HydrophobicContact CG2-CE2 3.83Å; V5-N42 PolarHBondContact N-O 3.36Å; V5-N42 CarbonylContact O-C 3.58Å; V5-N42 WeakPolarHBondContact O-CA 3.42Å; V5-N42 WeakPolarHBondContact O-CB 3.46Å; V5-I44 HydrophobicContact CB-CD1 4.2Å; V5-I44 HydrophobicContact CB-CG1 4.23Å; V5-I44 HydrophobicContact CG1-CD1 4.22Å; V5-I44 HydrophobicContact CG2-CD1 4.19Å; V5-I44 HydrophobicContact CG2-CG1 4.36Å; V5-F80 HydrophobicContact CG1-CB 4.12Å; V5-F80 HydrophobicContact CG1-CD1 3.94Å; V5-F80 HydrophobicContact CG1-CG 4.4Å; V5-I82 HydrophobicContact CG2-CG1 4.14Å
6	G	57.4	Low	60.5	Low	43 Å²	43	71 Å²	71	44%	0.443	35%	0.352	S	S	.	.			trans	-67.7	73.7	177.2	0	0	0	0	0	115	R8 R9	G6-R8 PolarHBondContact O-N 3Å; G6-R9 PolarHBondContact O-N 2.98Å
7	V	57.1	Low	61.3	Low	30 Å²	30	73.1 Å²	73.1	18%	0.182	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-51.6	-31.1	-172.1	173.9	0	0	0	0	114.2	V5 R9 L10 L38	V5-V7 VanDerWaalsContact C-N 3.3Å; V5-V7 PolarHBondContact O-N 3.48Å; V7-R9 PolarHBondContact O-N 3.36Å; V7-L10 HydrophobicContact CB-CD1 4.3Å; V7-L10 HydrophobicContact CG1-CD1 4.38Å; V7-L10 HydrophobicContact CG2-CD1 4.17Å; V7-L10 PolarHBondContact O-N 3.07Å; V7-L10 VanDerWaalsContact O-N 3.13Å; V7-L38 HydrophobicContact CG1-CB 4.14Å; V7-L38 HydrophobicContact CG1-CD1 4.29Å
8	R	51.2	Low	62.1	Low	230 Å²	230	69.1 Å²	69.1	87%	0.868	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-64.1	-1.6	-177.7	-58.1	-172.4	-174.5	-172	1.7	115.8	G6	G6-R8 PolarHBondContact O-N 3Å
9	R	54.1	Low	63.1	Low	219 Å²	219	69.2 Å²	69.2	83%	0.826	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-124.2	10.8	175.4	-65.4	-174.1	177.2	-176	-0.5	114	G6 V7 H14	G6-R9 PolarHBondContact O-N 2.98Å; V7-R9 PolarHBondContact O-N 3.36Å; R9-H14 PolarHBondContact O-CE1 3.14Å; R9-H14 PolarHBondContact O-ND1 3.27Å
10	L	60.2	Low	63.9	Low	35 Å²	35	68.6 Å²	68.6	18%	0.183	33%	0.33	C	S	.	.			trans	-81.9	134.9	-178.4	-59.6	178.4	0	0	0	111.9	V5 V7 H14 L15 L38 I44 F80	V5-L10 HydrophobicContact CG1-CD1 4.39Å; V5-L10 HydrophobicContact CG1-CD2 4.27Å; V7-L10 HydrophobicContact CB-CD1 4.3Å; V7-L10 HydrophobicContact CG1-CD1 4.38Å; V7-L10 HydrophobicContact CG2-CD1 4.17Å; V7-L10 PolarHBondContact O-N 3.07Å; V7-L10 VanDerWaalsContact O-N 3.13Å; L10-H14 HydrophobicContact CD2-CB 4.05Å; L10-L15 HydrophobicContact CB-CD2 4.39Å; L10-L15 HydrophobicContact CD1-CD2 3.94Å; L10-L38 HydrophobicContact CD1-CD2 4.27Å; L10-I44 HydrophobicContact CD1-CD1 3.81Å; L10-I44 HydrophobicContact CD1-CG1 4.42Å; L10-F80 HydrophobicContact CD2-CD1 3.88Å; L10-F80 HydrophobicContact CD2-CE1 3.52Å
11	N	64.9	Low	64.6	Low	76 Å²	76	65.4 Å²	65.4	41%	0.406	32%	0.315	S	S	.	.			trans	-122.1	-179.1	166.5	68	31.6	0	0	0	109.3	S13 H14 L15	N11-S13 PolarHBondContact O-N 3.48Å; N11-S13 WeakPolarHBondContact OD1-CA 3.38Å; N11-S13 WeakPolarHBondContact OD1-CB 3.29Å; N11-S13 PolarHBondContact OD1-N 2.82Å; N11-H14 PolarHBondContact N-ND1 3.38Å; N11-H14 PolarHBondContact ND2-CE1 3.19Å; N11-H14 VanDerWaalsContact ND2-CE1 3.27Å; N11-H14 PolarHBondContact ND2-NE2 3.5Å; N11-H14 PolarHBondContact O-N 2.63Å; N11-H14 PolarHBondContact OD1-CD2 3.5Å; N11-H14 VanDerWaalsContact OD1-CG 3.22Å; N11-H14 PolarHBondContact OD1-N 3.24Å; N11-L15 WeakPolarHBondContact O-CG 3.35Å; N11-L15 PolarHBondContact O-N 3.4Å
12	I	64.5	Low	65.7	Low	134 Å²	134	64.2 Å²	64.2	69%	0.687	31%	0.31	S	S	*	.	H	α-helix	trans	-60.1	-43.1	-177.7	-61.4	175.5	0	0	0	111.7	H14 L15 L16	I12-H14 VanDerWaalsContact C-N 3.33Å; I12-H14 PolarHBondContact O-N 2.89Å; I12-L15 PolarHBondContact O-N 2.79Å; I12-L16 HydrophobicContact CG2-CD1 4.25Å; I12-L16 WeakPolarHBondContact O-CG 3.26Å; I12-L16 PolarHBondContact O-N 2.76Å
13	S	68.7	Low	66.9	Low	81 Å²	81	62.3 Å²	62.3	57%	0.566	30%	0.302	S	S	*	.	H	α-helix	trans	-62	-40	176.8	-47.4	0	0	0	0	112.2	N11 L16 W17	N11-S13 PolarHBondContact O-N 3.48Å; N11-S13 WeakPolarHBondContact OD1-CA 3.38Å; N11-S13 WeakPolarHBondContact OD1-CB 3.29Å; N11-S13 PolarHBondContact OD1-N 2.82Å; S13-L16 PolarHBondContact O-N 3.11Å; S13-W17 WeakPolarHBondContact O-CB 3.49Å; S13-W17 PolarHBondContact O-N 3.42Å
14	H	69.3	Low	68.2	Low	73 Å²	73	64.5 Å²	64.5	34%	0.338	32%	0.32	S	S	.	.	H	α-helix	trans	-66	-36.8	175.1	-59.4	167.4	0	0	0	111.7	R9 L10 N11 I12 F18 F80	R9-H14 PolarHBondContact O-CE1 3.14Å; R9-H14 PolarHBondContact O-ND1 3.27Å; L10-H14 HydrophobicContact CD2-CB 4.05Å; N11-H14 PolarHBondContact N-ND1 3.38Å; N11-H14 PolarHBondContact ND2-CE1 3.19Å; N11-H14 VanDerWaalsContact ND2-CE1 3.27Å; N11-H14 PolarHBondContact ND2-NE2 3.5Å; N11-H14 PolarHBondContact O-N 2.63Å; N11-H14 PolarHBondContact OD1-CD2 3.5Å; N11-H14 VanDerWaalsContact OD1-CG 3.22Å; N11-H14 PolarHBondContact OD1-N 3.24Å; I12-H14 VanDerWaalsContact C-N 3.33Å; I12-H14 PolarHBondContact O-N 2.89Å; H14-F18 WeakPolarHBondContact O-CB 3.34Å; H14-F18 PolarHBondContact O-N 3.35Å; H14-F80 HydrophobicContact CB-CE1 4.02Å; H14-F80 HydrophobicContact CB-CZ 4.15Å; H14-F80 VanDerWaalsContact O-CZ 3.29Å; H14-F80 WeakPolarHBondContact O-CZ 3.41Å
15	L	69.9	Low	69.5	Low	46 Å²	46	63.7 Å²	63.7	24%	0.241	31%	0.313	C	S	.	.	H	α-helix	trans	-71	-35.4	176.3	-68.1	172	0	0	0	112.6	L10 N11 I12 R19 I35 L38 I44	L10-L15 HydrophobicContact CB-CD2 4.39Å; L10-L15 HydrophobicContact CD1-CD2 3.94Å; N11-L15 WeakPolarHBondContact O-CG 3.35Å; N11-L15 PolarHBondContact O-N 3.4Å; I12-L15 PolarHBondContact O-N 2.79Å; L15-R19 WeakPolarHBondContact O-CB 3.34Å; L15-R19 PolarHBondContact O-N 2.93Å; L15-I35 HydrophobicContact CB-CD1 4.33Å; L15-I35 HydrophobicContact CD2-CD1 4.12Å; L15-L38 HydrophobicContact CD2-CD2 4.02Å; L15-I44 HydrophobicContact CD2-CD1 4.44Å
16	L	73.5	Confident	70.4	Confident	81 Å²	81	64.2 Å²	64.2	42%	0.424	32%	0.316	S	S	.	.	H	α-helix	trans	-64.6	-53	171.9	-71	169.5	0	0	0	110.7	I12 S13 F18 R19 D20	I12-L16 HydrophobicContact CG2-CD1 4.25Å; I12-L16 WeakPolarHBondContact O-CG 3.26Å; I12-L16 PolarHBondContact O-N 2.76Å; S13-L16 PolarHBondContact O-N 3.11Å; L16-F18 VanDerWaalsContact C-N 3.3Å; L16-F18 PolarHBondContact O-N 3.46Å; L16-R19 WeakPolarHBondContact O-CB 3.38Å; L16-R19 PolarHBondContact O-N 3.19Å; L16-R19 VanDerWaalsContact O-N 3.09Å; L16-D20 PolarHBondContact O-N 3.48Å
17	W	74.8	Confident	71.4	Confident	107 Å²	107	65.5 Å²	65.5	41%	0.405	33%	0.329	S	S	.	.	H	α-helix	trans	-61.8	-37.2	179.3	-172.7	48.5	0	0	0	112.6	S13 D20 G21 H76 D79 F80	S13-W17 WeakPolarHBondContact O-CB 3.49Å; S13-W17 PolarHBondContact O-N 3.42Å; W17-D20 PolarHBondContact O-N 2.83Å; W17-G21 PolarHBondContact O-N 3.26Å; W17-H76 WeakPolarHBondContact CZ2-O 3.32Å; W17-D79 HydrophobicContact CH2-CB 4.11Å; W17-D79 WeakPolarHBondContact CH2-OD2 3.44Å; W17-D79 HydrophobicContact CZ3-CB 4.08Å; W17-F80 HydrophobicContact CD2-CE2 4.05Å; W17-F80 HydrophobicContact CE3-CD2 4.29Å; W17-F80 AromaticContact CE3-CE2 3.27Å; W17-F80 HydrophobicContact CE3-CE2 3.27Å; W17-F80 AromaticContact CE3-CZ 3.59Å; W17-F80 HydrophobicContact CE3-CZ 3.59Å; W17-F80 HydrophobicContact CH2-CE2 4.45Å; W17-F80 HydrophobicContact CZ3-CD2 4.11Å; W17-F80 AromaticContact CZ3-CE2 3.52Å; W17-F80 HydrophobicContact CZ3-CE2 3.52Å; W17-F80 HydrophobicContact CZ3-CZ 4.05Å
18	F	75.9	Confident	72.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-59.6	-48.8	171	174.2	-93.2	0	0	0	112.6	L3 V5 H14 L16 D20 G21 V22 I35 I44 L46 L77 F80 I82	L3-F18 HydrophobicContact CB-CZ 4.29Å; L3-F18 HydrophobicContact CD1-CE2 4.1Å; L3-F18 HydrophobicContact CD1-CZ 3.62Å; V5-F18 HydrophobicContact CG2-CD2 4.44Å; V5-F18 HydrophobicContact CG2-CE2 3.83Å; H14-F18 WeakPolarHBondContact O-CB 3.34Å; H14-F18 PolarHBondContact O-N 3.35Å; L16-F18 VanDerWaalsContact C-N 3.3Å; L16-F18 PolarHBondContact O-N 3.46Å; F18-D20 VanDerWaalsContact C-N 3.31Å; F18-D20 PolarHBondContact O-N 2.67Å; F18-G21 PolarHBondContact O-N 2.54Å; F18-V22 HydrophobicContact CD1-CG2 4.35Å; F18-V22 HydrophobicContact CE1-CG2 3.88Å; F18-V22 HydrophobicContact CE2-CG2 4.12Å; F18-V22 HydrophobicContact CZ-CG2 3.76Å; F18-V22 WeakPolarHBondContact O-CG2 3.29Å; F18-V22 PolarHBondContact O-N 2.77Å; F18-I35 HydrophobicContact CD1-CD1 4.06Å; F18-I44 HydrophobicContact CD1-CD1 3.81Å; F18-I44 HydrophobicContact CD1-CG2 4.4Å; F18-I44 HydrophobicContact CD2-CD1 3.97Å; F18-I44 HydrophobicContact CE1-CB 4.01Å; F18-I44 HydrophobicContact CE1-CD1 3.69Å; F18-I44 HydrophobicContact CE1-CG1 4.43Å; F18-I44 HydrophobicContact CE1-CG2 3.65Å; F18-I44 HydrophobicContact CE2-CD1 3.85Å; F18-I44 HydrophobicContact CG-CD1 3.95Å; F18-I44 HydrophobicContact CZ-CB 3.92Å; F18-I44 HydrophobicContact CZ-CD1 3.69Å; F18-I44 HydrophobicContact CZ-CG1 4.28Å; F18-I44 HydrophobicContact CZ-CG2 4.08Å; F18-L46 HydrophobicContact CE1-CD2 3.89Å; F18-L46 HydrophobicContact CZ-CD2 4.11Å; F18-L77 HydrophobicContact CD2-CD1 3.96Å; F18-L77 HydrophobicContact CD2-CD2 4.28Å; F18-L77 HydrophobicContact CE2-CD1 4.06Å; F18-F80 HydrophobicContact CB-CE2 4.13Å; F18-F80 HydrophobicContact CB-CZ 4.02Å; F18-I82 HydrophobicContact CE2-CD1 4.33Å
19	R	80.6	Confident	73.9	Confident	72 Å²	72	55.6 Å²	55.6	27%	0.272	30%	0.298	S	S	.	.	H	α-helix	trans	-59.6	-44	177.5	-178.7	-161.1	67.4	176.6	-3.2	111	L15 L16 V22 A23 P30 V33	L15-R19 WeakPolarHBondContact O-CB 3.34Å; L15-R19 PolarHBondContact O-N 2.93Å; L16-R19 WeakPolarHBondContact O-CB 3.38Å; L16-R19 PolarHBondContact O-N 3.19Å; L16-R19 VanDerWaalsContact O-N 3.09Å; R19-V22 PolarHBondContact O-N 3.38Å; R19-A23 WeakPolarHBondContact O-CB 3.49Å; R19-A23 PolarHBondContact O-N 2.97Å; R19-P30 VanDerWaalsContact CD-O 3.29Å; R19-P30 WeakPolarHBondContact CD-O 2.99Å; R19-P30 HydrophobicContact CG-CB 4.47Å; R19-V33 WeakPolarHBondContact CD-O 3.09Å; R19-V33 HydrophobicContact CG-CB 3.81Å; R19-V33 HydrophobicContact CG-CG1 3.86Å; R19-V33 WeakPolarHBondContact CG-O 3.37Å
20	D	78.9	Confident	75.1	Confident	57 Å²	57	47.1 Å²	47.1	31%	0.305	27%	0.271	S	S	.	.	H	α-helix	trans	-68.2	-38.5	-177.3	-58.2	-12.6	0	0	0	111	L16 W17 F18 A23 A24 P30	L16-D20 PolarHBondContact O-N 3.48Å; W17-D20 PolarHBondContact O-N 2.83Å; F18-D20 VanDerWaalsContact C-N 3.31Å; F18-D20 PolarHBondContact O-N 2.67Å; D20-A23 WeakPolarHBondContact O-CB 3.25Å; D20-A23 PolarHBondContact O-N 2.81Å; D20-A24 WeakPolarHBondContact O-CB 3.26Å; D20-A24 PolarHBondContact O-N 2.97Å; D20-P30 HydrophobicContact CB-CG 4.27Å; D20-P30 WeakPolarHBondContact OD1-CB 3.48Å
21	G	78.9	Confident	76	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-68.5	-36.1	172.5	0	0	0	0	0	114.4	W17 F18 A23 A25	W17-G21 PolarHBondContact O-N 3.26Å; F18-G21 PolarHBondContact O-N 2.54Å; G21-A23 VanDerWaalsContact C-N 3.34Å; G21-A25 WeakPolarHBondContact O-CB 3.32Å; G21-A25 PolarHBondContact O-N 3.43Å; G21-A25 VanDerWaalsContact O-N 3.07Å
22	V	78	Confident	76.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.4	-38.5	170.6	170.4	0	0	0	0	111.1	L3 F18 R19 A25 L26 V33 L46 L73 L77	L3-V22 HydrophobicContact CD1-CG2 3.86Å; F18-V22 HydrophobicContact CD1-CG2 4.35Å; F18-V22 HydrophobicContact CE1-CG2 3.88Å; F18-V22 HydrophobicContact CE2-CG2 4.12Å; F18-V22 HydrophobicContact CZ-CG2 3.76Å; F18-V22 WeakPolarHBondContact O-CG2 3.29Å; F18-V22 PolarHBondContact O-N 2.77Å; R19-V22 PolarHBondContact O-N 3.38Å; V22-A25 PolarHBondContact O-N 2.95Å; V22-L26 HydrophobicContact CG1-CD1 3.87Å; V22-L26 WeakPolarHBondContact O-CG 3.25Å; V22-L26 PolarHBondContact O-N 2.82Å; V22-V33 HydrophobicContact CB-CG1 4.13Å; V22-V33 HydrophobicContact CG1-CG1 3.71Å; V22-V33 HydrophobicContact CG1-CG2 4.29Å; V22-L46 HydrophobicContact CG1-CD1 4.24Å; V22-L46 HydrophobicContact CG1-CD2 3.99Å; V22-L46 HydrophobicContact CG2-CD2 4.16Å; V22-L73 HydrophobicContact CG2-CD1 4.01Å; V22-L77 HydrophobicContact CG2-CD1 3.96Å
23	A	80.5	Confident	76.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.3	-44.4	178.3	0	0	0	0	0	112.1	R19 D20 G21 A25 L26 G27 V28 P30 V33	R19-A23 WeakPolarHBondContact O-CB 3.49Å; R19-A23 PolarHBondContact O-N 2.97Å; D20-A23 WeakPolarHBondContact O-CB 3.25Å; D20-A23 PolarHBondContact O-N 2.81Å; G21-A23 VanDerWaalsContact C-N 3.34Å; A23-A25 VanDerWaalsContact C-N 3.32Å; A23-A25 PolarHBondContact O-N 3.13Å; A23-L26 CarbonylContact O-C 3.6Å; A23-L26 PolarHBondContact O-N 3.4Å; A23-L26 VanDerWaalsContact O-N 3.07Å; A23-G27 PolarHBondContact O-N 2.58Å; A23-V28 HydrophobicContact CB-CG2 4.29Å; A23-V28 WeakPolarHBondContact CB-O 3.48Å; A23-V28 PolarHBondContact O-N 2.92Å; A23-V28 VanDerWaalsContact O-N 3.16Å; A23-P30 HydrophobicContact CB-CB 4Å; A23-P30 HydrophobicContact CB-CG 3.89Å; A23-V33 HydrophobicContact CB-CG2 3.76Å
24	A	82.6	Confident	77.1	Confident	45 Å²	45	42.1 Å²	42.1	37%	0.372	23%	0.233	S	C	.	.	H	α-helix	trans	-58.5	-42.2	172.6	0	0	0	0	0	112.1	D20 L26 G27 V72	D20-A24 WeakPolarHBondContact O-CB 3.26Å; D20-A24 PolarHBondContact O-N 2.97Å; A24-L26 PolarHBondContact O-N 2.97Å; A24-G27 PolarHBondContact O-N 3.28Å; A24-V72 HydrophobicContact CB-CG1 4.35Å
25	A	79.4	Confident	77.1	Confident	2 Å²	2	41.4 Å²	41.4	2%	0.017	23%	0.231	C	C	.	.	H	α-helix	trans	-68.8	-14.2	176.2	0	0	0	0	0	114.7	G21 V22 A23 L68 N69 V72 L73	G21-A25 WeakPolarHBondContact O-CB 3.32Å; G21-A25 PolarHBondContact O-N 3.43Å; G21-A25 VanDerWaalsContact O-N 3.07Å; V22-A25 PolarHBondContact O-N 2.95Å; A23-A25 VanDerWaalsContact C-N 3.32Å; A23-A25 PolarHBondContact O-N 3.13Å; A25-L68 HydrophobicContact CB-CD1 3.92Å; A25-N69 WeakPolarHBondContact O-CB 3.39Å; A25-N69 PolarHBondContact O-N 3.45Å; A25-V72 HydrophobicContact CB-CG1 4.29Å; A25-L73 HydrophobicContact CB-CB 3.68Å; A25-L73 HydrophobicContact CB-CD1 3.64Å; A25-L73 HydrophobicContact CB-CG 4.27Å
26	L	77.7	Confident	76.9	Confident	16 Å²	16	43.8 Å²	43.8	8%	0.084	24%	0.244	C	C	.	.	H	α-helix	trans	-108.8	-5.5	178.4	-73.4	169.7	0	0	0	113.6	V22 A23 A24 V28 V48 V64 L68	V22-L26 HydrophobicContact CG1-CD1 3.87Å; V22-L26 WeakPolarHBondContact O-CG 3.25Å; V22-L26 PolarHBondContact O-N 2.82Å; A23-L26 CarbonylContact O-C 3.6Å; A23-L26 PolarHBondContact O-N 3.4Å; A23-L26 VanDerWaalsContact O-N 3.07Å; A24-L26 PolarHBondContact O-N 2.97Å; L26-V28 HydrophobicContact CB-CG2 3.99Å; L26-V48 HydrophobicContact CD1-CG1 4.48Å; L26-V48 HydrophobicContact CD1-CG2 3.73Å; L26-V64 HydrophobicContact CD1-CG1 4.21Å; L26-V64 HydrophobicContact CD2-CG1 4.04Å; L26-V64 WeakPolarHBondContact CD2-O 3.39Å; L26-L68 HydrophobicContact CD2-CB 4.13Å; L26-L68 HydrophobicContact CD2-CD1 3.86Å; L26-L68 HydrophobicContact CG-CD1 3.9Å
27	G	78.2	Confident	76.5	Confident	70 Å²	70	46 Å²	46	72%	0.722	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.9	32.2	-176.3	0	0	0	0	0	114.1	A23 A24	A23-G27 PolarHBondContact O-N 2.58Å; A24-G27 PolarHBondContact O-N 3.28Å
28	V	81	Confident	76.1	Confident	18 Å²	18	44.4 Å²	44.4	11%	0.109	25%	0.249	C	C	.	.	S	Bend	trans	-124.2	159.7	-179.6	-60.9	0	0	0	0	111.6	A23 L26 H32 V33	A23-V28 HydrophobicContact CB-CG2 4.29Å; A23-V28 WeakPolarHBondContact CB-O 3.48Å; A23-V28 PolarHBondContact O-N 2.92Å; A23-V28 VanDerWaalsContact O-N 3.16Å; L26-V28 HydrophobicContact CB-CG2 3.99Å; V28-H32 HydrophobicContact CB-CB 4.47Å; V28-H32 HydrophobicContact CG2-CB 4.44Å; V28-V33 HydrophobicContact CG2-CG2 3.96Å
29	A	80	Confident	75.3	Confident	35 Å²	35	46.6 Å²	46.6	29%	0.289	26%	0.261	S	S	.	.			trans	-65.1	142.3	170.8	0	0	0	0	0	111.5	Q31 H32	A29-Q31 HydrophobicContact CB-CG 4.01Å; A29-Q31 PolarHBondContact O-N 2.95Å; A29-H32 WeakPolarHBondContact O-CB 3.48Å; A29-H32 PolarHBondContact O-N 3.26Å
30	P	78.9	Confident	73.8	Confident	41 Å²	41	48.1 Å²	48.1	27%	0.266	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-60.4	-23.4	-176.9	-24.6	32.9	0	0	0	115.7	R19 D20 A23 H32 V33	R19-P30 VanDerWaalsContact CD-O 3.29Å; R19-P30 WeakPolarHBondContact CD-O 2.99Å; R19-P30 HydrophobicContact CG-CB 4.47Å; D20-P30 HydrophobicContact CB-CG 4.27Å; D20-P30 WeakPolarHBondContact OD1-CB 3.48Å; A23-P30 HydrophobicContact CB-CB 4Å; A23-P30 HydrophobicContact CB-CG 3.89Å; P30-H32 PolarHBondContact O-N 2.94Å; P30-H32 VanDerWaalsContact O-N 3.16Å; P30-V33 PolarHBondContact O-N 3.23Å; P30-V33 VanDerWaalsContact O-N 3.12Å
31	Q	79.1	Confident	72.8	Confident	133 Å²	133	55.7 Å²	55.7	62%	0.621	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-61.5	-15.9	172.3	75.4	-163.2	22.2	0	0	113.9	A29 H34	A29-Q31 HydrophobicContact CB-CG 4.01Å; A29-Q31 PolarHBondContact O-N 2.95Å; Q31-H34 PolarHBondContact O-CE1 2.85Å; Q31-H34 PolarHBondContact O-NE2 3.18Å
32	H	73.6	Confident	71.9	Confident	31 Å²	31	58.8 Å²	58.8	14%	0.144	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-94.3	-2.9	177.8	-55.9	142.7	0	0	0	113.3	V28 A29 P30 H34 V48 S49 E51	V28-H32 HydrophobicContact CB-CB 4.47Å; V28-H32 HydrophobicContact CG2-CB 4.44Å; A29-H32 WeakPolarHBondContact O-CB 3.48Å; A29-H32 PolarHBondContact O-N 3.26Å; P30-H32 PolarHBondContact O-N 2.94Å; P30-H32 VanDerWaalsContact O-N 3.16Å; H32-H34 PolarHBondContact O-CD2 3.05Å; H32-V48 VanDerWaalsContact O-CA 3.3Å; H32-V48 WeakPolarHBondContact O-CA 3.04Å; H32-S49 WeakPolarHBondContact CA-OG 3.48Å; H32-S49 PolarHBondContact O-N 2.87Å; H32-S49 PolarHBondContact O-OG 3.31Å; H32-E51 IonicContact CE1-OE1 3.05Å; H32-E51 PolarHBondContact CE1-OE1 2.84Å; H32-E51 IonicContact ND1-OE1 2.85Å; H32-E51 PolarHBondContact ND1-OE1 3.36Å
33	V	73.3	Confident	71	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.024	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	112.5	178.5	178	0	0	0	0	109.5	R19 V22 A23 V28 P30 L46	R19-V33 WeakPolarHBondContact CD-O 3.09Å; R19-V33 HydrophobicContact CG-CB 3.81Å; R19-V33 HydrophobicContact CG-CG1 3.86Å; R19-V33 WeakPolarHBondContact CG-O 3.37Å; V22-V33 HydrophobicContact CB-CG1 4.13Å; V22-V33 HydrophobicContact CG1-CG1 3.71Å; V22-V33 HydrophobicContact CG1-CG2 4.29Å; A23-V33 HydrophobicContact CB-CG2 3.76Å; V28-V33 HydrophobicContact CG2-CG2 3.96Å; P30-V33 PolarHBondContact O-N 3.23Å; P30-V33 VanDerWaalsContact O-N 3.12Å; V33-L46 HydrophobicContact CG1-CD1 4.27Å
34	H	74.7	Confident	70.3	Confident	53 Å²	53	58.8 Å²	58.8	25%	0.245	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	120.2	-171	-55.9	-81.4	0	0	0	110.7	Q31 H32 N36 L46 F47 S49	Q31-H34 PolarHBondContact O-CE1 2.85Å; Q31-H34 PolarHBondContact O-NE2 3.18Å; H32-H34 PolarHBondContact O-CD2 3.05Å; H34-N36 PolarHBondContact O-N 3.33Å; H34-L46 CarbonylContact O-C 3.58Å; H34-L46 WeakPolarHBondContact O-CA 3.42Å; H34-L46 VanDerWaalsContact O-CB 3.32Å; H34-L46 WeakPolarHBondContact O-CB 3.42Å; H34-F47 HydrophobicContact CB-CD1 4.03Å; H34-F47 HydrophobicContact CB-CD2 3.71Å; H34-F47 HydrophobicContact CB-CE1 3.68Å; H34-F47 HydrophobicContact CB-CE2 3.35Å; H34-F47 HydrophobicContact CB-CG 4.06Å; H34-F47 HydrophobicContact CB-CZ 3.33Å; H34-F47 AromaticContact CD2-CD2 3.76Å; H34-F47 AromaticContact CD2-CE2 3.48Å; H34-F47 VanDerWaalsContact CD2-CE2 3.48Å; H34-F47 WeakPolarHBondContact CD2-CE2 3.11Å; H34-F47 AromaticContact CG-CD2 4Å; H34-F47 AromaticContact CG-CE2 3.46Å; H34-F47 VanDerWaalsContact CG-CE2 3.46Å; H34-F47 AromaticContact CG-CZ 3.82Å; H34-F47 PolarHBondContact N-O 2.78Å; H34-F47 PolarHBondContact O-N 3.23Å; H34-S49 PolarHBondContact NE2-OG 3.07Å; H34-S49 VanDerWaalsContact NE2-OG 3.16Å
35	I	69.1	Low	69.7	Low	57 Å²	57	59.5 Å²	59.5	29%	0.292	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	112.9	175.8	-60.2	175.3	0	0	0	108.1	L15 F18 L38 I44	L15-I35 HydrophobicContact CB-CD1 4.33Å; L15-I35 HydrophobicContact CD2-CD1 4.12Å; F18-I35 HydrophobicContact CD1-CD1 4.06Å; I35-L38 HydrophobicContact CG2-CD2 4.46Å; I35-I44 HydrophobicContact CD1-CG2 4.46Å; I35-I44 HydrophobicContact CG1-CG2 4.27Å; I35-I44 HydrophobicContact CG2-CG2 3.73Å
36	N	65.9	Low	69.3	Low	96 Å²	96	59.6 Å²	59.6	51%	0.513	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-46.4	179	-167.5	32.4	0	0	0	111.3	H34 E45 F47	H34-N36 PolarHBondContact O-N 3.33Å; N36-E45 PolarHBondContact N-O 3.18Å; N36-E45 PolarHBondContact ND2-OE1 2.72Å; N36-F47 HydrophobicContact CB-CD1 4.09Å; N36-F47 HydrophobicContact CB-CE1 4.2Å
37	K	66.1	Low	69.2	Low	128 Å²	128	62.7 Å²	62.7	56%	0.557	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157	144.9	-170.5	-166.3	170.1	-180	177.1	0	113	E45	K37-E45 HydrophobicContact CB-CB 4.14Å; K37-E45 PolarHBondContact N-O 3.29Å; K37-E45 WeakPolarHBondContact O-CB 3.46Å; K37-E45 PolarHBondContact O-N 2.59Å
38	L	65.6	Low	68.9	Low	73 Å²	73	59.5 Å²	59.5	38%	0.382	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	120.2	163.5	-58.7	178.7	0	0	0	108.5	V7 L10 L15 I35 I44	V7-L38 HydrophobicContact CG1-CB 4.14Å; V7-L38 HydrophobicContact CG1-CD1 4.29Å; L10-L38 HydrophobicContact CD1-CD2 4.27Å; L15-L38 HydrophobicContact CD2-CD2 4.02Å; I35-L38 HydrophobicContact CG2-CD2 4.46Å; L38-I44 HydrophobicContact CD2-CB 4.44Å; L38-I44 HydrophobicContact CD2-CD1 4.24Å; L38-I44 HydrophobicContact CD2-CG1 3.83Å; L38-I44 HydrophobicContact CD2-CG2 4.18Å
39	N	59	Low	68.5	Low	47 Å²	47	59.1 Å²	59.1	25%	0.251	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	136.1	-175.4	-168.3	-38.9	0	0	0	110.6	Y2 R41 N42 G43	Y2-N39 HydrophobicContact CE2-CB 4.17Å; N39-R41 PolarHBondContact O-N 2.88Å; N39-R41 VanDerWaalsContact O-N 3.08Å; N39-R41 PolarHBondContact OD1-N 3.26Å; N39-N42 PolarHBondContact O-N 3.08Å; N39-N42 VanDerWaalsContact O-N 3.14Å; N39-G43 PolarHBondContact N-O 3.06Å; N39-G43 PolarHBondContact O-N 2.96Å
40	A	50.4	Low	67.8	Low	104 Å²	104	58.9 Å²	58.9	86%	0.86	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.9	176.8	0	0	0	0	0	113.6	N42	A40-N42 PolarHBondContact O-N 3.31Å
41	R	56.7	Low	66.7	Low	215 Å²	215	62 Å²	62	81%	0.811	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	26.8	173.5	-64.5	-175.6	173	175.7	-2.4	114.2	Y2 N39	Y2-R41 PolarHBondContact OH-O 2.95Å; N39-R41 PolarHBondContact O-N 2.88Å; N39-R41 VanDerWaalsContact O-N 3.08Å; N39-R41 PolarHBondContact OD1-N 3.26Å
42	N	60.8	Low	65.4	Low	67 Å²	67	64.1 Å²	64.1	36%	0.358	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	63.4	-175.2	-72.9	-30.6	0	0	0	111.9	A4 V5 N39 A40	A4-N42 WeakPolarHBondContact CA-O 3.46Å; V5-N42 PolarHBondContact N-O 3.36Å; V5-N42 CarbonylContact O-C 3.58Å; V5-N42 WeakPolarHBondContact O-CA 3.42Å; V5-N42 WeakPolarHBondContact O-CB 3.46Å; N39-N42 PolarHBondContact O-N 3.08Å; N39-N42 VanDerWaalsContact O-N 3.14Å; A40-N42 PolarHBondContact O-N 3.31Å
43	G	58.4	Low	64.1	Low	0 Å²	0	73.6 Å²	73.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	159.9	175.7	0	0	0	0	0	113.8	L3 N39	L3-G43 CarbonylContact O-C 3.12Å; L3-G43 WeakPolarHBondContact O-CA 3.26Å; N39-G43 PolarHBondContact N-O 3.06Å; N39-G43 PolarHBondContact O-N 2.96Å
44	I	64.9	Low	62.7	Low	0 Å²	0	81.4 Å²	81.4	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	122.4	177.1	-52.9	-176.1	0	0	0	108	L3 V5 L10 L15 F18 I35 L38	L3-I44 PolarHBondContact N-O 3.34Å; L3-I44 PolarHBondContact O-N 2.9Å; V5-I44 HydrophobicContact CB-CD1 4.2Å; V5-I44 HydrophobicContact CB-CG1 4.23Å; V5-I44 HydrophobicContact CG1-CD1 4.22Å; V5-I44 HydrophobicContact CG2-CD1 4.19Å; V5-I44 HydrophobicContact CG2-CG1 4.36Å; L10-I44 HydrophobicContact CD1-CD1 3.81Å; L10-I44 HydrophobicContact CD1-CG1 4.42Å; L15-I44 HydrophobicContact CD2-CD1 4.44Å; F18-I44 HydrophobicContact CD1-CD1 3.81Å; F18-I44 HydrophobicContact CD1-CG2 4.4Å; F18-I44 HydrophobicContact CD2-CD1 3.97Å; F18-I44 HydrophobicContact CE1-CB 4.01Å; F18-I44 HydrophobicContact CE1-CD1 3.69Å; F18-I44 HydrophobicContact CE1-CG1 4.43Å; F18-I44 HydrophobicContact CE1-CG2 3.65Å; F18-I44 HydrophobicContact CE2-CD1 3.85Å; F18-I44 HydrophobicContact CG-CD1 3.95Å; F18-I44 HydrophobicContact CZ-CB 3.92Å; F18-I44 HydrophobicContact CZ-CD1 3.69Å; F18-I44 HydrophobicContact CZ-CG1 4.28Å; F18-I44 HydrophobicContact CZ-CG2 4.08Å; I35-I44 HydrophobicContact CD1-CG2 4.46Å; I35-I44 HydrophobicContact CG1-CG2 4.27Å; I35-I44 HydrophobicContact CG2-CG2 3.73Å; L38-I44 HydrophobicContact CD2-CB 4.44Å; L38-I44 HydrophobicContact CD2-CD1 4.24Å; L38-I44 HydrophobicContact CD2-CG1 3.83Å; L38-I44 HydrophobicContact CD2-CG2 4.18Å
45	E	71.1	Confident	61.3	Low	60 Å²	60	83.4 Å²	83.4	28%	0.28	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.1	174.9	-167.7	-159.6	136.8	0	0	108.6	N36 K37	N36-E45 PolarHBondContact N-O 3.18Å; N36-E45 PolarHBondContact ND2-OE1 2.72Å; K37-E45 HydrophobicContact CB-CB 4.14Å; K37-E45 PolarHBondContact N-O 3.29Å; K37-E45 WeakPolarHBondContact O-CB 3.46Å; K37-E45 PolarHBondContact O-N 2.59Å
46	L	70.8	Confident	60.3	Low	4 Å²	4	89.4 Å²	89.4	2%	0.021	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.8	-177.3	73	89.8	0	0	0	113	M1 L3 F18 V22 V33 H34 V48	M1-L46 HydrophobicContact CE-CD1 4.07Å; M1-L46 HydrophobicContact CE-CD2 4.28Å; M1-L46 HydrophobicContact CE-CG 4.4Å; M1-L46 PolarHBondContact N-O 3.48Å; M1-L46 PolarHBondContact O-N 3.42Å; M1-L46 VanDerWaalsContact O-N 3.16Å; L3-L46 HydrophobicContact CD1-CD2 3.95Å; F18-L46 HydrophobicContact CE1-CD2 3.89Å; F18-L46 HydrophobicContact CZ-CD2 4.11Å; V22-L46 HydrophobicContact CG1-CD1 4.24Å; V22-L46 HydrophobicContact CG1-CD2 3.99Å; V22-L46 HydrophobicContact CG2-CD2 4.16Å; V33-L46 HydrophobicContact CG1-CD1 4.27Å; H34-L46 CarbonylContact O-C 3.58Å; H34-L46 WeakPolarHBondContact O-CA 3.42Å; H34-L46 VanDerWaalsContact O-CB 3.32Å; H34-L46 WeakPolarHBondContact O-CB 3.42Å; L46-V48 HydrophobicContact CD1-CG2 3.96Å
47	F	74.8	Confident	59.7	Low	81 Å²	81	89.3 Å²	89.3	36%	0.355	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	162.4	170.3	63	-92.2	0	0	0	111.4	H34 N36 L58	H34-F47 HydrophobicContact CB-CD1 4.03Å; H34-F47 HydrophobicContact CB-CD2 3.71Å; H34-F47 HydrophobicContact CB-CE1 3.68Å; H34-F47 HydrophobicContact CB-CE2 3.35Å; H34-F47 HydrophobicContact CB-CG 4.06Å; H34-F47 HydrophobicContact CB-CZ 3.33Å; H34-F47 AromaticContact CD2-CD2 3.76Å; H34-F47 AromaticContact CD2-CE2 3.48Å; H34-F47 VanDerWaalsContact CD2-CE2 3.48Å; H34-F47 WeakPolarHBondContact CD2-CE2 3.11Å; H34-F47 AromaticContact CG-CD2 4Å; H34-F47 AromaticContact CG-CE2 3.46Å; H34-F47 VanDerWaalsContact CG-CE2 3.46Å; H34-F47 AromaticContact CG-CZ 3.82Å; H34-F47 PolarHBondContact N-O 2.78Å; H34-F47 PolarHBondContact O-N 3.23Å; N36-F47 HydrophobicContact CB-CD1 4.09Å; N36-F47 HydrophobicContact CB-CE1 4.2Å; F47-L58 HydrophobicContact CB-CD2 3.76Å; F47-L58 HydrophobicContact CD2-CD2 3.3Å; F47-L58 HydrophobicContact CE2-CD2 4.01Å; F47-L58 HydrophobicContact CG-CD2 3.7Å
48	V	72.1	Confident	59.2	Low	3 Å²	3	88.2 Å²	88.2	2%	0.018	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	121.7	-176.3	-174.5	0	0	0	0	108.5	L26 H32 L46 R59 V64	L26-V48 HydrophobicContact CD1-CG1 4.48Å; L26-V48 HydrophobicContact CD1-CG2 3.73Å; H32-V48 VanDerWaalsContact O-CA 3.3Å; H32-V48 WeakPolarHBondContact O-CA 3.04Å; L46-V48 HydrophobicContact CD1-CG2 3.96Å; V48-R59 PolarHBondContact O-N 2.81Å; V48-V64 HydrophobicContact CB-CG2 4.13Å; V48-V64 HydrophobicContact CG2-CG1 3.81Å; V48-V64 HydrophobicContact CG2-CG2 4.2Å
49	S	72.6	Confident	59.1	Low	9 Å²	9	88.2 Å²	88.2	6%	0.063	42%	0.42	C	S	.	.	B	Isolated β-bridge	trans	-81.1	143.6	175.2	52.6	0	0	0	0	110.7	H32 H34	H32-S49 WeakPolarHBondContact CA-OG 3.48Å; H32-S49 PolarHBondContact O-N 2.87Å; H32-S49 PolarHBondContact O-OG 3.31Å; H34-S49 PolarHBondContact NE2-OG 3.07Å; H34-S49 VanDerWaalsContact NE2-OG 3.16Å
50	S	65.7	Low	59.5	Low	30 Å²	30	89.2 Å²	89.2	21%	0.21	43%	0.428	C	S	.	.			trans	-77.3	154	174.1	-153.2	0	0	0	0	112.1	R52 E57	S50-R52 PolarHBondContact O-N 2.84Å; S50-E57 PolarHBondContact N-O 3.39Å
51	E	56.2	Low	60.1	Low	107 Å²	107	85.3 Å²	85.3	50%	0.5	40%	0.396	S	S	.	.			trans	-85.9	20.8	-179	-59.5	-167.4	152.3	0	0	113.5	H32	H32-E51 IonicContact CE1-OE1 3.05Å; H32-E51 PolarHBondContact CE1-OE1 2.84Å; H32-E51 IonicContact ND1-OE1 2.85Å; H32-E51 PolarHBondContact ND1-OE1 3.36Å
52	R	51.4	Low	60.4	Low	178 Å²	178	82.8 Å²	82.8	67%	0.672	39%	0.391	S	S	*	.			trans	-78.3	123.7	172.5	-73.2	-176.3	171.5	176.5	-3.9	108.7	S50 E57	S50-R52 PolarHBondContact O-N 2.84Å; R52-E57 IonicContact NH1-OE2 3.91Å
53	R	46.8	Very low	60.7	Low	230 Å²	230	84.5 Å²	84.5	87%	0.868	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	138.6	-173.5	-64.7	-178.8	-178.3	172.4	0.4	111	V55	R53-V55 VanDerWaalsContact C-N 3.32Å; R53-V55 PolarHBondContact O-N 3.26Å
54	D	44.3	Very low	61.1	Low	167 Å²	167	84.7 Å²	84.7	89%	0.893	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	11.2	167.2	-47	-38.8	0	0	0	118
55	V	45.3	Very low	61.3	Low	96 Å²	96	85.8 Å²	85.8	58%	0.582	41%	0.405	S	S	*	.			trans	-136	126.7	163.9	-173.1	0	0	0	0	111.2	R53 E57	R53-V55 VanDerWaalsContact C-N 3.32Å; R53-V55 PolarHBondContact O-N 3.26Å; V55-E57 HydrophobicContact CB-CG 4.45Å; V55-E57 HydrophobicContact CG1-CG 3.94Å; V55-E57 PolarHBondContact O-N 2.84Å
56	F	47.5	Very low	61.2	Low	182 Å²	182	90.5 Å²	90.5	80%	0.798	43%	0.427	S	S	*	.			trans	-75	65.7	175.1	-79.9	-83.2	0	0	0	112.4	L58	F56-L58 PolarHBondContact O-N 2.87Å
57	E	53	Low	61.3	Low	95 Å²	95	92.9 Å²	92.9	44%	0.444	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-71	120.5	171.5	-66.9	-168.4	135.5	0	0	110.9	S50 R52 V55	S50-E57 PolarHBondContact N-O 3.39Å; R52-E57 IonicContact NH1-OE2 3.91Å; V55-E57 HydrophobicContact CB-CG 4.45Å; V55-E57 HydrophobicContact CG1-CG 3.94Å; V55-E57 PolarHBondContact O-N 2.84Å
58	L	57	Low	61.3	Low	105 Å²	105	89.5 Å²	89.5	55%	0.55	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-72.8	120.9	171.9	-73.4	163	0	0	0	109.9	F47 F56 P60	F47-L58 HydrophobicContact CB-CD2 3.76Å; F47-L58 HydrophobicContact CD2-CD2 3.3Å; F47-L58 HydrophobicContact CE2-CD2 4.01Å; F47-L58 HydrophobicContact CG-CD2 3.7Å; F56-L58 PolarHBondContact O-N 2.87Å; L58-P60 WeakPolarHBondContact O-CD 3.2Å
59	R	62	Low	61.6	Low	73 Å²	73	93 Å²	93	28%	0.275	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-63.8	129.1	172.9	-74.1	-168	176.4	-179.8	3.5	110.4	V48 A61 V64	V48-R59 PolarHBondContact O-N 2.81Å; R59-A61 PolarHBondContact O-N 3.36Å; R59-V64 HydrophobicContact CB-CG2 3.57Å
60	P	68.6	Low	61.6	Low	67 Å²	67	99.8 Å²	99.8	44%	0.435	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-53	136.3	176.7	-30.5	37.4	0	0	0	113	L58 K62 E63 V64	L58-P60 WeakPolarHBondContact O-CD 3.2Å; P60-K62 PolarHBondContact O-N 2.84Å; P60-E63 HydrophobicContact CB-CG 4.31Å; P60-E63 WeakPolarHBondContact CG-OE1 3.49Å; P60-E63 PolarHBondContact O-N 3.3Å; P60-V64 PolarHBondContact O-N 3.38Å; P60-V64 VanDerWaalsContact O-N 3.12Å
61	A	61.9	Low	61.7	Low	22 Å²	22	102.5 Å²	102.5	18%	0.182	49%	0.491	C	S	.	.	H	α-helix	trans	-59.6	-23.4	-173.6	0	0	0	0	0	114.2	R59 V65	R59-A61 PolarHBondContact O-N 3.36Å; A61-V65 VanDerWaalsContact O-CG2 3.28Å; A61-V65 WeakPolarHBondContact O-CG2 3.41Å; A61-V65 PolarHBondContact O-N 3.02Å
62	K	62.8	Low	62.7	Low	163 Å²	163	99.4 Å²	99.4	71%	0.709	48%	0.479	S	S	*	.	H	α-helix	trans	-68.3	-48.6	171.7	-70.7	-174.9	176.5	-177.8	0	112	P60 V65 Q66	P60-K62 PolarHBondContact O-N 2.84Å; K62-V65 PolarHBondContact O-N 3.11Å; K62-Q66 WeakPolarHBondContact O-CG 3.29Å; K62-Q66 PolarHBondContact O-N 3.18Å
63	E	66.9	Low	63.7	Low	102 Å²	102	90.9 Å²	90.9	48%	0.477	45%	0.447	S	S	.	.	H	α-helix	trans	-65	-40.6	-179.4	-66.9	170.5	-151.5	0	0	111.5	P60 V65 Q66 S67	P60-E63 HydrophobicContact CB-CG 4.31Å; P60-E63 WeakPolarHBondContact CG-OE1 3.49Å; P60-E63 PolarHBondContact O-N 3.3Å; E63-V65 VanDerWaalsContact C-N 3.31Å; E63-V65 PolarHBondContact O-N 2.92Å; E63-Q66 PolarHBondContact O-N 3.13Å; E63-S67 WeakPolarHBondContact O-CB 3.45Å; E63-S67 PolarHBondContact O-N 3.15Å; E63-S67 PolarHBondContact O-OG 2.94Å
64	V	68.1	Low	64.7	Low	5 Å²	5	84.3 Å²	84.3	3%	0.03	43%	0.426	C	S	.	.	H	α-helix	trans	-59.9	-42.2	174.4	179	0	0	0	0	110.8	M1 L26 V48 R59 P60 Q66 S67 L68	M1-V64 HydrophobicContact CE-CG1 4.29Å; M1-V64 HydrophobicContact SD-CG1 4.11Å; L26-V64 HydrophobicContact CD1-CG1 4.21Å; L26-V64 HydrophobicContact CD2-CG1 4.04Å; L26-V64 WeakPolarHBondContact CD2-O 3.39Å; V48-V64 HydrophobicContact CB-CG2 4.13Å; V48-V64 HydrophobicContact CG2-CG1 3.81Å; V48-V64 HydrophobicContact CG2-CG2 4.2Å; R59-V64 HydrophobicContact CB-CG2 3.57Å; P60-V64 PolarHBondContact O-N 3.38Å; P60-V64 VanDerWaalsContact O-N 3.12Å; V64-Q66 VanDerWaalsContact C-N 3.35Å; V64-S67 PolarHBondContact O-OG 3.26Å; V64-L68 WeakPolarHBondContact O-CB 3.19Å; V64-L68 PolarHBondContact O-N 3.34Å
65	V	68.6	Low	66.1	Low	23 Å²	23	83.6 Å²	83.6	14%	0.139	42%	0.417	C	S	.	.	H	α-helix	trans	-74	-24.9	178.8	169.8	0	0	0	0	112.7	M1 A61 K62 E63 P87	M1-V65 HydrophobicContact CG-CG2 3.97Å; M1-V65 HydrophobicContact SD-CG2 3.66Å; A61-V65 VanDerWaalsContact O-CG2 3.28Å; A61-V65 WeakPolarHBondContact O-CG2 3.41Å; A61-V65 PolarHBondContact O-N 3.02Å; K62-V65 PolarHBondContact O-N 3.11Å; E63-V65 VanDerWaalsContact C-N 3.31Å; E63-V65 PolarHBondContact O-N 2.92Å; V65-P87 HydrophobicContact CG2-CB 4.34Å
66	Q	68.3	Low	67.3	Low	159 Å²	159	82.4 Å²	82.4	74%	0.743	41%	0.405	S	S	*	.	H	α-helix	trans	-80.3	-35.2	174.1	-74.6	171.4	-41.6	0	0	112.9	K62 E63 V64 L68	K62-Q66 WeakPolarHBondContact O-CG 3.29Å; K62-Q66 PolarHBondContact O-N 3.18Å; E63-Q66 PolarHBondContact O-N 3.13Å; V64-Q66 VanDerWaalsContact C-N 3.35Å; Q66-L68 VanDerWaalsContact C-N 3.31Å
67	S	73	Confident	68.2	Low	53 Å²	53	73.8 Å²	73.8	37%	0.371	37%	0.367	S	S	.	.	H	α-helix	trans	-79.9	-9.1	176.4	51.5	0	0	0	0	114	E63 V64 N69	E63-S67 WeakPolarHBondContact O-CB 3.45Å; E63-S67 PolarHBondContact O-N 3.15Å; E63-S67 PolarHBondContact O-OG 2.94Å; V64-S67 PolarHBondContact O-OG 3.26Å; S67-N69 PolarHBondContact O-N 3.49Å
68	L	76.1	Confident	68.6	Low	10 Å²	10	72.2 Å²	72.2	5%	0.052	37%	0.371	C	S	.	.			trans	-74.5	104.7	-176.6	-171.5	69.1	0	0	0	112.5	M1 A25 L26 V64 Q66 R70 L73 V85	M1-L68 HydrophobicContact CE-CD1 4.38Å; M1-L68 HydrophobicContact CE-CD2 4.17Å; M1-L68 HydrophobicContact SD-CD2 3.89Å; A25-L68 HydrophobicContact CB-CD1 3.92Å; L26-L68 HydrophobicContact CD2-CB 4.13Å; L26-L68 HydrophobicContact CD2-CD1 3.86Å; L26-L68 HydrophobicContact CG-CD1 3.9Å; V64-L68 WeakPolarHBondContact O-CB 3.19Å; V64-L68 PolarHBondContact O-N 3.34Å; Q66-L68 VanDerWaalsContact C-N 3.31Å; L68-R70 PolarHBondContact O-N 3.4Å; L68-L73 HydrophobicContact CD1-CD1 4.25Å; L68-L73 HydrophobicContact CD1-CD2 4.26Å; L68-L73 HydrophobicContact CD2-CD2 3.98Å; L68-L73 HydrophobicContact CG-CD2 4.27Å; L68-V85 HydrophobicContact CD2-CG1 3.76Å; L68-V85 HydrophobicContact CD2-CG2 4.23Å
69	N	76.7	Confident	68.7	Low	78 Å²	78	73.9 Å²	73.9	42%	0.417	38%	0.38	S	S	.	.			trans	-69.8	100.1	172.7	-172.8	-22.6	0	0	0	110.5	A25 S67 S71 V72 L73	A25-N69 WeakPolarHBondContact O-CB 3.39Å; A25-N69 PolarHBondContact O-N 3.45Å; S67-N69 PolarHBondContact O-N 3.49Å; N69-S71 PolarHBondContact O-N 3.23Å; N69-S71 PolarHBondContact OD1-N 2.95Å; N69-S71 PolarHBondContact OD1-OG 3.33Å; N69-V72 HydrophobicContact CB-CB 4.18Å; N69-V72 HydrophobicContact CB-CG2 4.25Å; N69-V72 WeakPolarHBondContact ND2-CG2 3.45Å; N69-V72 PolarHBondContact O-N 2.83Å; N69-V72 PolarHBondContact OD1-N 2.95Å; N69-L73 PolarHBondContact O-N 3.45Å
70	R	72.6	Confident	68.7	Low	150 Å²	150	71.6 Å²	71.6	57%	0.566	37%	0.372	S	S	*	.	H	α-helix	trans	-66.3	-34.4	-172.4	-58.2	-175.2	-172.6	-178.6	2.6	113.4	L68 L73 H74	L68-R70 PolarHBondContact O-N 3.4Å; R70-L73 PolarHBondContact O-N 2.8Å; R70-H74 WeakPolarHBondContact O-CB 3.35Å; R70-H74 PolarHBondContact O-CD2 3.15Å; R70-H74 PolarHBondContact O-N 3.36Å
71	S	69.6	Low	68	Low	88 Å²	88	70.7 Å²	70.7	62%	0.615	38%	0.375	S	S	*	.	H	α-helix	trans	-70.8	-41	178.7	56.6	0	0	0	0	111.2	N69 L73 H74 H75	N69-S71 PolarHBondContact O-N 3.23Å; N69-S71 PolarHBondContact OD1-N 2.95Å; N69-S71 PolarHBondContact OD1-OG 3.33Å; S71-L73 VanDerWaalsContact C-N 3.33Å; S71-L73 PolarHBondContact O-N 3.31Å; S71-H74 PolarHBondContact O-N 3.4Å; S71-H75 VanDerWaalsContact O-CB 3.29Å; S71-H75 WeakPolarHBondContact O-CB 3.44Å; S71-H75 PolarHBondContact O-N 3.02Å
72	V	75.8	Confident	67.7	Low	41 Å²	41	70.2 Å²	70.2	25%	0.248	37%	0.369	C	S	.	.	H	α-helix	trans	-61.7	-41.7	172.7	175.4	0	0	0	0	111.1	A24 A25 N69 H75 H76	A24-V72 HydrophobicContact CB-CG1 4.35Å; A25-V72 HydrophobicContact CB-CG1 4.29Å; N69-V72 HydrophobicContact CB-CB 4.18Å; N69-V72 HydrophobicContact CB-CG2 4.25Å; N69-V72 WeakPolarHBondContact ND2-CG2 3.45Å; N69-V72 PolarHBondContact O-N 2.83Å; N69-V72 PolarHBondContact OD1-N 2.95Å; V72-H75 PolarHBondContact O-N 3.38Å; V72-H76 PolarHBondContact O-N 2.86Å; V72-H76 PolarHBondContact O-ND1 3.08Å
73	L	72.9	Confident	67.2	Low	0 Å²	0	68.4 Å²	68.4	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-62.5	-51	176.4	-168.9	75.2	0	0	0	112.3	L3 V22 A25 L68 N69 R70 S71 H75 H76 L77 I82 V85	L3-L73 HydrophobicContact CD2-CD2 4.12Å; V22-L73 HydrophobicContact CG2-CD1 4.01Å; A25-L73 HydrophobicContact CB-CB 3.68Å; A25-L73 HydrophobicContact CB-CD1 3.64Å; A25-L73 HydrophobicContact CB-CG 4.27Å; L68-L73 HydrophobicContact CD1-CD1 4.25Å; L68-L73 HydrophobicContact CD1-CD2 4.26Å; L68-L73 HydrophobicContact CD2-CD2 3.98Å; L68-L73 HydrophobicContact CG-CD2 4.27Å; N69-L73 PolarHBondContact O-N 3.45Å; R70-L73 PolarHBondContact O-N 2.8Å; S71-L73 VanDerWaalsContact C-N 3.33Å; S71-L73 PolarHBondContact O-N 3.31Å; L73-H75 VanDerWaalsContact C-N 3.27Å; L73-H75 PolarHBondContact O-N 3.19Å; L73-H76 PolarHBondContact O-N 3.31Å; L73-L77 HydrophobicContact CD1-CD1 3.51Å; L73-L77 HydrophobicContact CD1-CG 4.49Å; L73-L77 HydrophobicContact CG-CD1 4.11Å; L73-L77 WeakPolarHBondContact O-CB 3.18Å; L73-L77 PolarHBondContact O-N 3.21Å; L73-I82 HydrophobicContact CG-CD1 4.42Å; L73-V85 HydrophobicContact CD2-CG2 4.36Å
74	H	68.5	Low	66.5	Low	92 Å²	92	65.4 Å²	65.4	43%	0.426	37%	0.365	S	S	.	.	H	α-helix	trans	-66	-29.3	179.3	-77.8	-67.8	0	0	0	112.4	R70 S71 A78 I82	R70-H74 WeakPolarHBondContact O-CB 3.35Å; R70-H74 PolarHBondContact O-CD2 3.15Å; R70-H74 PolarHBondContact O-N 3.36Å; S71-H74 PolarHBondContact O-N 3.4Å; H74-A78 WeakPolarHBondContact O-CA 3.09Å; H74-A78 WeakPolarHBondContact O-CB 3.43Å; H74-A78 PolarHBondContact O-N 3.28Å; H74-I82 PolarHBondContact CE1-O 3.49Å; H74-I82 VanDerWaalsContact CE1-O 3.3Å
75	H	74.1	Confident	65.8	Low	151 Å²	151	66.9 Å²	66.9	70%	0.699	37%	0.374	S	S	*	.	H	α-helix	trans	-71.6	-49.3	174	-174.6	71.1	0	0	0	112.2	S71 V72 L73 L77	S71-H75 VanDerWaalsContact O-CB 3.29Å; S71-H75 WeakPolarHBondContact O-CB 3.44Å; S71-H75 PolarHBondContact O-N 3.02Å; V72-H75 PolarHBondContact O-N 3.38Å; L73-H75 VanDerWaalsContact C-N 3.27Å; L73-H75 PolarHBondContact O-N 3.19Å; H75-L77 VanDerWaalsContact C-N 3.31Å; H75-L77 PolarHBondContact O-N 3.29Å
76	H	68.6	Low	64.9	Low	71 Å²	71	72.3 Å²	72.3	33%	0.329	40%	0.396	S	S	.	.	H	α-helix	trans	-70.7	-25.3	-179.4	-76.5	77.6	0	0	0	113.6	W17 V72 L73	W17-H76 WeakPolarHBondContact CZ2-O 3.32Å; V72-H76 PolarHBondContact O-N 2.86Å; V72-H76 PolarHBondContact O-ND1 3.08Å; L73-H76 PolarHBondContact O-N 3.31Å
77	L	66.6	Low	64	Low	1 Å²	1	68.7 Å²	68.7	1%	0.005	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	27.4	-172	-54	177.2	0	0	0	112.6	F18 V22 L73 H75 D79 F80 I82	F18-L77 HydrophobicContact CD2-CD1 3.96Å; F18-L77 HydrophobicContact CD2-CD2 4.28Å; F18-L77 HydrophobicContact CE2-CD1 4.06Å; V22-L77 HydrophobicContact CG2-CD1 3.96Å; L73-L77 HydrophobicContact CD1-CD1 3.51Å; L73-L77 HydrophobicContact CD1-CG 4.49Å; L73-L77 HydrophobicContact CG-CD1 4.11Å; L73-L77 WeakPolarHBondContact O-CB 3.18Å; L73-L77 PolarHBondContact O-N 3.21Å; H75-L77 VanDerWaalsContact C-N 3.31Å; H75-L77 PolarHBondContact O-N 3.29Å; L77-D79 VanDerWaalsContact C-N 3.34Å; L77-D79 PolarHBondContact O-N 3.15Å; L77-F80 HydrophobicContact CB-CB 4.47Å; L77-F80 HydrophobicContact CB-CD2 3.89Å; L77-F80 HydrophobicContact CD2-CD2 3.57Å; L77-F80 HydrophobicContact CD2-CE2 3.64Å; L77-F80 HydrophobicContact CG-CD2 4.31Å; L77-F80 WeakPolarHBondContact O-CB 3.36Å; L77-F80 PolarHBondContact O-N 2.97Å; L77-F80 VanDerWaalsContact O-N 3.15Å; L77-I82 HydrophobicContact CB-CD1 3.54Å; L77-I82 HydrophobicContact CB-CG1 4.23Å; L77-I82 HydrophobicContact CD1-CD1 3.51Å; L77-I82 HydrophobicContact CG-CD1 4.17Å
78	A	62.9	Low	62.5	Low	63 Å²	63	72 Å²	72	52%	0.521	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-54.3	-48.7	178.4	0	0	0	0	0	111.9	H74 F80 G81	H74-A78 WeakPolarHBondContact O-CA 3.09Å; H74-A78 WeakPolarHBondContact O-CB 3.43Å; H74-A78 PolarHBondContact O-N 3.28Å; A78-F80 PolarHBondContact O-N 3.43Å; A78-F80 VanDerWaalsContact O-N 3.12Å; A78-G81 PolarHBondContact O-N 2.8Å
79	D	59.2	Low	60.7	Low	139 Å²	139	81 Å²	81	74%	0.743	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-65.9	-14.5	-178.4	-60.3	-28.1	0	0	0	113.9	W17 L77	W17-D79 HydrophobicContact CH2-CB 4.11Å; W17-D79 WeakPolarHBondContact CH2-OD2 3.44Å; W17-D79 HydrophobicContact CZ3-CB 4.08Å; L77-D79 VanDerWaalsContact C-N 3.34Å; L77-D79 PolarHBondContact O-N 3.15Å
80	F	60.5	Low	58.7	Low	26 Å²	26	83.2 Å²	83.2	11%	0.114	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-85.1	-10.3	174.7	-70.7	-70.1	0	0	0	113.9	V5 L10 H14 W17 F18 L77 A78 I82	V5-F80 HydrophobicContact CG1-CB 4.12Å; V5-F80 HydrophobicContact CG1-CD1 3.94Å; V5-F80 HydrophobicContact CG1-CG 4.4Å; L10-F80 HydrophobicContact CD2-CD1 3.88Å; L10-F80 HydrophobicContact CD2-CE1 3.52Å; H14-F80 HydrophobicContact CB-CE1 4.02Å; H14-F80 HydrophobicContact CB-CZ 4.15Å; H14-F80 VanDerWaalsContact O-CZ 3.29Å; H14-F80 WeakPolarHBondContact O-CZ 3.41Å; W17-F80 HydrophobicContact CD2-CE2 4.05Å; W17-F80 HydrophobicContact CE3-CD2 4.29Å; W17-F80 AromaticContact CE3-CE2 3.27Å; W17-F80 HydrophobicContact CE3-CE2 3.27Å; W17-F80 AromaticContact CE3-CZ 3.59Å; W17-F80 HydrophobicContact CE3-CZ 3.59Å; W17-F80 HydrophobicContact CH2-CE2 4.45Å; W17-F80 HydrophobicContact CZ3-CD2 4.11Å; W17-F80 AromaticContact CZ3-CE2 3.52Å; W17-F80 HydrophobicContact CZ3-CE2 3.52Å; W17-F80 HydrophobicContact CZ3-CZ 4.05Å; F18-F80 HydrophobicContact CB-CE2 4.13Å; F18-F80 HydrophobicContact CB-CZ 4.02Å; L77-F80 HydrophobicContact CB-CB 4.47Å; L77-F80 HydrophobicContact CB-CD2 3.89Å; L77-F80 HydrophobicContact CD2-CD2 3.57Å; L77-F80 HydrophobicContact CD2-CE2 3.64Å; L77-F80 HydrophobicContact CG-CD2 4.31Å; L77-F80 WeakPolarHBondContact O-CB 3.36Å; L77-F80 PolarHBondContact O-N 2.97Å; L77-F80 VanDerWaalsContact O-N 3.15Å; A78-F80 PolarHBondContact O-N 3.43Å; A78-F80 VanDerWaalsContact O-N 3.12Å; F80-I82 HydrophobicContact CB-CG1 4.24Å
81	G	54.6	Low	56.8	Low	47 Å²	47	83 Å²	83	49%	0.485	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	64	42.1	178.6	0	0	0	0	0	113.6	A78 T83	A78-G81 PolarHBondContact O-N 2.8Å; G81-T83 PolarHBondContact O-N 3.35Å; G81-T83 VanDerWaalsContact O-N 3.09Å
82	I	55.6	Low	55.1	Low	13 Å²	13	86.4 Å²	86.4	7%	0.067	47%	0.471	C	S	.	.			trans	-64.1	112.2	-178.7	-59.7	-171.4	0	0	0	110.3	L3 V5 F18 L73 H74 L77 F80	L3-I82 HydrophobicContact CD2-CG2 4.22Å; V5-I82 HydrophobicContact CG2-CG1 4.14Å; F18-I82 HydrophobicContact CE2-CD1 4.33Å; L73-I82 HydrophobicContact CG-CD1 4.42Å; H74-I82 PolarHBondContact CE1-O 3.49Å; H74-I82 VanDerWaalsContact CE1-O 3.3Å; L77-I82 HydrophobicContact CB-CD1 3.54Å; L77-I82 HydrophobicContact CB-CG1 4.23Å; L77-I82 HydrophobicContact CD1-CD1 3.51Å; L77-I82 HydrophobicContact CG-CD1 4.17Å; F80-I82 HydrophobicContact CB-CG1 4.24Å
83	T	51.7	Low	53	Low	124 Å²	124	93.6 Å²	93.6	76%	0.761	50%	0.502	S	S	*	.			trans	-103.9	-22.1	-175.8	39.1	0	0	0	0	114	G81	G81-T83 PolarHBondContact O-N 3.35Å; G81-T83 VanDerWaalsContact O-N 3.09Å
84	A	51.9	Low	51	Low	40 Å²	40	101.3 Å²	101.3	33%	0.331	54%	0.543	S	S	.	.			trans	-156.6	145	178.9	0	0	0	0	0	113.3	A4	A4-A84 PolarHBondContact N-O 3.01Å
85	V	54.7	Low	49.2	Very low	36 Å²	36	104 Å²	104	22%	0.218	56%	0.561	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.9	131.2	167	-166.4	0	0	0	0	108	M1 L3 L68 L73	M1-V85 HydrophobicContact CG-CG1 4.23Å; M1-V85 HydrophobicContact SD-CG1 3.81Å; L3-V85 HydrophobicContact CD2-CB 4.07Å; L3-V85 HydrophobicContact CD2-CG1 3.84Å; L3-V85 HydrophobicContact CD2-CG2 3.63Å; L68-V85 HydrophobicContact CD2-CG1 3.76Å; L68-V85 HydrophobicContact CD2-CG2 4.23Å; L73-V85 HydrophobicContact CD2-CG2 4.36Å
86	K	49.8	Very low	47.1	Very low	137 Å²	137	104.7 Å²	104.7	60%	0.596	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-133.8	137.7	175.9	-68.9	-171.8	177.8	-176.9	0	112.7	Y2	Y2-K86 PolarHBondContact N-O 3.28Å; Y2-K86 PolarHBondContact O-N 2.94Å
87	P	48.5	Very low	45.3	Very low	82 Å²	82	112.7 Å²	112.7	53%	0.532	59%	0.592	S	S	.	*			trans	-77.3	136.4	163.5	32.6	-31.4	0	0	0	109.5	V65	V65-P87 HydrophobicContact CG2-CB 4.34Å
88	E	42.1	Very low	43.7	Very low	122 Å²	122	118 Å²	118	57%	0.57	62%	0.62	S	S	*	*			trans	-121.3	143.1	175.2	-165.4	157.4	-148	0	0	107.7
89	K	38.1	Very low	42.5	Very low	200 Å²	200	124.1 Å²	124.1	87%	0.87	64%	0.637	S	S	*	*			trans	-80.2	126.7	179.9	-91.5	-173.6	171.9	-175.4	0	109.4	V91	K89-V91 PolarHBondContact O-N 2.92Å
90	N	35.4	Very low	41.6	Very low	125 Å²	125	121 Å²	121	67%	0.668	63%	0.631	S	S	*	*			trans	-64.6	126.9	171.8	-66.8	1.5	0	0	0	110.4	L92	N90-L92 VanDerWaalsContact C-N 3.28Å; N90-L92 PolarHBondContact O-N 3.37Å
91	V	32.6	Very low	40.7	Very low	144 Å²	144	131.6 Å²	131.6	87%	0.873	67%	0.67	S	S	*	*	S	Bend	trans	-91.4	67.9	164.4	-174.5	0	0	0	0	108.2	K89	K89-V91 PolarHBondContact O-N 2.92Å
92	L	33.4	Very low	40.8	Very low	160 Å²	160	132.1 Å²	132.1	84%	0.838	67%	0.667	S	S	*	*			trans	-150.2	59.6	174.4	-77.4	-176.8	0	0	0	109.7	N90	N90-L92 VanDerWaalsContact C-N 3.28Å; N90-L92 PolarHBondContact O-N 3.37Å
93	Q	31.8	Very low	40.6	Very low	193 Å²	193	140.5 Å²	140.5	90%	0.902	70%	0.697	S	S	*	*			trans	-156.1	59.4	167.8	-158	167.5	39.8	0	0	112.7
94	D	31.5	Very low	40.7	Very low	162 Å²	162	139 Å²	139	87%	0.866	69%	0.685	S	S	*	*	S	Bend	trans	-148.7	152.5	139.7	-137.4	-14.1	0	0	0	110.8
95	D	30.7	Very low	40.6	Very low	148 Å²	148	138.2 Å²	138.2	79%	0.791	68%	0.681	S	S	*	*	S	Bend	trans	86	64.1	-176.4	-153.3	23.2	0	0	0	118.5
96	Q	30.1	Very low	40.9	Very low	165 Å²	165	142.3 Å²	142.3	77%	0.771	70%	0.701	S	S	*	*			trans	-162.7	104.7	131	-112.8	-165.9	-44.2	0	0	109.8	D98	Q96-D98 PolarHBondContact NE2-OD2 3.31Å
97	R	29.2	Very low	41.7	Very low	239 Å²	239	143 Å²	143	90%	0.902	70%	0.701	S	S	*	*			trans	-127.7	53.6	168.9	-158.6	-175.3	-62.4	-169.6	4.7	110.5
98	D	33.1	Very low	42.4	Very low	113 Å²	113	144.2 Å²	144.2	60%	0.604	70%	0.703	S	S	*	*			trans	-60.8	150.4	-179.4	-82.6	-54.7	0	0	0	113.3	Q96 A100	Q96-D98 PolarHBondContact NE2-OD2 3.31Å; D98-A100 PolarHBondContact O-N 2.91Å
99	H	38.9	Very low	43.7	Very low	191 Å²	191	142.4 Å²	142.4	88%	0.884	70%	0.7	S	S	*	*	S	Bend	trans	-68.8	22.1	-167.6	-89.6	-89	0	0	0	116.9	W101	H99-W101 VanDerWaalsContact C-N 3.28Å; H99-W101 PolarHBondContact O-N 2.98Å
100	A	39.4	Very low	45.6	Very low	73 Å²	73	136.9 Å²	136.9	60%	0.603	68%	0.683	S	S	*	*			trans	-72	-9.7	-171.5	0	0	0	0	0	115.8	D98	D98-A100 PolarHBondContact O-N 2.91Å
101	W	41.9	Very low	47.6	Very low	249 Å²	249	135.2 Å²	135.2	94%	0.943	67%	0.673	S	S	*	*			trans	-107.2	44.2	-173.1	-75.5	64	0	0	0	113.8	H99	H99-W101 VanDerWaalsContact C-N 3.28Å; H99-W101 PolarHBondContact O-N 2.98Å
102	S	56.1	Low	49.8	Very low	59 Å²	59	135 Å²	135	41%	0.413	66%	0.661	S	S	.	*	S	Bend	trans	-79.1	158.3	155.4	93.8	0	0	0	0	110.1	D104 G105	S102-D104 PolarHBondContact O-N 2.61Å; S102-D104 PolarHBondContact OG-N 2.72Å; S102-D104 PolarHBondContact OG-OD2 2.71Å; S102-G105 PolarHBondContact O-N 3.28Å; S102-G105 PolarHBondContact OG-N 3.49Å
103	R	52.5	Low	51.6	Low	188 Å²	188	133 Å²	133	71%	0.709	65%	0.646	S	S	*	*	H	α-helix	trans	-59.3	-29.8	178	-163.1	174.5	65.9	179.5	2.4	112.1	L106 Y107	R103-L106 PolarHBondContact O-N 3.23Å; R103-Y107 HydrophobicContact CG-CE2 4.07Å; R103-Y107 WeakPolarHBondContact O-CD2 3.41Å; R103-Y107 PolarHBondContact O-N 3.36Å
104	D	52.1	Low	54.2	Low	93 Å²	93	127.5 Å²	127.5	50%	0.497	63%	0.625	S	S	.	*	H	α-helix	trans	-79.5	-28.6	-177	-34.9	-68	0	0	0	112	S102 L106 Y107 N108	S102-D104 PolarHBondContact O-N 2.61Å; S102-D104 PolarHBondContact OG-N 2.72Å; S102-D104 PolarHBondContact OG-OD2 2.71Å; D104-L106 VanDerWaalsContact C-N 3.31Å; D104-L106 PolarHBondContact O-N 2.94Å; D104-Y107 PolarHBondContact O-N 3.35Å; D104-N108 PolarHBondContact O-N 3.11Å; D104-N108 VanDerWaalsContact O-N 3.13Å; D104-N108 PolarHBondContact O-ND2 2.8Å
105	G	51.2	Low	56.7	Low	24 Å²	24	125.3 Å²	125.3	25%	0.247	61%	0.608	C	S	.	*	H	α-helix	trans	-59.7	-42.2	169.1	0	0	0	0	0	111.8	S102 N108 V109	S102-G105 PolarHBondContact O-N 3.28Å; S102-G105 PolarHBondContact OG-N 3.49Å; G105-N108 PolarHBondContact O-N 3.19Å; G105-V109 WeakPolarHBondContact O-CG2 3.45Å; G105-V109 PolarHBondContact O-N 3.29Å; G105-V109 VanDerWaalsContact O-N 3.13Å
106	L	61.6	Low	59.2	Low	121 Å²	121	123.2 Å²	123.2	63%	0.634	59%	0.592	S	S	*	*	H	α-helix	trans	-63.5	-43.4	177.5	-159.5	78.7	0	0	0	112.1	R103 D104 N108 V109 V110	R103-L106 PolarHBondContact O-N 3.23Å; D104-L106 VanDerWaalsContact C-N 3.31Å; D104-L106 PolarHBondContact O-N 2.94Å; L106-N108 PolarHBondContact O-N 3.34Å; L106-V109 PolarHBondContact O-N 3.11Å; L106-V110 WeakPolarHBondContact O-CG2 3.45Å; L106-V110 PolarHBondContact O-N 2.7Å
107	Y	65.6	Low	61.6	Low	151 Å²	151	120.2 Å²	120.2	59%	0.592	58%	0.581	S	S	*	*	H	α-helix	trans	-60.9	-41.7	176	-77.4	-66.6	0	0	0	112.4	R103 D104 V110 L111	R103-Y107 HydrophobicContact CG-CE2 4.07Å; R103-Y107 WeakPolarHBondContact O-CD2 3.41Å; R103-Y107 PolarHBondContact O-N 3.36Å; D104-Y107 PolarHBondContact O-N 3.35Å; Y107-V110 PolarHBondContact O-N 2.93Å; Y107-L111 VanDerWaalsContact O-CB 3.24Å; Y107-L111 WeakPolarHBondContact O-CB 3.48Å; Y107-L111 PolarHBondContact O-N 3.17Å
108	N	63.3	Low	64.4	Low	109 Å²	109	113.7 Å²	113.7	58%	0.583	56%	0.564	S	S	*	*	H	α-helix	trans	-64	-40.7	177.4	-77	-64.8	0	0	0	112.5	D104 G105 L106 F112	D104-N108 PolarHBondContact O-N 3.11Å; D104-N108 VanDerWaalsContact O-N 3.13Å; D104-N108 PolarHBondContact O-ND2 2.8Å; G105-N108 PolarHBondContact O-N 3.19Å; L106-N108 PolarHBondContact O-N 3.34Å; N108-F112 WeakPolarHBondContact O-CB 3.41Å; N108-F112 PolarHBondContact O-N 2.92Å
109	V	70.1	Confident	66.8	Low	84 Å²	84	113 Å²	113	51%	0.509	56%	0.559	S	S	.	*	H	α-helix	trans	-65.3	-45.1	175.9	174	0	0	0	0	111.3	G105 L106 F112 F113	G105-V109 WeakPolarHBondContact O-CG2 3.45Å; G105-V109 PolarHBondContact O-N 3.29Å; G105-V109 VanDerWaalsContact O-N 3.13Å; L106-V109 PolarHBondContact O-N 3.11Å; V109-F112 PolarHBondContact O-N 2.82Å; V109-F113 HydrophobicContact CG1-CD2 4.06Å; V109-F113 HydrophobicContact CG1-CE2 4.29Å; V109-F113 WeakPolarHBondContact O-CD2 3.36Å; V109-F113 PolarHBondContact O-N 2.92Å
110	V	77.6	Confident	68.9	Low	83 Å²	83	107.3 Å²	107.3	50%	0.503	53%	0.534	S	S	.	.	H	α-helix	trans	-62.1	-45.5	177	172	0	0	0	0	111.1	L106 Y107 F112 F113 T114	L106-V110 WeakPolarHBondContact O-CG2 3.45Å; L106-V110 PolarHBondContact O-N 2.7Å; Y107-V110 PolarHBondContact O-N 2.93Å; V110-F112 PolarHBondContact O-N 3.24Å; V110-F113 PolarHBondContact O-N 3.43Å; V110-T114 WeakPolarHBondContact O-CG2 3.39Å; V110-T114 PolarHBondContact O-N 3.04Å; V110-T114 PolarHBondContact O-OG1 3.39Å
111	L	76.5	Confident	71	Confident	90 Å²	90	107.7 Å²	107.7	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-40.9	179	-172	66.4	0	0	0	112	Y107 T114 F115	Y107-L111 VanDerWaalsContact O-CB 3.24Å; Y107-L111 WeakPolarHBondContact O-CB 3.48Å; Y107-L111 PolarHBondContact O-N 3.17Å; L111-T114 PolarHBondContact O-N 2.81Å; L111-T114 PolarHBondContact O-OG1 2.84Å; L111-F115 HydrophobicContact CD1-CD2 4.11Å; L111-F115 HydrophobicContact CD1-CE2 3.65Å; L111-F115 HydrophobicContact CD1-CZ 4.49Å; L111-F115 HydrophobicContact CD2-CE2 4.27Å; L111-F115 HydrophobicContact CG-CD2 3.95Å; L111-F115 HydrophobicContact CG-CE2 3.73Å; L111-F115 VanDerWaalsContact O-CD2 3.26Å; L111-F115 WeakPolarHBondContact O-CD2 3.45Å; L111-F115 PolarHBondContact O-N 3.19Å; L111-F115 VanDerWaalsContact O-N 3.08Å
112	F	78.5	Confident	72.9	Confident	139 Å²	139	99.2 Å²	99.2	61%	0.61	51%	0.507	S	S	*	.	H	α-helix	trans	-61.1	-45.7	174.2	-178.9	-94.3	0	0	0	111.7	N108 V109 V110 T114 F115 F116	N108-F112 WeakPolarHBondContact O-CB 3.41Å; N108-F112 PolarHBondContact O-N 2.92Å; V109-F112 PolarHBondContact O-N 2.82Å; V110-F112 PolarHBondContact O-N 3.24Å; F112-T114 PolarHBondContact O-N 2.59Å; F112-F115 PolarHBondContact O-N 2.78Å; F112-F116 VanDerWaalsContact O-CB 3.3Å; F112-F116 WeakPolarHBondContact O-CB 3.49Å; F112-F116 PolarHBondContact O-N 3.1Å
113	F	73	Confident	74.1	Confident	120 Å²	120	101.5 Å²	101.5	53%	0.526	51%	0.514	S	S	.	.	H	α-helix	trans	-64	-38.3	177	-95.5	-82.4	0	0	0	113	V109 V110 F116 L117	V109-F113 HydrophobicContact CG1-CD2 4.06Å; V109-F113 HydrophobicContact CG1-CE2 4.29Å; V109-F113 WeakPolarHBondContact O-CD2 3.36Å; V109-F113 PolarHBondContact O-N 2.92Å; V110-F113 PolarHBondContact O-N 3.43Å; F113-F116 PolarHBondContact O-N 2.83Å; F113-L117 WeakPolarHBondContact O-CB 3.28Å; F113-L117 VanDerWaalsContact O-CG 3.29Å; F113-L117 WeakPolarHBondContact O-CG 3.24Å; F113-L117 PolarHBondContact O-N 2.72Å
114	T	84.4	Confident	75.3	Confident	76 Å²	76	97.5 Å²	97.5	47%	0.466	51%	0.505	S	S	.	.	H	α-helix	trans	-67.5	-42.3	177.1	56.3	0	0	0	0	112.2	V110 L111 F112 L118	V110-T114 WeakPolarHBondContact O-CG2 3.39Å; V110-T114 PolarHBondContact O-N 3.04Å; V110-T114 PolarHBondContact O-OG1 3.39Å; L111-T114 PolarHBondContact O-N 2.81Å; L111-T114 PolarHBondContact O-OG1 2.84Å; F112-T114 PolarHBondContact O-N 2.59Å; T114-L118 WeakPolarHBondContact O-CB 3.49Å; T114-L118 PolarHBondContact O-N 3.35Å
115	F	84.9	Confident	76.7	Confident	117 Å²	117	96.9 Å²	96.9	51%	0.513	50%	0.504	S	S	.	.	H	α-helix	trans	-64	-41.4	173.2	-79.9	-61.3	0	0	0	112.6	L111 F112 L118 I119	L111-F115 HydrophobicContact CD1-CD2 4.11Å; L111-F115 HydrophobicContact CD1-CE2 3.65Å; L111-F115 HydrophobicContact CD1-CZ 4.49Å; L111-F115 HydrophobicContact CD2-CE2 4.27Å; L111-F115 HydrophobicContact CG-CD2 3.95Å; L111-F115 HydrophobicContact CG-CE2 3.73Å; L111-F115 VanDerWaalsContact O-CD2 3.26Å; L111-F115 WeakPolarHBondContact O-CD2 3.45Å; L111-F115 PolarHBondContact O-N 3.19Å; L111-F115 VanDerWaalsContact O-N 3.08Å; F112-F115 PolarHBondContact O-N 2.78Å; F115-L118 PolarHBondContact O-N 3.22Å; F115-I119 VanDerWaalsContact O-CG1 3.28Å; F115-I119 WeakPolarHBondContact O-CG1 3.46Å; F115-I119 PolarHBondContact O-N 2.96Å
116	F	82.5	Confident	77.9	Confident	103 Å²	103	101.1 Å²	101.1	45%	0.452	52%	0.52	S	S	.	.	H	α-helix	trans	-61.4	-45.3	177.8	-176	-106	0	0	0	112.1	F112 F113 I119 I120	F112-F116 VanDerWaalsContact O-CB 3.3Å; F112-F116 WeakPolarHBondContact O-CB 3.49Å; F112-F116 PolarHBondContact O-N 3.1Å; F113-F116 PolarHBondContact O-N 2.83Å; F116-I119 PolarHBondContact O-N 3.21Å; F116-I120 HydrophobicContact CD1-CD1 3.93Å; F116-I120 HydrophobicContact CE1-CD1 3.43Å; F116-I120 VanDerWaalsContact CE1-CD1 3.43Å; F116-I120 HydrophobicContact CE2-CD1 4.19Å; F116-I120 HydrophobicContact CZ-CD1 3.58Å; F116-I120 WeakPolarHBondContact O-CG1 3.39Å; F116-I120 PolarHBondContact O-N 3.2Å
117	L	81.9	Confident	78.5	Confident	102 Å²	102	102.2 Å²	102.2	53%	0.534	52%	0.517	S	S	.	.	H	α-helix	trans	-65.6	-38.3	175.6	-71.2	170.3	0	0	0	112.5	F113 T121	F113-L117 WeakPolarHBondContact O-CB 3.28Å; F113-L117 VanDerWaalsContact O-CG 3.29Å; F113-L117 WeakPolarHBondContact O-CG 3.24Å; F113-L117 PolarHBondContact O-N 2.72Å; L117-T121 WeakPolarHBondContact O-CB 3.44Å; L117-T121 PolarHBondContact O-N 3.27Å; L117-T121 PolarHBondContact O-OG1 2.97Å
118	L	86.8	Confident	78.7	Confident	103 Å²	103	103.2 Å²	103.2	54%	0.539	52%	0.52	S	S	.	.	H	α-helix	trans	-61.6	-47.7	174.7	-171.4	73.9	0	0	0	111.2	T114 F115 T121 C122	T114-L118 WeakPolarHBondContact O-CB 3.49Å; T114-L118 PolarHBondContact O-N 3.35Å; F115-L118 PolarHBondContact O-N 3.22Å; L118-T121 PolarHBondContact O-N 3.18Å; L118-C122 PolarHBondContact O-N 2.8Å; L118-C122 PolarHBondContact O-SG 3.41Å
119	I	84.1	Confident	78.9	Confident	99 Å²	99	104.2 Å²	104.2	51%	0.508	52%	0.522	S	S	.	.	H	α-helix	trans	-61.5	-46.9	179	-69.8	164.4	0	0	0	111	F115 F116 T121 C122 L123	F115-I119 VanDerWaalsContact O-CG1 3.28Å; F115-I119 WeakPolarHBondContact O-CG1 3.46Å; F115-I119 PolarHBondContact O-N 2.96Å; F116-I119 PolarHBondContact O-N 3.21Å; I119-T121 VanDerWaalsContact C-N 3.32Å; I119-T121 PolarHBondContact O-N 3.09Å; I119-C122 PolarHBondContact O-N 3.26Å; I119-L123 HydrophobicContact CG2-CD1 3.91Å; I119-L123 HydrophobicContact CG2-CG 4.48Å; I119-L123 VanDerWaalsContact O-CG 3.31Å; I119-L123 WeakPolarHBondContact O-CG 3.49Å; I119-L123 PolarHBondContact O-N 2.98Å
120	I	81.9	Confident	78.7	Confident	70 Å²	70	108.8 Å²	108.8	36%	0.359	54%	0.535	S	S	.	.	H	α-helix	trans	-61.1	-42.3	176.4	-72.9	177.2	0	0	0	111	F116 L123 M124	F116-I120 HydrophobicContact CD1-CD1 3.93Å; F116-I120 HydrophobicContact CE1-CD1 3.43Å; F116-I120 VanDerWaalsContact CE1-CD1 3.43Å; F116-I120 HydrophobicContact CE2-CD1 4.19Å; F116-I120 HydrophobicContact CZ-CD1 3.58Å; F116-I120 WeakPolarHBondContact O-CG1 3.39Å; F116-I120 PolarHBondContact O-N 3.2Å; I120-L123 PolarHBondContact O-N 3.42Å; I120-M124 HydrophobicContact CG2-CG 4.38Å; I120-M124 WeakPolarHBondContact O-CG 3.35Å; I120-M124 PolarHBondContact O-N 3.46Å
121	T	84.5	Confident	77.7	Confident	82 Å²	82	111 Å²	111	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-62.7	-45.8	178.9	-55.9	0	0	0	0	111.2	L117 L118 I119 L123 M124 V125	L117-T121 WeakPolarHBondContact O-CB 3.44Å; L117-T121 PolarHBondContact O-N 3.27Å; L117-T121 PolarHBondContact O-OG1 2.97Å; L118-T121 PolarHBondContact O-N 3.18Å; I119-T121 VanDerWaalsContact C-N 3.32Å; I119-T121 PolarHBondContact O-N 3.09Å; T121-L123 PolarHBondContact O-N 3.18Å; T121-M124 PolarHBondContact O-N 3.14Å; T121-V125 WeakPolarHBondContact O-CG2 3.4Å; T121-V125 PolarHBondContact O-N 3.17Å
122	C	81.1	Confident	76.4	Confident	71 Å²	71	115.4 Å²	115.4	48%	0.48	56%	0.556	S	S	.	*	H	α-helix	trans	-59.6	-44.9	174.2	-73.3	0	0	0	0	112.3	L118 I119 M124 V125 L126	L118-C122 PolarHBondContact O-N 2.8Å; L118-C122 PolarHBondContact O-SG 3.41Å; I119-C122 PolarHBondContact O-N 3.26Å; C122-M124 PolarHBondContact O-N 3.13Å; C122-V125 PolarHBondContact O-N 2.75Å; C122-L126 WeakPolarHBondContact O-CG 3.5Å; C122-L126 PolarHBondContact O-N 2.98Å
123	L	82.3	Confident	74.7	Confident	106 Å²	106	114.9 Å²	114.9	56%	0.555	56%	0.564	S	S	*	*	H	α-helix	trans	-62.7	-40.2	176.8	-71	169.5	0	0	0	112.2	I119 I120 T121 L126 Y127	I119-L123 HydrophobicContact CG2-CD1 3.91Å; I119-L123 HydrophobicContact CG2-CG 4.48Å; I119-L123 VanDerWaalsContact O-CG 3.31Å; I119-L123 WeakPolarHBondContact O-CG 3.49Å; I119-L123 PolarHBondContact O-N 2.98Å; I120-L123 PolarHBondContact O-N 3.42Å; T121-L123 PolarHBondContact O-N 3.18Å; L123-L126 PolarHBondContact O-N 3.08Å; L123-Y127 VanDerWaalsContact O-CB 3.28Å; L123-Y127 WeakPolarHBondContact O-CB 3.16Å; L123-Y127 PolarHBondContact O-N 2.96Å
124	M	77.1	Confident	73.2	Confident	105 Å²	105	114.4 Å²	114.4	52%	0.517	57%	0.573	S	S	.	*	H	α-helix	trans	-67.1	-36.1	175.3	-71.5	-146.9	78	0	0	113	I120 T121 C122 R128	I120-M124 HydrophobicContact CG2-CG 4.38Å; I120-M124 WeakPolarHBondContact O-CG 3.35Å; I120-M124 PolarHBondContact O-N 3.46Å; T121-M124 PolarHBondContact O-N 3.14Å; C122-M124 PolarHBondContact O-N 3.13Å; M124-R128 WeakPolarHBondContact O-CB 3.39Å; M124-R128 WeakPolarHBondContact O-CG 3.49Å; M124-R128 PolarHBondContact O-N 3.45Å
125	V	82.1	Confident	71	Confident	79 Å²	79	117.3 Å²	117.3	48%	0.479	59%	0.59	S	S	.	*	H	α-helix	trans	-66	-49	173.8	170.7	0	0	0	0	110.6	T121 C122 Y127 R128 M129	T121-V125 WeakPolarHBondContact O-CG2 3.4Å; T121-V125 PolarHBondContact O-N 3.17Å; C122-V125 PolarHBondContact O-N 2.75Å; V125-Y127 VanDerWaalsContact C-N 3.31Å; V125-Y127 PolarHBondContact O-N 3.25Å; V125-R128 PolarHBondContact O-N 2.89Å; V125-R128 VanDerWaalsContact O-N 3.16Å; V125-M129 WeakPolarHBondContact O-CG 3.4Å; V125-M129 PolarHBondContact O-N 3.4Å
126	L	76.8	Confident	68.5	Low	114 Å²	114	118.2 Å²	118.2	60%	0.597	61%	0.605	S	S	*	*	H	α-helix	trans	-58.5	-42.4	176.5	-70.5	169.7	0	0	0	112	C122 L123 M129 K130	C122-L126 WeakPolarHBondContact O-CG 3.5Å; C122-L126 PolarHBondContact O-N 2.98Å; L123-L126 PolarHBondContact O-N 3.08Å; L126-M129 PolarHBondContact O-N 2.96Å; L126-K130 PolarHBondContact O-N 3.44Å
127	Y	73.8	Confident	66	Low	144 Å²	144	119.9 Å²	119.9	57%	0.565	62%	0.615	S	S	*	*	H	α-helix	trans	-61.8	-44.4	175.2	-174.6	-90.9	0	0	0	112.2	L123 V125 M129 K130 Q131	L123-Y127 VanDerWaalsContact O-CB 3.28Å; L123-Y127 WeakPolarHBondContact O-CB 3.16Å; L123-Y127 PolarHBondContact O-N 2.96Å; V125-Y127 VanDerWaalsContact C-N 3.31Å; V125-Y127 PolarHBondContact O-N 3.25Å; Y127-M129 PolarHBondContact O-N 3.16Å; Y127-K130 PolarHBondContact O-N 2.84Å; Y127-Q131 HydrophobicContact CE1-CG 4.32Å; Y127-Q131 VanDerWaalsContact CE1-NE2 3.34Å; Y127-Q131 PolarHBondContact O-N 2.82Å; Y127-Q131 PolarHBondContact OH-NE2 3.26Å
128	R	69.4	Low	63.5	Low	171 Å²	171	122.9 Å²	122.9	65%	0.645	62%	0.623	S	S	*	*	H	α-helix	trans	-67.6	-31.8	176.5	-78.2	-178.2	170.5	-163.9	-2	113.4	M124 V125	M124-R128 WeakPolarHBondContact O-CB 3.39Å; M124-R128 WeakPolarHBondContact O-CG 3.49Å; M124-R128 PolarHBondContact O-N 3.45Å; V125-R128 PolarHBondContact O-N 2.89Å; V125-R128 VanDerWaalsContact O-N 3.16Å
129	M	67.5	Low	60.9	Low	130 Å²	130	126.9 Å²	126.9	64%	0.64	64%	0.639	S	S	*	*	H	α-helix	trans	-68.6	-41.3	171.9	-69.1	-167.7	76.6	0	0	111.4	V125 L126 Y127 Q131 K132	V125-M129 WeakPolarHBondContact O-CG 3.4Å; V125-M129 PolarHBondContact O-N 3.4Å; L126-M129 PolarHBondContact O-N 2.96Å; Y127-M129 PolarHBondContact O-N 3.16Å; M129-Q131 PolarHBondContact O-N 3.12Å; M129-K132 PolarHBondContact O-N 2.74Å; M129-K132 VanDerWaalsContact O-N 3.08Å
130	K	67	Low	58.4	Low	180 Å²	180	129.7 Å²	129.7	78%	0.783	65%	0.654	S	S	*	*	H	α-helix	trans	-60.9	-27.4	176.5	-168.8	174.3	-179	178.8	0	113.4	L126 Y127	L126-K130 PolarHBondContact O-N 3.44Å; Y127-K130 PolarHBondContact O-N 2.84Å
131	Q	56.5	Low	55.9	Low	131 Å²	131	135.5 Å²	135.5	61%	0.612	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-7.3	176.6	-73.1	-172.2	-28.4	0	0	115	Y127 M129	Y127-Q131 HydrophobicContact CE1-CG 4.32Å; Y127-Q131 VanDerWaalsContact CE1-NE2 3.34Å; Y127-Q131 PolarHBondContact O-N 2.82Å; Y127-Q131 PolarHBondContact OH-NE2 3.26Å; M129-Q131 PolarHBondContact O-N 3.12Å
132	K	49	Very low	53.4	Low	181 Å²	181	135.9 Å²	135.9	79%	0.787	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	22.4	-174	-79.6	-163.4	171.9	-167.8	0	115.6	M129 P134	M129-K132 PolarHBondContact O-N 2.74Å; M129-K132 VanDerWaalsContact O-N 3.08Å; K132-P134 WeakPolarHBondContact O-CD 3.45Å
133	V	42.7	Very low	52.4	Low	129 Å²	129	138.1 Å²	138.1	78%	0.782	70%	0.702	S	S	*	*			trans	-117.6	88.1	176	-174.1	0	0	0	0	111.1
134	P	40.8	Very low	50.7	Low	109 Å²	109	138.6 Å²	138.6	71%	0.708	71%	0.712	S	S	*	*			trans	-88	121.6	172.3	33.1	-30.9	0	0	0	112	K132	K132-P134 WeakPolarHBondContact O-CD 3.45Å
135	V	38.4	Very low	49.6	Very low	137 Å²	137	138.8 Å²	138.8	83%	0.83	72%	0.721	S	S	*	*			trans	21.7	107.1	151.6	-171.6	0	0	0	0	118.3
136	T	31.3	Very low	47.1	Very low	136 Å²	136	141.2 Å²	141.2	83%	0.834	73%	0.731	S	S	*	*			trans	-140.4	95.8	150.2	-55.6	0	0	0	0	110.5
137	E	32	Very low	45	Very low	139 Å²	139	143 Å²	143	65%	0.65	74%	0.736	S	S	*	*	S	Bend		-174.9	135.6	129.8	-91	-127.9	114.4	0	0	111.9
138	K	29.3	Very low	43	Very low	165 Å²	165	141.1 Å²	141.1	72%	0.717	74%	0.739	S	S	*	*			trans	57.6	91	151.1	-67.1	161.3	-178.5	147	0	119
139	Q	31.7	Very low	41.1	Very low	187 Å²	187	139 Å²	139	87%	0.874	74%	0.744	S	S	*	*			trans	-68.5	145.8	132.3	-86.2	-158.3	4	0	0	110.8
140	L	31.8	Very low	39.1	Very low	157 Å²	157	137.6 Å²	137.6	82%	0.822	75%	0.748	S	S	*	*			trans	-168.6	144.7	141.7	-123.7	71	0	0	0	105.3
141	K	29.4	Very low	37.3	Very low	193 Å²	193	136 Å²	136	84%	0.839	75%	0.747	S	S	*	*			cis	-160.8	155.3	8.3	-158.4	173.5	-171.8	-180	0	108.9
142	A	31.7	Very low	36	Very low	89 Å²	89	135.6 Å²	135.6	74%	0.736	75%	0.754	S	S	*	*			trans	-164.8	-179.9	178.4	0	0	0	0	0	110.9
143	P	59.8	Low	34.9	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	76%	0.756	S	S	*	*			cis	-106.3	-98.2	-20.2	20.1	2.9	0	0	0	111.4
144	P	46.9	Very low	35.3	Very low	116 Å²	116	134 Å²	134	75%	0.753	76%	0.755	S	S	*	*			cis	-113.8	-109.8	4.1	28.9	-2.4	0	0	0	114.8
145	P	52.8	Low	34.7	Very low	109 Å²	109	134.9 Å²	134.9	71%	0.708	76%	0.764	S	S	*	*			trans	-130.1	-178.1	-146.1	40.7	-17.6	0	0	0	116
146	D	30.5	Very low	34.2	Very low	129 Å²	129	135.7 Å²	135.7	69%	0.69	76%	0.764	S	S	*	*			cis	-145.4	-153.6	11.8	-133	-59	0	0	0	108.5
147	H	32.1	Very low	35.3	Very low	153 Å²	153	133 Å²	133	71%	0.708	75%	0.749	S	S	*	*			cis	-157.6	129.7	3.2	-134.2	31.8	0	0	0	107.3
148	V	31.5	Very low	35.3	Very low	103 Å²	103	133.2 Å²	133.2	62%	0.624	75%	0.749	S	S	*	*				97.1	118.2	89.5	157.8	0	0	0	0	117.1
149	V	30.4	Very low	35.3	Very low	126 Å²	126	133.1 Å²	133.1	76%	0.764	75%	0.749	S	S	*	*			trans	65.9	119.3	155.8	164.5	0	0	0	0	118.4
150	S	26.6	Very low	35.2	Very low	102 Å²	102	135.6 Å²	135.6	71%	0.713	75%	0.75	S	S	*	*				73.6	148.7	71	-93.5	0	0	0	0	114.6
151	L	28.9	Very low	35.2	Very low	145 Å²	145	132.3 Å²	132.3	76%	0.759	74%	0.74	S	S	*	*			cis	-168	164.8	28.9	-130.8	161.9	0	0	0	113.2
152	T	27.7	Very low	35.3	Very low	124 Å²	124	133.4 Å²	133.4	76%	0.761	75%	0.745	S	S	*	*			trans	81.2	159.3	152.9	16	0	0	0	0	124.7
153	L	27.2	Very low	35.1	Very low	159 Å²	159	132.5 Å²	132.5	83%	0.832	75%	0.745	S	S	*	*			trans	-117.7	-148.7	-175.1	-67.3	85.3	0	0	0	111.5
154	P	51	Low	33.7	Very low	116 Å²	116	133.8 Å²	133.8	75%	0.753	75%	0.75	S	S	*	*				-127	177.2	-88.4	39.3	-22.8	0	0	0	115.3
155	S	27.7	Very low	33	Very low	129 Å²	129	138 Å²	138	90%	0.902	76%	0.757	S	S	*	*			trans	-153.5	162.2	163.3	-59.3	0	0	0	0	113
156	D	28	Very low	31.7	Very low	154 Å²	154	138.6 Å²	138.6	82%	0.824	76%	0.764	S	S	*	*			trans	-130.7	-145.7	-176.1	-168.4	33.1	0	0	0	113.1
157	P	54.6	Low	31.8	Very low	80 Å²	80	139.1 Å²	139.1	52%	0.519	77%	0.771	S	S	.	*				-110.3	172.1	-113.5	38.6	-26.7	0	0	0	117.6
158	H	31.2	Very low	31.8	Very low	143 Å²	143	136.4 Å²	136.4	66%	0.662	78%	0.775	S	S	*	*				162.4	134	121.9	-91.3	-19.8	0	0	0	121.3
159	K	30.4	Very low	31.9	Very low	163 Å²	163	140.2 Å²	140.2	71%	0.709	79%	0.786	S	S	*	*				78.1	145.8	126.6	-71.9	169.6	175.9	152.3	0	126.2
160	R	29	Very low	32.4	Very low	239 Å²	239	140.3 Å²	140.3	90%	0.902	79%	0.789	S	S	*	*			trans	80.9	150.4	153.8	-76.6	-172.8	170.7	171	-2.7	120
161	S	31.1	Very low	32.6	Very low	88 Å²	88	141.7 Å²	141.7	62%	0.615	79%	0.793	S	S	*	*			cis	-176.3	150.9	-18.2	56	0	0	0	0	116.6
162	K	31.4	Very low	33.4	Very low	215 Å²	215	140.6 Å²	140.6	94%	0.935	79%	0.794	S	S	*	*			trans	64.4	156.1	161.6	-62	174.3	179	-176.2	0	116.5
163	G	27.9	Very low	33.6	Very low	71 Å²	71	141.1 Å²	141.1	73%	0.732	80%	0.797	S	S	*	*			cis	177.9	175.7	-1.9	0	0	0	0	0	108.7
164	T	30.5	Very low	34.7	Very low	145 Å²	145	138.7 Å²	138.7	89%	0.89	79%	0.791	S	S	*	*			cis	-153.3	-131.2	-1.2	-45.7	0	0	0	0	110.1
165	K	31.9	Very low	33.6	Very low	205 Å²	205	141.3 Å²	141.3	89%	0.891	80%	0.797	S	S	*	*			trans	-159	159.9	-178.6	-64.3	-175.7	-179.9	-179.9	0	114.4
166	S	26.7	Very low	33.7	Very low	122 Å²	122	141.9 Å²	141.9	85%	0.853	79%	0.788	S	S	*	*			trans	-166.7	159.8	151.1	-162.5	0	0	0	0	113.6
167	V	33.1	Very low	33.6	Very low	140 Å²	140	141.2 Å²	141.2	85%	0.848	79%	0.785	S	S	*	*			trans	-158.3	154	-167.4	166.8	0	0	0	0	114.8
168	A	30.2	Very low	32.4	Very low	95 Å²	95	142.5 Å²	142.5	79%	0.785	79%	0.791	S	S	*	*			trans	96.8	160.2	155.8	0	0	0	0	0	124.2
169	H	33.7	Very low	32.1	Very low	183 Å²	183	142.4 Å²	142.4	85%	0.847	80%	0.796	S	S	*	*			trans	-101.5	176.6	-172.6	-57.1	-92.5	0	0	0	115
170	P	41.6	Very low	31.9	Very low	129 Å²	129	138.7 Å²	138.7	84%	0.838	79%	0.79	S	S	*	*				-154	-162.6	97	40.7	-20.1	0	0	0	117.1
171	V	31.3	Very low	31.8	Very low	130 Å²	130	135.9 Å²	135.9	79%	0.788	79%	0.787	S	S	*	*			trans	-146	155.7	-174.5	-163.1	0	0	0	0	112.5
172	P	44.8	Very low	32.1	Very low	122 Å²	122	136.7 Å²	136.7	79%	0.792	79%	0.79	S	S	*	*			trans	-153.1	-178.8	133	37	-16.7	0	0	0	118.5
173	V	31.4	Very low	32.9	Very low	136 Å²	136	132 Å²	132	82%	0.824	78%	0.781	S	S	*	*			trans	-157.1	-175	-178.1	-80	0	0	0	0	110.5
174	P	52	Low	33.3	Very low	108 Å²	108	134.1 Å²	134.1	70%	0.701	78%	0.783	S	S	*	*			cis	-140.8	-165.5	5.1	46.4	-26.2	0	0	0	117.7
175	I	28.1	Very low	33.1	Very low	170 Å²	170	133.8 Å²	133.8	87%	0.872	78%	0.78	S	S	*	*			trans	-140	163.5	165.1	-72.4	-169.7	0	0	0	111.3
176	I	29.2	Very low	32.8	Very low	141 Å²	141	128.8 Å²	128.8	72%	0.723	77%	0.771	S	S	*	*			trans	-139.1	150.9	-156.9	-58	162.3	0	0	0	114.7
177	N	26.7	Very low	33	Very low	140 Å²	140	129.1 Å²	129.1	75%	0.749	77%	0.768	S	S	*	*			trans	163.1	166.7	140.7	-85.4	-2.5	0	0	0	112
178	T	27.5	Very low	32.7	Very low	107 Å²	107	128 Å²	128	66%	0.656	76%	0.763	S	S	*	*			cis	-159.8	-175.6	-33.4	43.3	0	0	0	0	109.3
179	D	25.1	Very low	32.5	Very low	142 Å²	142	129.1 Å²	129.1	76%	0.759	76%	0.763	S	S	*	*			trans	94.9	-168.5	146.9	-83.5	-73.5	0	0	0	123.4
180	S	26.9	Very low	32.8	Very low	85 Å²	85	127.4 Å²	127.4	59%	0.594	77%	0.765	S	S	*	*				-161.1	177.4	-124.3	62.7	0	0	0	0	113.2
181	H	27.6	Very low	32.1	Very low	180 Å²	180	127.5 Å²	127.5	83%	0.833	76%	0.763	S	S	*	*			cis	-155	170.7	-2.6	-115.9	-44.1	0	0	0	110.1
182	P	36.5	Very low	32.4	Very low	105 Å²	105	125.3 Å²	125.3	68%	0.682	77%	0.767	S	S	*	*			trans	-118.1	-166.5	-170.1	44	-34.9	0	0	0	115.3
183	P	49.1	Very low	31.5	Very low	115 Å²	115	123.7 Å²	123.7	75%	0.747	76%	0.764	S	S	*	*			cis	-123.9	-165.1	-47.3	36.4	-17.5	0	0	0	112
184	P	36.3	Very low	31.4	Very low	117 Å²	117	125.2 Å²	125.2	76%	0.76	77%	0.768	S	S	*	*				-152.6	175.1	98.3	39.2	-19.6	0	0	0	118.4
185	T	26.4	Very low	30.2	Very low	137 Å²	137	126.8 Å²	126.8	84%	0.84	77%	0.765	S	S	*	*			trans	-33.8	156.3	172.4	10.5	0	0	0	0	118.5
186	S	25.8	Very low	30.4	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	76%	0.764	S	S	*	*			cis	-172.8	163.8	48.4	64.6	0	0	0	0	116.7
187	V	29.6	Very low	30.5	Very low	130 Å²	130	127.2 Å²	127.2	79%	0.788	76%	0.763	S	S	*	*			trans	60.3	128.3	162.2	-163.9	0	0	0	0	120.3
188	P	27.8	Very low	31	Very low	116 Å²	116	126 Å²	126	75%	0.753	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-99.9	145.9	173.4	37.3	-32.1	0	0	0	114.7
189	P	26.4	Very low	31.8	Very low	118 Å²	118	125.1 Å²	125.1	77%	0.766	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-86.8	159.7	160.3	35.1	-32.4	0	0	0	112.1
190	V	38.4	Very low	32.7	Very low	148 Å²	148	123.7 Å²	123.7	90%	0.897	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-78.4	128.7	180	177.5	0	0	0	0	111.5
191	T	26.7	Very low	33.6	Very low	130 Å²	130	121 Å²	121	80%	0.798	74%	0.739	S	S	*	*			trans	-134.1	140.1	162.7	48.6	0	0	0	0	110.8
192	G	38.7	Very low	34.5	Very low	84 Å²	84	116 Å²	116	87%	0.866	72%	0.723	S	S	*	*			trans	-88.2	125.3	-179	0	0	0	0	0	112.2
193	A	26.4	Very low	35.1	Very low	89 Å²	89	114.7 Å²	114.7	74%	0.736	71%	0.706	S	S	*	*			trans	-146.4	74.1	170.9	0	0	0	0	0	110	E195	A193-E195 VanDerWaalsContact C-N 3.26Å; A193-E195 PolarHBondContact O-N 3.48Å
194	N	28.1	Very low	35	Very low	168 Å²	168	118.1 Å²	118.1	90%	0.898	70%	0.704	S	S	*	*			trans	-80.7	77.4	176.1	-144.3	21.5	0	0	0	109.1	L196	N194-L196 PolarHBondContact O-N 2.84Å; N194-L196 VanDerWaalsContact O-N 3.11Å
195	E	27	Very low	35	Very low	140 Å²	140	121 Å²	121	65%	0.654	71%	0.71	S	S	*	*			trans	-57.2	113.4	176.3	-69.5	-172.3	139.3	0	0	110.5	A193 K197	A193-E195 VanDerWaalsContact C-N 3.26Å; A193-E195 PolarHBondContact O-N 3.48Å; E195-K197 VanDerWaalsContact C-N 3.26Å; E195-K197 PolarHBondContact O-N 3.13Å; E195-K197 VanDerWaalsContact OE2-CE 3.26Å; E195-K197 WeakPolarHBondContact OE2-CE 3.43Å; E195-K197 IonicContact OE2-NZ 3.61Å
196	L	33.1	Very low	35.2	Very low	161 Å²	161	123.7 Å²	123.7	84%	0.843	71%	0.71	S	S	*	*			trans	-68.1	83.7	171.8	-78.2	164	0	0	0	110.2	N194	N194-L196 PolarHBondContact O-N 2.84Å; N194-L196 VanDerWaalsContact O-N 3.11Å
197	K	30.4	Very low	35.5	Very low	160 Å²	160	124.8 Å²	124.8	70%	0.696	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-68.8	130.2	176.6	-75.2	172.7	-179.9	165.8	0	109.9	E195 C199	E195-K197 VanDerWaalsContact C-N 3.26Å; E195-K197 PolarHBondContact O-N 3.13Å; E195-K197 VanDerWaalsContact OE2-CE 3.26Å; E195-K197 WeakPolarHBondContact OE2-CE 3.43Å; E195-K197 IonicContact OE2-NZ 3.61Å; K197-C199 PolarHBondContact O-N 3.17Å
198	P	38.1	Very low	35.9	Very low	113 Å²	113	123.3 Å²	123.3	73%	0.734	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-56.3	138.2	176.7	-26.2	34.6	0	0	0	112.1
199	C	43.8	Very low	36.2	Very low	89 Å²	89	122.2 Å²	122.2	60%	0.601	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-63.6	128.4	176.5	-169	0	0	0	0	110.3	K197 S201	K197-C199 PolarHBondContact O-N 3.17Å; C199-S201 PolarHBondContact O-N 3.16Å
200	P	44	Very low	36.9	Very low	113 Å²	113	119.9 Å²	119.9	73%	0.734	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-73	128.3	-178.2	28.8	-34.2	0	0	0	111.6
201	S	44.7	Very low	36.6	Very low	27 Å²	27	121.5 Å²	121.5	19%	0.189	72%	0.717	C	S	.	*	P	Polyproline II helix	trans	-58.5	121.2	-175.5	-168.2	0	0	0	0	114.1	C199 F203 R204 E278	C199-S201 PolarHBondContact O-N 3.16Å; S201-F203 PolarHBondContact O-N 3.31Å; S201-R204 PolarHBondContact O-N 2.61Å; S201-E278 WeakPolarHBondContact CB-OE2 3.48Å; S201-E278 PolarHBondContact OG-OE2 3.42Å
202	P	47.5	Very low	37.1	Very low	77 Å²	77	123.8 Å²	123.8	50%	0.5	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.7	-17.5	179.1	30.4	-35.3	0	0	0	112.8	R204 Y249	P202-R204 VanDerWaalsContact C-N 3.35Å; P202-Y249 HydrophobicContact CG-CD2 4.08Å
203	F	49.3	Very low	37.4	Very low	77 Å²	77	128.9 Å²	128.9	34%	0.338	72%	0.72	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.9	-10.4	-179.2	-51.7	-58	0	0	0	113.2	S201 M205 A245 Y249 E278 P280	S201-F203 PolarHBondContact O-N 3.31Å; F203-M205 PolarHBondContact O-N 2.9Å; F203-A245 HydrophobicContact CE1-CB 4.31Å; F203-Y249 HydrophobicContact CD2-CD2 4.37Å; F203-Y249 AromaticContact CE2-CD2 3.68Å; F203-Y249 HydrophobicContact CE2-CD2 3.68Å; F203-Y249 HydrophobicContact CE2-CE2 4.2Å; F203-Y249 AromaticContact CE2-CG 3.88Å; F203-Y249 HydrophobicContact CE2-CG 3.88Å; F203-Y249 HydrophobicContact CZ-CD2 4.5Å; F203-Y249 HydrophobicContact CZ-CG 4.43Å; F203-E278 WeakPolarHBondContact CD2-O 3.47Å; F203-E278 WeakPolarHBondContact CE2-O 3.33Å; F203-P280 HydrophobicContact CE2-CG 3.87Å; F203-P280 HydrophobicContact CZ-CG 3.79Å
204	R	45.9	Very low	37.9	Very low	186 Å²	186	136 Å²	136	70%	0.702	73%	0.728	S	S	*	*			trans	-94	85.9	-172.8	-164.4	171.6	-173	172.5	2.4	111.8	S201 P202 K206	S201-R204 PolarHBondContact O-N 2.61Å; P202-R204 VanDerWaalsContact C-N 3.35Å; R204-K206 PolarHBondContact O-N 2.8Å
205	M	36	Very low	38.5	Very low	179 Å²	179	140 Å²	140	88%	0.882	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-55.6	125.8	166.3	-63.5	-171	80.3	0	0	109.5	F203	F203-M205 PolarHBondContact O-N 2.9Å
206	K	32.3	Very low	38.7	Very low	192 Å²	192	136.5 Å²	136.5	84%	0.835	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-59.7	144.8	172.2	-69.1	-178.4	178.3	178.3	0	109.4	R204 A208	R204-K206 PolarHBondContact O-N 2.8Å; K206-A208 PolarHBondContact O-N 2.8Å
207	P	31.7	Very low	38.9	Very low	123 Å²	123	133.8 Å²	133.8	80%	0.799	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-51.1	139.5	159.2	-21.2	32.6	0	0	0	108.7	A209	P207-A209 VanDerWaalsContact C-N 3.3Å; P207-A209 PolarHBondContact O-N 3.37Å
208	A	36.8	Very low	39.4	Very low	100 Å²	100	134.1 Å²	134.1	83%	0.826	74%	0.735	S	S	*	*			trans	-69.2	87.8	-176.6	0	0	0	0	0	110.7	K206 G210	K206-A208 PolarHBondContact O-N 2.8Å; A208-G210 PolarHBondContact O-N 3.38Å
209	A	35.2	Very low	39.1	Very low	93 Å²	93	133.8 Å²	133.8	77%	0.769	73%	0.731	S	S	*	*			trans	-50.5	133.1	156.1	0	0	0	0	0	107.5	P207 L211	P207-A209 VanDerWaalsContact C-N 3.3Å; P207-A209 PolarHBondContact O-N 3.37Å; A209-L211 PolarHBondContact O-N 2.88Å
210	G	40.4	Very low	38.6	Very low	69 Å²	69	134.5 Å²	134.5	71%	0.711	74%	0.737	S	S	*	*			trans	-49.7	138.7	-159.7	0	0	0	0	0	113.9	A208 Q212	A208-G210 PolarHBondContact O-N 3.38Å; G210-Q212 PolarHBondContact O-N 2.84Å
211	L	33.4	Very low	37.9	Very low	181 Å²	181	136.6 Å²	136.6	95%	0.948	74%	0.741	S	S	*	*			trans	-62.5	84.3	171.2	-96.7	157.4	0	0	0	109.4	A209 E213	A209-L211 PolarHBondContact O-N 2.88Å; L211-E213 PolarHBondContact O-N 2.92Å
212	Q	37.1	Very low	37.5	Very low	178 Å²	178	141.3 Å²	141.3	83%	0.832	77%	0.768	S	S	*	*			trans	-72.5	121.7	176.6	-170.5	145.1	29.7	0	0	109	G210 R214	G210-Q212 PolarHBondContact O-N 2.84Å; Q212-R214 PolarHBondContact O-N 3.02Å
213	E	44.5	Very low	36.8	Very low	192 Å²	192	145.1 Å²	145.1	90%	0.897	78%	0.784	S	S	*	*			trans	-57.1	107.9	-172.2	-61.5	178.3	120.3	0	0	111.5	L211	L211-E213 PolarHBondContact O-N 2.92Å
214	R	35.7	Very low	36.3	Very low	239 Å²	239	147.4 Å²	147.4	90%	0.902	80%	0.8	S	S	*	*			trans	-105.3	124.6	160.6	-72.2	-168.2	170.4	-157.9	-3.1	107.7	Q212 G216	Q212-R214 PolarHBondContact O-N 3.02Å; R214-G216 PolarHBondContact O-N 3.36Å
215	R	41.6	Very low	36.2	Very low	252 Å²	252	145 Å²	145	95%	0.951	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-47.9	128.6	-172.4	-69.1	176.6	172.3	176.7	-4.3	111.1
216	G	32	Very low	36.5	Very low	65 Å²	65	140.8 Å²	140.8	67%	0.67	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-67.4	146.1	-179.4	0	0	0	0	0	112.7	R214	R214-G216 PolarHBondContact O-N 3.36Å
217	S	37	Very low	37	Very low	105 Å²	105	135 Å²	135	73%	0.734	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-96.2	120.4	153.1	-176.5	0	0	0	0	107.1	V219	S217-V219 PolarHBondContact O-N 3.28Å
218	N	40.6	Very low	37.5	Very low	166 Å²	166	134.2 Å²	134.2	89%	0.888	76%	0.763	S	S	*	*			trans	-80.3	40.2	-171.8	-69.4	-16.6	0	0	0	113	S220	N218-S220 PolarHBondContact O-N 2.99Å
219	V	31.2	Very low	37.7	Very low	107 Å²	107	133.3 Å²	133.3	65%	0.648	76%	0.762	S	S	*	*			trans	-95.5	93.6	179.4	-177.7	0	0	0	0	109.4	S217 L221	S217-V219 PolarHBondContact O-N 3.28Å; V219-L221 HydrophobicContact CG1-CG 4.41Å; V219-L221 PolarHBondContact O-N 3.05Å
220	S	34.6	Very low	38.1	Very low	103 Å²	103	134.1 Å²	134.1	72%	0.72	76%	0.763	S	S	*	*			trans	-78.3	105	167.4	-171.7	0	0	0	0	109.4	N218 V222	N218-S220 PolarHBondContact O-N 2.99Å; S220-V222 PolarHBondContact O-N 3.47Å
221	L	29.1	Very low	38.1	Very low	157 Å²	157	135 Å²	135	82%	0.822	75%	0.754	S	S	*	*			trans	-75	91.9	171.4	-81.8	167.8	0	0	0	109.9	V219 L223	V219-L221 HydrophobicContact CG1-CG 4.41Å; V219-L221 PolarHBondContact O-N 3.05Å; L221-L223 PolarHBondContact O-N 3.49Å
222	V	34.6	Very low	38.6	Very low	126 Å²	126	134.8 Å²	134.8	76%	0.764	75%	0.748	S	S	*	*			trans	-85.3	105.8	169.1	-177.2	0	0	0	0	108.4	S220	S220-V222 PolarHBondContact O-N 3.47Å
223	L	33.3	Very low	38.8	Very low	158 Å²	158	131.5 Å²	131.5	83%	0.827	74%	0.742	S	S	*	*			trans	-79.3	116.3	169	-81.7	160.7	0	0	0	109.2	L221	L221-L223 PolarHBondContact O-N 3.49Å
224	D	38.7	Very low	38.4	Very low	124 Å²	124	129.1 Å²	129.1	66%	0.663	74%	0.735	S	S	*	*			trans	-71.3	128.5	169.2	-174.9	13.7	0	0	0	110	S226	D224-S226 VanDerWaalsContact OD1-CB 3.26Å; D224-S226 WeakPolarHBondContact OD1-CB 3.43Å; D224-S226 PolarHBondContact OD1-N 3.15Å; D224-S226 PolarHBondContact OD1-OG 2.83Å; D224-S226 WeakPolarHBondContact OD2-CB 3.47Å; D224-S226 PolarHBondContact OD2-OG 2.93Å
225	M	43.8	Very low	38.5	Very low	137 Å²	137	125.7 Å²	125.7	68%	0.675	74%	0.735	S	S	*	*			trans	-104.4	4	178.5	-65.3	-171.6	73	0	0	112.7	A227 L228	M225-A227 PolarHBondContact O-N 2.88Å; M225-L228 HydrophobicContact CB-CD1 4.28Å; M225-L228 HydrophobicContact CE-CD1 3.46Å; M225-L228 VanDerWaalsContact CE-CD1 3.46Å; M225-L228 HydrophobicContact CG-CD1 4.34Å; M225-L228 PolarHBondContact O-N 2.9Å; M225-L228 VanDerWaalsContact O-N 3.14Å
226	S	42.3	Very low	38.5	Very low	89 Å²	89	118.3 Å²	118.3	62%	0.622	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-53.5	-35.9	179.9	67.1	0	0	0	0	113.4	D224 L228	D224-S226 VanDerWaalsContact OD1-CB 3.26Å; D224-S226 WeakPolarHBondContact OD1-CB 3.43Å; D224-S226 PolarHBondContact OD1-N 3.15Å; D224-S226 PolarHBondContact OD1-OG 2.83Å; D224-S226 WeakPolarHBondContact OD2-CB 3.47Å; D224-S226 PolarHBondContact OD2-OG 2.93Å; S226-L228 VanDerWaalsContact C-N 3.32Å; S226-L228 PolarHBondContact O-N 3.31Å
227	A	43.3	Very low	39.5	Very low	70 Å²	70	120.3 Å²	120.3	58%	0.579	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-75.6	-8.9	-178.1	0	0	0	0	0	115.3	M225 G229 S230	M225-A227 PolarHBondContact O-N 2.88Å; A227-G229 PolarHBondContact O-N 2.92Å; A227-S230 PolarHBondContact O-OG 3.03Å
228	L	42.3	Very low	40.4	Very low	108 Å²	108	121.2 Å²	121.2	57%	0.565	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-76.7	-2.5	-179.5	-81.4	163.7	0	0	0	114.1	M225 S226 S230 V231	M225-L228 HydrophobicContact CB-CD1 4.28Å; M225-L228 HydrophobicContact CE-CD1 3.46Å; M225-L228 VanDerWaalsContact CE-CD1 3.46Å; M225-L228 HydrophobicContact CG-CD1 4.34Å; M225-L228 PolarHBondContact O-N 2.9Å; M225-L228 VanDerWaalsContact O-N 3.14Å; S226-L228 VanDerWaalsContact C-N 3.32Å; S226-L228 PolarHBondContact O-N 3.31Å; L228-S230 VanDerWaalsContact C-N 3.25Å; L228-S230 PolarHBondContact O-N 3.37Å; L228-V231 HydrophobicContact CD2-CG2 4.5Å
229	G	40.5	Very low	41.5	Very low	80 Å²	80	116.7 Å²	116.7	83%	0.825	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-73.7	-7.8	175.4	0	0	0	0	0	115.3	A227	A227-G229 PolarHBondContact O-N 2.92Å
230	S	44.5	Very low	43.5	Very low	110 Å²	110	114.2 Å²	114.2	77%	0.769	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-130.1	25.1	-174.1	62.6	0	0	0	0	114.1	A227 L228	A227-S230 PolarHBondContact O-OG 3.03Å; L228-S230 VanDerWaalsContact C-N 3.25Å; L228-S230 PolarHBondContact O-N 3.37Å
231	V	39.3	Very low	45.2	Very low	88 Å²	88	114.7 Å²	114.7	53%	0.533	69%	0.686	S	S	.	*	S	Bend	trans	-113.5	133.9	172.3	-169.3	0	0	0	0	108	L228	L228-V231 HydrophobicContact CD2-CG2 4.5Å
232	E	44	Very low	47.3	Very low	176 Å²	176	116.9 Å²	116.9	82%	0.822	68%	0.683	S	S	*	*			trans	-57.8	143.3	172.5	-68.2	-167.3	140	0	0	110.5	L234	E232-L234 PolarHBondContact O-N 3.25Å
233	P	41.2	Very low	49.3	Very low	109 Å²	109	115.1 Å²	115.1	71%	0.708	67%	0.667	S	S	*	*			trans	-62.6	111.3	177.5	26.2	-33.4	0	0	0	109.3	N235	P233-N235 PolarHBondContact O-N 2.9Å
234	L	36.5	Very low	51.3	Low	142 Å²	142	111 Å²	111	74%	0.743	65%	0.648	S	S	*	*			trans	-57.7	105.4	175.3	-73.9	167.8	0	0	0	109.3	E232 V236	E232-L234 PolarHBondContact O-N 3.25Å; L234-V236 PolarHBondContact O-N 2.93Å
235	N	39.1	Very low	53.5	Low	168 Å²	168	106.1 Å²	106.1	90%	0.898	63%	0.625	S	S	*	*			trans	-72	38.5	172.1	-76.8	-29.6	0	0	0	112.2	P233	P233-N235 PolarHBondContact O-N 2.9Å
236	V	40.8	Very low	55.6	Low	97 Å²	97	100.5 Å²	100.5	59%	0.588	60%	0.601	S	S	*	*			trans	-101.3	116.7	172.3	-179	0	0	0	0	106.6	L234 V238	L234-V236 PolarHBondContact O-N 2.93Å; V236-V238 PolarHBondContact O-N 3.08Å
237	S	53.4	Low	57.7	Low	107 Å²	107	103.5 Å²	103.5	75%	0.748	60%	0.598	S	S	*	*			trans	-64.5	105	173.8	-171.3	0	0	0	0	109.4	V239	S237-V239 VanDerWaalsContact C-N 3.33Å; S237-V239 PolarHBondContact O-N 3.27Å
238	V	54.9	Low	59.8	Low	123 Å²	123	106 Å²	106	75%	0.745	60%	0.598	S	S	*	*			trans	-75.9	87.9	-179.6	-176.3	0	0	0	0	108.7	V236 T240	V236-V238 PolarHBondContact O-N 3.08Å; V238-T240 PolarHBondContact O-N 2.9Å; V238-T240 VanDerWaalsContact O-N 3.13Å
239	V	64.2	Low	62.2	Low	71 Å²	71	102 Å²	102	43%	0.43	58%	0.575	S	S	.	*			trans	-51.9	117.9	175	-175.7	0	0	0	0	109	S237 E243	S237-V239 VanDerWaalsContact C-N 3.33Å; S237-V239 PolarHBondContact O-N 3.27Å; V239-E243 HydrophobicContact CG1-CB 3.7Å
240	T	72.6	Confident	64.8	Low	56 Å²	56	98.3 Å²	98.3	34%	0.344	54%	0.537	S	S	.	.			trans	-72.8	154.3	-175.7	78.8	0	0	0	0	110.6	V238 R242 E243 T244	V238-T240 PolarHBondContact O-N 2.9Å; V238-T240 VanDerWaalsContact O-N 3.13Å; T240-R242 PolarHBondContact O-N 3.4Å; T240-R242 PolarHBondContact OG1-N 2.97Å; T240-E243 WeakPolarHBondContact CB-OE1 3.39Å; T240-E243 WeakPolarHBondContact CG2-OE1 3.37Å; T240-E243 PolarHBondContact N-OE2 2.85Å; T240-E243 PolarHBondContact O-N 2.87Å; T240-E243 PolarHBondContact OG1-N 3.46Å; T240-E243 PolarHBondContact OG1-OE1 3.49Å; T240-T244 PolarHBondContact O-N 2.86Å; T240-T244 PolarHBondContact O-OG1 3.45Å
241	P	70.4	Confident	67	Low	113 Å²	113	99 Å²	99	73%	0.734	53%	0.531	S	S	*	.	H	α-helix	trans	-54.3	-24.4	174.4	-27.7	35.7	0	0	0	113.8	A245	P241-A245 WeakPolarHBondContact O-CB 3.5Å; P241-A245 PolarHBondContact O-N 3.49Å
242	R	73.6	Confident	69.3	Low	203 Å²	203	98 Å²	98	77%	0.766	53%	0.528	S	S	*	.	H	α-helix	trans	-76.5	-39.9	175	-171.8	-179.2	-177.7	-172.3	0.8	112.5	T240 A246	T240-R242 PolarHBondContact O-N 3.4Å; T240-R242 PolarHBondContact OG1-N 2.97Å; R242-A246 VanDerWaalsContact O-CB 3.25Å; R242-A246 WeakPolarHBondContact O-CB 3.34Å; R242-A246 PolarHBondContact O-N 3.44Å
243	E	75.7	Confident	71.7	Confident	89 Å²	89	89.9 Å²	89.9	42%	0.416	49%	0.491	S	S	.	.	H	α-helix	trans	-65.4	-41.3	171.3	-74.2	122.2	-119.5	0	0	111.1	V239 T240 A246 R247	V239-E243 HydrophobicContact CG1-CB 3.7Å; T240-E243 WeakPolarHBondContact CB-OE1 3.39Å; T240-E243 WeakPolarHBondContact CG2-OE1 3.37Å; T240-E243 PolarHBondContact N-OE2 2.85Å; T240-E243 PolarHBondContact O-N 2.87Å; T240-E243 PolarHBondContact OG1-N 3.46Å; T240-E243 PolarHBondContact OG1-OE1 3.49Å; E243-A246 PolarHBondContact O-N 3.39Å; E243-R247 WeakPolarHBondContact O-CB 3.41Å; E243-R247 VanDerWaalsContact O-CG 3.29Å; E243-R247 WeakPolarHBondContact O-CG 3.39Å; E243-R247 PolarHBondContact O-N 2.93Å
244	T	77.2	Confident	74.3	Confident	71 Å²	71	85.9 Å²	85.9	44%	0.436	47%	0.47	S	S	.	.	H	α-helix	trans	-58.4	-53.4	175.5	-54.5	0	0	0	0	110.9	T240 A246 R247 E248	T240-T244 PolarHBondContact O-N 2.86Å; T240-T244 PolarHBondContact O-OG1 3.45Å; T244-A246 VanDerWaalsContact C-N 3.29Å; T244-A246 PolarHBondContact O-N 2.98Å; T244-R247 PolarHBondContact O-N 3.25Å; T244-E248 WeakPolarHBondContact O-CB 3.41Å; T244-E248 PolarHBondContact O-N 3.3Å
245	A	83.1	Confident	77.1	Confident	21 Å²	21	82.6 Å²	82.6	17%	0.174	45%	0.447	C	S	.	.	H	α-helix	trans	-62.6	-32.8	177.3	0	0	0	0	0	113.2	F203 P241 Y249	F203-A245 HydrophobicContact CE1-CB 4.31Å; P241-A245 WeakPolarHBondContact O-CB 3.5Å; P241-A245 PolarHBondContact O-N 3.49Å; A245-Y249 WeakPolarHBondContact O-CB 3.41Å; A245-Y249 PolarHBondContact O-N 3.28Å
246	A	87.9	Confident	79.9	Confident	20 Å²	20	77.8 Å²	77.8	17%	0.165	43%	0.426	C	S	.	.	H	α-helix	trans	-67.8	-41.9	174.1	0	0	0	0	0	112.4	R242 E243 T244 L250 P280	R242-A246 VanDerWaalsContact O-CB 3.25Å; R242-A246 WeakPolarHBondContact O-CB 3.34Å; R242-A246 PolarHBondContact O-N 3.44Å; E243-A246 PolarHBondContact O-N 3.39Å; T244-A246 VanDerWaalsContact C-N 3.29Å; T244-A246 PolarHBondContact O-N 2.98Å; A246-L250 VanDerWaalsContact O-CG 3.25Å; A246-L250 WeakPolarHBondContact O-CG 3.49Å; A246-L250 PolarHBondContact O-N 3.2Å; A246-P280 HydrophobicContact CB-CB 3.9Å; A246-P280 HydrophobicContact CB-CG 3.93Å
247	R	87.4	Confident	82.6	Confident	151 Å²	151	73.4 Å²	73.4	57%	0.57	40%	0.399	S	S	*	.	H	α-helix	trans	-69.7	-41	176.6	-68	172.2	74.7	130.6	3	111.4	E243 T244 L250 L251	E243-R247 WeakPolarHBondContact O-CB 3.41Å; E243-R247 VanDerWaalsContact O-CG 3.29Å; E243-R247 WeakPolarHBondContact O-CG 3.39Å; E243-R247 PolarHBondContact O-N 2.93Å; T244-R247 PolarHBondContact O-N 3.25Å; R247-L250 PolarHBondContact O-N 3.02Å; R247-L251 VanDerWaalsContact O-CG 3.26Å; R247-L251 WeakPolarHBondContact O-CG 3.24Å; R247-L251 PolarHBondContact O-N 3.34Å; R247-L251 VanDerWaalsContact O-N 3.08Å
248	E	87.9	Confident	84.6	Confident	124 Å²	124	71.3 Å²	71.3	58%	0.579	38%	0.381	S	S	*	.	H	α-helix	trans	-60.1	-47	174	-175.5	177	-167.4	0	0	111.5	T244 L250 L251 S252	T244-E248 WeakPolarHBondContact O-CB 3.41Å; T244-E248 PolarHBondContact O-N 3.3Å; E248-L250 PolarHBondContact O-N 3.45Å; E248-L251 PolarHBondContact O-N 2.92Å; E248-S252 WeakPolarHBondContact O-CB 3.3Å; E248-S252 PolarHBondContact O-N 2.9Å; E248-S252 PolarHBondContact O-OG 3.18Å
249	Y	92.5	Very high	86.5	Confident	23 Å²	23	69 Å²	69	9%	0.09	36%	0.359	C	S	.	.	H	α-helix	trans	-58.5	-47.6	174.4	-173.5	-77.9	0	0	0	111.4	P202 F203 A245 L251 S252 A253 I279 P280	P202-Y249 HydrophobicContact CG-CD2 4.08Å; F203-Y249 HydrophobicContact CD2-CD2 4.37Å; F203-Y249 AromaticContact CE2-CD2 3.68Å; F203-Y249 HydrophobicContact CE2-CD2 3.68Å; F203-Y249 HydrophobicContact CE2-CE2 4.2Å; F203-Y249 AromaticContact CE2-CG 3.88Å; F203-Y249 HydrophobicContact CE2-CG 3.88Å; F203-Y249 HydrophobicContact CZ-CD2 4.5Å; F203-Y249 HydrophobicContact CZ-CG 4.43Å; A245-Y249 WeakPolarHBondContact O-CB 3.41Å; A245-Y249 PolarHBondContact O-N 3.28Å; Y249-L251 PolarHBondContact O-N 3.18Å; Y249-S252 PolarHBondContact O-N 3.36Å; Y249-A253 HydrophobicContact CD1-CB 3.7Å; Y249-A253 HydrophobicContact CD2-CB 4.38Å; Y249-A253 HydrophobicContact CE1-CB 3.52Å; Y249-A253 HydrophobicContact CE2-CB 4.26Å; Y249-A253 HydrophobicContact CG-CB 4.13Å; Y249-A253 WeakPolarHBondContact O-CB 3.37Å; Y249-A253 PolarHBondContact O-N 2.88Å; Y249-I279 HydrophobicContact CE1-CB 4.38Å; Y249-I279 HydrophobicContact CE1-CG1 4.31Å; Y249-I279 HydrophobicContact CE1-CG2 4.39Å; Y249-P280 HydrophobicContact CD1-CG 4.1Å; Y249-P280 HydrophobicContact CG-CG 4.36Å
250	L	94.4	Very high	87.9	Confident	3 Å²	3	70.1 Å²	70.1	2%	0.016	36%	0.36	C	S	.	.	H	α-helix	trans	-66.3	-18.6	-179.5	-68.5	168.6	0	0	0	114.1	A246 R247 E248 I279 P280 N282 C501 Q502 R504	A246-L250 VanDerWaalsContact O-CG 3.25Å; A246-L250 WeakPolarHBondContact O-CG 3.49Å; A246-L250 PolarHBondContact O-N 3.2Å; R247-L250 PolarHBondContact O-N 3.02Å; E248-L250 PolarHBondContact O-N 3.45Å; L250-I279 HydrophobicContact CD2-CG2 4.1Å; L250-P280 HydrophobicContact CD1-CB 4.2Å; L250-P280 HydrophobicContact CG-CB 4.31Å; L250-P280 HydrophobicContact CG-CG 4.25Å; L250-N282 HydrophobicContact CD1-CB 3.74Å; L250-C501 HydrophobicContact CD2-CB 3.99Å; L250-C501 WeakPolarHBondContact O-CB 3.39Å; L250-Q502 PolarHBondContact O-NE2 2.9Å; L250-R504 HydrophobicContact CD2-CB 3.99Å
251	L	90.3	Very high	89	Confident	123 Å²	123	71.7 Å²	71.7	64%	0.644	36%	0.363	S	S	*	.	H	α-helix	trans	-92.9	-29.5	175.6	-69.5	169.7	0	0	0	113.2	R247 E248 Y249	R247-L251 VanDerWaalsContact O-CG 3.26Å; R247-L251 WeakPolarHBondContact O-CG 3.24Å; R247-L251 PolarHBondContact O-N 3.34Å; R247-L251 VanDerWaalsContact O-N 3.08Å; E248-L251 PolarHBondContact O-N 2.92Å; Y249-L251 PolarHBondContact O-N 3.18Å
252	S	88.9	Confident	90.2	Very high	68 Å²	68	66.3 Å²	66.3	48%	0.476	33%	0.328	S	S	.	.	H	α-helix	trans	-113.1	-18.2	-170.1	62.5	0	0	0	0	115.3	E248 Y249	E248-S252 WeakPolarHBondContact O-CB 3.3Å; E248-S252 PolarHBondContact O-N 2.9Å; E248-S252 PolarHBondContact O-OG 3.18Å; Y249-S252 PolarHBondContact O-N 3.36Å
253	A	93.8	Very high	91.1	Very high	5 Å²	5	61.2 Å²	61.2	4%	0.041	31%	0.309	C	S	.	.			trans	-69.9	133.9	-179.6	0	0	0	0	0	111.2	Y249 L497 N498	Y249-A253 HydrophobicContact CD1-CB 3.7Å; Y249-A253 HydrophobicContact CD2-CB 4.38Å; Y249-A253 HydrophobicContact CE1-CB 3.52Å; Y249-A253 HydrophobicContact CE2-CB 4.26Å; Y249-A253 HydrophobicContact CG-CB 4.13Å; Y249-A253 WeakPolarHBondContact O-CB 3.37Å; Y249-A253 PolarHBondContact O-N 2.88Å; A253-L497 HydrophobicContact CB-CD2 4.4Å; A253-L497 HydrophobicContact CB-CG 4.32Å; A253-N498 WeakPolarHBondContact O-CA 3.5Å; A253-N498 WeakPolarHBondContact O-CB 3.42Å; A253-N498 PolarHBondContact O-ND2 2.7Å
254	G	95.1	Very high	91.9	Very high	25 Å²	25	61 Å²	61	26%	0.258	31%	0.311	S	S	.	.			trans	-167.9	149.6	178.2	0	0	0	0	0	110.5	D495	G254-D495 WeakPolarHBondContact CA-OD2 3.41Å
255	R	95.8	Very high	92.7	Very high	73 Å²	73	58 Å²	58	28%	0.275	29%	0.292	S	S	.	.			trans	-150.1	79.9	177	-176.5	-171.6	158.8	-144.3	-18.1	108.3	L257 V265 E275 D495 L497	R255-L257 HydrophobicContact CG-CD2 4.15Å; R255-L257 PolarHBondContact O-N 3.3Å; R255-V265 VanDerWaalsContact NH2-CG2 3.3Å; R255-E275 WeakPolarHBondContact CD-OE2 3.5Å; R255-E275 IonicContact CZ-OE2 3.6Å; R255-E275 IonicContact NE-OE2 3.7Å; R255-E275 IonicContact NH1-OE1 3.95Å; R255-E275 PolarHBondContact NH1-OE1 3.15Å; R255-E275 IonicContact NH1-OE2 3.03Å; R255-E275 PolarHBondContact NH1-OE2 3.42Å; R255-D495 PolarHBondContact N-OD1 2.74Å; R255-D495 PolarHBondContact N-OD2 3.44Å; R255-L497 HydrophobicContact CB-CB 4.26Å; R255-L497 HydrophobicContact CB-CD2 3.93Å
256	P	97.1	Very high	93.1	Very high	68 Å²	68	58 Å²	58	44%	0.442	29%	0.291	S	S	.	.			trans	-59.6	130.4	175.9	-23.1	34.3	0	0	0	111.1	D495	P256-D495 VanDerWaalsContact CD-OD2 3.29Å; P256-D495 WeakPolarHBondContact CD-OD2 3.39Å; P256-D495 HydrophobicContact CG-CB 4.34Å
257	L	97.4	Very high	93.2	Very high	4 Å²	4	62.3 Å²	62.3	2%	0.021	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	129.1	178.2	-54.7	180	0	0	0	109.8	R255 Q261 L262 V265 V493 V494	R255-L257 HydrophobicContact CG-CD2 4.15Å; R255-L257 PolarHBondContact O-N 3.3Å; L257-Q261 HydrophobicContact CB-CB 4.23Å; L257-Q261 HydrophobicContact CD2-CB 4.33Å; L257-L262 HydrophobicContact CB-CB 4.43Å; L257-L262 HydrophobicContact CD1-CD1 4.22Å; L257-V265 HydrophobicContact CD1-CG1 3.85Å; L257-V493 CarbonylContact O-C 3.51Å; L257-V493 WeakPolarHBondContact O-CA 3.47Å; L257-V493 VanDerWaalsContact O-CB 3.29Å; L257-V493 WeakPolarHBondContact O-CB 3.39Å; L257-V494 HydrophobicContact CB-CG1 4.48Å; L257-V494 WeakPolarHBondContact CB-O 3.45Å; L257-V494 PolarHBondContact N-O 2.84Å; L257-V494 PolarHBondContact O-N 2.96Å
258	T	96.8	Very high	93.3	Very high	63 Å²	63	58.2 Å²	58.2	39%	0.387	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	161.9	164.1	69.6	0	0	0	0	111	Q260 Q261 L262 V493	T258-Q260 PolarHBondContact O-N 3.44Å; T258-Q260 VanDerWaalsContact O-N 3.11Å; T258-Q261 PolarHBondContact O-N 3.23Å; T258-Q261 WeakPolarHBondContact OG1-CG 3.23Å; T258-Q261 PolarHBondContact OG1-N 3.03Å; T258-L262 PolarHBondContact O-N 2.94Å; T258-V493 HydrophobicContact CG2-CG1 4.45Å
259	R	94.4	Very high	93.3	Very high	74 Å²	74	55.1 Å²	55.1	28%	0.279	30%	0.298	S	S	.	.	H	α-helix	trans	-47.5	-40.9	175.1	-62.3	-169.9	176.6	-167.8	2.6	113.1	R263 G492 E528 S532	R259-R263 WeakPolarHBondContact O-CG 3.43Å; R259-R263 PolarHBondContact O-N 3.1Å; R259-G492 WeakPolarHBondContact CG-O 3.39Å; R259-E528 HydrophobicContact CB-CG 3.7Å; R259-E528 WeakPolarHBondContact CD-OE1 3.4Å; R259-E528 HydrophobicContact CG-CG 3.6Å; R259-S532 PolarHBondContact NH1-OG 3.41Å
260	Q	93.3	Very high	93.3	Very high	96 Å²	96	60.4 Å²	60.4	45%	0.449	32%	0.323	S	S	.	.	H	α-helix	trans	-71.3	-47.5	176.7	-172.9	57.3	42.4	0	0	112.3	T258 L262 R263 D264	T258-Q260 PolarHBondContact O-N 3.44Å; T258-Q260 VanDerWaalsContact O-N 3.11Å; Q260-L262 PolarHBondContact O-N 3.43Å; Q260-R263 WeakPolarHBondContact O-CB 3.22Å; Q260-R263 PolarHBondContact O-N 2.88Å; Q260-D264 PolarHBondContact NE2-OD1 3.14Å; Q260-D264 PolarHBondContact O-N 2.65Å
261	Q	95.9	Very high	93.2	Very high	89 Å²	89	66.2 Å²	66.2	42%	0.416	35%	0.348	S	S	.	.	H	α-helix	trans	-60.8	-28.8	178.7	-70.2	169.7	-22.6	0	0	113	L257 T258 V265	L257-Q261 HydrophobicContact CB-CB 4.23Å; L257-Q261 HydrophobicContact CD2-CB 4.33Å; T258-Q261 PolarHBondContact O-N 3.23Å; T258-Q261 WeakPolarHBondContact OG1-CG 3.23Å; T258-Q261 PolarHBondContact OG1-N 3.03Å; Q261-V265 WeakPolarHBondContact O-CB 3.35Å; Q261-V265 PolarHBondContact O-N 3.3Å
262	L	95.8	Very high	93.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.3	-46.3	172.6	178.6	61	0	0	0	111.8	L257 T258 Q260 D264 V266 L488 V494 L524 E528	L257-L262 HydrophobicContact CB-CB 4.43Å; L257-L262 HydrophobicContact CD1-CD1 4.22Å; T258-L262 PolarHBondContact O-N 2.94Å; Q260-L262 PolarHBondContact O-N 3.43Å; L262-D264 VanDerWaalsContact C-N 3.34Å; L262-V266 WeakPolarHBondContact O-CG2 3.42Å; L262-V266 PolarHBondContact O-N 3.28Å; L262-L488 HydrophobicContact CD2-CD1 4.05Å; L262-L488 HydrophobicContact CD2-CD2 4.14Å; L262-V494 HydrophobicContact CD1-CG1 4.19Å; L262-V494 HydrophobicContact CD2-CG1 3.95Å; L262-L524 HydrophobicContact CD1-CB 4.24Å; L262-L524 HydrophobicContact CD2-CB 4.03Å; L262-E528 HydrophobicContact CD2-CB 4.33Å
263	R	92.7	Very high	93.7	Very high	95 Å²	95	60 Å²	60	36%	0.358	31%	0.309	S	S	.	.	H	α-helix	trans	-61.6	-42.7	173	-62.6	168.9	-176	-175.2	-0.3	111.4	R259 Q260 S267 E528	R259-R263 WeakPolarHBondContact O-CG 3.43Å; R259-R263 PolarHBondContact O-N 3.1Å; Q260-R263 WeakPolarHBondContact O-CB 3.22Å; Q260-R263 PolarHBondContact O-N 2.88Å; R263-S267 PolarHBondContact O-OG 2.88Å; R263-E528 IonicContact CZ-OE1 3.64Å; R263-E528 IonicContact CZ-OE2 3.69Å; R263-E528 IonicContact NE-OE1 2.89Å; R263-E528 IonicContact NE-OE2 3.96Å; R263-E528 PolarHBondContact NE-OE2 2.91Å; R263-E528 IonicContact NH2-OE1 2.79Å; R263-E528 PolarHBondContact NH2-OE1 3.47Å; R263-E528 IonicContact NH2-OE2 2.86Å; R263-E528 PolarHBondContact NH2-OE2 2.94Å
264	D	92.9	Very high	93.7	Very high	86 Å²	86	63 Å²	63	46%	0.46	33%	0.326	S	S	.	.	H	α-helix	trans	-66.7	-41	-178.5	-59.9	-25.6	0	0	0	112.1	Q260 L262 S267	Q260-D264 PolarHBondContact NE2-OD1 3.14Å; Q260-D264 PolarHBondContact O-N 2.65Å; L262-D264 VanDerWaalsContact C-N 3.34Å; D264-S267 WeakPolarHBondContact O-CB 3.12Å; D264-S267 PolarHBondContact O-N 3.14Å
265	V	93.4	Very high	93.7	Very high	7 Å²	7	63 Å²	63	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-74.2	-31.4	-178	81.4	0	0	0	0	112.7	R255 L257 Q261 S267 N268 L272	R255-V265 VanDerWaalsContact NH2-CG2 3.3Å; L257-V265 HydrophobicContact CD1-CG1 3.85Å; Q261-V265 WeakPolarHBondContact O-CB 3.35Å; Q261-V265 PolarHBondContact O-N 3.3Å; V265-S267 PolarHBondContact O-N 3.5Å; V265-N268 CarbonylContact O-C 3.54Å; V265-N268 WeakPolarHBondContact O-CA 3.22Å; V265-N268 PolarHBondContact O-N 3.15Å; V265-L272 HydrophobicContact CB-CD2 4.47Å; V265-L272 HydrophobicContact CG1-CD2 4.13Å; V265-L272 HydrophobicContact CG2-CD1 4.49Å; V265-L272 HydrophobicContact CG2-CD2 3.5Å; V265-L272 VanDerWaalsContact CG2-CD2 3.5Å; V265-L272 HydrophobicContact CG2-CG 3.92Å
266	V	91.5	Very high	93.8	Very high	22 Å²	22	60.7 Å²	60.7	13%	0.133	31%	0.311	C	S	.	.	H	α-helix	trans	-58.9	-33.9	172.5	164.8	0	0	0	0	111.3	L262 N268 H521 H522	L262-V266 WeakPolarHBondContact O-CG2 3.42Å; L262-V266 PolarHBondContact O-N 3.28Å; V266-N268 PolarHBondContact O-N 3.21Å; V266-H521 HydrophobicContact CG2-CB 3.74Å; V266-H521 WeakPolarHBondContact CG2-O 3.38Å; V266-H522 VanDerWaalsContact CG1-ND1 3.34Å; V266-H522 WeakPolarHBondContact CG1-ND1 3.38Å
267	S	89.3	Confident	93.7	Very high	110 Å²	110	61.3 Å²	61.3	77%	0.769	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-1.9	173.4	-55.7	0	0	0	0	114.3	R263 D264 V265	R263-S267 PolarHBondContact O-OG 2.88Å; D264-S267 WeakPolarHBondContact O-CB 3.12Å; D264-S267 PolarHBondContact O-N 3.14Å; V265-S267 PolarHBondContact O-N 3.5Å
268	N	89.9	Confident	93.4	Very high	65 Å²	65	63.5 Å²	63.5	35%	0.348	33%	0.333	S	S	.	.			trans	-134.7	64.7	-177.6	-159.4	-47.9	0	0	0	111.7	V265 V266 H270 K271	V265-N268 CarbonylContact O-C 3.54Å; V265-N268 WeakPolarHBondContact O-CA 3.22Å; V265-N268 PolarHBondContact O-N 3.15Å; V266-N268 PolarHBondContact O-N 3.21Å; N268-H270 PolarHBondContact O-N 3.38Å; N268-H270 VanDerWaalsContact O-N 3.15Å; N268-K271 HydrophobicContact CB-CD 4.31Å; N268-K271 PolarHBondContact O-N 3.41Å; N268-K271 WeakPolarHBondContact OD1-CG 3.5Å; N268-K271 PolarHBondContact OD1-N 3.3Å
269	T	88.8	Confident	93.4	Very high	58 Å²	58	60.9 Å²	60.9	36%	0.356	32%	0.316	S	S	.	.	H	α-helix	trans	-51.4	-37.4	-177.8	62.3	0	0	0	0	113.4	K271 L272 H273 E518	T269-K271 VanDerWaalsContact C-N 3.31Å; T269-K271 PolarHBondContact O-N 3.49Å; T269-L272 WeakPolarHBondContact O-CB 3.38Å; T269-L272 PolarHBondContact O-N 3.18Å; T269-H273 PolarHBondContact O-CD2 2.97Å; T269-H273 PolarHBondContact O-N 3.25Å; T269-E518 WeakPolarHBondContact CB-OE2 3.49Å; T269-E518 HydrophobicContact CG2-CG 3.92Å; T269-E518 VanDerWaalsContact CG2-OE1 3.26Å; T269-E518 WeakPolarHBondContact CG2-OE1 3.24Å
270	H	92.8	Very high	93.5	Very high	134 Å²	134	58.2 Å²	58.2	62%	0.62	31%	0.308	S	S	*	.	H	α-helix	trans	-57	-39.8	178	-178.2	61	0	0	0	113.1	N268 L272 H273 V274	N268-H270 PolarHBondContact O-N 3.38Å; N268-H270 VanDerWaalsContact O-N 3.15Å; H270-L272 VanDerWaalsContact C-N 3.35Å; H270-L272 PolarHBondContact O-N 3.42Å; H270-H273 PolarHBondContact O-N 2.94Å; H270-V274 WeakPolarHBondContact O-CG2 3.46Å; H270-V274 PolarHBondContact O-N 3.42Å
271	K	92.3	Very high	93.6	Very high	125 Å²	125	56.7 Å²	56.7	54%	0.543	30%	0.302	S	S	.	.	H	α-helix	trans	-63.4	-40.5	175.1	-75.6	176.3	-177.3	179.3	0	111.9	N268 T269 V274 E275	N268-K271 HydrophobicContact CB-CD 4.31Å; N268-K271 PolarHBondContact O-N 3.41Å; N268-K271 WeakPolarHBondContact OD1-CG 3.5Å; N268-K271 PolarHBondContact OD1-N 3.3Å; T269-K271 VanDerWaalsContact C-N 3.31Å; T269-K271 PolarHBondContact O-N 3.49Å; K271-V274 PolarHBondContact O-N 3.38Å; K271-E275 WeakPolarHBondContact O-CB 3.4Å; K271-E275 PolarHBondContact O-N 3.23Å
272	L	95.1	Very high	93.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.9	-38.3	178	-62.6	178.5	0	0	0	111.8	V265 T269 H270 F276 Y517 E518 H521	V265-L272 HydrophobicContact CB-CD2 4.47Å; V265-L272 HydrophobicContact CG1-CD2 4.13Å; V265-L272 HydrophobicContact CG2-CD1 4.49Å; V265-L272 HydrophobicContact CG2-CD2 3.5Å; V265-L272 VanDerWaalsContact CG2-CD2 3.5Å; V265-L272 HydrophobicContact CG2-CG 3.92Å; T269-L272 WeakPolarHBondContact O-CB 3.38Å; T269-L272 PolarHBondContact O-N 3.18Å; H270-L272 VanDerWaalsContact C-N 3.35Å; H270-L272 PolarHBondContact O-N 3.42Å; L272-F276 WeakPolarHBondContact O-CB 3.42Å; L272-F276 PolarHBondContact O-N 3.03Å; L272-Y517 HydrophobicContact CB-CD1 4.21Å; L272-Y517 HydrophobicContact CB-CE1 4.37Å; L272-Y517 HydrophobicContact CD2-CE1 4.23Å; L272-Y517 WeakPolarHBondContact O-CD1 3.29Å; L272-E518 HydrophobicContact CD1-CG 4.11Å; L272-H521 HydrophobicContact CD1-CB 3.94Å; L272-H521 WeakPolarHBondContact CD2-NE2 3.3Å
273	H	94.3	Very high	93.5	Very high	62 Å²	62	58.9 Å²	58.9	29%	0.287	31%	0.312	S	S	.	.	H	α-helix	trans	-70.5	-37.5	177.2	-73.4	-139	0	0	0	112.2	T269 H270 A277 E518	T269-H273 PolarHBondContact O-CD2 2.97Å; T269-H273 PolarHBondContact O-N 3.25Å; H270-H273 PolarHBondContact O-N 2.94Å; H273-A277 WeakPolarHBondContact O-CB 3.16Å; H273-A277 PolarHBondContact O-N 3.12Å; H273-A277 VanDerWaalsContact O-N 3.12Å; H273-E518 IonicContact CD2-OE2 2.81Å; H273-E518 IonicContact CE1-OE2 3.71Å; H273-E518 IonicContact NE2-OE2 2.72Å; H273-E518 PolarHBondContact NE2-OE2 3Å
274	V	94.3	Very high	93.4	Very high	66 Å²	66	55.2 Å²	55.2	40%	0.4	30%	0.3	S	S	.	.	H	α-helix	trans	-64.9	-46.7	173.5	169.5	0	0	0	0	111.1	H270 K271 A277	H270-V274 WeakPolarHBondContact O-CG2 3.46Å; H270-V274 PolarHBondContact O-N 3.42Å; K271-V274 PolarHBondContact O-N 3.38Å; V274-A277 PolarHBondContact O-N 3.3Å
275	E	94.6	Very high	93	Very high	27 Å²	27	54.3 Å²	54.3	13%	0.126	30%	0.295	C	S	.	.	H	α-helix	trans	-60.5	-48.4	176.6	-177.1	175.7	86.8	0	0	111.7	R255 K271 A277 E278 L497 Y517	R255-E275 WeakPolarHBondContact CD-OE2 3.5Å; R255-E275 IonicContact CZ-OE2 3.6Å; R255-E275 IonicContact NE-OE2 3.7Å; R255-E275 IonicContact NH1-OE1 3.95Å; R255-E275 PolarHBondContact NH1-OE1 3.15Å; R255-E275 IonicContact NH1-OE2 3.03Å; R255-E275 PolarHBondContact NH1-OE2 3.42Å; K271-E275 WeakPolarHBondContact O-CB 3.4Å; K271-E275 PolarHBondContact O-N 3.23Å; E275-A277 VanDerWaalsContact C-N 3.25Å; E275-A277 PolarHBondContact O-N 2.87Å; E275-E278 PolarHBondContact O-N 2.97Å; E275-E278 VanDerWaalsContact O-N 3.08Å; E275-L497 HydrophobicContact CG-CD1 4.21Å; E275-L497 HydrophobicContact CG-CD2 4.38Å; E275-Y517 HydrophobicContact CG-CE1 4.5Å; E275-Y517 WeakPolarHBondContact OE1-CE1 3.38Å; E275-Y517 PolarHBondContact OE1-OH 2.93Å
276	F	96.8	Very high	92.7	Very high	23 Å²	23	57.2 Å²	57.2	10%	0.101	31%	0.314	C	S	.	.	H	α-helix	trans	-57.7	-35.6	177.3	-178.9	-99.4	0	0	0	113.5	L272 E278 I279 I511 T513 Y517	L272-F276 WeakPolarHBondContact O-CB 3.42Å; L272-F276 PolarHBondContact O-N 3.03Å; F276-E278 VanDerWaalsContact C-N 3.26Å; F276-E278 PolarHBondContact O-N 2.8Å; F276-I279 HydrophobicContact CD2-CD1 4.38Å; F276-I279 PolarHBondContact O-N 3.37Å; F276-I511 HydrophobicContact CE2-CB 4.29Å; F276-I511 HydrophobicContact CE2-CG2 3.73Å; F276-I511 HydrophobicContact CZ-CG2 4.38Å; F276-I511 WeakPolarHBondContact CZ-O 3.48Å; F276-T513 VanDerWaalsContact CZ-C 3.45Å; F276-T513 WeakPolarHBondContact CZ-O 3.4Å; F276-Y517 HydrophobicContact CB-CD1 3.77Å; F276-Y517 HydrophobicContact CB-CE1 4.26Å; F276-Y517 HydrophobicContact CB-CG 4.12Å; F276-Y517 VanDerWaalsContact CD2-CB 3.41Å; F276-Y517 HydrophobicContact CD2-CD1 4.1Å; F276-Y517 AromaticContact CD2-CD2 3.86Å; F276-Y517 HydrophobicContact CD2-CD2 3.86Å; F276-Y517 AromaticContact CD2-CG 3.55Å; F276-Y517 HydrophobicContact CD2-CG 3.55Å; F276-Y517 HydrophobicContact CE2-CG 4.36Å; F276-Y517 HydrophobicContact CG-CD1 4.34Å; F276-Y517 HydrophobicContact CG-CG 4.19Å
277	A	94.6	Very high	92.2	Very high	82 Å²	82	64.5 Å²	64.5	68%	0.678	34%	0.344	S	S	*	.	H	α-helix	trans	-70.5	-18.9	179.4	0	0	0	0	0	113.7	H273 V274 E275	H273-A277 WeakPolarHBondContact O-CB 3.16Å; H273-A277 PolarHBondContact O-N 3.12Å; H273-A277 VanDerWaalsContact O-N 3.12Å; V274-A277 PolarHBondContact O-N 3.3Å; E275-A277 VanDerWaalsContact C-N 3.25Å; E275-A277 PolarHBondContact O-N 2.87Å
278	E	93	Very high	91.9	Very high	50 Å²	50	64.3 Å²	64.3	23%	0.234	33%	0.331	C	S	.	.	H	α-helix	trans	-86.4	-20.2	174.4	-63	-168.5	178.3	0	0	113	S201 F203 E275 F276 P280	S201-E278 WeakPolarHBondContact CB-OE2 3.48Å; S201-E278 PolarHBondContact OG-OE2 3.42Å; F203-E278 WeakPolarHBondContact CD2-O 3.47Å; F203-E278 WeakPolarHBondContact CE2-O 3.33Å; E275-E278 PolarHBondContact O-N 2.97Å; E275-E278 VanDerWaalsContact O-N 3.08Å; F276-E278 VanDerWaalsContact C-N 3.26Å; F276-E278 PolarHBondContact O-N 2.8Å; E278-P280 WeakPolarHBondContact O-CD 3.46Å
279	I	95.7	Very high	91.8	Very high	8 Å²	8	61.7 Å²	61.7	4%	0.041	32%	0.317	C	S	.	.	S	Bend	trans	-69	122	-179.8	-48.9	177.6	0	0	0	110.1	Y249 L250 F276 L497 T500 R504 Y517	Y249-I279 HydrophobicContact CE1-CB 4.38Å; Y249-I279 HydrophobicContact CE1-CG1 4.31Å; Y249-I279 HydrophobicContact CE1-CG2 4.39Å; L250-I279 HydrophobicContact CD2-CG2 4.1Å; F276-I279 HydrophobicContact CD2-CD1 4.38Å; F276-I279 PolarHBondContact O-N 3.37Å; I279-L497 HydrophobicContact CD1-CD1 3.61Å; I279-L497 HydrophobicContact CG1-CD1 3.71Å; I279-T500 HydrophobicContact CD1-CG2 3.87Å; I279-R504 PolarHBondContact O-NH1 3.27Å; I279-Y517 HydrophobicContact CD1-CE2 4.11Å
280	P	95.9	Very high	91.8	Very high	18 Å²	18	65.6 Å²	65.6	12%	0.117	34%	0.335	C	S	.	.			trans	-60.7	147	175.6	-22.7	33.6	0	0	0	112.4	F203 A246 Y249 L250 E278 R504	F203-P280 HydrophobicContact CE2-CG 3.87Å; F203-P280 HydrophobicContact CZ-CG 3.79Å; A246-P280 HydrophobicContact CB-CB 3.9Å; A246-P280 HydrophobicContact CB-CG 3.93Å; Y249-P280 HydrophobicContact CD1-CG 4.1Å; Y249-P280 HydrophobicContact CG-CG 4.36Å; L250-P280 HydrophobicContact CD1-CB 4.2Å; L250-P280 HydrophobicContact CG-CB 4.31Å; L250-P280 HydrophobicContact CG-CG 4.25Å; E278-P280 WeakPolarHBondContact O-CD 3.46Å; P280-R504 WeakPolarHBondContact O-CD 3.13Å; P280-R504 PolarHBondContact O-NH1 3.48Å
281	M	95.7	Very high	91.7	Very high	64 Å²	64	59.6 Å²	59.6	32%	0.315	31%	0.308	S	S	.	.			trans	-81.1	-22.8	180	-68.3	-63.6	-74.2	0	0	114	F283 R504 G508 G509	M281-F283 HydrophobicContact CB-CD2 3.75Å; M281-F283 HydrophobicContact CB-CE2 3.82Å; M281-F283 HydrophobicContact CB-CG 4.46Å; M281-F283 HydrophobicContact CE-CE2 3.57Å; M281-F283 HydrophobicContact CE-CZ 3.57Å; M281-F283 HydrophobicContact CG-CE2 4.21Å; M281-F283 PolarHBondContact O-N 3.4Å; M281-F283 VanDerWaalsContact O-N 3.16Å; M281-R504 PolarHBondContact SD-NH1 2.93Å; M281-R504 VanDerWaalsContact SD-NH1 3.44Å; M281-G508 CarbonylContact O-C 3.47Å; M281-G508 VanDerWaalsContact O-CA 3.3Å; M281-G508 WeakPolarHBondContact O-CA 3.2Å; M281-G509 PolarHBondContact O-N 3.5Å
282	N	95.8	Very high	91.6	Very high	42 Å²	42	57.4 Å²	57.4	23%	0.225	31%	0.306	C	S	.	.			trans	52.7	30.8	-179.5	-156.1	41.6	0	0	0	116	L250 N306 R504 A505 G508	L250-N282 HydrophobicContact CD1-CB 3.74Å; N282-N306 PolarHBondContact ND2-ND2 2.98Å; N282-N306 PolarHBondContact O-ND2 3.21Å; N282-R504 VanDerWaalsContact CB-O 3.32Å; N282-R504 WeakPolarHBondContact CB-O 3.42Å; N282-R504 PolarHBondContact ND2-O 2.89Å; N282-A505 PolarHBondContact ND2-O 3.26Å; N282-G508 VanDerWaalsContact O-CA 3.24Å; N282-G508 WeakPolarHBondContact O-CA 3.34Å
283	F	94.8	Very high	91.4	Very high	92 Å²	92	63.2 Å²	63.2	40%	0.404	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-69.6	137.7	165.3	-63	-54.4	0	0	0	109.8	M281 I472 G508	M281-F283 HydrophobicContact CB-CD2 3.75Å; M281-F283 HydrophobicContact CB-CE2 3.82Å; M281-F283 HydrophobicContact CB-CG 4.46Å; M281-F283 HydrophobicContact CE-CE2 3.57Å; M281-F283 HydrophobicContact CE-CZ 3.57Å; M281-F283 HydrophobicContact CG-CE2 4.21Å; M281-F283 PolarHBondContact O-N 3.4Å; M281-F283 VanDerWaalsContact O-N 3.16Å; F283-I472 HydrophobicContact CE1-CD1 3.96Å; F283-I472 HydrophobicContact CZ-CD1 4.24Å; F283-G508 WeakPolarHBondContact CE1-O 3.42Å
284	I	90.1	Very high	91.4	Very high	19 Å²	19	61.7 Å²	61.7	10%	0.097	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-81.9	150.4	174.5	61.2	177.9	0	0	0	111.7	E288 L289 L304 P305 N306 P307	I284-E288 WeakPolarHBondContact CA-OE1 3.45Å; I284-E288 HydrophobicContact CB-CB 4.4Å; I284-L289 HydrophobicContact CD1-CB 4.39Å; I284-L304 HydrophobicContact CD1-CB 3.73Å; I284-L304 HydrophobicContact CD1-CD1 4.36Å; I284-L304 HydrophobicContact CG1-CB 3.81Å; I284-L304 HydrophobicContact CG1-CD1 4.19Å; I284-P305 WeakPolarHBondContact CD1-O 3.48Å; I284-N306 HydrophobicContact CG2-CB 4.49Å; I284-P307 HydrophobicContact CD1-CG 4.4Å
285	D	85.5	Confident	91.4	Very high	67 Å²	67	60.4 Å²	60.4	36%	0.358	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-66.1	134.3	162.3	-173.9	-42	0	0	0	107.7	K287 E288	D285-K287 PolarHBondContact O-N 3.18Å; D285-K287 WeakPolarHBondContact OD1-CB 3.35Å; D285-K287 VanDerWaalsContact OD1-CG 3.25Å; D285-K287 WeakPolarHBondContact OD1-CG 3.49Å; D285-K287 PolarHBondContact OD1-N 2.78Å; D285-K287 IonicContact OD1-NZ 3.49Å; D285-K287 IonicContact OD2-NZ 2.71Å; D285-K287 PolarHBondContact OD2-NZ 3.18Å; D285-E288 HydrophobicContact CB-CG 4.43Å; D285-E288 PolarHBondContact N-OE1 3.38Å; D285-E288 WeakPolarHBondContact O-CB 3.34Å; D285-E288 PolarHBondContact O-N 2.71Å
286	P	85.6	Confident	91.5	Very high	68 Å²	68	62.7 Å²	62.7	44%	0.442	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-49.8	-25.3	173.8	-28.3	34.4	0	0	0	114.9	E288 L289 L304	P286-E288 VanDerWaalsContact C-N 3.27Å; P286-E288 PolarHBondContact O-N 3.18Å; P286-L289 PolarHBondContact O-N 3.49Å; P286-L304 HydrophobicContact CB-CD1 3.97Å; P286-L304 HydrophobicContact CG-CD1 3.92Å
287	K	82.5	Confident	91.5	Very high	174 Å²	174	62.6 Å²	62.6	76%	0.757	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-67.3	-19.9	174.4	-62.3	175.6	-150.8	112.1	0	114.6	D285 L289	D285-K287 PolarHBondContact O-N 3.18Å; D285-K287 WeakPolarHBondContact OD1-CB 3.35Å; D285-K287 VanDerWaalsContact OD1-CG 3.25Å; D285-K287 WeakPolarHBondContact OD1-CG 3.49Å; D285-K287 PolarHBondContact OD1-N 2.78Å; D285-K287 IonicContact OD1-NZ 3.49Å; D285-K287 IonicContact OD2-NZ 2.71Å; D285-K287 PolarHBondContact OD2-NZ 3.18Å; K287-L289 PolarHBondContact O-N 2.64Å
288	E	82.8	Confident	91.7	Very high	107 Å²	107	59.2 Å²	59.2	50%	0.5	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-74.5	-13.1	174.9	-64.7	174	-117.9	0	0	112.4	I284 D285 P286	I284-E288 WeakPolarHBondContact CA-OE1 3.45Å; I284-E288 HydrophobicContact CB-CB 4.4Å; D285-E288 HydrophobicContact CB-CG 4.43Å; D285-E288 PolarHBondContact N-OE1 3.38Å; D285-E288 WeakPolarHBondContact O-CB 3.34Å; D285-E288 PolarHBondContact O-N 2.71Å; P286-E288 VanDerWaalsContact C-N 3.27Å; P286-E288 PolarHBondContact O-N 3.18Å
289	L	87.4	Confident	91.8	Very high	10 Å²	10	58.8 Å²	58.8	5%	0.052	31%	0.313	C	S	.	.			trans	-106.9	77.8	-175.1	-169.8	64.6	0	0	0	110.9	I284 P286 K287 I291 H294 L304 Y325	I284-L289 HydrophobicContact CD1-CB 4.39Å; P286-L289 PolarHBondContact O-N 3.49Å; K287-L289 PolarHBondContact O-N 2.64Å; L289-I291 HydrophobicContact CD1-CD1 3.78Å; L289-I291 HydrophobicContact CD1-CG1 4.21Å; L289-I291 HydrophobicContact CG-CB 4.5Å; L289-I291 HydrophobicContact CG-CD1 4.34Å; L289-I291 HydrophobicContact CG-CG1 4.39Å; L289-I291 PolarHBondContact O-N 3.32Å; L289-H294 HydrophobicContact CD2-CB 4.31Å; L289-L304 HydrophobicContact CD2-CB 4.41Å; L289-L304 HydrophobicContact CD2-CD1 4.46Å; L289-Y325 HydrophobicContact CD1-CE2 4.46Å; L289-Y325 HydrophobicContact CD2-CE2 3.96Å
290	D	88.8	Confident	91.8	Very high	139 Å²	139	62.4 Å²	62.4	74%	0.743	33%	0.326	S	S	*	.			trans	-70	73.1	175.9	-172.4	23	0	0	0	112.1
291	I	90.5	Very high	91.7	Very high	8 Å²	8	70 Å²	70	4%	0.041	36%	0.357	C	S	.	.			trans	-139.5	99.5	176.8	-59.7	-177.7	0	0	0	107	L289 N293 H294 L321 Y325	L289-I291 HydrophobicContact CD1-CD1 3.78Å; L289-I291 HydrophobicContact CD1-CG1 4.21Å; L289-I291 HydrophobicContact CG-CB 4.5Å; L289-I291 HydrophobicContact CG-CD1 4.34Å; L289-I291 HydrophobicContact CG-CG1 4.39Å; L289-I291 PolarHBondContact O-N 3.32Å; I291-N293 PolarHBondContact O-N 3.17Å; I291-H294 HydrophobicContact CB-CB 4.09Å; I291-H294 HydrophobicContact CG2-CB 3.98Å; I291-H294 WeakPolarHBondContact O-CB 3.35Å; I291-H294 PolarHBondContact O-CD2 2.94Å; I291-H294 VanDerWaalsContact O-CD2 3.26Å; I291-H294 PolarHBondContact O-N 2.68Å; I291-L321 HydrophobicContact CG2-CB 4.28Å; I291-Y325 HydrophobicContact CD1-CD2 3.52Å; I291-Y325 HydrophobicContact CD1-CE2 4.22Å; I291-Y325 HydrophobicContact CD1-CG 4.32Å; I291-Y325 HydrophobicContact CG2-CD2 4.33Å; I291-Y325 HydrophobicContact CG2-CG 4.22Å
292	P	90.6	Very high	91.6	Very high	79 Å²	79	72 Å²	72	51%	0.513	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	136.6	-179.9	-30.6	36.7	0	0	0	112.7	H294	P292-H294 PolarHBondContact O-N 2.86Å; P292-H294 VanDerWaalsContact O-N 3.11Å
293	N	90.8	Very high	91.6	Very high	122 Å²	122	70.8 Å²	70.8	65%	0.652	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	16.1	179.1	-60.3	-38.3	0	0	0	116.4	I291 G295 T296 L322	I291-N293 PolarHBondContact O-N 3.17Å; N293-G295 PolarHBondContact O-N 3.35Å; N293-T296 HydrophobicContact CB-CG2 4.37Å; N293-T296 WeakPolarHBondContact O-CB 3.31Å; N293-T296 WeakPolarHBondContact O-CG2 3.44Å; N293-T296 PolarHBondContact O-N 3.17Å; N293-T296 PolarHBondContact O-OG1 3.41Å; N293-L322 HydrophobicContact CB-CD2 4.15Å
294	H	93.2	Very high	91.8	Very high	31 Å²	31	66.8 Å²	66.8	14%	0.144	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-51.7	-29.9	177.8	75.5	75.7	0	0	0	113.6	L289 I291 P292 T296 K297 N298 Y325	L289-H294 HydrophobicContact CD2-CB 4.31Å; I291-H294 HydrophobicContact CB-CB 4.09Å; I291-H294 HydrophobicContact CG2-CB 3.98Å; I291-H294 WeakPolarHBondContact O-CB 3.35Å; I291-H294 PolarHBondContact O-CD2 2.94Å; I291-H294 VanDerWaalsContact O-CD2 3.26Å; I291-H294 PolarHBondContact O-N 2.68Å; P292-H294 PolarHBondContact O-N 2.86Å; P292-H294 VanDerWaalsContact O-N 3.11Å; H294-T296 PolarHBondContact O-N 2.96Å; H294-K297 PolarHBondContact O-N 2.88Å; H294-N298 PolarHBondContact ND1-ND2 2.96Å; H294-N298 PolarHBondContact O-ND2 3.04Å; H294-Y325 HydrophobicContact CB-CD1 4.22Å; H294-Y325 HydrophobicContact CB-CE1 4Å; H294-Y325 HydrophobicContact CB-CE2 4.38Å
295	G	94.8	Very high	92.2	Very high	39 Å²	39	65.9 Å²	65.9	40%	0.402	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-58.1	-27.6	178	0	0	0	0	0	114	N293 K297 N298	N293-G295 PolarHBondContact O-N 3.35Å; G295-K297 PolarHBondContact O-N 3.13Å; G295-N298 PolarHBondContact O-N 2.91Å
296	T	96.1	Very high	92.7	Very high	75 Å²	75	62.9 Å²	62.9	46%	0.46	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-65.5	-26.3	175.5	61.8	0	0	0	0	113	N293 H294 M348 N350	N293-T296 HydrophobicContact CB-CG2 4.37Å; N293-T296 WeakPolarHBondContact O-CB 3.31Å; N293-T296 WeakPolarHBondContact O-CG2 3.44Å; N293-T296 PolarHBondContact O-N 3.17Å; N293-T296 PolarHBondContact O-OG1 3.41Å; H294-T296 PolarHBondContact O-N 2.96Å; T296-M348 WeakPolarHBondContact O-CE 3.49Å; T296-N350 PolarHBondContact O-ND2 3.14Å
297	K	97.8	Very high	93.2	Very high	20 Å²	20	62.1 Å²	62.1	9%	0.087	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-98.2	9	178.1	-70.7	-172.9	161.9	-166.9	0	113	H294 G295 L322 Y325 Q345 M348 T351 D354	H294-K297 PolarHBondContact O-N 2.88Å; G295-K297 PolarHBondContact O-N 3.13Å; K297-L322 HydrophobicContact CD-CD1 3.89Å; K297-L322 HydrophobicContact CD-CG 4.26Å; K297-L322 WeakPolarHBondContact CE-O 3.44Å; K297-L322 HydrophobicContact CG-CD1 4.21Å; K297-L322 PolarHBondContact NZ-O 3.2Å; K297-Y325 HydrophobicContact CB-CD1 3.8Å; K297-Y325 HydrophobicContact CB-CE1 3.84Å; K297-Y325 HydrophobicContact CD-CD1 3.9Å; K297-Y325 WeakPolarHBondContact CD-O 3.31Å; K297-Y325 HydrophobicContact CG-CD1 4.44Å; K297-Y325 PolarHBondContact NZ-O 2.8Å; K297-Q345 PolarHBondContact O-NE2 3.41Å; K297-M348 VanDerWaalsContact C-CE 3.4Å; K297-T351 HydrophobicContact CB-CG2 4.01Å; K297-T351 HydrophobicContact CG-CG2 4.07Å; K297-D354 WeakPolarHBondContact CE-OD2 3.49Å; K297-D354 IonicContact NZ-OD1 3.93Å; K297-D354 PolarHBondContact NZ-OD1 3.12Å; K297-D354 IonicContact NZ-OD2 2.75Å; K297-D354 PolarHBondContact NZ-OD2 3.23Å
298	N	97.5	Very high	93.8	Very high	11 Å²	11	60.2 Å²	60.2	6%	0.059	32%	0.318	C	S	.	.			trans	-113	118.8	-176.8	-70.6	-19.6	0	0	0	112.8	H294 G295 Y300 L304 Y325 N327	H294-N298 PolarHBondContact ND1-ND2 2.96Å; H294-N298 PolarHBondContact O-ND2 3.04Å; G295-N298 PolarHBondContact O-N 2.91Å; N298-Y300 PolarHBondContact O-N 2.95Å; N298-L304 WeakPolarHBondContact ND2-CD2 3.46Å; N298-Y325 PolarHBondContact ND2-OH 2.77Å; N298-Y325 WeakPolarHBondContact OD1-CE1 3.26Å; N298-Y325 PolarHBondContact OD1-OH 2.98Å; N298-N327 WeakPolarHBondContact OD1-CB 3.42Å; N298-N327 PolarHBondContact OD1-ND2 3.27Å
299	R	96.8	Very high	94.4	Very high	41 Å²	41	55.7 Å²	55.7	16%	0.155	30%	0.298	C	S	.	.	S	Bend	trans	-64.9	-26.2	176.4	-174.5	174.5	-78.3	-78.4	2.7	112.8	G346 P347 M348 E378 K379	R299-G346 PolarHBondContact NE-O 2.98Å; R299-P347 PolarHBondContact NH2-O 3.21Å; R299-M348 WeakPolarHBondContact CA-SD 3.48Å; R299-M348 HydrophobicContact CB-CG 4.17Å; R299-M348 HydrophobicContact CB-SD 3.72Å; R299-M348 HydrophobicContact CG-SD 4.33Å; R299-E378 IonicContact CZ-OE1 3.38Å; R299-E378 IonicContact NH1-OE1 2.65Å; R299-E378 PolarHBondContact NH1-OE1 3.03Å; R299-E378 IonicContact NH2-OE1 2.74Å; R299-E378 PolarHBondContact NH2-OE1 3.27Å; R299-K379 PolarHBondContact NE-O 2.95Å
300	Y	95.4	Very high	94.9	Very high	84 Å²	84	57.7 Å²	57.7	33%	0.329	31%	0.305	S	S	.	.	S	Bend	trans	-135.8	121.8	176.3	-60.5	-81.6	0	0	0	109.8	N298 T302 I303 S469 A470	N298-Y300 PolarHBondContact O-N 2.95Å; Y300-T302 PolarHBondContact O-N 2.98Å; Y300-T302 VanDerWaalsContact O-N 3.13Å; Y300-I303 HydrophobicContact CD2-CD1 4.25Å; Y300-I303 HydrophobicContact CG-CD1 4.07Å; Y300-I303 PolarHBondContact O-N 3.16Å; Y300-S469 PolarHBondContact OH-OG 3.3Å; Y300-A470 HydrophobicContact CD2-CB 3.74Å; Y300-A470 HydrophobicContact CE2-CB 3.69Å
301	K	93.4	Very high	95.3	Very high	177 Å²	177	51.1 Å²	51.1	77%	0.77	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.9	-173.7	-64.8	-172.3	178.1	-173.9	0	114.4
302	T	93.1	Very high	95.6	Very high	108 Å²	108	54.7 Å²	54.7	66%	0.663	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	0	-176.8	51.1	0	0	0	0	114.2	Y300	Y300-T302 PolarHBondContact O-N 2.98Å; Y300-T302 VanDerWaalsContact O-N 3.13Å
303	I	96.8	Very high	95.9	Very high	16 Å²	16	51.3 Å²	51.3	8%	0.082	27%	0.265	C	S	.	.			trans	-115.6	94.8	-179.5	-56.2	174.5	0	0	0	106.9	Y300 N327 A470 I472	Y300-I303 HydrophobicContact CD2-CD1 4.25Å; Y300-I303 HydrophobicContact CG-CD1 4.07Å; Y300-I303 PolarHBondContact O-N 3.16Å; I303-N327 PolarHBondContact O-ND2 3.49Å; I303-A470 HydrophobicContact CD1-CB 3.67Å; I303-I472 HydrophobicContact CD1-CD1 3.85Å; I303-I472 HydrophobicContact CD1-CG1 4.48Å; I303-I472 HydrophobicContact CG1-CD1 4.22Å; I303-I472 HydrophobicContact CG2-CD1 3.88Å; I303-I472 HydrophobicContact CG2-CG1 4.28Å; I303-I472 HydrophobicContact CG2-CG2 4.19Å
304	L	98	Very high	95.9	Very high	8 Å²	8	51.8 Å²	51.8	4%	0.042	26%	0.262	C	S	.	.			trans	-117.2	150.6	-170.9	-54.9	-179.4	0	0	0	110.1	I284 P286 L289 N298	I284-L304 HydrophobicContact CD1-CB 3.73Å; I284-L304 HydrophobicContact CD1-CD1 4.36Å; I284-L304 HydrophobicContact CG1-CB 3.81Å; I284-L304 HydrophobicContact CG1-CD1 4.19Å; P286-L304 HydrophobicContact CB-CD1 3.97Å; P286-L304 HydrophobicContact CG-CD1 3.92Å; L289-L304 HydrophobicContact CD2-CB 4.41Å; L289-L304 HydrophobicContact CD2-CD1 4.46Å; N298-L304 WeakPolarHBondContact ND2-CD2 3.46Å
305	P	98.1	Very high	95.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.			trans	-77.1	126.5	178.4	32.3	-34.4	0	0	0	111.1	I284 R310 Y325 N329	I284-P305 WeakPolarHBondContact CD1-O 3.48Å; P305-R310 HydrophobicContact CB-CB 4.07Å; P305-R310 HydrophobicContact CG-CB 4.47Å; P305-Y325 WeakPolarHBondContact CD-OH 3.48Å; P305-Y325 HydrophobicContact CG-CE2 3.7Å; P305-N329 WeakPolarHBondContact CA-OD1 3.13Å; P305-N329 VanDerWaalsContact CB-OD1 3.23Å; P305-N329 WeakPolarHBondContact CB-OD1 3.4Å
306	N	96.8	Very high	93.6	Very high	3 Å²	3	60.4 Å²	60.4	2%	0.016	29%	0.294	C	S	.	.			trans	-57	130	177.1	-60.4	68.3	0	0	0	110.8	N282 I284 H308 S309 R310 N329 R507 G508	N282-N306 PolarHBondContact ND2-ND2 2.98Å; N282-N306 PolarHBondContact O-ND2 3.21Å; I284-N306 HydrophobicContact CG2-CB 4.49Å; N306-H308 VanDerWaalsContact C-N 3.3Å; N306-H308 PolarHBondContact O-N 3.43Å; N306-H308 VanDerWaalsContact O-N 3.15Å; N306-S309 PolarHBondContact O-N 2.86Å; N306-S309 PolarHBondContact O-OG 2.86Å; N306-R310 PolarHBondContact O-N 3.21Å; N306-R310 VanDerWaalsContact O-N 3.16Å; N306-N329 PolarHBondContact N-ND2 3.42Å; N306-N329 VanDerWaalsContact N-ND2 3.17Å; N306-N329 PolarHBondContact O-ND2 3Å; N306-N329 VanDerWaalsContact O-ND2 3.13Å; N306-R507 WeakPolarHBondContact OD1-CA 3.21Å; N306-G508 PolarHBondContact OD1-N 3.26Å
307	P	95.3	Very high	92.2	Very high	53 Å²	53	59.5 Å²	59.5	34%	0.344	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-30.1	-165.9	-28.8	35.8	0	0	0	115.9	I284	I284-P307 HydrophobicContact CD1-CG 4.4Å
308	H	94.9	Very high	90.4	Very high	134 Å²	134	64 Å²	64	62%	0.62	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-22.1	-175.3	69.9	-89.4	0	0	0	113.9	N306 A505	N306-H308 VanDerWaalsContact C-N 3.3Å; N306-H308 PolarHBondContact O-N 3.43Å; N306-H308 VanDerWaalsContact O-N 3.15Å; H308-A505 PolarHBondContact CE1-O 3.2Å; H308-A505 PolarHBondContact NE2-O 3.19Å
309	S	96.9	Very high	88.9	Confident	12 Å²	12	70.5 Å²	70.5	8%	0.084	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-0.1	-175.7	58	0	0	0	0	112.8	N306 N329 Y330 D506	N306-S309 PolarHBondContact O-N 2.86Å; N306-S309 PolarHBondContact O-OG 2.86Å; S309-N329 CarbonylContact O-C 3.59Å; S309-N329 VanDerWaalsContact O-CA 3.3Å; S309-N329 WeakPolarHBondContact O-CA 3.43Å; S309-N329 PolarHBondContact OG-ND2 2.96Å; S309-Y330 WeakPolarHBondContact O-CD2 3.21Å; S309-Y330 PolarHBondContact O-N 2.9Å; S309-D506 WeakPolarHBondContact CB-O 3.43Å; S309-D506 PolarHBondContact OG-O 2.86Å
310	R	97.3	Very high	88.3	Confident	52 Å²	52	72 Å²	72	20%	0.196	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	143.9	-176.4	76.2	-177.9	179	98.2	-7.8	111.8	P305 N306 I312 A328 N329	P305-R310 HydrophobicContact CB-CB 4.07Å; P305-R310 HydrophobicContact CG-CB 4.47Å; N306-R310 PolarHBondContact O-N 3.21Å; N306-R310 VanDerWaalsContact O-N 3.16Å; R310-I312 HydrophobicContact CG-CG1 4.13Å; R310-A328 WeakPolarHBondContact CA-O 3.14Å; R310-N329 PolarHBondContact N-ND2 3.08Å
311	V	98	Very high	87.8	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	139.8	168.5	-171.7	0	0	0	0	108.8	I326 A328 Y330 I342 M358 E362	V311-I326 HydrophobicContact CB-CG2 4.11Å; V311-I326 HydrophobicContact CG1-CG2 4.43Å; V311-A328 HydrophobicContact CB-CB 4.17Å; V311-A328 HydrophobicContact CG2-CB 3.89Å; V311-A328 PolarHBondContact N-O 3.14Å; V311-Y330 HydrophobicContact CB-CE2 4.42Å; V311-Y330 HydrophobicContact CG2-CD1 4.46Å; V311-Y330 HydrophobicContact CG2-CD2 4.18Å; V311-Y330 HydrophobicContact CG2-CE1 4.37Å; V311-Y330 HydrophobicContact CG2-CE2 4.08Å; V311-Y330 HydrophobicContact CG2-CG 4.37Å; V311-I342 HydrophobicContact CG2-CD1 3.92Å; V311-I342 HydrophobicContact CG2-CG1 3.99Å; V311-I342 HydrophobicContact CG2-CG2 4.03Å; V311-M358 HydrophobicContact CB-SD 4.21Å; V311-M358 HydrophobicContact CG1-CG 3.93Å; V311-M358 HydrophobicContact CG1-SD 3.98Å; V311-M358 HydrophobicContact CG2-SD 4.21Å; V311-E362 HydrophobicContact CG1-CG 4.46Å
312	I	96.4	Very high	87.7	Confident	83 Å²	83	65.5 Å²	65.5	43%	0.426	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.5	-178.4	-48.7	-174.3	0	0	0	108.4	R310 Q361	R310-I312 HydrophobicContact CG-CG1 4.13Å; I312-Q361 PolarHBondContact O-NE2 3.14Å
313	L	95.8	Very high	87.7	Confident	8 Å²	8	61.6 Å²	61.6	4%	0.042	33%	0.326	C	S	.	.			trans	-74.9	132.1	-178.8	-57.2	-179.8	0	0	0	111.2	S315 S324 I326 D354 Q357 M358	L313-S315 VanDerWaalsContact C-N 3.27Å; L313-S315 PolarHBondContact O-N 3.49Å; L313-S324 PolarHBondContact N-O 3.37Å; L313-I326 HydrophobicContact CD1-CB 4.19Å; L313-I326 HydrophobicContact CD1-CG2 4.47Å; L313-I326 HydrophobicContact CD2-CB 4.41Å; L313-I326 HydrophobicContact CD2-CG2 3.9Å; L313-I326 HydrophobicContact CG-CB 4.28Å; L313-I326 HydrophobicContact CG-CG2 4.01Å; L313-D354 HydrophobicContact CD1-CB 3.75Å; L313-Q357 HydrophobicContact CD2-CG 4.35Å; L313-M358 HydrophobicContact CD2-CB 3.88Å
314	K	91.1	Very high	87.5	Confident	132 Å²	132	61.7 Å²	61.7	57%	0.574	33%	0.327	S	S	*	.			trans	-77.4	74	179.9	-62.2	169.5	-163.7	160.7	0	109.8	Q361 E362	K314-Q361 HydrophobicContact CD-CB 4.16Å; K314-Q361 PolarHBondContact NZ-O 2.82Å; K314-E362 IonicContact NZ-OE1 3.78Å
315	S	77.6	Confident	87.4	Confident	54 Å²	54	61.3 Å²	61.3	38%	0.378	33%	0.325	S	S	.	.			trans	-70.2	159.1	175.4	-171.8	0	0	0	0	112.2	L313 S317 S323	L313-S315 VanDerWaalsContact C-N 3.27Å; L313-S315 PolarHBondContact O-N 3.49Å; S315-S317 PolarHBondContact OG-N 3.1Å; S315-S317 PolarHBondContact OG-O 3.44Å; S315-S323 WeakPolarHBondContact CB-OG 3.45Å; S315-S323 PolarHBondContact OG-OG 2.92Å
316	K	63	Low	87.5	Confident	197 Å²	197	61.6 Å²	61.6	86%	0.857	33%	0.327	S	S	*	.	S	Bend	trans	-83.6	-17	168	-81.7	-161.8	173.7	-168.6	0	112.8
317	S	66.3	Low	87.5	Confident	56 Å²	56	61.5 Å²	61.5	39%	0.392	33%	0.327	S	S	.	.			trans	-100.5	113.7	174	-175.7	0	0	0	0	108.9	S315 N319	S315-S317 PolarHBondContact OG-N 3.1Å; S315-S317 PolarHBondContact OG-O 3.44Å; S317-N319 VanDerWaalsContact C-N 3.27Å
318	C	59.1	Low	87.7	Confident	114 Å²	114	59 Å²	59	77%	0.77	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-22.8	172.1	46.9	0	0	0	0	112.8
319	N	67.8	Low	87.9	Confident	148 Å²	148	52.6 Å²	52.6	79%	0.791	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-4.7	-174	-65.3	-2.9	0	0	0	113.8	S317	S317-N319 VanDerWaalsContact C-N 3.27Å
320	D	82.5	Confident	88	Confident	73 Å²	73	53.6 Å²	53.6	39%	0.39	28%	0.283	S	S	.	.			trans	-108.9	93.4	176.4	-179.7	-4.5	0	0	0	110.8	L322 S323 S324	D320-L322 PolarHBondContact O-N 2.89Å; D320-L322 WeakPolarHBondContact OD1-CA 3.18Å; D320-L322 WeakPolarHBondContact OD1-CB 3.25Å; D320-L322 PolarHBondContact OD1-N 3.42Å; D320-S323 PolarHBondContact O-N 3.04Å; D320-S323 PolarHBondContact O-OG 2.92Å; D320-S323 PolarHBondContact OD1-N 3.33Å; D320-S323 WeakPolarHBondContact OD2-CB 3.43Å; D320-S324 PolarHBondContact O-N 3.08Å
321	L	86.3	Confident	88	Confident	83 Å²	83	51.1 Å²	51.1	44%	0.435	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-32.5	176.5	-63.3	177.6	0	0	0	112.6	I291 S324 Y325	I291-L321 HydrophobicContact CG2-CB 4.28Å; L321-S324 WeakPolarHBondContact O-CB 3.5Å; L321-S324 PolarHBondContact O-N 3.29Å; L321-S324 PolarHBondContact O-OG 2.74Å; L321-Y325 PolarHBondContact O-N 3.42Å
322	L	91.6	Very high	88	Confident	42 Å²	42	55.4 Å²	55.4	22%	0.22	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-30.8	179.2	-171.9	66.3	0	0	0	111.4	N293 K297 D320 S324 Y325	N293-L322 HydrophobicContact CB-CD2 4.15Å; K297-L322 HydrophobicContact CD-CD1 3.89Å; K297-L322 HydrophobicContact CD-CG 4.26Å; K297-L322 WeakPolarHBondContact CE-O 3.44Å; K297-L322 HydrophobicContact CG-CD1 4.21Å; K297-L322 PolarHBondContact NZ-O 3.2Å; D320-L322 PolarHBondContact O-N 2.89Å; D320-L322 WeakPolarHBondContact OD1-CA 3.18Å; D320-L322 WeakPolarHBondContact OD1-CB 3.25Å; D320-L322 PolarHBondContact OD1-N 3.42Å; L322-S324 PolarHBondContact O-N 3.41Å; L322-Y325 HydrophobicContact CD1-CD1 4.43Å; L322-Y325 PolarHBondContact O-N 2.95Å; L322-Y325 VanDerWaalsContact O-N 3.17Å
323	S	91.2	Very high	87.8	Confident	26 Å²	26	52.1 Å²	52.1	18%	0.182	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-26.6	168.9	79.8	0	0	0	0	113	S315 D320 Y325	S315-S323 WeakPolarHBondContact CB-OG 3.45Å; S315-S323 PolarHBondContact OG-OG 2.92Å; D320-S323 PolarHBondContact O-N 3.04Å; D320-S323 PolarHBondContact O-OG 2.92Å; D320-S323 PolarHBondContact OD1-N 3.33Å; D320-S323 WeakPolarHBondContact OD2-CB 3.43Å; S323-Y325 VanDerWaalsContact C-N 3.33Å
324	S	93.5	Very high	87.5	Confident	17 Å²	17	53.6 Å²	53.6	12%	0.119	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-12.3	173.7	87.2	0	0	0	0	113.7	L313 D320 L321 L322	L313-S324 PolarHBondContact N-O 3.37Å; D320-S324 PolarHBondContact O-N 3.08Å; L321-S324 WeakPolarHBondContact O-CB 3.5Å; L321-S324 PolarHBondContact O-N 3.29Å; L321-S324 PolarHBondContact O-OG 2.74Å; L322-S324 PolarHBondContact O-N 3.41Å
325	Y	96.8	Very high	87.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.1	-168.4	-179.2	-100.3	0	0	0	113.9	L289 I291 H294 K297 N298 P305 L321 L322 S323	L289-Y325 HydrophobicContact CD1-CE2 4.46Å; L289-Y325 HydrophobicContact CD2-CE2 3.96Å; I291-Y325 HydrophobicContact CD1-CD2 3.52Å; I291-Y325 HydrophobicContact CD1-CE2 4.22Å; I291-Y325 HydrophobicContact CD1-CG 4.32Å; I291-Y325 HydrophobicContact CG2-CD2 4.33Å; I291-Y325 HydrophobicContact CG2-CG 4.22Å; H294-Y325 HydrophobicContact CB-CD1 4.22Å; H294-Y325 HydrophobicContact CB-CE1 4Å; H294-Y325 HydrophobicContact CB-CE2 4.38Å; K297-Y325 HydrophobicContact CB-CD1 3.8Å; K297-Y325 HydrophobicContact CB-CE1 3.84Å; K297-Y325 HydrophobicContact CD-CD1 3.9Å; K297-Y325 WeakPolarHBondContact CD-O 3.31Å; K297-Y325 HydrophobicContact CG-CD1 4.44Å; K297-Y325 PolarHBondContact NZ-O 2.8Å; N298-Y325 PolarHBondContact ND2-OH 2.77Å; N298-Y325 WeakPolarHBondContact OD1-CE1 3.26Å; N298-Y325 PolarHBondContact OD1-OH 2.98Å; P305-Y325 WeakPolarHBondContact CD-OH 3.48Å; P305-Y325 HydrophobicContact CG-CE2 3.7Å; L321-Y325 PolarHBondContact O-N 3.42Å; L322-Y325 HydrophobicContact CD1-CD1 4.43Å; L322-Y325 PolarHBondContact O-N 2.95Å; L322-Y325 VanDerWaalsContact O-N 3.17Å; S323-Y325 VanDerWaalsContact C-N 3.33Å
326	I	98.5	Very high	86.7	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	147	164.4	-174.6	163.4	0	0	0	109	V311 L313 A328 D354 F355 M358	V311-I326 HydrophobicContact CB-CG2 4.11Å; V311-I326 HydrophobicContact CG1-CG2 4.43Å; L313-I326 HydrophobicContact CD1-CB 4.19Å; L313-I326 HydrophobicContact CD1-CG2 4.47Å; L313-I326 HydrophobicContact CD2-CB 4.41Å; L313-I326 HydrophobicContact CD2-CG2 3.9Å; L313-I326 HydrophobicContact CG-CB 4.28Å; L313-I326 HydrophobicContact CG-CG2 4.01Å; I326-A328 HydrophobicContact CG1-CB 4.33Å; I326-A328 HydrophobicContact CG2-CB 4.12Å; I326-A328 PolarHBondContact O-N 2.94Å; I326-D354 HydrophobicContact CD1-CB 4.08Å; I326-F355 HydrophobicContact CD1-CB 4.47Å; I326-M358 HydrophobicContact CD1-CB 4.14Å; I326-M358 HydrophobicContact CD1-CE 4.22Å; I326-M358 HydrophobicContact CD1-SD 3.85Å; I326-M358 HydrophobicContact CG2-SD 4.21Å
327	N	98.6	Very high	87.8	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.011	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	71.6	176	-166.2	-38.6	0	0	0	111.2	N298 I303 T344 Q345 R507	N298-N327 WeakPolarHBondContact OD1-CB 3.42Å; N298-N327 PolarHBondContact OD1-ND2 3.27Å; I303-N327 PolarHBondContact O-ND2 3.49Å; N327-T344 WeakPolarHBondContact O-CA 3.47Å; N327-T344 PolarHBondContact O-OG1 3.42Å; N327-Q345 HydrophobicContact CB-CG 4.11Å; N327-Q345 PolarHBondContact O-N 2.89Å; N327-R507 PolarHBondContact OD1-NH1 3.46Å; N327-R507 PolarHBondContact OD1-NH2 3.38Å
328	A	98.8	Very high	88.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	150.3	-179.2	0	0	0	0	0	111.6	R310 V311 I326 I342 A343 M358	R310-A328 WeakPolarHBondContact CA-O 3.14Å; V311-A328 HydrophobicContact CB-CB 4.17Å; V311-A328 HydrophobicContact CG2-CB 3.89Å; V311-A328 PolarHBondContact N-O 3.14Å; I326-A328 HydrophobicContact CG1-CB 4.33Å; I326-A328 HydrophobicContact CG2-CB 4.12Å; I326-A328 PolarHBondContact O-N 2.94Å; A328-I342 HydrophobicContact CB-CG2 3.87Å; A328-A343 CarbonylContact C-O 3.49Å; A328-A343 VanDerWaalsContact CA-O 3.28Å; A328-A343 WeakPolarHBondContact CA-O 3.5Å; A328-M358 HydrophobicContact CB-CE 4.35Å; A328-M358 HydrophobicContact CB-SD 3.64Å
329	N	98.8	Very high	90.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	143.4	174	-63.2	87.2	0	0	0	110.1	P305 N306 S309 R310 I331 I342 A343 R507	P305-N329 WeakPolarHBondContact CA-OD1 3.13Å; P305-N329 VanDerWaalsContact CB-OD1 3.23Å; P305-N329 WeakPolarHBondContact CB-OD1 3.4Å; N306-N329 PolarHBondContact N-ND2 3.42Å; N306-N329 VanDerWaalsContact N-ND2 3.17Å; N306-N329 PolarHBondContact O-ND2 3Å; N306-N329 VanDerWaalsContact O-ND2 3.13Å; S309-N329 CarbonylContact O-C 3.59Å; S309-N329 VanDerWaalsContact O-CA 3.3Å; S309-N329 WeakPolarHBondContact O-CA 3.43Å; S309-N329 PolarHBondContact OG-ND2 2.96Å; R310-N329 PolarHBondContact N-ND2 3.08Å; N329-I331 HydrophobicContact CB-CD1 4.29Å; N329-I342 CarbonylContact O-C 3.58Å; N329-I342 VanDerWaalsContact O-CA 3.29Å; N329-I342 WeakPolarHBondContact O-CA 3.47Å; N329-A343 PolarHBondContact N-O 3.47Å; N329-A343 PolarHBondContact O-N 2.95Å; N329-R507 HydrophobicContact CB-CB 4.04Å; N329-R507 HydrophobicContact CB-CG 4.35Å; N329-R507 WeakPolarHBondContact OD1-CD 3.34Å; N329-R507 WeakPolarHBondContact OD1-CG 3.25Å; N329-R507 PolarHBondContact OD1-NH1 3.48Å
330	Y	98.8	Very high	91.7	Very high	32 Å²	32	42.5 Å²	42.5	13%	0.125	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	140.6	158.8	-57.6	-80.9	0	0	0	108.8	S309 V311 R339 I342 E362	S309-Y330 WeakPolarHBondContact O-CD2 3.21Å; S309-Y330 PolarHBondContact O-N 2.9Å; V311-Y330 HydrophobicContact CB-CE2 4.42Å; V311-Y330 HydrophobicContact CG2-CD1 4.46Å; V311-Y330 HydrophobicContact CG2-CD2 4.18Å; V311-Y330 HydrophobicContact CG2-CE1 4.37Å; V311-Y330 HydrophobicContact CG2-CE2 4.08Å; V311-Y330 HydrophobicContact CG2-CG 4.37Å; Y330-R339 HydrophobicContact CD1-CB 4.22Å; Y330-R339 HydrophobicContact CD1-CG 3.92Å; Y330-R339 HydrophobicContact CG-CG 4.28Å; Y330-R339 VanDerWaalsContact CZ-NH1 3.34Å; Y330-R339 PolarHBondContact OH-NH1 2.94Å; Y330-I342 HydrophobicContact CD1-CD1 4.13Å; Y330-I342 HydrophobicContact CD1-CG1 3.87Å; Y330-I342 HydrophobicContact CE1-CD1 4.05Å; Y330-I342 HydrophobicContact CE1-CG1 4.31Å; Y330-E362 VanDerWaalsContact OH-CD 3.26Å; Y330-E362 PolarHBondContact OH-OE1 3.2Å; Y330-E362 PolarHBondContact OH-OE2 3.44Å; Y330-E362 VanDerWaalsContact OH-OE2 3.08Å
331	I	98.5	Very high	92.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.4	177.8	-54.9	-62.8	0	0	0	108	N329 A340 F341 A343 I479 L503 D506 R507 M510	N329-I331 HydrophobicContact CB-CD1 4.29Å; I331-A340 PolarHBondContact O-N 3.31Å; I331-F341 HydrophobicContact CB-CB 4.21Å; I331-F341 PolarHBondContact N-O 3.39Å; I331-F341 PolarHBondContact O-N 3.43Å; I331-A343 HydrophobicContact CD1-CB 3.85Å; I331-A343 HydrophobicContact CG1-CB 3.55Å; I331-I479 HydrophobicContact CG1-CD1 4.42Å; I331-I479 HydrophobicContact CG2-CD1 4.43Å; I331-I479 HydrophobicContact CG2-CG2 4.15Å; I331-L503 HydrophobicContact CG2-CD2 3.29Å; I331-D506 HydrophobicContact CD1-CB 3.65Å; I331-R507 HydrophobicContact CD1-CB 3.74Å; I331-M510 HydrophobicContact CD1-CE 4.19Å; I331-M510 HydrophobicContact CG1-CE 4.38Å
332	R	96.7	Very high	93.1	Very high	90 Å²	90	35.2 Å²	35.2	34%	0.34	20%	0.197	S	C	.	.			trans	-70.6	140.4	177.2	-65.8	175.2	-74.9	140.8	2.1	110.5	D337 Q502 D506	R332-D337 CarbonylContact C-O 3.58Å; R332-D337 WeakPolarHBondContact CA-O 3.02Å; R332-Q502 VanDerWaalsContact CZ-OE1 3.27Å; R332-Q502 PolarHBondContact NH2-O 3.04Å; R332-D506 WeakPolarHBondContact CB-OD2 3.26Å; R332-D506 WeakPolarHBondContact CG-OD2 3.49Å; R332-D506 IonicContact CZ-OD1 3.17Å; R332-D506 IonicContact CZ-OD2 3.95Å; R332-D506 PolarHBondContact N-OD2 3.28Å; R332-D506 IonicContact NE-OD1 2.78Å; R332-D506 PolarHBondContact NE-OD1 2.96Å; R332-D506 IonicContact NE-OD2 3.23Å; R332-D506 PolarHBondContact NE-OD2 3.29Å; R332-D506 IonicContact NH2-OD1 2.72Å; R332-D506 PolarHBondContact NH2-OD1 2.78Å; R332-D506 IonicContact NH2-OD2 3.88Å
333	G	93.4	Very high	93.4	Very high	15 Å²	15	33.2 Å²	33.2	16%	0.155	19%	0.186	C	C	.	.			trans	-91.4	-165.3	170.5	0	0	0	0	0	112.3	D337 A340	G333-D337 PolarHBondContact N-O 3.09Å; G333-A340 VanDerWaalsContact CA-CB 3.42Å
334	Y	89.7	Confident	93.8	Very high	39 Å²	39	32.1 Å²	32.1	15%	0.153	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-73.2	155.3	174.9	-175.2	-125.2	0	0	0	111.8	G336 D337 R486 Q487 V490 E491	Y334-G336 VanDerWaalsContact C-N 3.28Å; Y334-G336 PolarHBondContact O-N 3.09Å; Y334-G336 VanDerWaalsContact O-N 3.15Å; Y334-D337 PolarHBondContact O-N 2.98Å; Y334-R486 HydrophobicContact CD1-CB 4.11Å; Y334-R486 HydrophobicContact CD1-CG 3.43Å; Y334-R486 VanDerWaalsContact CD1-CG 3.43Å; Y334-R486 HydrophobicContact CE1-CG 3.92Å; Y334-R486 HydrophobicContact CG-CG 4.28Å; Y334-Q487 HydrophobicContact CD2-CB 4.47Å; Y334-Q487 HydrophobicContact CE2-CB 3.95Å; Y334-Q487 HydrophobicContact CE2-CG 3.77Å; Y334-V490 HydrophobicContact CE1-CB 4.03Å; Y334-V490 HydrophobicContact CE1-CG1 4.28Å; Y334-V490 HydrophobicContact CE1-CG2 4.11Å; Y334-E491 WeakPolarHBondContact CE2-OE1 3.33Å; Y334-E491 WeakPolarHBondContact OH-CG 3.37Å; Y334-E491 PolarHBondContact OH-OE1 3.13Å
335	L	82.4	Confident	94	Very high	132 Å²	132	31.6 Å²	31.6	69%	0.691	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	47.5	39.5	176.6	-65.1	172	0	0	0	116	V490	L335-V490 HydrophobicContact CD1-CG1 4.46Å
336	G	68.8	Low	94.1	Very high	71 Å²	71	31.6 Å²	31.6	73%	0.732	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	84.5	8.7	171.1	0	0	0	0	0	115.6	Y334 S338	Y334-G336 VanDerWaalsContact C-N 3.28Å; Y334-G336 PolarHBondContact O-N 3.09Å; Y334-G336 VanDerWaalsContact O-N 3.15Å; G336-S338 VanDerWaalsContact C-N 3.35Å; G336-S338 PolarHBondContact O-N 2.94Å
337	D	85.8	Confident	94.1	Very high	59 Å²	59	31.3 Å²	31.3	32%	0.316	17%	0.173	S	C	.	.			trans	-62	93.5	169.1	-178.2	-6.3	0	0	0	110.4	R332 G333 Y334 R339 A340 R455	R332-D337 CarbonylContact C-O 3.58Å; R332-D337 WeakPolarHBondContact CA-O 3.02Å; G333-D337 PolarHBondContact N-O 3.09Å; Y334-D337 PolarHBondContact O-N 2.98Å; D337-R339 PolarHBondContact O-N 3.1Å; D337-R339 VanDerWaalsContact O-N 3.11Å; D337-R339 PolarHBondContact OD1-N 3.43Å; D337-A340 HydrophobicContact CB-CB 4.22Å; D337-A340 VanDerWaalsContact CG-CB 3.49Å; D337-A340 WeakPolarHBondContact OD1-CA 3.36Å; D337-A340 PolarHBondContact OD1-N 3.43Å; D337-A340 VanDerWaalsContact OD1-N 3.11Å; D337-A340 WeakPolarHBondContact OD2-CA 3.45Å; D337-A340 WeakPolarHBondContact OD2-CB 3.44Å; D337-R455 IonicContact OD2-CZ 2.8Å; D337-R455 IonicContact OD2-NH2 3.79Å; D337-R455 PolarHBondContact OD2-NH2 3.37Å
338	S	87.6	Confident	94.1	Very high	82 Å²	82	32.5 Å²	32.5	57%	0.573	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-14.6	-169.5	67.2	0	0	0	0	115	G336	G336-S338 VanDerWaalsContact C-N 3.35Å; G336-S338 PolarHBondContact O-N 2.94Å
339	R	91.4	Very high	94	Very high	124 Å²	124	38.4 Å²	38.4	47%	0.468	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-145.5	42.8	-175.9	-61.9	-172.7	-177.8	-159.6	1.5	111.9	Y330 D337 F341 P463	Y330-R339 HydrophobicContact CD1-CB 4.22Å; Y330-R339 HydrophobicContact CD1-CG 3.92Å; Y330-R339 HydrophobicContact CG-CG 4.28Å; Y330-R339 VanDerWaalsContact CZ-NH1 3.34Å; Y330-R339 PolarHBondContact OH-NH1 2.94Å; D337-R339 PolarHBondContact O-N 3.1Å; D337-R339 VanDerWaalsContact O-N 3.11Å; D337-R339 PolarHBondContact OD1-N 3.43Å; R339-F341 VanDerWaalsContact C-N 3.28Å; R339-F341 PolarHBondContact O-N 2.92Å; R339-P463 WeakPolarHBondContact O-CA 3.38Å; R339-P463 VanDerWaalsContact O-CB 3.31Å; R339-P463 WeakPolarHBondContact O-CB 3.34Å
340	A	96.2	Very high	93.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-58.8	-39.8	-179.7	0	0	0	0	0	113.2	I331 G333 D337 P463 V464	I331-A340 PolarHBondContact O-N 3.31Å; G333-A340 VanDerWaalsContact CA-CB 3.42Å; D337-A340 HydrophobicContact CB-CB 4.22Å; D337-A340 VanDerWaalsContact CG-CB 3.49Å; D337-A340 WeakPolarHBondContact OD1-CA 3.36Å; D337-A340 PolarHBondContact OD1-N 3.43Å; D337-A340 VanDerWaalsContact OD1-N 3.11Å; D337-A340 WeakPolarHBondContact OD2-CA 3.45Å; D337-A340 WeakPolarHBondContact OD2-CB 3.44Å; A340-P463 WeakPolarHBondContact O-CA 3.47Å; A340-V464 PolarHBondContact O-N 3.41Å
341	F	98.5	Very high	93.9	Very high	3 Å²	3	41.2 Å²	41.2	1%	0.013	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	163.2	-176.3	-47.2	-90.6	0	0	0	111.9	I331 R339 V464 V466 I479 T482 I483	I331-F341 HydrophobicContact CB-CB 4.21Å; I331-F341 PolarHBondContact N-O 3.39Å; I331-F341 PolarHBondContact O-N 3.43Å; R339-F341 VanDerWaalsContact C-N 3.28Å; R339-F341 PolarHBondContact O-N 2.92Å; F341-V464 CarbonylContact C-O 3.56Å; F341-V464 WeakPolarHBondContact CA-O 3.39Å; F341-V464 WeakPolarHBondContact CB-O 3.4Å; F341-V464 HydrophobicContact CD1-CB 3.81Å; F341-V464 HydrophobicContact CD1-CG1 4.18Å; F341-V464 HydrophobicContact CE1-CB 4.29Å; F341-V466 HydrophobicContact CD1-CG2 4Å; F341-I479 HydrophobicContact CB-CD1 3.75Å; F341-I479 HydrophobicContact CB-CG1 4.37Å; F341-I479 HydrophobicContact CD1-CD1 4.41Å; F341-I479 HydrophobicContact CD1-CG1 4.13Å; F341-I479 HydrophobicContact CD2-CD1 4.4Å; F341-I479 HydrophobicContact CD2-CG1 4.33Å; F341-I479 HydrophobicContact CD2-CG2 3.61Å; F341-I479 HydrophobicContact CE2-CG2 3.75Å; F341-I479 HydrophobicContact CG-CD1 3.95Å; F341-I479 HydrophobicContact CG-CG1 4.02Å; F341-I479 HydrophobicContact CG-CG2 4.18Å; F341-I479 HydrophobicContact CZ-CG2 4.4Å; F341-T482 HydrophobicContact CE1-CG2 4.42Å; F341-T482 HydrophobicContact CZ-CG2 3.93Å; F341-I483 HydrophobicContact CE2-CD1 4.45Å; F341-I483 HydrophobicContact CE2-CG1 4.29Å
342	I	98.9	Very high	93.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	122.1	160.2	-76.2	166.9	0	0	0	108.5	V311 A328 N329 Y330 M358 E362 P463 V464 I465 V466	V311-I342 HydrophobicContact CG2-CD1 3.92Å; V311-I342 HydrophobicContact CG2-CG1 3.99Å; V311-I342 HydrophobicContact CG2-CG2 4.03Å; A328-I342 HydrophobicContact CB-CG2 3.87Å; N329-I342 CarbonylContact O-C 3.58Å; N329-I342 VanDerWaalsContact O-CA 3.29Å; N329-I342 WeakPolarHBondContact O-CA 3.47Å; Y330-I342 HydrophobicContact CD1-CD1 4.13Å; Y330-I342 HydrophobicContact CD1-CG1 3.87Å; Y330-I342 HydrophobicContact CE1-CD1 4.05Å; Y330-I342 HydrophobicContact CE1-CG1 4.31Å; I342-M358 HydrophobicContact CD1-CG 4.45Å; I342-M358 HydrophobicContact CD1-SD 4.39Å; I342-M358 HydrophobicContact CG2-CE 3.82Å; I342-M358 HydrophobicContact CG2-SD 3.85Å; I342-E362 HydrophobicContact CD1-CB 4.23Å; I342-E362 HydrophobicContact CD1-CG 3.9Å; I342-P463 HydrophobicContact CB-CB 4.47Å; I342-P463 HydrophobicContact CD1-CB 3.95Å; I342-P463 HydrophobicContact CD1-CG 3.45Å; I342-P463 VanDerWaalsContact CD1-CG 3.45Å; I342-P463 HydrophobicContact CG1-CB 3.78Å; I342-P463 HydrophobicContact CG1-CG 3.85Å; I342-V464 PolarHBondContact N-O 3.07Å; I342-I465 HydrophobicContact CB-CG1 4.17Å; I342-I465 WeakPolarHBondContact O-CA 3.01Å; I342-V466 PolarHBondContact O-N 2.91Å
343	A	98.9	Very high	93.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.8	170.5	0	0	0	0	0	109.7	A328 N329 I331 T475 M510	A328-A343 CarbonylContact C-O 3.49Å; A328-A343 VanDerWaalsContact CA-O 3.28Å; A328-A343 WeakPolarHBondContact CA-O 3.5Å; N329-A343 PolarHBondContact N-O 3.47Å; N329-A343 PolarHBondContact O-N 2.95Å; I331-A343 HydrophobicContact CD1-CB 3.85Å; I331-A343 HydrophobicContact CG1-CB 3.55Å; A343-T475 HydrophobicContact CB-CG2 3.65Å; A343-M510 HydrophobicContact CB-CE 4.19Å; A343-M510 HydrophobicContact CB-SD 4.19Å
344	T	98.9	Very high	94.2	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	155.3	-176.5	-178.2	0	0	0	0	112	N327 F355 M358 I465 V466 H467 G471	N327-T344 WeakPolarHBondContact O-CA 3.47Å; N327-T344 PolarHBondContact O-OG1 3.42Å; T344-F355 HydrophobicContact CG2-CD2 4.36Å; T344-F355 HydrophobicContact CG2-CE2 3.95Å; T344-M358 HydrophobicContact CG2-CE 4.09Å; T344-I465 HydrophobicContact CG2-CG2 3.75Å; T344-V466 PolarHBondContact N-O 2.97Å; T344-H467 HydrophobicContact CG2-CB 3.64Å; T344-H467 WeakPolarHBondContact O-CA 3.28Å; T344-H467 VanDerWaalsContact O-CB 3.23Å; T344-H467 WeakPolarHBondContact O-CB 3.36Å; T344-G471 WeakPolarHBondContact O-CA 3.46Å
345	Q	98.5	Very high	94.6	Very high	6 Å²	6	40.1 Å²	40.1	3%	0.028	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-64.3	160.4	168.4	75.8	-178.7	10.5	0	0	111.6	K297 N327 P347	K297-Q345 PolarHBondContact O-NE2 3.41Å; N327-Q345 HydrophobicContact CB-CG 4.11Å; N327-Q345 PolarHBondContact O-N 2.89Å; Q345-P347 WeakPolarHBondContact O-CD 3.44Å
346	G	98.5	Very high	95.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-67.3	124.2	168.6	0	0	0	0	0	110.7	R299 H467 C468 S469	R299-G346 PolarHBondContact NE-O 2.98Å; G346-H467 WeakPolarHBondContact CA-ND1 3.33Å; G346-C468 WeakPolarHBondContact CA-O 3.36Å; G346-C468 PolarHBondContact N-O 3.5Å; G346-C468 VanDerWaalsContact N-O 3.07Å; G346-S469 PolarHBondContact N-O 2.82Å
347	P	98.6	Very high	96.7	Very high	1 Å²	1	32 Å²	32	1%	0.006	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-47.5	145.2	-176.1	-34.1	37.6	0	0	0	114.6	R299 Q345 V352 F355 V381 Y383	R299-P347 PolarHBondContact NH2-O 3.21Å; Q345-P347 WeakPolarHBondContact O-CD 3.44Å; P347-V352 HydrophobicContact CB-CG2 4.39Å; P347-F355 HydrophobicContact CG-CB 4Å; P347-F355 HydrophobicContact CG-CD1 4.2Å; P347-F355 HydrophobicContact CG-CD2 3.58Å; P347-F355 HydrophobicContact CG-CE2 4.04Å; P347-F355 HydrophobicContact CG-CG 3.66Å; P347-V381 HydrophobicContact CB-CG2 4.3Å; P347-V381 WeakPolarHBondContact O-CG2 3.47Å; P347-V381 PolarHBondContact O-N 3.43Å; P347-V381 VanDerWaalsContact O-N 3.13Å; P347-Y383 HydrophobicContact CB-CD1 4.16Å; P347-Y383 HydrophobicContact CB-CG 4.37Å; P347-Y383 HydrophobicContact CG-CD1 3.76Å; P347-Y383 HydrophobicContact CG-CE1 4.16Å; P347-Y383 HydrophobicContact CG-CG 4.05Å
348	M	98.1	Very high	97.3	Very high	27 Å²	27	29.2 Å²	29.2	13%	0.133	16%	0.156	C	C	.	.			trans	-106	164.4	169.5	-53.2	-166.5	-57	0	0	109	T296 K297 R299 N350 T351 V352	T296-M348 WeakPolarHBondContact O-CE 3.49Å; K297-M348 VanDerWaalsContact C-CE 3.4Å; R299-M348 WeakPolarHBondContact CA-SD 3.48Å; R299-M348 HydrophobicContact CB-CG 4.17Å; R299-M348 HydrophobicContact CB-SD 3.72Å; R299-M348 HydrophobicContact CG-SD 4.33Å; M348-N350 WeakPolarHBondContact CB-OD1 3.47Å; M348-N350 PolarHBondContact O-N 2.97Å; M348-N350 VanDerWaalsContact O-N 3.15Å; M348-T351 HydrophobicContact CB-CG2 4.31Å; M348-T351 HydrophobicContact CE-CG2 4Å; M348-T351 PolarHBondContact N-OG1 3.16Å; M348-T351 CarbonylContact O-C 3.6Å; M348-T351 PolarHBondContact O-N 3.17Å; M348-T351 PolarHBondContact O-OG1 2.89Å; M348-V352 WeakPolarHBondContact O-CG2 3.22Å; M348-V352 PolarHBondContact O-N 2.91Å
349	V	97.4	Very high	97.8	Very high	123 Å²	123	25.4 Å²	25.4	75%	0.745	13%	0.129	S	C	*	.	G	3₁₀ helix	trans	-50.1	-44.4	-178.1	-177	0	0	0	0	112.1	T351 V381	V349-T351 PolarHBondContact O-N 3.19Å; V349-V381 HydrophobicContact CG2-CG1 3.88Å
350	N	96.9	Very high	98	Very high	87 Å²	87	19.9 Å²	19.9	47%	0.465	11%	0.109	S	C	.	.	G	3₁₀ helix	trans	-81	-5.5	179.8	64.8	-37.4	0	0	0	114.9	T296 M348	T296-N350 PolarHBondContact O-ND2 3.14Å; M348-N350 WeakPolarHBondContact CB-OD1 3.47Å; M348-N350 PolarHBondContact O-N 2.97Å; M348-N350 VanDerWaalsContact O-N 3.15Å
351	T	98.3	Very high	98	Very high	5 Å²	5	20.6 Å²	20.6	3%	0.031	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-117.5	8.8	-179.7	80.9	0	0	0	0	113.8	K297 M348 V349 D354 F355	K297-T351 HydrophobicContact CB-CG2 4.01Å; K297-T351 HydrophobicContact CG-CG2 4.07Å; M348-T351 HydrophobicContact CB-CG2 4.31Å; M348-T351 HydrophobicContact CE-CG2 4Å; M348-T351 PolarHBondContact N-OG1 3.16Å; M348-T351 CarbonylContact O-C 3.6Å; M348-T351 PolarHBondContact O-N 3.17Å; M348-T351 PolarHBondContact O-OG1 2.89Å; V349-T351 PolarHBondContact O-N 3.19Å; T351-D354 WeakPolarHBondContact CA-OD2 3.25Å; T351-D354 PolarHBondContact O-N 3.33Å; T351-F355 WeakPolarHBondContact O-CB 3.26Å; T351-F355 PolarHBondContact O-N 3.39Å
352	V	98.6	Very high	97.9	Very high	13 Å²	13	21.3 Å²	21.3	8%	0.079	12%	0.116	C	C	.	.	H	α-helix	trans	-64	-42.9	175.5	175.1	0	0	0	0	111	P347 M348 F355 W356 V381 Y391	P347-V352 HydrophobicContact CB-CG2 4.39Å; M348-V352 WeakPolarHBondContact O-CG2 3.22Å; M348-V352 PolarHBondContact O-N 2.91Å; V352-F355 PolarHBondContact O-N 3.35Å; V352-W356 VanDerWaalsContact O-CD1 3.3Å; V352-W356 PolarHBondContact O-N 2.74Å; V352-W356 VanDerWaalsContact O-N 3.08Å; V352-V381 HydrophobicContact CG2-CG2 3.66Å; V352-Y391 HydrophobicContact CG1-CD1 3.39Å; V352-Y391 HydrophobicContact CG1-CE1 3.69Å; V352-Y391 HydrophobicContact CG1-CG 4.12Å
353	N	97.4	Very high	97.8	Very high	83 Å²	83	25.3 Å²	25.3	44%	0.444	13%	0.134	S	C	.	.	H	α-helix	trans	-64.9	-40	177.5	-65.2	-21.7	0	0	0	111.8	F355 W356 Q357 Y391 G392	N353-F355 VanDerWaalsContact C-N 3.35Å; N353-W356 PolarHBondContact O-N 3.26Å; N353-Q357 VanDerWaalsContact O-CB 3.31Å; N353-Q357 WeakPolarHBondContact O-CB 3.32Å; N353-Q357 PolarHBondContact O-N 3.17Å; N353-Y391 VanDerWaalsContact OD1-C 3.25Å; N353-Y391 WeakPolarHBondContact OD1-CA 3.2Å; N353-Y391 WeakPolarHBondContact OD1-CB 3.19Å; N353-G392 PolarHBondContact OD1-N 3.08Å
354	D	97.9	Very high	97.7	Very high	22 Å²	22	25.5 Å²	25.5	12%	0.118	14%	0.135	C	C	.	.	H	α-helix	trans	-59.9	-44.9	174.6	-63.8	-37.3	0	0	0	111.3	K297 L313 I326 T351 Q357 M358	K297-D354 WeakPolarHBondContact CE-OD2 3.49Å; K297-D354 IonicContact NZ-OD1 3.93Å; K297-D354 PolarHBondContact NZ-OD1 3.12Å; K297-D354 IonicContact NZ-OD2 2.75Å; K297-D354 PolarHBondContact NZ-OD2 3.23Å; L313-D354 HydrophobicContact CD1-CB 3.75Å; I326-D354 HydrophobicContact CD1-CB 4.08Å; T351-D354 WeakPolarHBondContact CA-OD2 3.25Å; T351-D354 PolarHBondContact O-N 3.33Å; D354-Q357 PolarHBondContact O-N 2.96Å; D354-M358 WeakPolarHBondContact O-CB 3.39Å; D354-M358 PolarHBondContact O-N 2.85Å
355	F	98.8	Very high	97.6	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.009	14%	0.137	C	C	.	.	H	α-helix	trans	-65.4	-42.4	-179.1	178.3	-88	0	0	0	112.4	I326 T344 P347 T351 V352 N353 M358 A359 I367 Y383 I465	I326-F355 HydrophobicContact CD1-CB 4.47Å; T344-F355 HydrophobicContact CG2-CD2 4.36Å; T344-F355 HydrophobicContact CG2-CE2 3.95Å; P347-F355 HydrophobicContact CG-CB 4Å; P347-F355 HydrophobicContact CG-CD1 4.2Å; P347-F355 HydrophobicContact CG-CD2 3.58Å; P347-F355 HydrophobicContact CG-CE2 4.04Å; P347-F355 HydrophobicContact CG-CG 3.66Å; T351-F355 WeakPolarHBondContact O-CB 3.26Å; T351-F355 PolarHBondContact O-N 3.39Å; V352-F355 PolarHBondContact O-N 3.35Å; N353-F355 VanDerWaalsContact C-N 3.35Å; F355-M358 HydrophobicContact CD2-CE 4.23Å; F355-M358 HydrophobicContact CE2-CE 4.43Å; F355-M358 WeakPolarHBondContact O-CB 3.49Å; F355-M358 PolarHBondContact O-N 3.19Å; F355-A359 PolarHBondContact O-N 3.11Å; F355-I367 HydrophobicContact CE1-CD1 3.8Å; F355-I367 HydrophobicContact CZ-CD1 3.92Å; F355-I367 HydrophobicContact CZ-CG1 4.37Å; F355-I367 HydrophobicContact CZ-CG2 4.1Å; F355-Y383 HydrophobicContact CD1-CD2 4Å; F355-Y383 HydrophobicContact CD1-CE2 4.13Å; F355-Y383 AromaticContact CE1-CD2 3.7Å; F355-Y383 HydrophobicContact CE1-CD2 3.7Å; F355-Y383 AromaticContact CE1-CE2 3.36Å; F355-Y383 HydrophobicContact CE1-CE2 3.36Å; F355-Y383 AromaticContact CE1-CZ 3.96Å; F355-Y383 HydrophobicContact CZ-CD2 4.48Å; F355-Y383 AromaticContact CZ-CE2 3.84Å; F355-Y383 HydrophobicContact CZ-CE2 3.84Å; F355-Y383 AromaticContact CZ-CZ 3.96Å; F355-I465 HydrophobicContact CE2-CG2 3.93Å; F355-I465 HydrophobicContact CZ-CG2 4.15Å
356	W	98.3	Very high	97.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-72.2	-34.2	175.3	-73	116.4	0	0	0	113	V352 N353 M358 A359 W360 I367 Y383 W384 Y391 V394 V396 L412 L414	V352-W356 VanDerWaalsContact O-CD1 3.3Å; V352-W356 PolarHBondContact O-N 2.74Å; V352-W356 VanDerWaalsContact O-N 3.08Å; N353-W356 PolarHBondContact O-N 3.26Å; W356-M358 VanDerWaalsContact C-N 3.28Å; W356-M358 PolarHBondContact O-N 3.41Å; W356-A359 HydrophobicContact CE3-CB 4.21Å; W356-A359 PolarHBondContact O-N 3.13Å; W356-W360 VanDerWaalsContact O-CB 3.24Å; W356-W360 WeakPolarHBondContact O-CB 3.4Å; W356-W360 PolarHBondContact O-N 2.89Å; W356-I367 HydrophobicContact CH2-CD1 4.13Å; W356-I367 HydrophobicContact CZ3-CD1 3.96Å; W356-Y383 HydrophobicContact CH2-CE2 4.45Å; W356-Y383 AromaticContact CZ2-CD2 3.7Å; W356-Y383 HydrophobicContact CZ2-CD2 3.7Å; W356-Y383 HydrophobicContact CZ2-CE2 4.05Å; W356-Y383 PolarHBondContact NE1-O 2.84Å; W356-W384 HydrophobicContact CZ2-CB 4.13Å; W356-Y391 VanDerWaalsContact CD1-CB 3.48Å; W356-Y391 AromaticContact CD1-CD1 3.96Å; W356-Y391 AromaticContact CD1-CD2 3.39Å; W356-Y391 AromaticContact CD1-CG 3.31Å; W356-Y391 HydrophobicContact CD2-CD2 4.48Å; W356-Y391 HydrophobicContact CG-CD2 4.02Å; W356-Y391 HydrophobicContact CG-CG 4.14Å; W356-Y391 AromaticContact NE1-CD2 3.47Å; W356-Y391 AromaticContact NE1-CE2 3.65Å; W356-Y391 AromaticContact NE1-CG 3.75Å; W356-V394 HydrophobicContact CB-CB 4.18Å; W356-V394 HydrophobicContact CB-CG1 4.35Å; W356-V396 HydrophobicContact CD2-CG2 3.72Å; W356-V396 HydrophobicContact CE3-CG2 3.78Å; W356-V396 HydrophobicContact CG-CG2 4.26Å; W356-V396 HydrophobicContact CH2-CG1 4.05Å; W356-V396 HydrophobicContact CH2-CG2 4.28Å; W356-V396 HydrophobicContact CZ2-CG1 4.21Å; W356-V396 HydrophobicContact CZ2-CG2 4.19Å; W356-V396 HydrophobicContact CZ3-CG1 4.39Å; W356-V396 HydrophobicContact CZ3-CG2 4.07Å; W356-L412 HydrophobicContact CH2-CD1 3.69Å; W356-L412 HydrophobicContact CZ3-CD1 4.39Å; W356-L414 HydrophobicContact CE3-CD2 4.13Å; W356-L414 HydrophobicContact CE3-CG 4.45Å; W356-L414 HydrophobicContact CZ3-CD1 4.23Å; W356-L414 HydrophobicContact CZ3-CD2 4.27Å; W356-L414 HydrophobicContact CZ3-CG 4.4Å
357	Q	97	Very high	97.6	Very high	34 Å²	34	25.5 Å²	25.5	16%	0.159	14%	0.136	C	C	.	.	H	α-helix	trans	-61.2	-38.5	169.5	175.2	59.8	43.3	0	0	111.2	L313 N353 D354 Q361	L313-Q357 HydrophobicContact CD2-CG 4.35Å; N353-Q357 VanDerWaalsContact O-CB 3.31Å; N353-Q357 WeakPolarHBondContact O-CB 3.32Å; N353-Q357 PolarHBondContact O-N 3.17Å; D354-Q357 PolarHBondContact O-N 2.96Å; Q357-Q361 VanDerWaalsContact O-CB 3.32Å; Q357-Q361 WeakPolarHBondContact O-CB 3.45Å; Q357-Q361 VanDerWaalsContact O-CG 3.25Å; Q357-Q361 WeakPolarHBondContact O-CG 3.5Å; Q357-Q361 PolarHBondContact O-N 3.44Å
358	M	98.2	Very high	97.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.2	-56.5	173.4	-173.5	177.2	73.4	0	0	112	V311 L313 I326 A328 I342 T344 D354 F355 W356 W360 Q361 E362 I465	V311-M358 HydrophobicContact CB-SD 4.21Å; V311-M358 HydrophobicContact CG1-CG 3.93Å; V311-M358 HydrophobicContact CG1-SD 3.98Å; V311-M358 HydrophobicContact CG2-SD 4.21Å; L313-M358 HydrophobicContact CD2-CB 3.88Å; I326-M358 HydrophobicContact CD1-CB 4.14Å; I326-M358 HydrophobicContact CD1-CE 4.22Å; I326-M358 HydrophobicContact CD1-SD 3.85Å; I326-M358 HydrophobicContact CG2-SD 4.21Å; A328-M358 HydrophobicContact CB-CE 4.35Å; A328-M358 HydrophobicContact CB-SD 3.64Å; I342-M358 HydrophobicContact CD1-CG 4.45Å; I342-M358 HydrophobicContact CD1-SD 4.39Å; I342-M358 HydrophobicContact CG2-CE 3.82Å; I342-M358 HydrophobicContact CG2-SD 3.85Å; T344-M358 HydrophobicContact CG2-CE 4.09Å; D354-M358 WeakPolarHBondContact O-CB 3.39Å; D354-M358 PolarHBondContact O-N 2.85Å; F355-M358 HydrophobicContact CD2-CE 4.23Å; F355-M358 HydrophobicContact CE2-CE 4.43Å; F355-M358 WeakPolarHBondContact O-CB 3.49Å; F355-M358 PolarHBondContact O-N 3.19Å; W356-M358 VanDerWaalsContact C-N 3.28Å; W356-M358 PolarHBondContact O-N 3.41Å; M358-W360 PolarHBondContact O-N 3.02Å; M358-Q361 PolarHBondContact O-N 3.4Å; M358-Q361 VanDerWaalsContact O-N 3.14Å; M358-E362 HydrophobicContact CG-CG 4.42Å; M358-E362 PolarHBondContact O-N 2.95Å; M358-E362 VanDerWaalsContact O-N 3.14Å; M358-I465 HydrophobicContact CE-CD1 3.9Å; M358-I465 HydrophobicContact CE-CG1 4.16Å; M358-I465 HydrophobicContact CE-CG2 4.16Å
359	A	97.9	Very high	97.6	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-58	-34.1	179.9	0	0	0	0	0	112.5	F355 W356 S364 I367 L414 L424 I465	F355-A359 PolarHBondContact O-N 3.11Å; W356-A359 HydrophobicContact CE3-CB 4.21Å; W356-A359 PolarHBondContact O-N 3.13Å; A359-S364 PolarHBondContact O-N 2.98Å; A359-I367 HydrophobicContact CB-CD1 4.44Å; A359-L414 HydrophobicContact CB-CD2 4.43Å; A359-L424 HydrophobicContact CB-CD1 4.18Å; A359-I465 HydrophobicContact CB-CD1 3.69Å
360	W	96.6	Very high	97.6	Very high	8 Å²	8	18.3 Å²	18.3	3%	0.03	9%	0.094	C	C	.	.	H	α-helix	trans	-67.8	-53.8	172.1	178.9	-102.3	0	0	0	112.9	W356 M358 E362 E363 V394 L414 Q416 Q420 R422	W356-W360 VanDerWaalsContact O-CB 3.24Å; W356-W360 WeakPolarHBondContact O-CB 3.4Å; W356-W360 PolarHBondContact O-N 2.89Å; M358-W360 PolarHBondContact O-N 3.02Å; W360-E362 VanDerWaalsContact C-N 3.34Å; W360-E362 PolarHBondContact O-N 2.91Å; W360-E363 PolarHBondContact O-N 3.33Å; W360-V394 HydrophobicContact CB-CG1 4.48Å; W360-V394 HydrophobicContact CB-CG2 3.76Å; W360-V394 HydrophobicContact CG-CG2 4.03Å; W360-L414 HydrophobicContact CE3-CB 3.81Å; W360-L414 HydrophobicContact CE3-CD2 4.37Å; W360-L414 HydrophobicContact CZ3-CB 3.96Å; W360-Q416 HydrophobicContact CD2-CB 4.26Å; W360-Q416 HydrophobicContact CH2-CB 3.86Å; W360-Q416 HydrophobicContact CZ2-CB 3.33Å; W360-Q416 HydrophobicContact CZ2-CG 4.33Å; W360-Q416 HydrophobicContact CZ3-CB 4.5Å; W360-Q420 HydrophobicContact CH2-CB 3.73Å; W360-Q420 WeakPolarHBondContact CH2-O 3.39Å; W360-Q420 HydrophobicContact CZ2-CB 3.85Å; W360-R422 HydrophobicContact CE3-CG 4.44Å; W360-R422 HydrophobicContact CH2-CG 4.31Å; W360-R422 HydrophobicContact CZ3-CB 4.11Å; W360-R422 HydrophobicContact CZ3-CG 3.91Å; W360-R422 PolarHBondContact O-NH1 2.99Å
361	Q	95.8	Very high	97.4	Very high	15 Å²	15	14.2 Å²	14.2	7%	0.07	7%	0.072	C	C	.	.	H	α-helix	trans	-76.8	-18.2	-166.9	76.3	170.8	44.3	0	0	115.3	I312 K314 Q357 M358	I312-Q361 PolarHBondContact O-NE2 3.14Å; K314-Q361 HydrophobicContact CD-CB 4.16Å; K314-Q361 PolarHBondContact NZ-O 2.82Å; Q357-Q361 VanDerWaalsContact O-CB 3.32Å; Q357-Q361 WeakPolarHBondContact O-CB 3.45Å; Q357-Q361 VanDerWaalsContact O-CG 3.25Å; Q357-Q361 WeakPolarHBondContact O-CG 3.5Å; Q357-Q361 PolarHBondContact O-N 3.44Å; M358-Q361 PolarHBondContact O-N 3.4Å; M358-Q361 VanDerWaalsContact O-N 3.14Å
362	E	96.6	Very high	97.2	Very high	19 Å²	19	18.8 Å²	18.8	9%	0.089	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	1.3	176.8	-57.2	-52.5	136.9	0	0	111.7	V311 K314 Y330 I342 M358 W360 S364 G462 P463	V311-E362 HydrophobicContact CG1-CG 4.46Å; K314-E362 IonicContact NZ-OE1 3.78Å; Y330-E362 VanDerWaalsContact OH-CD 3.26Å; Y330-E362 PolarHBondContact OH-OE1 3.2Å; Y330-E362 PolarHBondContact OH-OE2 3.44Å; Y330-E362 VanDerWaalsContact OH-OE2 3.08Å; I342-E362 HydrophobicContact CD1-CB 4.23Å; I342-E362 HydrophobicContact CD1-CG 3.9Å; M358-E362 HydrophobicContact CG-CG 4.42Å; M358-E362 PolarHBondContact O-N 2.95Å; M358-E362 VanDerWaalsContact O-N 3.14Å; W360-E362 VanDerWaalsContact C-N 3.34Å; W360-E362 PolarHBondContact O-N 2.91Å; E362-S364 PolarHBondContact O-N 3.02Å; E362-G462 WeakPolarHBondContact O-CA 3.41Å; E362-P463 HydrophobicContact CB-CG 3.94Å; E362-P463 WeakPolarHBondContact O-CD 3.35Å
363	E	95.9	Very high	96.9	Very high	84 Å²	84	20.4 Å²	20.4	39%	0.393	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	32	178.2	-39.4	-154.1	164.4	0	0	114	W360 P365 R422 C460	W360-E363 PolarHBondContact O-N 3.33Å; E363-P365 WeakPolarHBondContact O-CD 3.36Å; E363-R422 VanDerWaalsContact CD-NH2 3.31Å; E363-R422 IonicContact OE1-CZ 3.14Å; E363-R422 IonicContact OE1-NE 3.96Å; E363-R422 IonicContact OE1-NH2 2.91Å; E363-R422 PolarHBondContact OE1-NH2 2.74Å; E363-R422 IonicContact OE2-NE 3.34Å; E363-R422 IonicContact OE2-NH2 3.94Å; E363-C460 HydrophobicContact CB-CB 4.28Å; E363-C460 WeakPolarHBondContact O-CB 3.37Å
364	S	97.3	Very high	96.5	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.021	11%	0.109	C	C	.	.			trans	-59.3	119.5	-174.6	-70.6	0	0	0	0	112.2	A359 E362 L424 P463 I465	A359-S364 PolarHBondContact O-N 2.98Å; E362-S364 PolarHBondContact O-N 3.02Å; S364-L424 VanDerWaalsContact O-CD1 3.25Å; S364-L424 WeakPolarHBondContact O-CD1 3.45Å; S364-P463 WeakPolarHBondContact CA-O 3.46Å; S364-P463 WeakPolarHBondContact CB-O 3.5Å; S364-P463 PolarHBondContact OG-O 2.77Å; S364-I465 WeakPolarHBondContact OG-CD1 3.09Å; S364-I465 WeakPolarHBondContact OG-CG1 3.43Å
365	P	96.3	Very high	95.8	Very high	8 Å²	8	24.2 Å²	24.2	5%	0.052	11%	0.112	C	C	.	.	S	Bend	trans	-79.1	-22.5	-178.5	31.4	-35.4	0	0	0	113	E363 L424 Q425 A458 G462	E363-P365 WeakPolarHBondContact O-CD 3.36Å; P365-L424 CarbonylContact O-C 3.55Å; P365-L424 VanDerWaalsContact O-CA 3.32Å; P365-L424 WeakPolarHBondContact O-CA 3.17Å; P365-Q425 PolarHBondContact O-N 2.88Å; P365-A458 HydrophobicContact CB-CB 3.52Å; P365-A458 HydrophobicContact CG-CB 4.23Å; P365-G462 WeakPolarHBondContact CD-O 3.4Å
366	V	98.3	Very high	95.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	139.5	-174.9	-174.4	0	0	0	0	111.4	V368 Q425 Y427 V451 E454 V464 I465	V366-V368 HydrophobicContact CG1-CG2 3.98Å; V366-Q425 CarbonylContact C-O 3.58Å; V366-Q425 WeakPolarHBondContact CA-O 3.47Å; V366-Y427 HydrophobicContact CG1-CD2 3.63Å; V366-Y427 HydrophobicContact CG1-CE2 3.77Å; V366-V451 HydrophobicContact CG1-CG1 4.17Å; V366-V451 HydrophobicContact CG1-CG2 4.26Å; V366-E454 HydrophobicContact CG2-CB 4.26Å; V366-E454 HydrophobicContact CG2-CG 3.95Å; V366-V464 HydrophobicContact CB-CG1 4.07Å; V366-V464 HydrophobicContact CB-CG2 4.18Å; V366-V464 HydrophobicContact CG1-CG1 4.27Å; V366-I465 PolarHBondContact O-N 3.01Å
367	I	98.8	Very high	94.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.4	164.4	-64.5	165	0	0	0	108.9	F355 W356 A359 Y383 L424 Q425 Y427 I465	F355-I367 HydrophobicContact CE1-CD1 3.8Å; F355-I367 HydrophobicContact CZ-CD1 3.92Å; F355-I367 HydrophobicContact CZ-CG1 4.37Å; F355-I367 HydrophobicContact CZ-CG2 4.1Å; W356-I367 HydrophobicContact CH2-CD1 4.13Å; W356-I367 HydrophobicContact CZ3-CD1 3.96Å; A359-I367 HydrophobicContact CB-CD1 4.44Å; I367-Y383 WeakPolarHBondContact CG2-OH 3.34Å; I367-L424 HydrophobicContact CB-CD2 4.23Å; I367-L424 HydrophobicContact CD1-CD1 3.8Å; I367-L424 HydrophobicContact CD1-CD2 3.58Å; I367-L424 HydrophobicContact CD1-CG 4.34Å; I367-L424 HydrophobicContact CG1-CD1 4.05Å; I367-L424 HydrophobicContact CG1-CD2 3.8Å; I367-L424 HydrophobicContact CG1-CG 4.39Å; I367-Q425 PolarHBondContact N-O 2.8Å; I367-Y427 PolarHBondContact O-N 3.2Å; I367-I465 CarbonylContact C-O 3.41Å; I367-I465 WeakPolarHBondContact CA-O 3.47Å; I367-I465 HydrophobicContact CG1-CB 4.07Å; I367-I465 HydrophobicContact CG1-CD1 4.26Å; I367-I465 HydrophobicContact CG1-CG2 4.43Å; I367-I465 HydrophobicContact CG2-CG2 4.47Å
368	V	98.8	Very high	94.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	111.8	175.4	-171.8	0	0	0	0	109.7	V366 I370 L447 V451 V464 I465 V466 H467 F478	V366-V368 HydrophobicContact CG1-CG2 3.98Å; V368-I370 HydrophobicContact CG1-CD1 4.09Å; V368-I370 HydrophobicContact CG1-CG1 3.91Å; V368-L447 HydrophobicContact CG1-CD2 3.94Å; V368-L447 HydrophobicContact CG1-CG 4.45Å; V368-V451 HydrophobicContact CG2-CG1 4.05Å; V368-V451 HydrophobicContact CG2-CG2 3.73Å; V368-V464 HydrophobicContact CG2-CG1 3.93Å; V368-I465 PolarHBondContact N-O 3.14Å; V368-V466 HydrophobicContact CB-CG1 4.35Å; V368-V466 HydrophobicContact CB-CG2 4.32Å; V368-V466 WeakPolarHBondContact O-CA 3.45Å; V368-H467 PolarHBondContact O-N 2.77Å; V368-F478 HydrophobicContact CB-CE1 4.36Å; V368-F478 HydrophobicContact CG1-CD1 4.45Å; V368-F478 HydrophobicContact CG1-CE1 4.15Å; V368-F478 HydrophobicContact CG1-CE2 4.28Å; V368-F478 HydrophobicContact CG1-CZ 4.05Å; V368-F478 HydrophobicContact CG2-CE1 4.08Å; V368-F478 HydrophobicContact CG2-CZ 4.11Å
369	M	98.6	Very high	94.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	111.4	-178.4	175.5	171.9	-177.8	0	0	110.9	T371 L373 C380 Y383 W384 Y427 W428 Y429 H467	M369-T371 HydrophobicContact CE-CG2 3.79Å; M369-T371 HydrophobicContact CG-CG2 4.21Å; M369-L373 HydrophobicContact CE-CD2 3.81Å; M369-C380 HydrophobicContact CE-CB 3.92Å; M369-Y383 HydrophobicContact CE-CE1 4.43Å; M369-Y383 HydrophobicContact SD-CE1 3.84Å; M369-W384 HydrophobicContact CE-CH2 4.02Å; M369-W384 HydrophobicContact CE-CZ3 3.93Å; M369-W384 HydrophobicContact SD-CE3 4.48Å; M369-W384 HydrophobicContact SD-CH2 3.7Å; M369-W384 HydrophobicContact SD-CZ3 3.4Å; M369-W384 WeakPolarHBondContact SD-CZ3 3.29Å; M369-Y427 PolarHBondContact N-O 2.82Å; M369-W428 HydrophobicContact CG-CG 4.49Å; M369-W428 VanDerWaalsContact SD-CD1 3.56Å; M369-W428 HydrophobicContact SD-CG 4.2Å; M369-Y429 PolarHBondContact O-N 3.48Å; M369-H467 WeakPolarHBondContact CB-NE2 3.35Å; M369-H467 VanDerWaalsContact CG-CE1 3.42Å; M369-H467 WeakPolarHBondContact CG-CE1 3.48Å; M369-H467 VanDerWaalsContact CG-NE2 3.29Å; M369-H467 WeakPolarHBondContact CG-NE2 3.29Å
370	I	96.8	Very high	94	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.192	C	C	.	.			trans	-110.6	54.1	-173.4	-41	-176.9	0	0	0	110.3	V368 Y429 W432 V466 H467 R474 F478	V368-I370 HydrophobicContact CG1-CD1 4.09Å; V368-I370 HydrophobicContact CG1-CG1 3.91Å; I370-Y429 HydrophobicContact CG2-CD1 3.77Å; I370-Y429 HydrophobicContact CG2-CE1 4.46Å; I370-W432 HydrophobicContact CG2-CB 4.3Å; I370-W432 HydrophobicContact CG2-CD2 4.18Å; I370-W432 HydrophobicContact CG2-CE3 3.51Å; I370-W432 HydrophobicContact CG2-CZ3 4.24Å; I370-V466 HydrophobicContact CD1-CG1 4.09Å; I370-H467 PolarHBondContact N-O 2.89Å; I370-R474 HydrophobicContact CB-CB 4.27Å; I370-R474 HydrophobicContact CG2-CB 3.98Å; I370-R474 WeakPolarHBondContact O-CD 3.44Å; I370-R474 PolarHBondContact O-NH1 2.81Å; I370-R474 VanDerWaalsContact O-NH1 3.14Å; I370-F478 HydrophobicContact CD1-CB 3.36Å; I370-F478 HydrophobicContact CD1-CD1 4.4Å; I370-F478 HydrophobicContact CD1-CD2 4.11Å; I370-F478 HydrophobicContact CD1-CG 3.71Å
371	T	93.8	Very high	94	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	20%	0.196	C	C	.	.	S	Bend	trans	-161.2	150	178.7	-168.9	0	0	0	0	112.2	M369 E375 K379 C380 W428 Y429 R474	M369-T371 HydrophobicContact CE-CG2 3.79Å; M369-T371 HydrophobicContact CG-CG2 4.21Å; T371-E375 PolarHBondContact OG1-OE1 2.78Å; T371-K379 WeakPolarHBondContact OG1-CB 3.34Å; T371-C380 HydrophobicContact CG2-CB 3.93Å; T371-W428 PolarHBondContact O-NE1 2.89Å; T371-Y429 PolarHBondContact N-O 2.79Å; T371-R474 PolarHBondContact OG1-NH1 2.99Å
372	K	93.6	Very high	94.1	Very high	101 Å²	101	45.7 Å²	45.7	44%	0.439	22%	0.217	S	C	.	.			trans	-73.6	158.1	159.5	-57.1	-175.3	-176.7	-174.2	0	109	K374 E375 T430	K372-K374 WeakPolarHBondContact CB-O 3.37Å; K372-E375 HydrophobicContact CB-CG 3.92Å; K372-T430 WeakPolarHBondContact CE-O 3.32Å
373	L	92.6	Very high	94.2	Very high	48 Å²	48	44.8 Å²	44.8	25%	0.251	21%	0.213	S	C	.	.	S	Bend	trans	-63	-47	176.7	-64.1	174	0	0	0	110.9	M369 K379 C380 V381 L382 W384 W428	M369-L373 HydrophobicContact CE-CD2 3.81Å; L373-K379 PolarHBondContact O-N 3.25Å; L373-C380 CarbonylContact C-O 3.54Å; L373-C380 VanDerWaalsContact CA-O 3.3Å; L373-C380 WeakPolarHBondContact CA-O 3.42Å; L373-C380 WeakPolarHBondContact CB-O 3.38Å; L373-C380 HydrophobicContact CD2-CB 4.41Å; L373-C380 WeakPolarHBondContact CD2-O 3.05Å; L373-C380 PolarHBondContact O-N 2.94Å; L373-C380 VanDerWaalsContact O-O 3.05Å; L373-V381 WeakPolarHBondContact CD2-O 3.48Å; L373-L382 HydrophobicContact CD1-CB 4.19Å; L373-L382 HydrophobicContact CD1-CD1 4.45Å; L373-L382 HydrophobicContact CD2-CB 4.48Å; L373-W384 HydrophobicContact CD2-CH2 4.09Å; L373-W384 HydrophobicContact CD2-CZ3 4.38Å; L373-W428 HydrophobicContact CD1-CZ2 4.5Å; L373-W428 HydrophobicContact CG-CZ2 4.11Å
374	K	89.6	Confident	94.4	Very high	147 Å²	147	41.4 Å²	41.4	64%	0.639	20%	0.197	S	C	*	.	B	Isolated β-bridge	trans	-123.6	139.1	171.6	-175.8	176.8	177.5	179.3	0	108.9	K372 K376	K372-K374 WeakPolarHBondContact CB-O 3.37Å; K374-K376 WeakPolarHBondContact CE-O 3.18Å
375	E	83.6	Confident	94.4	Very high	38 Å²	38	41.9 Å²	41.9	18%	0.178	20%	0.199	C	C	.	.	S	Bend	trans	-116.1	-106.7	168.8	-65	173.7	171.8	0	0	106.5	T371 K372 N377 K379 D434 R474	T371-E375 PolarHBondContact OG1-OE1 2.78Å; K372-E375 HydrophobicContact CB-CG 3.92Å; E375-N377 PolarHBondContact N-O 2.58Å; E375-K379 HydrophobicContact CB-CG 4.06Å; E375-K379 HydrophobicContact CG-CG 3.93Å; E375-K379 IonicContact OE2-NZ 3.57Å; E375-K379 PolarHBondContact OE2-NZ 2.96Å; E375-D434 HydrophobicContact CB-CB 4.02Å; E375-D434 VanDerWaalsContact CB-OD2 3.26Å; E375-D434 WeakPolarHBondContact CB-OD2 3.36Å; E375-D434 HydrophobicContact CG-CB 4.44Å; E375-D434 WeakPolarHBondContact OE2-CB 3.25Å; E375-R474 IonicContact OE1-CZ 3.84Å; E375-R474 IonicContact OE1-NH1 3.14Å; E375-R474 PolarHBondContact OE1-NH1 3.33Å; E375-R474 IonicContact OE1-NH2 3.64Å; E375-R474 PolarHBondContact OE1-NH2 2.84Å; E375-R474 IonicContact OE2-CZ 3.52Å; E375-R474 IonicContact OE2-NH1 2.81Å; E375-R474 IonicContact OE2-NH2 4Å; E375-R474 PolarHBondContact OE2-NH2 3.03Å; E375-R474 VanDerWaalsContact OE2-NH2 3.14Å
376	K	83.4	Confident	94.3	Very high	153 Å²	153	50.1 Å²	50.1	67%	0.665	24%	0.237	S	C	*	.	S	Bend	trans	-71	-54.3	161.1	-65.6	178.3	-178.5	176.5	0	111.1	K374	K374-K376 WeakPolarHBondContact CE-O 3.18Å
377	N	86.6	Confident	94.2	Very high	122 Å²	122	58 Å²	58	65%	0.652	27%	0.272	S	S	*	.	S	Bend	trans	-105.5	172.8	174.8	-64.7	-24.2	0	0	0	110.5	E375 K379	E375-N377 PolarHBondContact N-O 2.58Å; N377-K379 PolarHBondContact O-N 3.36Å
378	E	91.4	Very high	94.1	Very high	96 Å²	96	64.8 Å²	64.8	45%	0.449	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-60.9	132.6	167.6	-164.5	-159.2	92.4	0	0	110.2	R299	R299-E378 IonicContact CZ-OE1 3.38Å; R299-E378 IonicContact NH1-OE1 2.65Å; R299-E378 PolarHBondContact NH1-OE1 3.03Å; R299-E378 IonicContact NH2-OE1 2.74Å; R299-E378 PolarHBondContact NH2-OE1 3.27Å
379	K	93.9	Very high	94.1	Very high	22 Å²	22	65.4 Å²	65.4	10%	0.096	30%	0.304	C	S	.	.			trans	-114.8	-29.1	175.7	-57.8	-58.7	175.7	80.8	0	111.6	R299 T371 L373 E375 N377 D434 S469	R299-K379 PolarHBondContact NE-O 2.95Å; T371-K379 WeakPolarHBondContact OG1-CB 3.34Å; L373-K379 PolarHBondContact O-N 3.25Å; E375-K379 HydrophobicContact CB-CG 4.06Å; E375-K379 HydrophobicContact CG-CG 3.93Å; E375-K379 IonicContact OE2-NZ 3.57Å; E375-K379 PolarHBondContact OE2-NZ 2.96Å; N377-K379 PolarHBondContact O-N 3.36Å; K379-D434 IonicContact NZ-OD1 3.84Å; K379-D434 PolarHBondContact NZ-OD1 3.2Å; K379-D434 IonicContact NZ-OD2 2.67Å; K379-D434 PolarHBondContact NZ-OD2 3.42Å; K379-S469 WeakPolarHBondContact CA-OG 3.42Å; K379-S469 WeakPolarHBondContact O-CA 3.33Å; K379-S469 PolarHBondContact O-OG 3.46Å
380	C	96.6	Very high	94	Very high	1 Å²	1	70.4 Å²	70.4	1%	0.007	33%	0.329	C	S	.	.			trans	-158	141.4	177.2	-173.6	0	0	0	0	110	M369 T371 L373	M369-C380 HydrophobicContact CE-CB 3.92Å; T371-C380 HydrophobicContact CG2-CB 3.93Å; L373-C380 CarbonylContact C-O 3.54Å; L373-C380 VanDerWaalsContact CA-O 3.3Å; L373-C380 WeakPolarHBondContact CA-O 3.42Å; L373-C380 WeakPolarHBondContact CB-O 3.38Å; L373-C380 HydrophobicContact CD2-CB 4.41Å; L373-C380 WeakPolarHBondContact CD2-O 3.05Å; L373-C380 PolarHBondContact O-N 2.94Å; L373-C380 VanDerWaalsContact O-O 3.05Å
381	V	97.1	Very high	93.9	Very high	17 Å²	17	72.2 Å²	72.2	10%	0.103	34%	0.337	C	S	.	.			trans	-76.9	159.2	168.8	-51.7	0	0	0	0	110.7	P347 V349 V352 L373 Y383	P347-V381 HydrophobicContact CB-CG2 4.3Å; P347-V381 WeakPolarHBondContact O-CG2 3.47Å; P347-V381 PolarHBondContact O-N 3.43Å; P347-V381 VanDerWaalsContact O-N 3.13Å; V349-V381 HydrophobicContact CG2-CG1 3.88Å; V352-V381 HydrophobicContact CG2-CG2 3.66Å; L373-V381 WeakPolarHBondContact CD2-O 3.48Å; V381-Y383 PolarHBondContact O-N 3.4Å
382	L	97.9	Very high	93.9	Very high	100 Å²	100	74.8 Å²	74.8	52%	0.524	36%	0.363	S	S	.	.			trans	-69.8	110.3	167.5	178.2	64.2	0	0	0	108.2	L373 W384	L373-L382 HydrophobicContact CD1-CB 4.19Å; L373-L382 HydrophobicContact CD1-CD1 4.45Å; L373-L382 HydrophobicContact CD2-CB 4.48Å; L382-W384 HydrophobicContact CD1-CD2 3.68Å; L382-W384 HydrophobicContact CD1-CE3 4.07Å; L382-W384 HydrophobicContact CD1-CG 4.24Å; L382-W384 HydrophobicContact CD1-CH2 3.89Å; L382-W384 HydrophobicContact CD1-CZ2 3.46Å; L382-W384 VanDerWaalsContact CD1-CZ2 3.46Å; L382-W384 HydrophobicContact CD1-CZ3 4.15Å
383	Y	98.4	Very high	93.8	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	37%	0.366	C	S	.	.			trans	-109	-10.2	-174.9	64.3	-100.2	0	0	0	114.2	P347 F355 W356 I367 M369 V381 Y391 H426 H467	P347-Y383 HydrophobicContact CB-CD1 4.16Å; P347-Y383 HydrophobicContact CB-CG 4.37Å; P347-Y383 HydrophobicContact CG-CD1 3.76Å; P347-Y383 HydrophobicContact CG-CE1 4.16Å; P347-Y383 HydrophobicContact CG-CG 4.05Å; F355-Y383 HydrophobicContact CD1-CD2 4Å; F355-Y383 HydrophobicContact CD1-CE2 4.13Å; F355-Y383 AromaticContact CE1-CD2 3.7Å; F355-Y383 HydrophobicContact CE1-CD2 3.7Å; F355-Y383 AromaticContact CE1-CE2 3.36Å; F355-Y383 HydrophobicContact CE1-CE2 3.36Å; F355-Y383 AromaticContact CE1-CZ 3.96Å; F355-Y383 HydrophobicContact CZ-CD2 4.48Å; F355-Y383 AromaticContact CZ-CE2 3.84Å; F355-Y383 HydrophobicContact CZ-CE2 3.84Å; F355-Y383 AromaticContact CZ-CZ 3.96Å; W356-Y383 HydrophobicContact CH2-CE2 4.45Å; W356-Y383 AromaticContact CZ2-CD2 3.7Å; W356-Y383 HydrophobicContact CZ2-CD2 3.7Å; W356-Y383 HydrophobicContact CZ2-CE2 4.05Å; W356-Y383 PolarHBondContact NE1-O 2.84Å; I367-Y383 WeakPolarHBondContact CG2-OH 3.34Å; M369-Y383 HydrophobicContact CE-CE1 4.43Å; M369-Y383 HydrophobicContact SD-CE1 3.84Å; V381-Y383 PolarHBondContact O-N 3.4Å; Y383-Y391 PolarHBondContact O-OH 3.47Å; Y383-H426 AromaticContact CE2-NE2 3.92Å; Y383-H426 AromaticContact CZ-NE2 3.55Å; Y383-H426 PolarHBondContact OH-CD2 3.4Å; Y383-H426 PolarHBondContact OH-NE2 3.39Å; Y383-H467 AromaticContact CE1-CE1 3.71Å; Y383-H467 AromaticContact CE1-NE2 3.35Å; Y383-H467 WeakPolarHBondContact CE1-NE2 3.33Å; Y383-H467 AromaticContact CZ-NE2 3.44Å; Y383-H467 PolarHBondContact OH-NE2 3.38Å
384	W	98.3	Very high	94	Very high	13 Å²	13	73.1 Å²	73.1	5%	0.049	35%	0.354	C	S	.	.	S	Bend	trans	-104.2	154.3	173.5	65.5	89.3	0	0	0	110.6	W356 M369 L373 L382 H426 W428	W356-W384 HydrophobicContact CZ2-CB 4.13Å; M369-W384 HydrophobicContact CE-CH2 4.02Å; M369-W384 HydrophobicContact CE-CZ3 3.93Å; M369-W384 HydrophobicContact SD-CE3 4.48Å; M369-W384 HydrophobicContact SD-CH2 3.7Å; M369-W384 HydrophobicContact SD-CZ3 3.4Å; M369-W384 WeakPolarHBondContact SD-CZ3 3.29Å; L373-W384 HydrophobicContact CD2-CH2 4.09Å; L373-W384 HydrophobicContact CD2-CZ3 4.38Å; L382-W384 HydrophobicContact CD1-CD2 3.68Å; L382-W384 HydrophobicContact CD1-CE3 4.07Å; L382-W384 HydrophobicContact CD1-CG 4.24Å; L382-W384 HydrophobicContact CD1-CH2 3.89Å; L382-W384 HydrophobicContact CD1-CZ2 3.46Å; L382-W384 VanDerWaalsContact CD1-CZ2 3.46Å; L382-W384 HydrophobicContact CD1-CZ3 4.15Å; W384-H426 AromaticContact CD2-CE1 3.87Å; W384-H426 AromaticContact CE3-CE1 3.63Å; W384-H426 AromaticContact CE3-NE2 3.83Å; W384-H426 AromaticContact CZ3-CE1 3.75Å; W384-W428 HydrophobicContact CH2-CD2 4.06Å; W384-W428 HydrophobicContact CH2-CE3 4.35Å; W384-W428 HydrophobicContact CH2-CH2 4.46Å; W384-W428 HydrophobicContact CH2-CZ2 4.23Å; W384-W428 HydrophobicContact CZ2-CD2 4.16Å; W384-W428 AromaticContact CZ2-CE3 3.98Å; W384-W428 HydrophobicContact CZ2-CE3 3.98Å; W384-W428 HydrophobicContact CZ2-CH2 4.27Å; W384-W428 HydrophobicContact CZ2-CZ2 4.48Å; W384-W428 HydrophobicContact CZ2-CZ3 4.03Å
385	P	97.6	Very high	94.4	Very high	12 Å²	12	68.2 Å²	68.2	8%	0.078	33%	0.333	C	S	.	.			trans	-86.1	166.5	179.1	34.8	-32.6	0	0	0	111.3	R388 Y391 V396 V398	P385-R388 WeakPolarHBondContact CB-O 3.47Å; P385-Y391 WeakPolarHBondContact CD-OH 3.29Å; P385-Y391 HydrophobicContact CG-CE2 4.46Å; P385-V396 HydrophobicContact CG-CB 4.37Å; P385-V396 HydrophobicContact CG-CG1 4.27Å; P385-V398 HydrophobicContact CG-CG2 4.23Å; P385-V398 VanDerWaalsContact O-CG2 3.26Å; P385-V398 WeakPolarHBondContact O-CG2 3.39Å
386	E	95	Very high	95.1	Very high	181 Å²	181	66.4 Å²	66.4	85%	0.846	33%	0.325	S	S	*	.	S	Bend	trans	-70.5	-36.4	170.8	-63.1	179	165.9	0	0	112.2
387	K	96.2	Very high	95.8	Very high	166 Å²	166	60.5 Å²	60.5	72%	0.722	30%	0.301	S	S	*	.	S	Bend	trans	-141.3	-46.2	-179.4	-173.4	172.8	-176.8	173.8	0	113.4	L397 V398	K387-L397 WeakPolarHBondContact O-CA 3.48Å; K387-V398 PolarHBondContact O-N 2.96Å
388	R	97.4	Very high	96.3	Very high	142 Å²	142	55.7 Å²	55.7	54%	0.536	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	137.4	-179.8	179.5	173.3	-169	-93.4	-4	110.9	P385 E395 V396 L397	P385-R388 WeakPolarHBondContact CB-O 3.47Å; R388-E395 IonicContact CZ-OE1 2.74Å; R388-E395 IonicContact NE-OE1 3.84Å; R388-E395 PolarHBondContact NE-OE1 3.36Å; R388-E395 IonicContact NH2-OE1 2.7Å; R388-E395 PolarHBondContact NH2-OE1 2.86Å; R388-E395 IonicContact NH2-OE2 2.84Å; R388-V396 CarbonylContact C-O 3.59Å; R388-V396 WeakPolarHBondContact CA-O 3.4Å; R388-L397 HydrophobicContact CB-CD2 3.85Å; R388-L397 HydrophobicContact CG-CD2 3.64Å
389	G	96.9	Very high	96.6	Very high	14 Å²	14	56.7 Å²	56.7	14%	0.144	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	157.3	174.5	0	0	0	0	0	111.1	E395 V396	G389-E395 WeakPolarHBondContact O-CA 3.32Å; G389-V396 PolarHBondContact N-O 3.48Å; G389-V396 PolarHBondContact O-N 3.3Å
390	I	96.9	Very high	96.7	Very high	104 Å²	104	57 Å²	57	53%	0.533	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121.7	174	-56.4	176.6	0	0	0	107.5
391	Y	95.8	Very high	96.7	Very high	39 Å²	39	61.6 Å²	61.6	15%	0.153	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	92.8	-175.2	-55.6	-75.5	0	0	0	108.7	V352 N353 W356 Y383 P385 K393 V394 V396	V352-Y391 HydrophobicContact CG1-CD1 3.39Å; V352-Y391 HydrophobicContact CG1-CE1 3.69Å; V352-Y391 HydrophobicContact CG1-CG 4.12Å; N353-Y391 VanDerWaalsContact OD1-C 3.25Å; N353-Y391 WeakPolarHBondContact OD1-CA 3.2Å; N353-Y391 WeakPolarHBondContact OD1-CB 3.19Å; W356-Y391 VanDerWaalsContact CD1-CB 3.48Å; W356-Y391 AromaticContact CD1-CD1 3.96Å; W356-Y391 AromaticContact CD1-CD2 3.39Å; W356-Y391 AromaticContact CD1-CG 3.31Å; W356-Y391 HydrophobicContact CD2-CD2 4.48Å; W356-Y391 HydrophobicContact CG-CD2 4.02Å; W356-Y391 HydrophobicContact CG-CG 4.14Å; W356-Y391 AromaticContact NE1-CD2 3.47Å; W356-Y391 AromaticContact NE1-CE2 3.65Å; W356-Y391 AromaticContact NE1-CG 3.75Å; Y383-Y391 PolarHBondContact O-OH 3.47Å; P385-Y391 WeakPolarHBondContact CD-OH 3.29Å; P385-Y391 HydrophobicContact CG-CE2 4.46Å; Y391-K393 PolarHBondContact O-N 3.5Å; Y391-V394 PolarHBondContact N-O 3.31Å; Y391-V394 PolarHBondContact O-N 2.89Å; Y391-V394 VanDerWaalsContact O-N 3.08Å; Y391-V396 HydrophobicContact CD2-CB 4.24Å; Y391-V396 HydrophobicContact CD2-CG2 3.75Å; Y391-V396 HydrophobicContact CE2-CB 4.04Å; Y391-V396 HydrophobicContact CE2-CG2 4.01Å
392	G	93	Very high	96.7	Very high	55 Å²	55	67.5 Å²	67.5	57%	0.567	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	-99.1	-170.6	0	0	0	0	0	112.1	N353	N353-G392 PolarHBondContact OD1-N 3.08Å
393	K	92.3	Very high	96.5	Very high	114 Å²	114	70.7 Å²	70.7	50%	0.496	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	4.2	-179.3	-61.7	171.2	-171.5	150.9	0	113.5	Y391 Q416	Y391-K393 PolarHBondContact O-N 3.5Å; K393-Q416 WeakPolarHBondContact O-CG 2.96Å; K393-Q416 PolarHBondContact O-NE2 3.4Å
394	V	96.3	Very high	96.1	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	113.3	-178.5	-175.3	0	0	0	0	108.3	W356 W360 Y391 V396 L414 K415	W356-V394 HydrophobicContact CB-CB 4.18Å; W356-V394 HydrophobicContact CB-CG1 4.35Å; W360-V394 HydrophobicContact CB-CG1 4.48Å; W360-V394 HydrophobicContact CB-CG2 3.76Å; W360-V394 HydrophobicContact CG-CG2 4.03Å; Y391-V394 PolarHBondContact N-O 3.31Å; Y391-V394 PolarHBondContact O-N 2.89Å; Y391-V394 VanDerWaalsContact O-N 3.08Å; V394-V396 HydrophobicContact CG1-CG2 4.12Å; V394-L414 HydrophobicContact CG1-CB 4.23Å; V394-L414 HydrophobicContact CG1-CD2 4.23Å; V394-L414 HydrophobicContact CG1-CG 4.15Å; V394-K415 WeakPolarHBondContact CA-O 3.5Å
395	E	97.3	Very high	95.6	Very high	43 Å²	43	80.5 Å²	80.5	20%	0.201	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	135.3	165.2	167.5	-179.2	-149	0	0	108.3	R388 G389 L397 L414 K415	R388-E395 IonicContact CZ-OE1 2.74Å; R388-E395 IonicContact NE-OE1 3.84Å; R388-E395 PolarHBondContact NE-OE1 3.36Å; R388-E395 IonicContact NH2-OE1 2.7Å; R388-E395 PolarHBondContact NH2-OE1 2.86Å; R388-E395 IonicContact NH2-OE2 2.84Å; G389-E395 WeakPolarHBondContact O-CA 3.32Å; E395-L397 HydrophobicContact CG-CG 4.27Å; E395-L414 CarbonylContact O-C 3.51Å; E395-L414 VanDerWaalsContact O-CA 3.32Å; E395-L414 WeakPolarHBondContact O-CA 3.38Å; E395-K415 HydrophobicContact CB-CB 4.19Å; E395-K415 PolarHBondContact N-O 2.91Å; E395-K415 PolarHBondContact O-N 3.3Å; E395-K415 WeakPolarHBondContact OE2-CD 3.41Å
396	V	98.3	Very high	95.3	Very high	0 Å²	0	82.5 Å²	82.5	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	125.5	176.9	-178.2	0	0	0	0	108.6	W356 P385 R388 G389 Y391 V394 L412 L414	W356-V396 HydrophobicContact CD2-CG2 3.72Å; W356-V396 HydrophobicContact CE3-CG2 3.78Å; W356-V396 HydrophobicContact CG-CG2 4.26Å; W356-V396 HydrophobicContact CH2-CG1 4.05Å; W356-V396 HydrophobicContact CH2-CG2 4.28Å; W356-V396 HydrophobicContact CZ2-CG1 4.21Å; W356-V396 HydrophobicContact CZ2-CG2 4.19Å; W356-V396 HydrophobicContact CZ3-CG1 4.39Å; W356-V396 HydrophobicContact CZ3-CG2 4.07Å; P385-V396 HydrophobicContact CG-CB 4.37Å; P385-V396 HydrophobicContact CG-CG1 4.27Å; R388-V396 CarbonylContact C-O 3.59Å; R388-V396 WeakPolarHBondContact CA-O 3.4Å; G389-V396 PolarHBondContact N-O 3.48Å; G389-V396 PolarHBondContact O-N 3.3Å; Y391-V396 HydrophobicContact CD2-CB 4.24Å; Y391-V396 HydrophobicContact CD2-CG2 3.75Å; Y391-V396 HydrophobicContact CE2-CB 4.04Å; Y391-V396 HydrophobicContact CE2-CG2 4.01Å; V394-V396 HydrophobicContact CG1-CG2 4.12Å; V396-L412 HydrophobicContact CG1-CB 4.49Å; V396-L412 HydrophobicContact CG1-CD1 4.22Å; V396-L414 HydrophobicContact CG2-CG 4.39Å
397	L	98.1	Very high	95.3	Very high	30 Å²	30	74.6 Å²	74.6	16%	0.157	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	140.1	177.2	-62.3	166.9	0	0	0	109.3	K387 R388 E395 L412 V413 K415	K387-L397 WeakPolarHBondContact O-CA 3.48Å; R388-L397 HydrophobicContact CB-CD2 3.85Å; R388-L397 HydrophobicContact CG-CD2 3.64Å; E395-L397 HydrophobicContact CG-CG 4.27Å; L397-L412 CarbonylContact O-C 3.54Å; L397-L412 VanDerWaalsContact O-CA 3.27Å; L397-L412 WeakPolarHBondContact O-CA 3.44Å; L397-V413 HydrophobicContact CB-CB 4.31Å; L397-V413 PolarHBondContact N-O 3.09Å; L397-V413 PolarHBondContact O-N 2.84Å; L397-K415 HydrophobicContact CD1-CD 4.11Å
398	V	98.3	Very high	95.3	Very high	20 Å²	20	67.3 Å²	67.3	12%	0.121	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	111.6	170.1	-171.6	0	0	0	0	108	P385 K387 I401 R410 L412	P385-V398 HydrophobicContact CG-CG2 4.23Å; P385-V398 VanDerWaalsContact O-CG2 3.26Å; P385-V398 WeakPolarHBondContact O-CG2 3.39Å; K387-V398 PolarHBondContact O-N 2.96Å; V398-I401 HydrophobicContact CG1-CD1 4.15Å; V398-I401 HydrophobicContact CG1-CG1 3.72Å; V398-R410 HydrophobicContact CG1-CB 4.47Å; V398-L412 HydrophobicContact CB-CD2 4.21Å; V398-L412 HydrophobicContact CG1-CD2 4.2Å; V398-L412 HydrophobicContact CG2-CD2 3.78Å
399	N	96.6	Very high	95.3	Very high	117 Å²	117	60.8 Å²	60.8	63%	0.626	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	-25.4	179.3	-79.4	18	0	0	0	112.6	S411 V413	N399-S411 PolarHBondContact N-O 2.91Å; N399-V413 VanDerWaalsContact ND2-CG2 3.33Å; N399-V413 WeakPolarHBondContact ND2-CG2 3.21Å
400	G	96.4	Very high	95.3	Very high	30 Å²	30	61.2 Å²	61.2	31%	0.309	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	152.8	178.7	0	0	0	0	0	112	R410 S411	G400-R410 CarbonylContact O-C 3.49Å; G400-R410 VanDerWaalsContact O-CA 3.29Å; G400-R410 WeakPolarHBondContact O-CA 3.38Å; G400-S411 PolarHBondContact O-N 3.43Å
401	I	97.4	Very high	95.4	Very high	96 Å²	96	58.4 Å²	58.4	49%	0.492	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133	172.5	-54.5	-179.3	0	0	0	106.8	V398 T409 R410	V398-I401 HydrophobicContact CG1-CD1 4.15Å; V398-I401 HydrophobicContact CG1-CG1 3.72Å; I401-T409 WeakPolarHBondContact CA-O 3.46Å; I401-R410 HydrophobicContact CG1-CG 4.15Å; I401-R410 HydrophobicContact CG2-CG 4.35Å
402	R	96.4	Very high	95.5	Very high	141 Å²	141	56.6 Å²	56.6	53%	0.532	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	122	172.9	170.1	-172.2	67.4	-157.2	0.8	108.3	T409	R402-T409 WeakPolarHBondContact CB-OG1 3.47Å; R402-T409 PolarHBondContact N-O 2.81Å; R402-T409 PolarHBondContact NE-OG1 3.22Å; R402-T409 VanDerWaalsContact NE-OG1 3.13Å; R402-T409 PolarHBondContact NH2-OG1 3.22Å; R402-T409 PolarHBondContact O-N 2.86Å; R402-T409 PolarHBondContact O-OG1 2.88Å
403	E	94.1	Very high	95.7	Very high	167 Å²	167	54.6 Å²	54.6	78%	0.78	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	139.3	174.9	-58.3	-168.9	153.4	0	0	110.1
404	C	90.1	Very high	95.9	Very high	47 Å²	47	49.3 Å²	49.3	32%	0.318	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	160.6	173.7	-52.5	0	0	0	0	107.8	H406 Y407	C404-H406 PolarHBondContact O-N 3.26Å; C404-Y407 CarbonylContact C-O 3.49Å; C404-Y407 WeakPolarHBondContact CA-O 3.41Å; C404-Y407 HydrophobicContact CB-CD2 4.24Å; C404-Y407 HydrophobicContact CB-CE2 4.1Å; C404-Y407 VanDerWaalsContact CB-O 3.28Å; C404-Y407 WeakPolarHBondContact CB-O 3.48Å; C404-Y407 PolarHBondContact N-O 2.84Å; C404-Y407 PolarHBondContact O-N 2.92Å; C404-Y407 VanDerWaalsContact O-O 3.04Å
405	E	88.1	Confident	95.9	Very high	173 Å²	173	52.8 Å²	52.8	81%	0.808	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-27.7	-166.8	-160.8	-172.1	149.8	0	0	115.1
406	H	90.1	Very high	95.5	Very high	53 Å²	53	53.2 Å²	53.2	25%	0.245	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-4.3	-174.2	-52	-39.1	0	0	0	114.5	C404 Y429 T430 S431 P443	C404-H406 PolarHBondContact O-N 3.26Å; H406-Y429 HydrophobicContact CB-CE2 4.11Å; H406-Y429 WeakPolarHBondContact O-CD2 3.31Å; H406-T430 PolarHBondContact O-N 3.45Å; H406-S431 WeakPolarHBondContact CA-OG 3.24Å; H406-S431 PolarHBondContact O-OG 2.94Å; H406-P443 HydrophobicContact CB-CB 3.91Å; H406-P443 WeakPolarHBondContact CD2-CB 3.35Å; H406-P443 WeakPolarHBondContact CD2-CG 3.32Å
407	Y	94.4	Very high	94.2	Very high	15 Å²	15	59.2 Å²	59.2	6%	0.059	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	147	178.3	52.5	-88.4	0	0	0	111.7	C404 T409 Y427 W428 Y429 Q446 L447 D450	C404-Y407 CarbonylContact C-O 3.49Å; C404-Y407 WeakPolarHBondContact CA-O 3.41Å; C404-Y407 HydrophobicContact CB-CD2 4.24Å; C404-Y407 HydrophobicContact CB-CE2 4.1Å; C404-Y407 VanDerWaalsContact CB-O 3.28Å; C404-Y407 WeakPolarHBondContact CB-O 3.48Å; C404-Y407 PolarHBondContact N-O 2.84Å; C404-Y407 PolarHBondContact O-N 2.92Å; C404-Y407 VanDerWaalsContact O-O 3.04Å; Y407-T409 HydrophobicContact CD2-CG2 3.77Å; Y407-T409 HydrophobicContact CE2-CG2 3.9Å; Y407-Y427 AromaticContact CD2-CD1 3.97Å; Y407-Y427 HydrophobicContact CD2-CD1 3.97Å; Y407-Y427 AromaticContact CE2-CD1 3.99Å; Y407-Y427 HydrophobicContact CE2-CD1 3.99Å; Y407-Y427 HydrophobicContact CE2-CE1 4.17Å; Y407-W428 CarbonylContact C-O 3.5Å; Y407-W428 WeakPolarHBondContact CA-O 3.49Å; Y407-W428 WeakPolarHBondContact CB-O 2.99Å; Y407-Y429 HydrophobicContact CD1-CD2 4.18Å; Y407-Q446 WeakPolarHBondContact OH-CG 3.42Å; Y407-L447 HydrophobicContact CD1-CB 4.34Å; Y407-L447 HydrophobicContact CD1-CD1 4.28Å; Y407-L447 HydrophobicContact CD2-CD1 4.23Å; Y407-L447 HydrophobicContact CE1-CB 4.18Å; Y407-L447 HydrophobicContact CE2-CD1 4.45Å; Y407-L447 HydrophobicContact CG-CD1 4.14Å; Y407-D450 PolarHBondContact OH-OD1 3.35Å; Y407-D450 PolarHBondContact OH-OD2 3.3Å
408	A	96.4	Very high	92.8	Very high	14 Å²	14	60.9 Å²	60.9	12%	0.116	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	143	167.2	0	0	0	0	0	109.9	W428	A408-W428 PolarHBondContact N-O 3.21Å; A408-W428 PolarHBondContact O-N 2.82Å
409	T	97.7	Very high	91.8	Very high	5 Å²	5	67.7 Å²	67.7	3%	0.031	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	140.3	174	53.9	0	0	0	0	110.4	I401 R402 Y407 H426 Y427	I401-T409 WeakPolarHBondContact CA-O 3.46Å; R402-T409 WeakPolarHBondContact CB-OG1 3.47Å; R402-T409 PolarHBondContact N-O 2.81Å; R402-T409 PolarHBondContact NE-OG1 3.22Å; R402-T409 VanDerWaalsContact NE-OG1 3.13Å; R402-T409 PolarHBondContact NH2-OG1 3.22Å; R402-T409 PolarHBondContact O-N 2.86Å; R402-T409 PolarHBondContact O-OG1 2.88Å; Y407-T409 HydrophobicContact CD2-CG2 3.77Å; Y407-T409 HydrophobicContact CE2-CG2 3.9Å; T409-H426 CarbonylContact C-O 3.37Å; T409-H426 VanDerWaalsContact CA-O 3.31Å; T409-H426 WeakPolarHBondContact CA-O 3.23Å; T409-Y427 HydrophobicContact CG2-CD1 3.46Å; T409-Y427 VanDerWaalsContact CG2-CD1 3.46Å; T409-Y427 HydrophobicContact CG2-CE1 3.54Å; T409-Y427 HydrophobicContact CG2-CG 4.11Å
410	R	98.3	Very high	91.4	Very high	23 Å²	23	67.5 Å²	67.5	9%	0.087	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	128.3	175.1	-47.4	-176.8	173.9	82.3	2.9	110.7	V398 G400 I401 L412 Q425 H426 W428	V398-R410 HydrophobicContact CG1-CB 4.47Å; G400-R410 CarbonylContact O-C 3.49Å; G400-R410 VanDerWaalsContact O-CA 3.29Å; G400-R410 WeakPolarHBondContact O-CA 3.38Å; I401-R410 HydrophobicContact CG1-CG 4.15Å; I401-R410 HydrophobicContact CG2-CG 4.35Å; R410-L412 HydrophobicContact CB-CD2 3.9Å; R410-L412 HydrophobicContact CB-CG 4.41Å; R410-L412 PolarHBondContact O-N 2.81Å; R410-Q425 PolarHBondContact O-OE1 3.48Å; R410-H426 HydrophobicContact CB-CB 4.21Å; R410-H426 PolarHBondContact N-O 3.43Å; R410-H426 PolarHBondContact NH1-CE1 3Å; R410-H426 PolarHBondContact NH1-ND1 3Å; R410-H426 PolarHBondContact O-N 3.34Å; R410-W428 VanDerWaalsContact NH2-CE3 3.34Å
411	S	97.6	Very high	91.2	Very high	45 Å²	45	69.8 Å²	69.8	32%	0.315	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	110.6	172.3	-55.6	0	0	0	0	109	N399 G400 Q425	N399-S411 PolarHBondContact N-O 2.91Å; G400-S411 PolarHBondContact O-N 3.43Å; S411-Q425 PolarHBondContact OG-OE1 3.02Å
412	L	98.1	Very high	91.1	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	146.3	-176.1	-53.9	-173.3	0	0	0	111	W356 V396 L397 V398 R410 L414 L424 H426	W356-L412 HydrophobicContact CH2-CD1 3.69Å; W356-L412 HydrophobicContact CZ3-CD1 4.39Å; V396-L412 HydrophobicContact CG1-CB 4.49Å; V396-L412 HydrophobicContact CG1-CD1 4.22Å; L397-L412 CarbonylContact O-C 3.54Å; L397-L412 VanDerWaalsContact O-CA 3.27Å; L397-L412 WeakPolarHBondContact O-CA 3.44Å; V398-L412 HydrophobicContact CB-CD2 4.21Å; V398-L412 HydrophobicContact CG1-CD2 4.2Å; V398-L412 HydrophobicContact CG2-CD2 3.78Å; R410-L412 HydrophobicContact CB-CD2 3.9Å; R410-L412 HydrophobicContact CB-CG 4.41Å; R410-L412 PolarHBondContact O-N 2.81Å; L412-L414 HydrophobicContact CB-CD1 4.16Å; L412-L424 WeakPolarHBondContact CA-O 3.5Å; L412-L424 WeakPolarHBondContact CB-O 3.5Å; L412-L424 HydrophobicContact CD1-CD2 4.15Å; L412-L424 PolarHBondContact N-O 2.83Å; L412-L424 PolarHBondContact O-N 3.38Å; L412-H426 HydrophobicContact CD1-CB 3.83Å; L412-H426 HydrophobicContact CG-CB 4.22Å
413	V	97	Very high	91	Very high	14 Å²	14	64.5 Å²	64.5	9%	0.085	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	116.8	171.1	174.9	0	0	0	0	108.7	L397 N399 K415 T421 R422	L397-V413 HydrophobicContact CB-CB 4.31Å; L397-V413 PolarHBondContact N-O 3.09Å; L397-V413 PolarHBondContact O-N 2.84Å; N399-V413 VanDerWaalsContact ND2-CG2 3.33Å; N399-V413 WeakPolarHBondContact ND2-CG2 3.21Å; V413-K415 HydrophobicContact CG1-CG 4.4Å; V413-T421 HydrophobicContact CG1-CG2 3.34Å; V413-R422 WeakPolarHBondContact CA-O 3.45Å
414	L	96.9	Very high	91.1	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	139.6	177.1	-74.2	64.3	0	0	0	109.1	W356 A359 W360 V394 E395 V396 L412 T421 R422 L424	W356-L414 HydrophobicContact CE3-CD2 4.13Å; W356-L414 HydrophobicContact CE3-CG 4.45Å; W356-L414 HydrophobicContact CZ3-CD1 4.23Å; W356-L414 HydrophobicContact CZ3-CD2 4.27Å; W356-L414 HydrophobicContact CZ3-CG 4.4Å; A359-L414 HydrophobicContact CB-CD2 4.43Å; W360-L414 HydrophobicContact CE3-CB 3.81Å; W360-L414 HydrophobicContact CE3-CD2 4.37Å; W360-L414 HydrophobicContact CZ3-CB 3.96Å; V394-L414 HydrophobicContact CG1-CB 4.23Å; V394-L414 HydrophobicContact CG1-CD2 4.23Å; V394-L414 HydrophobicContact CG1-CG 4.15Å; E395-L414 CarbonylContact O-C 3.51Å; E395-L414 VanDerWaalsContact O-CA 3.32Å; E395-L414 WeakPolarHBondContact O-CA 3.38Å; V396-L414 HydrophobicContact CG2-CG 4.39Å; L412-L414 HydrophobicContact CB-CD1 4.16Å; L414-T421 CarbonylContact O-C 3.56Å; L414-T421 WeakPolarHBondContact O-CA 3.5Å; L414-R422 PolarHBondContact N-O 3.31Å; L414-R422 PolarHBondContact O-N 3.04Å; L414-L424 HydrophobicContact CD1-CB 3.73Å; L414-L424 HydrophobicContact CD1-CD1 4.11Å; L414-L424 HydrophobicContact CD1-CG 4.44Å; L414-L424 HydrophobicContact CD2-CD1 4.13Å
415	K	95.3	Very high	91.4	Very high	74 Å²	74	55.6 Å²	55.6	32%	0.322	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	149.6	176.1	-64.9	177.7	177.9	177.7	0	111.5	V394 E395 L397 V413 T421	V394-K415 WeakPolarHBondContact CA-O 3.5Å; E395-K415 HydrophobicContact CB-CB 4.19Å; E395-K415 PolarHBondContact N-O 2.91Å; E395-K415 PolarHBondContact O-N 3.3Å; E395-K415 WeakPolarHBondContact OE2-CD 3.41Å; L397-K415 HydrophobicContact CD1-CD 4.11Å; V413-K415 HydrophobicContact CG1-CG 4.4Å; K415-T421 HydrophobicContact CG-CG2 4.18Å
416	Q	89.2	Confident	91.9	Very high	52 Å²	52	47.4 Å²	47.4	24%	0.243	27%	0.272	C	S	.	.			trans	-136.8	157.9	171	-175.2	156.1	99.2	0	0	110	W360 K393 G418 Q420	W360-Q416 HydrophobicContact CD2-CB 4.26Å; W360-Q416 HydrophobicContact CH2-CB 3.86Å; W360-Q416 HydrophobicContact CZ2-CB 3.33Å; W360-Q416 HydrophobicContact CZ2-CG 4.33Å; W360-Q416 HydrophobicContact CZ3-CB 4.5Å; K393-Q416 WeakPolarHBondContact O-CG 2.96Å; K393-Q416 PolarHBondContact O-NE2 3.4Å; Q416-G418 PolarHBondContact O-N 3.4Å; Q416-Q420 PolarHBondContact N-O 2.72Å
417	C	71.9	Confident	92.3	Very high	126 Å²	126	45.1 Å²	45.1	85%	0.851	26%	0.262	S	S	*	.	S	Bend	trans	-53.5	122.9	176.6	-53.7	0	0	0	0	111
418	G	67.9	Low	92.5	Very high	65 Å²	65	46.8 Å²	46.8	67%	0.67	27%	0.268	S	S	*	.	S	Bend	trans	116.9	22.1	-172.8	0	0	0	0	0	115	Q416 Q420	Q416-G418 PolarHBondContact O-N 3.4Å; G418-Q420 PolarHBondContact O-N 2.93Å
419	N	77.6	Confident	92.5	Very high	162 Å²	162	46.2 Å²	46.2	87%	0.866	26%	0.263	S	S	*	.	S	Bend	trans	59.6	-3.5	177.8	-65.6	-5.2	0	0	0	117	T421	N419-T421 PolarHBondContact O-N 3.5Å; N419-T421 PolarHBondContact O-OG1 2.62Å
420	Q	88.6	Confident	92.1	Very high	113 Å²	113	48.1 Å²	48.1	53%	0.528	27%	0.274	S	S	.	.			trans	-60.4	133.1	171.5	-69.1	-171.5	-18.3	0	0	110.6	W360 Q416 G418	W360-Q420 HydrophobicContact CH2-CB 3.73Å; W360-Q420 WeakPolarHBondContact CH2-O 3.39Å; W360-Q420 HydrophobicContact CZ2-CB 3.85Å; Q416-Q420 PolarHBondContact N-O 2.72Å; G418-Q420 PolarHBondContact O-N 2.93Å
421	T	92.9	Very high	91.4	Very high	78 Å²	78	49.2 Å²	49.2	48%	0.479	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	132.7	-179.3	-59.5	0	0	0	0	107.9	V413 L414 K415 N419	V413-T421 HydrophobicContact CG1-CG2 3.34Å; L414-T421 CarbonylContact O-C 3.56Å; L414-T421 WeakPolarHBondContact O-CA 3.5Å; K415-T421 HydrophobicContact CG-CG2 4.18Å; N419-T421 PolarHBondContact O-N 3.5Å; N419-T421 PolarHBondContact O-OG1 2.62Å
422	R	93.9	Very high	90.8	Very high	36 Å²	36	47.2 Å²	47.2	14%	0.136	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.3	175.1	-66.4	-168.2	179.7	93.5	9.5	110.1	W360 E363 V413 L414	W360-R422 HydrophobicContact CE3-CG 4.44Å; W360-R422 HydrophobicContact CH2-CG 4.31Å; W360-R422 HydrophobicContact CZ3-CB 4.11Å; W360-R422 HydrophobicContact CZ3-CG 3.91Å; W360-R422 PolarHBondContact O-NH1 2.99Å; E363-R422 VanDerWaalsContact CD-NH2 3.31Å; E363-R422 IonicContact OE1-CZ 3.14Å; E363-R422 IonicContact OE1-NE 3.96Å; E363-R422 IonicContact OE1-NH2 2.91Å; E363-R422 PolarHBondContact OE1-NH2 2.74Å; E363-R422 IonicContact OE2-NE 3.34Å; E363-R422 IonicContact OE2-NH2 3.94Å; V413-R422 WeakPolarHBondContact CA-O 3.45Å; L414-R422 PolarHBondContact N-O 3.31Å; L414-R422 PolarHBondContact O-N 3.04Å
423	V	94.6	Very high	89.8	Confident	91 Å²	91	49.1 Å²	49.1	55%	0.552	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	140.2	173.6	-177.8	0	0	0	0	108.5
424	L	96.1	Very high	88.1	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.016	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	132.6	-178.4	-176.4	157.1	0	0	0	109.7	A359 S364 P365 I367 L412 L414	A359-L424 HydrophobicContact CB-CD1 4.18Å; S364-L424 VanDerWaalsContact O-CD1 3.25Å; S364-L424 WeakPolarHBondContact O-CD1 3.45Å; P365-L424 CarbonylContact O-C 3.55Å; P365-L424 VanDerWaalsContact O-CA 3.32Å; P365-L424 WeakPolarHBondContact O-CA 3.17Å; I367-L424 HydrophobicContact CB-CD2 4.23Å; I367-L424 HydrophobicContact CD1-CD1 3.8Å; I367-L424 HydrophobicContact CD1-CD2 3.58Å; I367-L424 HydrophobicContact CD1-CG 4.34Å; I367-L424 HydrophobicContact CG1-CD1 4.05Å; I367-L424 HydrophobicContact CG1-CD2 3.8Å; I367-L424 HydrophobicContact CG1-CG 4.39Å; L412-L424 WeakPolarHBondContact CA-O 3.5Å; L412-L424 WeakPolarHBondContact CB-O 3.5Å; L412-L424 HydrophobicContact CD1-CD2 4.15Å; L412-L424 PolarHBondContact N-O 2.83Å; L412-L424 PolarHBondContact O-N 3.38Å; L414-L424 HydrophobicContact CD1-CB 3.73Å; L414-L424 HydrophobicContact CD1-CD1 4.11Å; L414-L424 HydrophobicContact CD1-CG 4.44Å; L414-L424 HydrophobicContact CD2-CD1 4.13Å
425	Q	97.8	Very high	86.3	Confident	24 Å²	24	57.6 Å²	57.6	11%	0.112	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	133.4	168.8	-55.4	-59.9	-14.3	0	0	111.5	P365 V366 I367 R410 S411 Y427 E454	P365-Q425 PolarHBondContact O-N 2.88Å; V366-Q425 CarbonylContact C-O 3.58Å; V366-Q425 WeakPolarHBondContact CA-O 3.47Å; I367-Q425 PolarHBondContact N-O 2.8Å; R410-Q425 PolarHBondContact O-OE1 3.48Å; S411-Q425 PolarHBondContact OG-OE1 3.02Å; Q425-Y427 HydrophobicContact CB-CD2 4.17Å; Q425-Y427 HydrophobicContact CB-CE2 3.68Å; Q425-Y427 HydrophobicContact CG-CE2 4.46Å; Q425-E454 HydrophobicContact CB-CG 4.33Å; Q425-E454 HydrophobicContact CG-CG 3.5Å; Q425-E454 WeakPolarHBondContact CG-OE1 3.47Å; Q425-E454 PolarHBondContact NE2-OE1 3.43Å
426	H	98.6	Very high	85.4	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	114.5	172.2	-179.1	-106.1	0	0	0	110	Y383 W384 T409 R410 L412	Y383-H426 AromaticContact CE2-NE2 3.92Å; Y383-H426 AromaticContact CZ-NE2 3.55Å; Y383-H426 PolarHBondContact OH-CD2 3.4Å; Y383-H426 PolarHBondContact OH-NE2 3.39Å; W384-H426 AromaticContact CD2-CE1 3.87Å; W384-H426 AromaticContact CE3-CE1 3.63Å; W384-H426 AromaticContact CE3-NE2 3.83Å; W384-H426 AromaticContact CZ3-CE1 3.75Å; T409-H426 CarbonylContact C-O 3.37Å; T409-H426 VanDerWaalsContact CA-O 3.31Å; T409-H426 WeakPolarHBondContact CA-O 3.23Å; R410-H426 HydrophobicContact CB-CB 4.21Å; R410-H426 PolarHBondContact N-O 3.43Å; R410-H426 PolarHBondContact NH1-CE1 3Å; R410-H426 PolarHBondContact NH1-ND1 3Å; R410-H426 PolarHBondContact O-N 3.34Å; L412-H426 HydrophobicContact CD1-CB 3.83Å; L412-H426 HydrophobicContact CG-CB 4.22Å
427	Y	98.6	Very high	85	Confident	6 Å²	6	60 Å²	60	2%	0.024	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124	173.5	-69.7	-106	0	0	0	109.5	V366 I367 M369 Y407 T409 Q425 L447 D450 V451	V366-Y427 HydrophobicContact CG1-CD2 3.63Å; V366-Y427 HydrophobicContact CG1-CE2 3.77Å; I367-Y427 PolarHBondContact O-N 3.2Å; M369-Y427 PolarHBondContact N-O 2.82Å; Y407-Y427 AromaticContact CD2-CD1 3.97Å; Y407-Y427 HydrophobicContact CD2-CD1 3.97Å; Y407-Y427 AromaticContact CE2-CD1 3.99Å; Y407-Y427 HydrophobicContact CE2-CD1 3.99Å; Y407-Y427 HydrophobicContact CE2-CE1 4.17Å; T409-Y427 HydrophobicContact CG2-CD1 3.46Å; T409-Y427 VanDerWaalsContact CG2-CD1 3.46Å; T409-Y427 HydrophobicContact CG2-CE1 3.54Å; T409-Y427 HydrophobicContact CG2-CG 4.11Å; Q425-Y427 HydrophobicContact CB-CD2 4.17Å; Q425-Y427 HydrophobicContact CB-CE2 3.68Å; Q425-Y427 HydrophobicContact CG-CE2 4.46Å; Y427-L447 HydrophobicContact CD1-CD1 3.51Å; Y427-L447 HydrophobicContact CE1-CD1 4.4Å; Y427-L447 HydrophobicContact CG-CD1 3.97Å; Y427-D450 HydrophobicContact CE1-CB 3.69Å; Y427-D450 PolarHBondContact OH-O 3.44Å; Y427-V451 HydrophobicContact CD1-CG2 4.07Å; Y427-V451 HydrophobicContact CD2-CG2 3.89Å; Y427-V451 HydrophobicContact CE1-CG2 4.1Å; Y427-V451 HydrophobicContact CE2-CG2 3.92Å; Y427-V451 HydrophobicContact CG-CG2 3.97Å
428	W	98.1	Very high	85.5	Confident	50 Å²	50	54.6 Å²	54.6	19%	0.189	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	95	179.6	-174.8	24.7	0	0	0	111.5	M369 T371 L373 W384 Y407 A408 R410 T430	M369-W428 HydrophobicContact CG-CG 4.49Å; M369-W428 VanDerWaalsContact SD-CD1 3.56Å; M369-W428 HydrophobicContact SD-CG 4.2Å; T371-W428 PolarHBondContact O-NE1 2.89Å; L373-W428 HydrophobicContact CD1-CZ2 4.5Å; L373-W428 HydrophobicContact CG-CZ2 4.11Å; W384-W428 HydrophobicContact CH2-CD2 4.06Å; W384-W428 HydrophobicContact CH2-CE3 4.35Å; W384-W428 HydrophobicContact CH2-CH2 4.46Å; W384-W428 HydrophobicContact CH2-CZ2 4.23Å; W384-W428 HydrophobicContact CZ2-CD2 4.16Å; W384-W428 AromaticContact CZ2-CE3 3.98Å; W384-W428 HydrophobicContact CZ2-CE3 3.98Å; W384-W428 HydrophobicContact CZ2-CH2 4.27Å; W384-W428 HydrophobicContact CZ2-CZ2 4.48Å; W384-W428 HydrophobicContact CZ2-CZ3 4.03Å; Y407-W428 CarbonylContact C-O 3.5Å; Y407-W428 WeakPolarHBondContact CA-O 3.49Å; Y407-W428 WeakPolarHBondContact CB-O 2.99Å; A408-W428 PolarHBondContact N-O 3.21Å; A408-W428 PolarHBondContact O-N 2.82Å; R410-W428 VanDerWaalsContact NH2-CE3 3.34Å; W428-T430 HydrophobicContact CD2-CG2 3.83Å; W428-T430 HydrophobicContact CE3-CG2 4.41Å; W428-T430 HydrophobicContact CG-CG2 4.11Å; W428-T430 HydrophobicContact CZ2-CG2 4Å
429	Y	96.2	Very high	86.1	Confident	1 Å²	1	59.1 Å²	59.1	0%	0.004	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	112.2	178.2	-174.7	-89.7	0	0	0	111	M369 I370 T371 H406 Y407 W432 P443 L447	M369-Y429 PolarHBondContact O-N 3.48Å; I370-Y429 HydrophobicContact CG2-CD1 3.77Å; I370-Y429 HydrophobicContact CG2-CE1 4.46Å; T371-Y429 PolarHBondContact N-O 2.79Å; H406-Y429 HydrophobicContact CB-CE2 4.11Å; H406-Y429 WeakPolarHBondContact O-CD2 3.31Å; Y407-Y429 HydrophobicContact CD1-CD2 4.18Å; Y429-W432 HydrophobicContact CD1-CB 4.13Å; Y429-W432 HydrophobicContact CE1-CB 3.8Å; Y429-W432 HydrophobicContact CE1-CE3 4.15Å; Y429-W432 VanDerWaalsContact CE1-N 3.34Å; Y429-P443 HydrophobicContact CE2-CB 3.69Å; Y429-P443 WeakPolarHBondContact OH-CB 3.47Å; Y429-L447 HydrophobicContact CD2-CD2 3.88Å; Y429-L447 HydrophobicContact CG-CD2 4Å
430	T	88.3	Confident	86.6	Confident	45 Å²	45	54 Å²	54	28%	0.276	28%	0.284	S	S	.	.			trans	-105.5	-11.6	-174.2	55.2	0	0	0	0	113.4	K372 H406 W428 W432	K372-T430 WeakPolarHBondContact CE-O 3.32Å; H406-T430 PolarHBondContact O-N 3.45Å; W428-T430 HydrophobicContact CD2-CG2 3.83Å; W428-T430 HydrophobicContact CE3-CG2 4.41Å; W428-T430 HydrophobicContact CG-CG2 4.11Å; W428-T430 HydrophobicContact CZ2-CG2 4Å; T430-W432 VanDerWaalsContact C-N 3.28Å; T430-W432 PolarHBondContact O-N 3.21Å
431	S	84.7	Confident	86.8	Confident	46 Å²	46	48.9 Å²	48.9	32%	0.322	26%	0.261	S	S	.	.			trans	-77.3	0.2	-176.9	-59.1	0	0	0	0	115.4	H406 P433	H406-S431 WeakPolarHBondContact CA-OG 3.24Å; H406-S431 PolarHBondContact O-OG 2.94Å; S431-P433 WeakPolarHBondContact O-CD 3.47Å
432	W	85.4	Confident	86.8	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.015	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-78	121.9	175.6	-153.6	-56.3	0	0	0	110.8	I370 Y429 T430 K436 T437 P438 L444 R474 C477 F519	I370-W432 HydrophobicContact CG2-CB 4.3Å; I370-W432 HydrophobicContact CG2-CD2 4.18Å; I370-W432 HydrophobicContact CG2-CE3 3.51Å; I370-W432 HydrophobicContact CG2-CZ3 4.24Å; Y429-W432 HydrophobicContact CD1-CB 4.13Å; Y429-W432 HydrophobicContact CE1-CB 3.8Å; Y429-W432 HydrophobicContact CE1-CE3 4.15Å; Y429-W432 VanDerWaalsContact CE1-N 3.34Å; T430-W432 VanDerWaalsContact C-N 3.28Å; T430-W432 PolarHBondContact O-N 3.21Å; W432-K436 PolarHBondContact NE1-O 3.23Å; W432-T437 HydrophobicContact CZ2-CG2 4.46Å; W432-P438 HydrophobicContact CD2-CG 3.81Å; W432-P438 HydrophobicContact CE3-CG 4.04Å; W432-P438 HydrophobicContact CG-CG 4.12Å; W432-P438 HydrophobicContact CZ2-CG 4.42Å; W432-P438 HydrophobicContact CZ3-CG 4.45Å; W432-L444 HydrophobicContact CE3-CD1 4.37Å; W432-L444 HydrophobicContact CH2-CD2 4.28Å; W432-L444 HydrophobicContact CZ3-CD1 3.9Å; W432-L444 HydrophobicContact CZ3-CD2 3.81Å; W432-R474 HydrophobicContact CD2-CB 4.21Å; W432-R474 HydrophobicContact CD2-CG 3.75Å; W432-R474 HydrophobicContact CE3-CB 4.27Å; W432-R474 HydrophobicContact CE3-CG 4.32Å; W432-R474 VanDerWaalsContact CG-CD 3.45Å; W432-R474 HydrophobicContact CG-CG 3.99Å; W432-R474 VanDerWaalsContact CG-NE 3.34Å; W432-R474 HydrophobicContact CZ2-CB 4.48Å; W432-R474 HydrophobicContact CZ2-CG 4.17Å; W432-R474 HydrophobicContact CZ3-CB 4.43Å; W432-C477 HydrophobicContact CH2-CB 3.52Å; W432-C477 HydrophobicContact CZ2-CB 4.3Å; W432-C477 HydrophobicContact CZ3-CB 4.31Å; W432-F519 AromaticContact CH2-CD1 3.99Å; W432-F519 HydrophobicContact CH2-CD1 3.99Å; W432-F519 AromaticContact CH2-CE1 3.59Å; W432-F519 HydrophobicContact CH2-CE1 3.59Å; W432-F519 HydrophobicContact CH2-CZ 4.4Å; W432-F519 HydrophobicContact CZ2-CD1 4.32Å; W432-F519 HydrophobicContact CZ2-CE1 4.23Å; W432-F519 HydrophobicContact CZ3-CE1 4.19Å
433	P	77.1	Confident	86.8	Confident	40 Å²	40	47.2 Å²	47.2	26%	0.26	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-68.7	155.2	-179.5	-19.6	33.2	0	0	0	114	S431 K436 R474	S431-P433 WeakPolarHBondContact O-CD 3.47Å; P433-K436 HydrophobicContact CB-CB 4.18Å; P433-R474 PolarHBondContact O-NH2 2.79Å
434	D	60.6	Low	86.8	Confident	40 Å²	40	42.9 Å²	42.9	21%	0.214	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	136.1	170	-159.6	-2.3	0	0	0	110.2	E375 K379 K436	E375-D434 HydrophobicContact CB-CB 4.02Å; E375-D434 VanDerWaalsContact CB-OD2 3.26Å; E375-D434 WeakPolarHBondContact CB-OD2 3.36Å; E375-D434 HydrophobicContact CG-CB 4.44Å; E375-D434 WeakPolarHBondContact OE2-CB 3.25Å; K379-D434 IonicContact NZ-OD1 3.84Å; K379-D434 PolarHBondContact NZ-OD1 3.2Å; K379-D434 IonicContact NZ-OD2 2.67Å; K379-D434 PolarHBondContact NZ-OD2 3.42Å; D434-K436 PolarHBondContact O-N 3.31Å; D434-K436 VanDerWaalsContact O-N 3.09Å
435	H	58.9	Low	86.8	Confident	153 Å²	153	43 Å²	43	71%	0.708	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	17.6	-177.5	-57.7	-86.7	0	0	0	117.5
436	K	76.6	Confident	86.6	Confident	146 Å²	146	46 Å²	46	64%	0.635	24%	0.241	S	C	*	.	S	Bend	trans	-138	176.1	172.2	-60.4	-173	175.3	-171.5	0	112.2	W432 P433 D434	W432-K436 PolarHBondContact NE1-O 3.23Å; P433-K436 HydrophobicContact CB-CB 4.18Å; D434-K436 PolarHBondContact O-N 3.31Å; D434-K436 VanDerWaalsContact O-N 3.09Å
437	T	80.8	Confident	86.5	Confident	32 Å²	32	46 Å²	46	20%	0.196	24%	0.241	C	C	.	.			trans	-85.3	162.1	160.8	44.5	0	0	0	0	110.8	W432 E515 Q516 F519	W432-T437 HydrophobicContact CZ2-CG2 4.46Å; T437-E515 WeakPolarHBondContact CG2-O 3.34Å; T437-Q516 HydrophobicContact CG2-CG 4.29Å; T437-F519 HydrophobicContact CG2-CB 3.43Å; T437-F519 VanDerWaalsContact CG2-CB 3.43Å; T437-F519 HydrophobicContact CG2-CD1 4.31Å; T437-F519 HydrophobicContact CG2-CD2 4.27Å; T437-F519 HydrophobicContact CG2-CG 3.75Å
438	P	82.9	Confident	86.4	Confident	11 Å²	11	46.2 Å²	46.2	7%	0.071	24%	0.243	C	C	.	.			trans	-69.3	145.8	170	-15.7	30.8	0	0	0	111.5	W432 S440 F519	W432-P438 HydrophobicContact CD2-CG 3.81Å; W432-P438 HydrophobicContact CE3-CG 4.04Å; W432-P438 HydrophobicContact CG-CG 4.12Å; W432-P438 HydrophobicContact CZ2-CG 4.42Å; W432-P438 HydrophobicContact CZ3-CG 4.45Å; P438-S440 PolarHBondContact O-N 3.26Å; P438-F519 HydrophobicContact CB-CE2 4.24Å; P438-F519 HydrophobicContact CB-CZ 4.46Å; P438-F519 HydrophobicContact CG-CE2 4.1Å; P438-F519 HydrophobicContact CG-CZ 3.93Å
439	D	79.6	Confident	86.3	Confident	161 Å²	161	45.7 Å²	45.7	86%	0.861	25%	0.249	S	C	*	.	S	Bend	trans	-69.9	-13.3	-179.9	-48.7	-70.3	0	0	0	113.5
440	S	88.1	Confident	86.3	Confident	53 Å²	53	47.3 Å²	47.3	37%	0.371	26%	0.258	S	S	.	.			trans	-139.2	139.4	171.5	176.2	0	0	0	0	110.4	P438 L442 P443	P438-S440 PolarHBondContact O-N 3.26Å; S440-L442 PolarHBondContact OG-N 2.92Å; S440-P443 WeakPolarHBondContact O-CD 3.48Å
441	A	92.8	Very high	86.7	Confident	6 Å²	6	45.2 Å²	45.2	5%	0.05	25%	0.245	C	C	.	.	S	Bend	trans	-84.1	-13.5	175.1	0	0	0	0	0	113.8	P443 L444 L445 F519 A523 L526	A441-P443 VanDerWaalsContact C-CD 3.41Å; A441-L444 PolarHBondContact O-N 3.01Å; A441-L445 PolarHBondContact O-N 3.35Å; A441-F519 HydrophobicContact CB-CE2 3.85Å; A441-F519 HydrophobicContact CB-CZ 3.95Å; A441-A523 HydrophobicContact CB-CB 3.63Å; A441-L526 HydrophobicContact CB-CD2 4.13Å
442	L	92.6	Very high	87.1	Confident	66 Å²	66	44.5 Å²	44.5	35%	0.346	24%	0.236	S	C	.	.	H	α-helix	trans	-52.5	-43.3	-179.1	-62.2	-179.1	0	0	0	114.2	S440 L444 L445 Q446 L526	S440-L442 PolarHBondContact OG-N 2.92Å; L442-L444 VanDerWaalsContact C-N 3.26Å; L442-L444 PolarHBondContact O-N 3.45Å; L442-L445 PolarHBondContact O-N 3.39Å; L442-Q446 PolarHBondContact O-N 2.95Å; L442-L526 HydrophobicContact CD2-CD1 4.17Å; L442-L526 HydrophobicContact CD2-CD2 3.45Å; L442-L526 VanDerWaalsContact CD2-CD2 3.45Å; L442-L526 HydrophobicContact CD2-CG 3.77Å; L442-L526 HydrophobicContact CG-CD2 3.82Å
443	P	93.9	Very high	87.5	Confident	14 Å²	14	46.3 Å²	46.3	9%	0.091	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-33.1	178.1	-26.3	38.6	0	0	0	113.6	H406 Y429 S440 A441 L447	H406-P443 HydrophobicContact CB-CB 3.91Å; H406-P443 WeakPolarHBondContact CD2-CB 3.35Å; H406-P443 WeakPolarHBondContact CD2-CG 3.32Å; Y429-P443 HydrophobicContact CE2-CB 3.69Å; Y429-P443 WeakPolarHBondContact OH-CB 3.47Å; S440-P443 WeakPolarHBondContact O-CD 3.48Å; A441-P443 VanDerWaalsContact C-CD 3.41Å; P443-L447 WeakPolarHBondContact O-CB 3.45Å; P443-L447 PolarHBondContact O-N 3.45Å; P443-L447 VanDerWaalsContact O-N 3.09Å
444	L	94.9	Very high	88.3	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-78.4	-37	179.6	-167	72.3	0	0	0	111.4	W432 A441 L442 Q446 L447 M448 F478 F519	W432-L444 HydrophobicContact CE3-CD1 4.37Å; W432-L444 HydrophobicContact CH2-CD2 4.28Å; W432-L444 HydrophobicContact CZ3-CD1 3.9Å; W432-L444 HydrophobicContact CZ3-CD2 3.81Å; A441-L444 PolarHBondContact O-N 3.01Å; L442-L444 VanDerWaalsContact C-N 3.26Å; L442-L444 PolarHBondContact O-N 3.45Å; L444-Q446 VanDerWaalsContact C-N 3.34Å; L444-L447 HydrophobicContact CD1-CD2 4.2Å; L444-L447 PolarHBondContact O-N 2.97Å; L444-M448 WeakPolarHBondContact O-CB 3.31Å; L444-M448 PolarHBondContact O-N 2.76Å; L444-F478 HydrophobicContact CD1-CD2 3.87Å; L444-F478 HydrophobicContact CG-CD2 4.38Å; L444-F519 HydrophobicContact CD2-CE1 3.62Å; L444-F519 HydrophobicContact CD2-CZ 4.02Å
445	L	95.8	Very high	89.7	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-65.3	-37.6	173.2	-66.3	176.8	0	0	0	111.5	A441 L442 M448 A449 T481 L526 Y527	A441-L445 PolarHBondContact O-N 3.35Å; L442-L445 PolarHBondContact O-N 3.39Å; L445-M448 PolarHBondContact O-N 2.93Å; L445-A449 WeakPolarHBondContact O-CB 3.36Å; L445-A449 PolarHBondContact O-N 3.09Å; L445-T481 HydrophobicContact CD2-CG2 3.77Å; L445-L526 HydrophobicContact CD1-CB 4.3Å; L445-L526 HydrophobicContact CD1-CD2 4.44Å; L445-L526 HydrophobicContact CD1-CG 4.2Å; L445-Y527 HydrophobicContact CD2-CD2 4.42Å; L445-Y527 HydrophobicContact CD2-CG 4.41Å
446	Q	95.3	Very high	91.1	Very high	87 Å²	87	49 Å²	49	41%	0.407	25%	0.25	S	S	.	.	H	α-helix	trans	-66.6	-47.4	173.2	-170.2	61.2	49	0	0	111.5	Y407 L442 L444 M448 A449 D450	Y407-Q446 WeakPolarHBondContact OH-CG 3.42Å; L442-Q446 PolarHBondContact O-N 2.95Å; L444-Q446 VanDerWaalsContact C-N 3.34Å; Q446-M448 VanDerWaalsContact C-N 3.27Å; Q446-M448 PolarHBondContact O-N 3.4Å; Q446-A449 PolarHBondContact O-N 3.02Å; Q446-A449 VanDerWaalsContact O-N 3.08Å; Q446-D450 PolarHBondContact NE2-OD1 2.84Å; Q446-D450 PolarHBondContact O-N 2.96Å
447	L	96.3	Very high	91.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-55.1	-43.5	174.4	176.7	67	0	0	0	112	V368 Y407 Y427 Y429 P443 L444 V451 F478	V368-L447 HydrophobicContact CG1-CD2 3.94Å; V368-L447 HydrophobicContact CG1-CG 4.45Å; Y407-L447 HydrophobicContact CD1-CB 4.34Å; Y407-L447 HydrophobicContact CD1-CD1 4.28Å; Y407-L447 HydrophobicContact CD2-CD1 4.23Å; Y407-L447 HydrophobicContact CE1-CB 4.18Å; Y407-L447 HydrophobicContact CE2-CD1 4.45Å; Y407-L447 HydrophobicContact CG-CD1 4.14Å; Y427-L447 HydrophobicContact CD1-CD1 3.51Å; Y427-L447 HydrophobicContact CE1-CD1 4.4Å; Y427-L447 HydrophobicContact CG-CD1 3.97Å; Y429-L447 HydrophobicContact CD2-CD2 3.88Å; Y429-L447 HydrophobicContact CG-CD2 4Å; P443-L447 WeakPolarHBondContact O-CB 3.45Å; P443-L447 PolarHBondContact O-N 3.45Å; P443-L447 VanDerWaalsContact O-N 3.09Å; L444-L447 HydrophobicContact CD1-CD2 4.2Å; L444-L447 PolarHBondContact O-N 2.97Å; L447-V451 HydrophobicContact CD1-CG2 4.2Å; L447-V451 WeakPolarHBondContact O-CB 3.49Å; L447-V451 WeakPolarHBondContact O-CG2 3.48Å; L447-V451 PolarHBondContact O-N 3.3Å; L447-F478 HydrophobicContact CD2-CD2 4.22Å; L447-F478 HydrophobicContact CD2-CE2 3.98Å; L447-F478 HydrophobicContact CG-CE2 3.96Å
448	M	96.4	Very high	91.9	Very high	12 Å²	12	47.1 Å²	47.1	6%	0.059	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-43.7	175.8	178	-134.4	68.4	0	0	111.7	L444 L445 Q446 V451 E452 F478 T482 C485	L444-M448 WeakPolarHBondContact O-CB 3.31Å; L444-M448 PolarHBondContact O-N 2.76Å; L445-M448 PolarHBondContact O-N 2.93Å; Q446-M448 VanDerWaalsContact C-N 3.27Å; Q446-M448 PolarHBondContact O-N 3.4Å; M448-V451 PolarHBondContact O-N 2.91Å; M448-E452 WeakPolarHBondContact O-CB 3.37Å; M448-E452 PolarHBondContact O-N 2.93Å; M448-F478 HydrophobicContact CB-CE2 4.13Å; M448-T482 HydrophobicContact CG-CG2 4.03Å; M448-T482 WeakPolarHBondContact CG-OG1 3.37Å; M448-C485 HydrophobicContact CE-CB 4.44Å; M448-C485 HydrophobicContact SD-CB 3.58Å; M448-C485 VanDerWaalsContact SD-CB 3.58Å; M448-C485 VanDerWaalsContact SD-SG 3.61Å
449	A	95.5	Very high	91.7	Very high	39 Å²	39	51.7 Å²	51.7	32%	0.322	29%	0.293	S	S	.	.	H	α-helix	trans	-64.2	-44.8	179.4	0	0	0	0	0	112	L445 Q446 A453	L445-A449 WeakPolarHBondContact O-CB 3.36Å; L445-A449 PolarHBondContact O-N 3.09Å; Q446-A449 PolarHBondContact O-N 3.02Å; Q446-A449 VanDerWaalsContact O-N 3.08Å; A449-A453 WeakPolarHBondContact O-CB 3.29Å; A449-A453 PolarHBondContact O-N 2.77Å
450	D	95.8	Very high	91.4	Very high	35 Å²	35	45.7 Å²	45.7	19%	0.187	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-46.1	174.8	-75.5	26.7	0	0	0	111.8	Y407 Y427 Q446 A453 E454	Y407-D450 PolarHBondContact OH-OD1 3.35Å; Y407-D450 PolarHBondContact OH-OD2 3.3Å; Y427-D450 HydrophobicContact CE1-CB 3.69Å; Y427-D450 PolarHBondContact OH-O 3.44Å; Q446-D450 PolarHBondContact NE2-OD1 2.84Å; Q446-D450 PolarHBondContact O-N 2.96Å; D450-A453 WeakPolarHBondContact O-CB 3.28Å; D450-A453 PolarHBondContact O-N 3.23Å; D450-E454 PolarHBondContact O-N 3.5Å
451	V	96.2	Very high	91.2	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-65.5	-43.2	-178.4	165.8	0	0	0	0	111.5	V366 V368 Y427 L447 M448 A453 E454 R455 V464 F478	V366-V451 HydrophobicContact CG1-CG1 4.17Å; V366-V451 HydrophobicContact CG1-CG2 4.26Å; V368-V451 HydrophobicContact CG2-CG1 4.05Å; V368-V451 HydrophobicContact CG2-CG2 3.73Å; Y427-V451 HydrophobicContact CD1-CG2 4.07Å; Y427-V451 HydrophobicContact CD2-CG2 3.89Å; Y427-V451 HydrophobicContact CE1-CG2 4.1Å; Y427-V451 HydrophobicContact CE2-CG2 3.92Å; Y427-V451 HydrophobicContact CG-CG2 3.97Å; L447-V451 HydrophobicContact CD1-CG2 4.2Å; L447-V451 WeakPolarHBondContact O-CB 3.49Å; L447-V451 WeakPolarHBondContact O-CG2 3.48Å; L447-V451 PolarHBondContact O-N 3.3Å; M448-V451 PolarHBondContact O-N 2.91Å; V451-A453 VanDerWaalsContact C-N 3.31Å; V451-E454 PolarHBondContact O-N 3.22Å; V451-R455 VanDerWaalsContact O-CB 3.25Å; V451-R455 WeakPolarHBondContact O-CB 3.4Å; V451-R455 PolarHBondContact O-N 3.29Å; V451-V464 HydrophobicContact CG1-CG1 4.17Å; V451-F478 HydrophobicContact CB-CZ 4.29Å; V451-F478 HydrophobicContact CG1-CZ 4.17Å; V451-F478 HydrophobicContact CG2-CZ 4.33Å
452	E	93.7	Very high	91.3	Very high	31 Å²	31	50.6 Å²	50.6	15%	0.145	29%	0.292	C	S	.	.	H	α-helix	trans	-73.7	-21.4	175.8	-78.9	-73.7	132.6	0	0	112.6	M448 R455 R456 T482	M448-E452 WeakPolarHBondContact O-CB 3.37Å; M448-E452 PolarHBondContact O-N 2.93Å; E452-R455 WeakPolarHBondContact OE1-CD 3.38Å; E452-R455 IonicContact OE1-CZ 2.7Å; E452-R455 IonicContact OE1-NE 2.83Å; E452-R455 IonicContact OE1-NH1 3.19Å; E452-R455 PolarHBondContact OE1-NH1 2.87Å; E452-R456 VanDerWaalsContact O-CG 3.31Å; E452-R456 WeakPolarHBondContact O-CG 3.32Å; E452-R456 PolarHBondContact O-N 3.07Å; E452-R456 PolarHBondContact O-NE 2.8Å; E452-R456 PolarHBondContact O-NH1 2.84Å; E452-R456 PolarHBondContact O-NH2 3.09Å; E452-T482 HydrophobicContact CG-CG2 3.84Å
453	A	93.9	Very high	91.5	Very high	42 Å²	42	47.9 Å²	47.9	35%	0.347	28%	0.278	S	S	.	.	H	α-helix	trans	-69	-51.5	168.2	0	0	0	0	0	111.3	A449 D450 V451 R455 R456 T457	A449-A453 WeakPolarHBondContact O-CB 3.29Å; A449-A453 PolarHBondContact O-N 2.77Å; D450-A453 WeakPolarHBondContact O-CB 3.28Å; D450-A453 PolarHBondContact O-N 3.23Å; V451-A453 VanDerWaalsContact C-N 3.31Å; A453-R455 VanDerWaalsContact C-N 3.32Å; A453-R455 PolarHBondContact O-N 3.46Å; A453-R456 PolarHBondContact O-N 3.14Å; A453-R456 VanDerWaalsContact O-N 3.15Å; A453-T457 PolarHBondContact O-N 3.21Å; A453-T457 PolarHBondContact O-OG1 3.04Å
454	E	93.6	Very high	91.7	Very high	54 Å²	54	47.2 Å²	47.2	25%	0.252	27%	0.274	S	S	.	.	H	α-helix	trans	-61	-40.5	176.6	-170.3	75	-173.6	0	0	111.7	V366 Q425 D450 V451 R456 T457 A458	V366-E454 HydrophobicContact CG2-CB 4.26Å; V366-E454 HydrophobicContact CG2-CG 3.95Å; Q425-E454 HydrophobicContact CB-CG 4.33Å; Q425-E454 HydrophobicContact CG-CG 3.5Å; Q425-E454 WeakPolarHBondContact CG-OE1 3.47Å; Q425-E454 PolarHBondContact NE2-OE1 3.43Å; D450-E454 PolarHBondContact O-N 3.5Å; V451-E454 PolarHBondContact O-N 3.22Å; E454-R456 PolarHBondContact O-N 2.91Å; E454-T457 WeakPolarHBondContact CA-OG1 3.4Å; E454-T457 PolarHBondContact O-N 2.87Å; E454-T457 VanDerWaalsContact O-N 3.09Å; E454-T457 PolarHBondContact O-OG1 3.02Å; E454-T457 VanDerWaalsContact O-OG1 3.09Å; E454-A458 WeakPolarHBondContact O-CB 3.2Å; E454-A458 PolarHBondContact O-N 2.95Å
455	R	90.2	Very high	91.9	Very high	66 Å²	66	47.2 Å²	47.2	25%	0.249	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-29.3	177.5	-168.4	-176	-178.5	-147.9	-9.9	112.9	D337 V451 E452 A453 V464	D337-R455 IonicContact OD2-CZ 2.8Å; D337-R455 IonicContact OD2-NH2 3.79Å; D337-R455 PolarHBondContact OD2-NH2 3.37Å; V451-R455 VanDerWaalsContact O-CB 3.25Å; V451-R455 WeakPolarHBondContact O-CB 3.4Å; V451-R455 PolarHBondContact O-N 3.29Å; E452-R455 WeakPolarHBondContact OE1-CD 3.38Å; E452-R455 IonicContact OE1-CZ 2.7Å; E452-R455 IonicContact OE1-NE 2.83Å; E452-R455 IonicContact OE1-NH1 3.19Å; E452-R455 PolarHBondContact OE1-NH1 2.87Å; A453-R455 VanDerWaalsContact C-N 3.32Å; A453-R455 PolarHBondContact O-N 3.46Å; R455-V464 HydrophobicContact CG-CG2 4.11Å
456	R	88.6	Confident	92.1	Very high	169 Å²	169	47 Å²	47	64%	0.638	27%	0.273	S	S	*	.	H	α-helix	trans	-82.6	-21.8	176.3	-73.1	-178.5	-62.5	-107.2	3.2	113.8	E452 A453 E454	E452-R456 VanDerWaalsContact O-CG 3.31Å; E452-R456 WeakPolarHBondContact O-CG 3.32Å; E452-R456 PolarHBondContact O-N 3.07Å; E452-R456 PolarHBondContact O-NE 2.8Å; E452-R456 PolarHBondContact O-NH1 2.84Å; E452-R456 PolarHBondContact O-NH2 3.09Å; A453-R456 PolarHBondContact O-N 3.14Å; A453-R456 VanDerWaalsContact O-N 3.15Å; E454-R456 PolarHBondContact O-N 2.91Å
457	T	89.6	Confident	92.2	Very high	108 Å²	108	42.9 Å²	42.9	66%	0.663	25%	0.254	S	S	*	.	H	α-helix	trans	-99.2	-14.8	178.3	54.3	0	0	0	0	113.4	A453 E454	A453-T457 PolarHBondContact O-N 3.21Å; A453-T457 PolarHBondContact O-OG1 3.04Å; E454-T457 WeakPolarHBondContact CA-OG1 3.4Å; E454-T457 PolarHBondContact O-N 2.87Å; E454-T457 VanDerWaalsContact O-N 3.09Å; E454-T457 PolarHBondContact O-OG1 3.02Å; E454-T457 VanDerWaalsContact O-OG1 3.09Å
458	A	85.2	Confident	92.2	Very high	30 Å²	30	43.1 Å²	43.1	25%	0.248	26%	0.255	C	S	.	.			trans	-62.9	135	179.7	0	0	0	0	0	113.1	P365 E454 C460	P365-A458 HydrophobicContact CB-CB 3.52Å; P365-A458 HydrophobicContact CG-CB 4.23Å; E454-A458 WeakPolarHBondContact O-CB 3.2Å; E454-A458 PolarHBondContact O-N 2.95Å; A458-C460 PolarHBondContact O-N 3.18Å
459	A	77.4	Confident	92.2	Very high	108 Å²	108	43.1 Å²	43.1	89%	0.893	26%	0.257	S	S	*	.	S	Bend	trans	-75.1	-4.2	177.2	0	0	0	0	0	114.4
460	C	74.1	Confident	92.3	Very high	35 Å²	35	41.6 Å²	41.6	24%	0.236	24%	0.244	C	C	.	.			trans	-125.1	128.6	-179.4	-57.9	0	0	0	0	109.9	E363 A458 G462	E363-C460 HydrophobicContact CB-CB 4.28Å; E363-C460 WeakPolarHBondContact O-CB 3.37Å; A458-C460 PolarHBondContact O-N 3.18Å; C460-G462 PolarHBondContact O-N 3.08Å
461	V	83.7	Confident	92.4	Very high	152 Å²	152	40 Å²	40	92%	0.921	24%	0.235	S	C	*	.			trans	-90.2	30.1	-175.2	-154.4	0	0	0	0	112.1
462	G	94.6	Very high	92.5	Very high	10 Å²	10	39.9 Å²	39.9	10%	0.103	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-72.8	159.2	-179.2	0	0	0	0	0	113.4	E362 P365 C460	E362-G462 WeakPolarHBondContact O-CA 3.41Å; P365-G462 WeakPolarHBondContact CD-O 3.4Å; C460-G462 PolarHBondContact O-N 3.08Å
463	P	97.3	Very high	92.6	Very high	9 Å²	9	38.4 Å²	38.4	6%	0.058	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-57.2	138.2	173.9	19.1	-31.4	0	0	0	112.5	R339 A340 I342 E362 S364 I465	R339-P463 WeakPolarHBondContact O-CA 3.38Å; R339-P463 VanDerWaalsContact O-CB 3.31Å; R339-P463 WeakPolarHBondContact O-CB 3.34Å; A340-P463 WeakPolarHBondContact O-CA 3.47Å; I342-P463 HydrophobicContact CB-CB 4.47Å; I342-P463 HydrophobicContact CD1-CB 3.95Å; I342-P463 HydrophobicContact CD1-CG 3.45Å; I342-P463 VanDerWaalsContact CD1-CG 3.45Å; I342-P463 HydrophobicContact CG1-CB 3.78Å; I342-P463 HydrophobicContact CG1-CG 3.85Å; E362-P463 HydrophobicContact CB-CG 3.94Å; E362-P463 WeakPolarHBondContact O-CD 3.35Å; S364-P463 WeakPolarHBondContact CA-O 3.46Å; S364-P463 WeakPolarHBondContact CB-O 3.5Å; S364-P463 PolarHBondContact OG-O 2.77Å; P463-I465 PolarHBondContact O-N 3.37Å
464	V	98.3	Very high	92.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	119.9	167.6	173.3	0	0	0	0	109.3	A340 F341 I342 V366 V368 V451 R455 V466	A340-V464 PolarHBondContact O-N 3.41Å; F341-V464 CarbonylContact C-O 3.56Å; F341-V464 WeakPolarHBondContact CA-O 3.39Å; F341-V464 WeakPolarHBondContact CB-O 3.4Å; F341-V464 HydrophobicContact CD1-CB 3.81Å; F341-V464 HydrophobicContact CD1-CG1 4.18Å; F341-V464 HydrophobicContact CE1-CB 4.29Å; I342-V464 PolarHBondContact N-O 3.07Å; V366-V464 HydrophobicContact CB-CG1 4.07Å; V366-V464 HydrophobicContact CB-CG2 4.18Å; V366-V464 HydrophobicContact CG1-CG1 4.27Å; V368-V464 HydrophobicContact CG2-CG1 3.93Å; V451-V464 HydrophobicContact CG1-CG1 4.17Å; R455-V464 HydrophobicContact CG-CG2 4.11Å; V464-V466 HydrophobicContact CG1-CG2 4.09Å; V464-V466 PolarHBondContact O-N 2.85Å
465	I	98.9	Very high	93	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	122.2	178.9	-67.1	166.2	0	0	0	108.8	I342 T344 F355 M358 A359 S364 V366 I367 V368 P463	I342-I465 HydrophobicContact CB-CG1 4.17Å; I342-I465 WeakPolarHBondContact O-CA 3.01Å; T344-I465 HydrophobicContact CG2-CG2 3.75Å; F355-I465 HydrophobicContact CE2-CG2 3.93Å; F355-I465 HydrophobicContact CZ-CG2 4.15Å; M358-I465 HydrophobicContact CE-CD1 3.9Å; M358-I465 HydrophobicContact CE-CG1 4.16Å; M358-I465 HydrophobicContact CE-CG2 4.16Å; A359-I465 HydrophobicContact CB-CD1 3.69Å; S364-I465 WeakPolarHBondContact OG-CD1 3.09Å; S364-I465 WeakPolarHBondContact OG-CG1 3.43Å; V366-I465 PolarHBondContact O-N 3.01Å; I367-I465 CarbonylContact C-O 3.41Å; I367-I465 WeakPolarHBondContact CA-O 3.47Å; I367-I465 HydrophobicContact CG1-CB 4.07Å; I367-I465 HydrophobicContact CG1-CD1 4.26Å; I367-I465 HydrophobicContact CG1-CG2 4.43Å; I367-I465 HydrophobicContact CG2-CG2 4.47Å; V368-I465 PolarHBondContact N-O 3.14Å; P463-I465 PolarHBondContact O-N 3.37Å
466	V	98.9	Very high	93.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.7	178.3	-172	0	0	0	0	109.7	F341 I342 T344 V368 I370 V464 T475 F478 I479	F341-V466 HydrophobicContact CD1-CG2 4Å; I342-V466 PolarHBondContact O-N 2.91Å; T344-V466 PolarHBondContact N-O 2.97Å; V368-V466 HydrophobicContact CB-CG1 4.35Å; V368-V466 HydrophobicContact CB-CG2 4.32Å; V368-V466 WeakPolarHBondContact O-CA 3.45Å; I370-V466 HydrophobicContact CD1-CG1 4.09Å; V464-V466 HydrophobicContact CG1-CG2 4.09Å; V464-V466 PolarHBondContact O-N 2.85Å; V466-T475 HydrophobicContact CB-CG2 4.07Å; V466-T475 HydrophobicContact CG1-CG2 3.89Å; V466-T475 WeakPolarHBondContact O-CG2 3.49Å; V466-F478 HydrophobicContact CB-CD1 4.48Å; V466-F478 HydrophobicContact CG1-CB 4.41Å; V466-F478 HydrophobicContact CG1-CD1 3.71Å; V466-F478 HydrophobicContact CG1-CE1 4.43Å; V466-F478 HydrophobicContact CG1-CG 4.37Å; V466-F478 HydrophobicContact CG2-CD1 3.89Å; V466-F478 HydrophobicContact CG2-CE1 3.95Å; V466-I479 HydrophobicContact CB-CD1 4.03Å; V466-I479 HydrophobicContact CB-CG1 4.27Å; V466-I479 HydrophobicContact CG1-CG1 4.38Å; V466-I479 HydrophobicContact CG2-CD1 4.03Å; V466-I479 HydrophobicContact CG2-CG1 3.96Å
467	H	98.8	Very high	93.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	156.5	-178.4	89.7	89.2	0	0	0	113.9	T344 G346 V368 M369 I370 Y383	T344-H467 HydrophobicContact CG2-CB 3.64Å; T344-H467 WeakPolarHBondContact O-CA 3.28Å; T344-H467 VanDerWaalsContact O-CB 3.23Å; T344-H467 WeakPolarHBondContact O-CB 3.36Å; G346-H467 WeakPolarHBondContact CA-ND1 3.33Å; V368-H467 PolarHBondContact O-N 2.77Å; M369-H467 WeakPolarHBondContact CB-NE2 3.35Å; M369-H467 VanDerWaalsContact CG-CE1 3.42Å; M369-H467 WeakPolarHBondContact CG-CE1 3.48Å; M369-H467 VanDerWaalsContact CG-NE2 3.29Å; M369-H467 WeakPolarHBondContact CG-NE2 3.29Å; I370-H467 PolarHBondContact N-O 2.89Å; Y383-H467 AromaticContact CE1-CE1 3.71Å; Y383-H467 AromaticContact CE1-NE2 3.35Å; Y383-H467 WeakPolarHBondContact CE1-NE2 3.33Å; Y383-H467 AromaticContact CZ-NE2 3.44Å; Y383-H467 PolarHBondContact OH-NE2 3.38Å
468	C	96.4	Very high	94.3	Very high	5 Å²	5	18.6 Å²	18.6	3%	0.034	13%	0.129	C	C	.	.	S	Bend	trans	-133.4	-131.6	168.1	67.2	0	0	0	0	108.4	G346 G471 R474 T475	G346-C468 WeakPolarHBondContact CA-O 3.36Å; G346-C468 PolarHBondContact N-O 3.5Å; G346-C468 VanDerWaalsContact N-O 3.07Å; C468-G471 PolarHBondContact SG-N 3.5Å; C468-G471 VanDerWaalsContact SG-N 3.36Å; C468-R474 HydrophobicContact CB-CB 3.97Å; C468-T475 PolarHBondContact N-OG1 2.9Å
469	S	96.2	Very high	94.9	Very high	12 Å²	12	17.1 Å²	17.1	8%	0.084	12%	0.118	C	C	.	.	S	Bend	trans	-78.3	-61.4	167.2	-166.5	0	0	0	0	111.6	Y300 G346 K379	Y300-S469 PolarHBondContact OH-OG 3.3Å; G346-S469 PolarHBondContact N-O 2.82Å; K379-S469 WeakPolarHBondContact CA-OG 3.42Å; K379-S469 WeakPolarHBondContact O-CA 3.33Å; K379-S469 PolarHBondContact O-OG 3.46Å
470	A	96.9	Very high	95.9	Very high	7 Å²	7	12 Å²	12	6%	0.058	8%	0.075	C	C	.	.	S	Bend	trans	-91.9	-12.4	-176.6	0	0	0	0	0	114.4	Y300 I303 I472 R507	Y300-A470 HydrophobicContact CD2-CB 3.74Å; Y300-A470 HydrophobicContact CE2-CB 3.69Å; I303-A470 HydrophobicContact CD1-CB 3.67Å; A470-I472 HydrophobicContact CB-CG1 4Å; A470-R507 PolarHBondContact O-NH2 3.46Å
471	G	97.8	Very high	97.1	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.064	C	C	.	.	S	Bend	trans	71.9	26.2	-178.2	0	0	0	0	0	114.9	T344 C468 R507	T344-G471 WeakPolarHBondContact O-CA 3.46Å; C468-G471 PolarHBondContact SG-N 3.5Å; C468-G471 VanDerWaalsContact SG-N 3.36Å; G471-R507 PolarHBondContact O-NE 3.44Å
472	I	98.3	Very high	97.8	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.023	C	C	.	.	S	Bend	trans	-136.5	-45.5	-178.3	57.6	165.8	0	0	0	115	F283 I303 A470 G476 R507 G508 M510 I511 Q512	F283-I472 HydrophobicContact CE1-CD1 3.96Å; F283-I472 HydrophobicContact CZ-CD1 4.24Å; I303-I472 HydrophobicContact CD1-CD1 3.85Å; I303-I472 HydrophobicContact CD1-CG1 4.48Å; I303-I472 HydrophobicContact CG1-CD1 4.22Å; I303-I472 HydrophobicContact CG2-CD1 3.88Å; I303-I472 HydrophobicContact CG2-CG1 4.28Å; I303-I472 HydrophobicContact CG2-CG2 4.19Å; A470-I472 HydrophobicContact CB-CG1 4Å; I472-G476 WeakPolarHBondContact O-CA 3.06Å; I472-G476 PolarHBondContact O-N 2.91Å; I472-R507 HydrophobicContact CG2-CG 3.93Å; I472-R507 VanDerWaalsContact CG2-NE 3.33Å; I472-G508 WeakPolarHBondContact CG2-O 2.87Å; I472-M510 HydrophobicContact CB-SD 4.39Å; I472-M510 HydrophobicContact CG2-CG 4.48Å; I472-M510 HydrophobicContact CG2-SD 4.36Å; I472-M510 WeakPolarHBondContact O-CA 3.45Å; I472-I511 PolarHBondContact O-N 2.87Å; I472-Q512 HydrophobicContact CD1-CG 3.79Å; I472-Q512 HydrophobicContact CG1-CG 3.84Å
473	G	96.6	Very high	97.9	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-69.1	-87.2	-179.7	0	0	0	0	0	113.3	T475 G476 C477 Q512 Q516	G473-T475 PolarHBondContact O-N 2.83Å; G473-T475 VanDerWaalsContact O-N 3.16Å; G473-G476 WeakPolarHBondContact O-CA 3.38Å; G473-G476 PolarHBondContact O-N 3.48Å; G473-C477 PolarHBondContact O-N 2.89Å; G473-C477 PolarHBondContact O-SG 3.07Å; G473-Q512 VanDerWaalsContact CA-OE1 3.27Å; G473-Q516 VanDerWaalsContact CA-OE1 3.23Å
474	R	96.8	Very high	98	Very high	21 Å²	21	3.4 Å²	3.4	8%	0.079	2%	0.019	C	C	.	.	H	α-helix	trans	-53.7	-35.1	177.1	-54.6	-179.6	-179.9	152.4	-1.2	113.3	I370 T371 E375 W432 P433 C468 C477 F478	I370-R474 HydrophobicContact CB-CB 4.27Å; I370-R474 HydrophobicContact CG2-CB 3.98Å; I370-R474 WeakPolarHBondContact O-CD 3.44Å; I370-R474 PolarHBondContact O-NH1 2.81Å; I370-R474 VanDerWaalsContact O-NH1 3.14Å; T371-R474 PolarHBondContact OG1-NH1 2.99Å; E375-R474 IonicContact OE1-CZ 3.84Å; E375-R474 IonicContact OE1-NH1 3.14Å; E375-R474 PolarHBondContact OE1-NH1 3.33Å; E375-R474 IonicContact OE1-NH2 3.64Å; E375-R474 PolarHBondContact OE1-NH2 2.84Å; E375-R474 IonicContact OE2-CZ 3.52Å; E375-R474 IonicContact OE2-NH1 2.81Å; E375-R474 IonicContact OE2-NH2 4Å; E375-R474 PolarHBondContact OE2-NH2 3.03Å; E375-R474 VanDerWaalsContact OE2-NH2 3.14Å; W432-R474 HydrophobicContact CD2-CB 4.21Å; W432-R474 HydrophobicContact CD2-CG 3.75Å; W432-R474 HydrophobicContact CE3-CB 4.27Å; W432-R474 HydrophobicContact CE3-CG 4.32Å; W432-R474 VanDerWaalsContact CG-CD 3.45Å; W432-R474 HydrophobicContact CG-CG 3.99Å; W432-R474 VanDerWaalsContact CG-NE 3.34Å; W432-R474 HydrophobicContact CZ2-CB 4.48Å; W432-R474 HydrophobicContact CZ2-CG 4.17Å; W432-R474 HydrophobicContact CZ3-CB 4.43Å; P433-R474 PolarHBondContact O-NH2 2.79Å; C468-R474 HydrophobicContact CB-CB 3.97Å; R474-C477 PolarHBondContact O-N 2.89Å; R474-F478 PolarHBondContact O-N 2.81Å
475	T	98.6	Very high	97.9	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-60.8	-47.7	173.1	-63.7	0	0	0	0	111.9	A343 V466 C468 G473 F478 I479 M510	A343-T475 HydrophobicContact CB-CG2 3.65Å; V466-T475 HydrophobicContact CB-CG2 4.07Å; V466-T475 HydrophobicContact CG1-CG2 3.89Å; V466-T475 WeakPolarHBondContact O-CG2 3.49Å; C468-T475 PolarHBondContact N-OG1 2.9Å; G473-T475 PolarHBondContact O-N 2.83Å; G473-T475 VanDerWaalsContact O-N 3.16Å; T475-F478 PolarHBondContact O-N 2.95Å; T475-I479 HydrophobicContact CG2-CD1 4.15Å; T475-I479 WeakPolarHBondContact O-CG1 3.4Å; T475-I479 PolarHBondContact O-N 3.3Å; T475-I479 VanDerWaalsContact O-N 3.1Å; T475-M510 HydrophobicContact CG2-CE 4.39Å; T475-M510 HydrophobicContact CG2-SD 4.25Å
476	G	98.4	Very high	97.8	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-63.4	-42.1	175.3	0	0	0	0	0	112.2	I472 G473 F478 I479 A480	I472-G476 WeakPolarHBondContact O-CA 3.06Å; I472-G476 PolarHBondContact O-N 2.91Å; G473-G476 WeakPolarHBondContact O-CA 3.38Å; G473-G476 PolarHBondContact O-N 3.48Å; G476-F478 PolarHBondContact O-N 2.89Å; G476-I479 PolarHBondContact O-N 2.97Å; G476-A480 WeakPolarHBondContact O-CB 3.46Å; G476-A480 PolarHBondContact O-N 3.12Å
477	C	98.4	Very high	97.6	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-57.8	-49.7	175	-61.7	0	0	0	0	112.2	W432 G473 R474 A480 T481 V520	W432-C477 HydrophobicContact CH2-CB 3.52Å; W432-C477 HydrophobicContact CZ2-CB 4.3Å; W432-C477 HydrophobicContact CZ3-CB 4.31Å; G473-C477 PolarHBondContact O-N 2.89Å; G473-C477 PolarHBondContact O-SG 3.07Å; R474-C477 PolarHBondContact O-N 2.89Å; C477-A480 PolarHBondContact O-N 2.78Å; C477-T481 WeakPolarHBondContact O-CB 3.46Å; C477-T481 PolarHBondContact O-N 2.96Å; C477-T481 PolarHBondContact O-OG1 3.13Å; C477-T481 VanDerWaalsContact O-OG1 3.08Å; C477-V520 HydrophobicContact CB-CG2 3.99Å
478	F	98.6	Very high	97.5	Very high	1 Å²	1	9.9 Å²	9.9	0%	0.004	4%	0.044	C	C	.	.	H	α-helix	trans	-61.8	-49.6	-179.5	175.8	-97.5	0	0	0	111.7	V368 I370 L444 L447 M448 V451 V466 R474 T475 G476 A480 T481 T482	V368-F478 HydrophobicContact CB-CE1 4.36Å; V368-F478 HydrophobicContact CG1-CD1 4.45Å; V368-F478 HydrophobicContact CG1-CE1 4.15Å; V368-F478 HydrophobicContact CG1-CE2 4.28Å; V368-F478 HydrophobicContact CG1-CZ 4.05Å; V368-F478 HydrophobicContact CG2-CE1 4.08Å; V368-F478 HydrophobicContact CG2-CZ 4.11Å; I370-F478 HydrophobicContact CD1-CB 3.36Å; I370-F478 HydrophobicContact CD1-CD1 4.4Å; I370-F478 HydrophobicContact CD1-CD2 4.11Å; I370-F478 HydrophobicContact CD1-CG 3.71Å; L444-F478 HydrophobicContact CD1-CD2 3.87Å; L444-F478 HydrophobicContact CG-CD2 4.38Å; L447-F478 HydrophobicContact CD2-CD2 4.22Å; L447-F478 HydrophobicContact CD2-CE2 3.98Å; L447-F478 HydrophobicContact CG-CE2 3.96Å; M448-F478 HydrophobicContact CB-CE2 4.13Å; V451-F478 HydrophobicContact CB-CZ 4.29Å; V451-F478 HydrophobicContact CG1-CZ 4.17Å; V451-F478 HydrophobicContact CG2-CZ 4.33Å; V466-F478 HydrophobicContact CB-CD1 4.48Å; V466-F478 HydrophobicContact CG1-CB 4.41Å; V466-F478 HydrophobicContact CG1-CD1 3.71Å; V466-F478 HydrophobicContact CG1-CE1 4.43Å; V466-F478 HydrophobicContact CG1-CG 4.37Å; V466-F478 HydrophobicContact CG2-CD1 3.89Å; V466-F478 HydrophobicContact CG2-CE1 3.95Å; R474-F478 PolarHBondContact O-N 2.81Å; T475-F478 PolarHBondContact O-N 2.95Å; G476-F478 PolarHBondContact O-N 2.89Å; F478-A480 PolarHBondContact O-N 2.84Å; F478-T481 PolarHBondContact O-N 2.99Å; F478-T482 PolarHBondContact O-N 3.07Å; F478-T482 PolarHBondContact O-OG1 3.07Å
479	I	98.7	Very high	97.4	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-64.7	-41.2	-179.7	-63.3	173.7	0	0	0	111	I331 F341 V466 T475 G476 T482 I483 L503 M510	I331-I479 HydrophobicContact CG1-CD1 4.42Å; I331-I479 HydrophobicContact CG2-CD1 4.43Å; I331-I479 HydrophobicContact CG2-CG2 4.15Å; F341-I479 HydrophobicContact CB-CD1 3.75Å; F341-I479 HydrophobicContact CB-CG1 4.37Å; F341-I479 HydrophobicContact CD1-CD1 4.41Å; F341-I479 HydrophobicContact CD1-CG1 4.13Å; F341-I479 HydrophobicContact CD2-CD1 4.4Å; F341-I479 HydrophobicContact CD2-CG1 4.33Å; F341-I479 HydrophobicContact CD2-CG2 3.61Å; F341-I479 HydrophobicContact CE2-CG2 3.75Å; F341-I479 HydrophobicContact CG-CD1 3.95Å; F341-I479 HydrophobicContact CG-CG1 4.02Å; F341-I479 HydrophobicContact CG-CG2 4.18Å; F341-I479 HydrophobicContact CZ-CG2 4.4Å; V466-I479 HydrophobicContact CB-CD1 4.03Å; V466-I479 HydrophobicContact CB-CG1 4.27Å; V466-I479 HydrophobicContact CG1-CG1 4.38Å; V466-I479 HydrophobicContact CG2-CD1 4.03Å; V466-I479 HydrophobicContact CG2-CG1 3.96Å; T475-I479 HydrophobicContact CG2-CD1 4.15Å; T475-I479 WeakPolarHBondContact O-CG1 3.4Å; T475-I479 PolarHBondContact O-N 3.3Å; T475-I479 VanDerWaalsContact O-N 3.1Å; G476-I479 PolarHBondContact O-N 2.97Å; I479-T482 PolarHBondContact O-N 3.2Å; I479-I483 HydrophobicContact CG2-CD1 3.72Å; I479-I483 HydrophobicContact CG2-CG1 4.29Å; I479-I483 WeakPolarHBondContact O-CG1 3.45Å; I479-I483 PolarHBondContact O-N 3.43Å; I479-L503 HydrophobicContact CB-CD2 4.37Å; I479-L503 HydrophobicContact CG2-CD2 3.6Å; I479-M510 HydrophobicContact CD1-CE 4.1Å
480	A	98.6	Very high	97.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-62.8	-43.1	177.1	0	0	0	0	0	112.5	G476 C477 F478 G484 I499 L503 I511 V520	G476-A480 WeakPolarHBondContact O-CB 3.46Å; G476-A480 PolarHBondContact O-N 3.12Å; C477-A480 PolarHBondContact O-N 2.78Å; F478-A480 PolarHBondContact O-N 2.84Å; A480-G484 PolarHBondContact O-N 2.96Å; A480-I499 HydrophobicContact CB-CG2 3.92Å; A480-L503 HydrophobicContact CB-CD1 3.68Å; A480-I511 HydrophobicContact CB-CD1 3.86Å; A480-V520 HydrophobicContact CB-CG1 4.05Å; A480-V520 HydrophobicContact CB-CG2 4.28Å
481	T	98.5	Very high	97.1	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.006	10%	0.095	C	C	.	.	H	α-helix	trans	-62.8	-45.3	173.3	-63.4	0	0	0	0	110.8	L445 C477 F478 I483 G484 C485 A523	L445-T481 HydrophobicContact CD2-CG2 3.77Å; C477-T481 WeakPolarHBondContact O-CB 3.46Å; C477-T481 PolarHBondContact O-N 2.96Å; C477-T481 PolarHBondContact O-OG1 3.13Å; C477-T481 VanDerWaalsContact O-OG1 3.08Å; F478-T481 PolarHBondContact O-N 2.99Å; T481-I483 PolarHBondContact O-N 3.41Å; T481-G484 PolarHBondContact O-N 3.32Å; T481-C485 VanDerWaalsContact O-CB 3.26Å; T481-C485 WeakPolarHBondContact O-CB 3.5Å; T481-C485 PolarHBondContact O-N 2.92Å; T481-C485 PolarHBondContact O-SG 3.39Å; T481-A523 HydrophobicContact CG2-CB 4.05Å
482	T	98	Very high	97	Very high	9 Å²	9	21.3 Å²	21.3	6%	0.055	11%	0.105	C	C	.	.	H	α-helix	trans	-59.2	-47.1	177.8	-53.4	0	0	0	0	112.1	F341 M448 E452 F478 I479 R486	F341-T482 HydrophobicContact CE1-CG2 4.42Å; F341-T482 HydrophobicContact CZ-CG2 3.93Å; M448-T482 HydrophobicContact CG-CG2 4.03Å; M448-T482 WeakPolarHBondContact CG-OG1 3.37Å; E452-T482 HydrophobicContact CG-CG2 3.84Å; F478-T482 PolarHBondContact O-N 3.07Å; F478-T482 PolarHBondContact O-OG1 3.07Å; I479-T482 PolarHBondContact O-N 3.2Å; T482-R486 PolarHBondContact O-N 3.28Å
483	I	98.1	Very high	96.9	Very high	16 Å²	16	23 Å²	23	8%	0.082	12%	0.116	C	C	.	.	H	α-helix	trans	-64.7	-47	177.8	-67.6	172.6	0	0	0	110.7	F341 I479 T481 R486 Q487 I499 L503	F341-I483 HydrophobicContact CE2-CD1 4.45Å; F341-I483 HydrophobicContact CE2-CG1 4.29Å; I479-I483 HydrophobicContact CG2-CD1 3.72Å; I479-I483 HydrophobicContact CG2-CG1 4.29Å; I479-I483 WeakPolarHBondContact O-CG1 3.45Å; I479-I483 PolarHBondContact O-N 3.43Å; T481-I483 PolarHBondContact O-N 3.41Å; I483-R486 PolarHBondContact O-N 3.16Å; I483-Q487 PolarHBondContact O-N 2.91Å; I483-I499 HydrophobicContact CB-CG2 4.31Å; I483-I499 HydrophobicContact CG2-CD1 3.82Å; I483-I499 HydrophobicContact CG2-CG1 3.77Å; I483-I499 HydrophobicContact CG2-CG2 4.17Å; I483-L503 HydrophobicContact CD1-CD2 4.22Å
484	G	98.1	Very high	97	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-67.1	-37.8	-178.9	0	0	0	0	0	113.6	A480 T481 R486 Q487 L488	A480-G484 PolarHBondContact O-N 2.96Å; T481-G484 PolarHBondContact O-N 3.32Å; G484-R486 VanDerWaalsContact C-N 3.27Å; G484-R486 PolarHBondContact O-N 2.93Å; G484-Q487 PolarHBondContact O-N 2.98Å; G484-L488 WeakPolarHBondContact O-CG 3.31Å; G484-L488 PolarHBondContact O-N 3.01Å
485	C	97.3	Very high	97	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.7	-39.7	172	-73.4	0	0	0	0	110.8	M448 T481 L488 Q489 L524 Y527	M448-C485 HydrophobicContact CE-CB 4.44Å; M448-C485 HydrophobicContact SD-CB 3.58Å; M448-C485 VanDerWaalsContact SD-CB 3.58Å; M448-C485 VanDerWaalsContact SD-SG 3.61Å; T481-C485 VanDerWaalsContact O-CB 3.26Å; T481-C485 WeakPolarHBondContact O-CB 3.5Å; T481-C485 PolarHBondContact O-N 2.92Å; T481-C485 PolarHBondContact O-SG 3.39Å; C485-L488 PolarHBondContact O-N 3.12Å; C485-Q489 WeakPolarHBondContact O-CG 3.34Å; C485-Q489 PolarHBondContact O-N 3.16Å; C485-Q489 VanDerWaalsContact O-N 3.1Å; C485-L524 VanDerWaalsContact N-CD2 3.27Å; C485-Y527 HydrophobicContact CB-CD1 3.66Å; C485-Y527 HydrophobicContact CB-CE1 3.71Å; C485-Y527 HydrophobicContact CB-CG 4.24Å; C485-Y527 WeakPolarHBondContact O-CE1 3.33Å; C485-Y527 WeakPolarHBondContact SG-CD1 3.28Å
486	R	95.3	Very high	97	Very high	115 Å²	115	22.8 Å²	22.8	43%	0.434	12%	0.116	S	C	.	.	H	α-helix	trans	-69.7	-35.7	176.1	-170.8	59.2	176.1	163	3.4	112.5	Y334 T482 I483 G484 Q489 V490	Y334-R486 HydrophobicContact CD1-CB 4.11Å; Y334-R486 HydrophobicContact CD1-CG 3.43Å; Y334-R486 VanDerWaalsContact CD1-CG 3.43Å; Y334-R486 HydrophobicContact CE1-CG 3.92Å; Y334-R486 HydrophobicContact CG-CG 4.28Å; T482-R486 PolarHBondContact O-N 3.28Å; I483-R486 PolarHBondContact O-N 3.16Å; G484-R486 VanDerWaalsContact C-N 3.27Å; G484-R486 PolarHBondContact O-N 2.93Å; R486-Q489 PolarHBondContact O-N 3.36Å; R486-V490 WeakPolarHBondContact O-CG2 3.39Å; R486-V490 PolarHBondContact O-N 3.11Å
487	Q	96.5	Very high	97	Very high	20 Å²	20	23.5 Å²	23.5	9%	0.093	12%	0.12	C	C	.	.	H	α-helix	trans	-64.8	-43.7	172.9	-160.9	179.4	7.4	0	0	111.5	Y334 I483 G484 Q489 V490 E491 G492 V493 V494	Y334-Q487 HydrophobicContact CD2-CB 4.47Å; Y334-Q487 HydrophobicContact CE2-CB 3.95Å; Y334-Q487 HydrophobicContact CE2-CG 3.77Å; I483-Q487 PolarHBondContact O-N 2.91Å; G484-Q487 PolarHBondContact O-N 2.98Å; Q487-Q489 VanDerWaalsContact C-N 3.3Å; Q487-Q489 PolarHBondContact O-N 3.35Å; Q487-V490 PolarHBondContact O-N 3.15Å; Q487-V490 VanDerWaalsContact O-N 3.13Å; Q487-E491 HydrophobicContact CG-CB 4.41Å; Q487-E491 HydrophobicContact CG-CG 4.41Å; Q487-E491 WeakPolarHBondContact CG-OE2 3.27Å; Q487-E491 PolarHBondContact NE2-OE2 2.78Å; Q487-E491 PolarHBondContact O-N 2.71Å; Q487-G492 PolarHBondContact O-N 3.03Å; Q487-V493 CarbonylContact C-O 3.32Å; Q487-V493 VanDerWaalsContact C-O 3.32Å; Q487-V493 WeakPolarHBondContact CG-O 3.15Å; Q487-V494 HydrophobicContact CB-CG2 4.47Å
488	L	96	Very high	97	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.3	-34	175.4	-73.3	169.7	0	0	0	113.6	L262 G484 C485 G492 V493 V494 L524 Y527 E528 L531	L262-L488 HydrophobicContact CD2-CD1 4.05Å; L262-L488 HydrophobicContact CD2-CD2 4.14Å; G484-L488 WeakPolarHBondContact O-CG 3.31Å; G484-L488 PolarHBondContact O-N 3.01Å; C485-L488 PolarHBondContact O-N 3.12Å; L488-G492 WeakPolarHBondContact O-CA 3.29Å; L488-G492 PolarHBondContact O-N 2.71Å; L488-V493 PolarHBondContact N-O 2.83Å; L488-V494 HydrophobicContact CD2-CB 3.98Å; L488-V494 HydrophobicContact CD2-CG1 4Å; L488-V494 HydrophobicContact CG-CB 3.98Å; L488-V494 HydrophobicContact CG-CG1 4.29Å; L488-L524 HydrophobicContact CD1-CB 4.14Å; L488-L524 HydrophobicContact CD1-CD2 4Å; L488-Y527 HydrophobicContact CD1-CD1 4.18Å; L488-E528 HydrophobicContact CD1-CB 4.26Å; L488-L531 HydrophobicContact CB-CD1 4.42Å
489	Q	93.6	Very high	97	Very high	75 Å²	75	26.4 Å²	26.4	35%	0.35	14%	0.136	S	C	.	.	H	α-helix	trans	-67.7	-39.7	173.6	-73.9	168.7	13.2	0	0	112.6	C485 R486 Q487 Y527 L531	C485-Q489 WeakPolarHBondContact O-CG 3.34Å; C485-Q489 PolarHBondContact O-N 3.16Å; C485-Q489 VanDerWaalsContact O-N 3.1Å; R486-Q489 PolarHBondContact O-N 3.36Å; Q487-Q489 VanDerWaalsContact C-N 3.3Å; Q487-Q489 PolarHBondContact O-N 3.35Å; Q489-Y527 HydrophobicContact CG-CE1 4.17Å; Q489-Y527 WeakPolarHBondContact CG-OH 3.28Å; Q489-Y527 PolarHBondContact NE2-OH 3.35Å; Q489-L531 HydrophobicContact CG-CD1 4.23Å
490	V	93.4	Very high	97	Very high	74 Å²	74	26.4 Å²	26.4	45%	0.448	14%	0.136	S	C	.	.	H	α-helix	trans	-98.3	-43.2	-166.2	174.4	0	0	0	0	112.9	Y334 L335 R486 Q487	Y334-V490 HydrophobicContact CE1-CB 4.03Å; Y334-V490 HydrophobicContact CE1-CG1 4.28Å; Y334-V490 HydrophobicContact CE1-CG2 4.11Å; L335-V490 HydrophobicContact CD1-CG1 4.46Å; R486-V490 WeakPolarHBondContact O-CG2 3.39Å; R486-V490 PolarHBondContact O-N 3.11Å; Q487-V490 PolarHBondContact O-N 3.15Å; Q487-V490 VanDerWaalsContact O-N 3.13Å
491	E	94.9	Very high	97	Very high	93 Å²	93	26.4 Å²	26.4	44%	0.435	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-16.4	-177.8	-65.9	165.4	-151.6	0	0	113	Y334 Q487 V493	Y334-E491 WeakPolarHBondContact CE2-OE1 3.33Å; Y334-E491 WeakPolarHBondContact OH-CG 3.37Å; Y334-E491 PolarHBondContact OH-OE1 3.13Å; Q487-E491 HydrophobicContact CG-CB 4.41Å; Q487-E491 HydrophobicContact CG-CG 4.41Å; Q487-E491 WeakPolarHBondContact CG-OE2 3.27Å; Q487-E491 PolarHBondContact NE2-OE2 2.78Å; Q487-E491 PolarHBondContact O-N 2.71Å; E491-V493 HydrophobicContact CB-CG2 3.81Å; E491-V493 PolarHBondContact O-N 3.45Å; E491-V493 WeakPolarHBondContact OE2-CG2 3.47Å
492	G	94.5	Very high	96.9	Very high	22 Å²	22	28 Å²	28	23%	0.227	14%	0.143	C	C	.	.	S	Bend	trans	72.2	3.4	-172.6	0	0	0	0	0	114.8	R259 Q487 L488	R259-G492 WeakPolarHBondContact CG-O 3.39Å; Q487-G492 PolarHBondContact O-N 3.03Å; L488-G492 WeakPolarHBondContact O-CA 3.29Å; L488-G492 PolarHBondContact O-N 2.71Å
493	V	96.8	Very high	96.9	Very high	37 Å²	37	27.8 Å²	27.8	22%	0.224	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	171.9	174.4	-58.2	0	0	0	0	110.5	L257 T258 Q487 L488 E491	L257-V493 CarbonylContact O-C 3.51Å; L257-V493 WeakPolarHBondContact O-CA 3.47Å; L257-V493 VanDerWaalsContact O-CB 3.29Å; L257-V493 WeakPolarHBondContact O-CB 3.39Å; T258-V493 HydrophobicContact CG2-CG1 4.45Å; Q487-V493 CarbonylContact C-O 3.32Å; Q487-V493 VanDerWaalsContact C-O 3.32Å; Q487-V493 WeakPolarHBondContact CG-O 3.15Å; L488-V493 PolarHBondContact N-O 2.83Å; E491-V493 HydrophobicContact CB-CG2 3.81Å; E491-V493 PolarHBondContact O-N 3.45Å; E491-V493 WeakPolarHBondContact OE2-CG2 3.47Å
494	V	98.1	Very high	97	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	138.1	169.6	65.8	0	0	0	0	112.5	L257 L262 Q487 L488 V496 I499 L524	L257-V494 HydrophobicContact CB-CG1 4.48Å; L257-V494 WeakPolarHBondContact CB-O 3.45Å; L257-V494 PolarHBondContact N-O 2.84Å; L257-V494 PolarHBondContact O-N 2.96Å; L262-V494 HydrophobicContact CD1-CG1 4.19Å; L262-V494 HydrophobicContact CD2-CG1 3.95Å; Q487-V494 HydrophobicContact CB-CG2 4.47Å; L488-V494 HydrophobicContact CD2-CB 3.98Å; L488-V494 HydrophobicContact CD2-CG1 4Å; L488-V494 HydrophobicContact CG-CB 3.98Å; L488-V494 HydrophobicContact CG-CG1 4.29Å; V494-V496 HydrophobicContact CG1-CG2 4.16Å; V494-V496 HydrophobicContact CG2-CG2 4.06Å; V494-I499 HydrophobicContact CG2-CD1 3.93Å; V494-L524 HydrophobicContact CG2-CD1 4.04Å
495	D	97.9	Very high	96.9	Very high	15 Å²	15	27.7 Å²	27.7	8%	0.08	14%	0.143	C	C	.	.			trans	-112.9	79.7	176.5	-166.2	-21.9	0	0	0	111.2	G254 R255 P256 L497 N498 I499	G254-D495 WeakPolarHBondContact CA-OD2 3.41Å; R255-D495 PolarHBondContact N-OD1 2.74Å; R255-D495 PolarHBondContact N-OD2 3.44Å; P256-D495 VanDerWaalsContact CD-OD2 3.29Å; P256-D495 WeakPolarHBondContact CD-OD2 3.39Å; P256-D495 HydrophobicContact CG-CB 4.34Å; D495-L497 PolarHBondContact O-N 3.5Å; D495-L497 PolarHBondContact OD1-N 2.67Å; D495-N498 HydrophobicContact CB-CB 4Å; D495-N498 PolarHBondContact O-N 3.2Å; D495-N498 WeakPolarHBondContact OD1-CB 3.34Å; D495-N498 PolarHBondContact OD1-N 2.87Å; D495-N498 WeakPolarHBondContact OD2-CB 3.3Å; D495-I499 WeakPolarHBondContact O-CB 3.49Å; D495-I499 WeakPolarHBondContact O-CD1 3.38Å; D495-I499 WeakPolarHBondContact O-CG1 3.48Å; D495-I499 PolarHBondContact O-N 2.92Å
496	V	98.3	Very high	96.9	Very high	1 Å²	1	28 Å²	28	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-64.1	-28.6	-177.2	-165.7	0	0	0	0	112	V494 T500 Y517 V520 H521 L524	V494-V496 HydrophobicContact CG1-CG2 4.16Å; V494-V496 HydrophobicContact CG2-CG2 4.06Å; V496-T500 VanDerWaalsContact O-CB 3.28Å; V496-T500 WeakPolarHBondContact O-CB 3.1Å; V496-T500 PolarHBondContact O-N 2.91Å; V496-T500 PolarHBondContact O-OG1 2.81Å; V496-Y517 HydrophobicContact CG1-CD2 4.41Å; V496-Y517 HydrophobicContact CG1-CE2 3.92Å; V496-V520 HydrophobicContact CG1-CG1 3.73Å; V496-H521 VanDerWaalsContact CB-CE1 3.49Å; V496-H521 WeakPolarHBondContact CB-CE1 3.38Å; V496-H521 VanDerWaalsContact CG1-CE1 3.45Å; V496-H521 WeakPolarHBondContact CG1-CE1 3.49Å; V496-L524 HydrophobicContact CG2-CD1 3.52Å
497	L	98.4	Very high	97	Very high	15 Å²	15	22.6 Å²	22.6	8%	0.079	12%	0.124	C	C	.	.	H	α-helix	trans	-66.7	-52.3	174.6	175.1	57.5	0	0	0	110.5	A253 R255 E275 I279 D495 T500 C501 Y517	A253-L497 HydrophobicContact CB-CD2 4.4Å; A253-L497 HydrophobicContact CB-CG 4.32Å; R255-L497 HydrophobicContact CB-CB 4.26Å; R255-L497 HydrophobicContact CB-CD2 3.93Å; E275-L497 HydrophobicContact CG-CD1 4.21Å; E275-L497 HydrophobicContact CG-CD2 4.38Å; I279-L497 HydrophobicContact CD1-CD1 3.61Å; I279-L497 HydrophobicContact CG1-CD1 3.71Å; D495-L497 PolarHBondContact O-N 3.5Å; D495-L497 PolarHBondContact OD1-N 2.67Å; L497-T500 PolarHBondContact O-N 3.38Å; L497-C501 WeakPolarHBondContact O-CB 3.44Å; L497-C501 PolarHBondContact O-N 2.96Å; L497-C501 PolarHBondContact O-SG 3.07Å; L497-Y517 WeakPolarHBondContact CA-OH 3.49Å
498	N	97.8	Very high	97.1	Very high	51 Å²	51	21.7 Å²	21.7	27%	0.273	12%	0.121	S	C	.	.	H	α-helix	trans	-63.4	-44.8	178.2	-171.3	-96.9	0	0	0	111.5	A253 D495 T500 C501 Q502	A253-N498 WeakPolarHBondContact O-CA 3.5Å; A253-N498 WeakPolarHBondContact O-CB 3.42Å; A253-N498 PolarHBondContact O-ND2 2.7Å; D495-N498 HydrophobicContact CB-CB 4Å; D495-N498 PolarHBondContact O-N 3.2Å; D495-N498 WeakPolarHBondContact OD1-CB 3.34Å; D495-N498 PolarHBondContact OD1-N 2.87Å; D495-N498 WeakPolarHBondContact OD2-CB 3.3Å; N498-T500 VanDerWaalsContact C-N 3.32Å; N498-T500 PolarHBondContact O-N 2.88Å; N498-C501 CarbonylContact O-C 3.58Å; N498-C501 WeakPolarHBondContact O-CA 3.48Å; N498-C501 WeakPolarHBondContact O-CB 3.46Å; N498-C501 PolarHBondContact O-N 3.36Å; N498-C501 VanDerWaalsContact O-N 3.07Å; N498-Q502 WeakPolarHBondContact O-CG 3.44Å; N498-Q502 PolarHBondContact O-N 2.74Å
499	I	98.4	Very high	97.2	Very high	11 Å²	11	21.7 Å²	21.7	6%	0.056	12%	0.121	C	C	.	.	H	α-helix	trans	-53.7	-50.4	175	-68.6	165.5	0	0	0	110	A480 I483 V494 D495 C501 Q502 L503	A480-I499 HydrophobicContact CB-CG2 3.92Å; I483-I499 HydrophobicContact CB-CG2 4.31Å; I483-I499 HydrophobicContact CG2-CD1 3.82Å; I483-I499 HydrophobicContact CG2-CG1 3.77Å; I483-I499 HydrophobicContact CG2-CG2 4.17Å; V494-I499 HydrophobicContact CG2-CD1 3.93Å; D495-I499 WeakPolarHBondContact O-CB 3.49Å; D495-I499 WeakPolarHBondContact O-CD1 3.38Å; D495-I499 WeakPolarHBondContact O-CG1 3.48Å; D495-I499 PolarHBondContact O-N 2.92Å; I499-C501 VanDerWaalsContact C-N 3.3Å; I499-C501 PolarHBondContact O-N 3.16Å; I499-Q502 PolarHBondContact O-N 2.87Å; I499-L503 HydrophobicContact CG2-CD1 4.01Å; I499-L503 HydrophobicContact CG2-CG 4.38Å; I499-L503 WeakPolarHBondContact O-CB 3.43Å; I499-L503 VanDerWaalsContact O-CG 3.24Å; I499-L503 WeakPolarHBondContact O-CG 3.29Å; I499-L503 PolarHBondContact O-N 2.79Å
500	T	98.6	Very high	97.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-36.3	179.1	-56.9	0	0	0	0	112	I279 V496 L497 N498 R504 I511 Y517	I279-T500 HydrophobicContact CD1-CG2 3.87Å; V496-T500 VanDerWaalsContact O-CB 3.28Å; V496-T500 WeakPolarHBondContact O-CB 3.1Å; V496-T500 PolarHBondContact O-N 2.91Å; V496-T500 PolarHBondContact O-OG1 2.81Å; L497-T500 PolarHBondContact O-N 3.38Å; N498-T500 VanDerWaalsContact C-N 3.32Å; N498-T500 PolarHBondContact O-N 2.88Å; T500-R504 WeakPolarHBondContact O-CB 3.48Å; T500-R504 WeakPolarHBondContact O-CG 3.4Å; T500-R504 PolarHBondContact O-N 3.05Å; T500-I511 HydrophobicContact CG2-CB 4.42Å; T500-I511 HydrophobicContact CG2-CD1 4.13Å; T500-Y517 HydrophobicContact CG2-CD2 4.35Å; T500-Y517 HydrophobicContact CG2-CE2 4.3Å; T500-Y517 WeakPolarHBondContact OG1-CE2 3.21Å
501	C	98.1	Very high	97.7	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-65.8	-45.2	174.8	-69.6	0	0	0	0	112.6	L250 L497 N498 I499 R504 A505	L250-C501 HydrophobicContact CD2-CB 3.99Å; L250-C501 WeakPolarHBondContact O-CB 3.39Å; L497-C501 WeakPolarHBondContact O-CB 3.44Å; L497-C501 PolarHBondContact O-N 2.96Å; L497-C501 PolarHBondContact O-SG 3.07Å; N498-C501 CarbonylContact O-C 3.58Å; N498-C501 WeakPolarHBondContact O-CA 3.48Å; N498-C501 WeakPolarHBondContact O-CB 3.46Å; N498-C501 PolarHBondContact O-N 3.36Å; N498-C501 VanDerWaalsContact O-N 3.07Å; I499-C501 VanDerWaalsContact C-N 3.3Å; I499-C501 PolarHBondContact O-N 3.16Å; C501-R504 PolarHBondContact O-N 2.92Å; C501-A505 PolarHBondContact O-N 3.24Å
502	Q	97.4	Very high	97.7	Very high	35 Å²	35	13.7 Å²	13.7	16%	0.164	8%	0.079	C	C	.	.	H	α-helix	trans	-64.2	-43.4	175.8	-60.8	-46.6	-46.3	0	0	111.8	L250 R332 N498 I499 R504 A505 D506	L250-Q502 PolarHBondContact O-NE2 2.9Å; R332-Q502 VanDerWaalsContact CZ-OE1 3.27Å; R332-Q502 PolarHBondContact NH2-O 3.04Å; N498-Q502 WeakPolarHBondContact O-CG 3.44Å; N498-Q502 PolarHBondContact O-N 2.74Å; I499-Q502 PolarHBondContact O-N 2.87Å; Q502-R504 VanDerWaalsContact C-N 3.28Å; Q502-R504 PolarHBondContact O-N 2.85Å; Q502-A505 WeakPolarHBondContact O-CB 3.3Å; Q502-A505 PolarHBondContact O-N 2.82Å; Q502-D506 PolarHBondContact O-N 3.18Å
503	L	98.4	Very high	97.8	Very high	3 Å²	3	15 Å²	15	2%	0.016	8%	0.082	C	C	.	.	H	α-helix	trans	-60.1	-38.2	175.7	-67.9	178.1	0	0	0	112.2	I331 I479 A480 I483 I499 D506 R507 M510	I331-L503 HydrophobicContact CG2-CD2 3.29Å; I479-L503 HydrophobicContact CB-CD2 4.37Å; I479-L503 HydrophobicContact CG2-CD2 3.6Å; A480-L503 HydrophobicContact CB-CD1 3.68Å; I483-L503 HydrophobicContact CD1-CD2 4.22Å; I499-L503 HydrophobicContact CG2-CD1 4.01Å; I499-L503 HydrophobicContact CG2-CG 4.38Å; I499-L503 WeakPolarHBondContact O-CB 3.43Å; I499-L503 VanDerWaalsContact O-CG 3.24Å; I499-L503 WeakPolarHBondContact O-CG 3.29Å; I499-L503 PolarHBondContact O-N 2.79Å; L503-D506 PolarHBondContact O-N 3.17Å; L503-R507 PolarHBondContact O-N 3.35Å; L503-M510 HydrophobicContact CB-CB 3.88Å; L503-M510 HydrophobicContact CB-CE 4.22Å; L503-M510 HydrophobicContact CB-CG 4.35Å; L503-M510 HydrophobicContact CD1-CE 4.45Å; L503-M510 HydrophobicContact CD2-CE 4Å; L503-M510 HydrophobicContact CG-CE 4.45Å; L503-M510 WeakPolarHBondContact O-CG 3.38Å
504	R	98.3	Very high	97.7	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-76.6	-31	176.4	-74.7	-170.5	-177.7	177.1	3.9	113.8	L250 I279 P280 M281 N282 T500 C501 Q502 D506 R507 M510 I511	L250-R504 HydrophobicContact CD2-CB 3.99Å; I279-R504 PolarHBondContact O-NH1 3.27Å; P280-R504 WeakPolarHBondContact O-CD 3.13Å; P280-R504 PolarHBondContact O-NH1 3.48Å; M281-R504 PolarHBondContact SD-NH1 2.93Å; M281-R504 VanDerWaalsContact SD-NH1 3.44Å; N282-R504 VanDerWaalsContact CB-O 3.32Å; N282-R504 WeakPolarHBondContact CB-O 3.42Å; N282-R504 PolarHBondContact ND2-O 2.89Å; T500-R504 WeakPolarHBondContact O-CB 3.48Å; T500-R504 WeakPolarHBondContact O-CG 3.4Å; T500-R504 PolarHBondContact O-N 3.05Å; C501-R504 PolarHBondContact O-N 2.92Å; Q502-R504 VanDerWaalsContact C-N 3.28Å; Q502-R504 PolarHBondContact O-N 2.85Å; R504-D506 VanDerWaalsContact C-N 3.29Å; R504-R507 WeakPolarHBondContact CA-O 3.45Å; R504-R507 CarbonylContact O-C 3.5Å; R504-M510 HydrophobicContact CG-CB 4.09Å; R504-M510 WeakPolarHBondContact CG-O 3.42Å; R504-M510 PolarHBondContact NE-O 3.33Å; R504-I511 PolarHBondContact NH2-O 3.25Å
505	A	96.4	Very high	97.6	Very high	14 Å²	14	18.4 Å²	18.4	12%	0.116	10%	0.098	C	C	.	.	H	α-helix	trans	-58.4	-46.2	168.6	0	0	0	0	0	110.1	N282 H308 C501 Q502	N282-A505 PolarHBondContact ND2-O 3.26Å; H308-A505 PolarHBondContact CE1-O 3.2Å; H308-A505 PolarHBondContact NE2-O 3.19Å; C501-A505 PolarHBondContact O-N 3.24Å; Q502-A505 WeakPolarHBondContact O-CB 3.3Å; Q502-A505 PolarHBondContact O-N 2.82Å
506	D	97.6	Very high	97.5	Very high	8 Å²	8	18.8 Å²	18.8	4%	0.043	10%	0.1	C	C	.	.	H	α-helix	trans	-72.4	-40	-179	-64.7	-4	0	0	0	113.2	S309 I331 R332 Q502 L503 R504	S309-D506 WeakPolarHBondContact CB-O 3.43Å; S309-D506 PolarHBondContact OG-O 2.86Å; I331-D506 HydrophobicContact CD1-CB 3.65Å; R332-D506 WeakPolarHBondContact CB-OD2 3.26Å; R332-D506 WeakPolarHBondContact CG-OD2 3.49Å; R332-D506 IonicContact CZ-OD1 3.17Å; R332-D506 IonicContact CZ-OD2 3.95Å; R332-D506 PolarHBondContact N-OD2 3.28Å; R332-D506 IonicContact NE-OD1 2.78Å; R332-D506 PolarHBondContact NE-OD1 2.96Å; R332-D506 IonicContact NE-OD2 3.23Å; R332-D506 PolarHBondContact NE-OD2 3.29Å; R332-D506 IonicContact NH2-OD1 2.72Å; R332-D506 PolarHBondContact NH2-OD1 2.78Å; R332-D506 IonicContact NH2-OD2 3.88Å; Q502-D506 PolarHBondContact O-N 3.18Å; L503-D506 PolarHBondContact O-N 3.17Å; R504-D506 VanDerWaalsContact C-N 3.29Å
507	R	98.4	Very high	97.5	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.099	C	C	.	.	S	Bend	trans	-146.7	121.7	175.8	-175.5	172.2	170.3	81.2	-0.5	112.4	N306 N327 N329 I331 A470 G471 I472 L503 R504 G509 M510	N306-R507 WeakPolarHBondContact OD1-CA 3.21Å; N327-R507 PolarHBondContact OD1-NH1 3.46Å; N327-R507 PolarHBondContact OD1-NH2 3.38Å; N329-R507 HydrophobicContact CB-CB 4.04Å; N329-R507 HydrophobicContact CB-CG 4.35Å; N329-R507 WeakPolarHBondContact OD1-CD 3.34Å; N329-R507 WeakPolarHBondContact OD1-CG 3.25Å; N329-R507 PolarHBondContact OD1-NH1 3.48Å; I331-R507 HydrophobicContact CD1-CB 3.74Å; A470-R507 PolarHBondContact O-NH2 3.46Å; G471-R507 PolarHBondContact O-NE 3.44Å; I472-R507 HydrophobicContact CG2-CG 3.93Å; I472-R507 VanDerWaalsContact CG2-NE 3.33Å; L503-R507 PolarHBondContact O-N 3.35Å; R504-R507 WeakPolarHBondContact CA-O 3.45Å; R504-R507 CarbonylContact O-C 3.5Å; R507-G509 PolarHBondContact O-N 3.01Å; R507-M510 HydrophobicContact CB-CG 3.9Å; R507-M510 HydrophobicContact CG-CG 4.36Å; R507-M510 WeakPolarHBondContact O-CG 3.42Å; R507-M510 PolarHBondContact O-N 3.49Å
508	G	98.1	Very high	97.4	Very high	2 Å²	2	19.8 Å²	19.8	2%	0.021	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	128.4	-177.3	0	0	0	0	0	113.7	M281 N282 F283 N306 I472	M281-G508 CarbonylContact O-C 3.47Å; M281-G508 VanDerWaalsContact O-CA 3.3Å; M281-G508 WeakPolarHBondContact O-CA 3.2Å; N282-G508 VanDerWaalsContact O-CA 3.24Å; N282-G508 WeakPolarHBondContact O-CA 3.34Å; F283-G508 WeakPolarHBondContact CE1-O 3.42Å; N306-G508 PolarHBondContact OD1-N 3.26Å; I472-G508 WeakPolarHBondContact CG2-O 2.87Å
509	G	97.7	Very high	97.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	13	175	0	0	0	0	0	115.9	M281 R507 I511 Q512	M281-G509 PolarHBondContact O-N 3.5Å; R507-G509 PolarHBondContact O-N 3.01Å; G509-I511 CarbonylContact O-C 3.59Å; G509-I511 PolarHBondContact O-N 3.33Å; G509-Q512 WeakPolarHBondContact O-CG 3.47Å
510	M	98.6	Very high	97.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	-52.8	128.6	168.7	-73.2	-78.3	-85.2	0	0	110.7	I331 A343 I472 T475 I479 L503 R504 R507	I331-M510 HydrophobicContact CD1-CE 4.19Å; I331-M510 HydrophobicContact CG1-CE 4.38Å; A343-M510 HydrophobicContact CB-CE 4.19Å; A343-M510 HydrophobicContact CB-SD 4.19Å; I472-M510 HydrophobicContact CB-SD 4.39Å; I472-M510 HydrophobicContact CG2-CG 4.48Å; I472-M510 HydrophobicContact CG2-SD 4.36Å; I472-M510 WeakPolarHBondContact O-CA 3.45Å; T475-M510 HydrophobicContact CG2-CE 4.39Å; T475-M510 HydrophobicContact CG2-SD 4.25Å; I479-M510 HydrophobicContact CD1-CE 4.1Å; L503-M510 HydrophobicContact CB-CB 3.88Å; L503-M510 HydrophobicContact CB-CE 4.22Å; L503-M510 HydrophobicContact CB-CG 4.35Å; L503-M510 HydrophobicContact CD1-CE 4.45Å; L503-M510 HydrophobicContact CD2-CE 4Å; L503-M510 HydrophobicContact CG-CE 4.45Å; L503-M510 WeakPolarHBondContact O-CG 3.38Å; R504-M510 HydrophobicContact CG-CB 4.09Å; R504-M510 WeakPolarHBondContact CG-O 3.42Å; R504-M510 PolarHBondContact NE-O 3.33Å; R507-M510 HydrophobicContact CB-CG 3.9Å; R507-M510 HydrophobicContact CG-CG 4.36Å; R507-M510 WeakPolarHBondContact O-CG 3.42Å; R507-M510 PolarHBondContact O-N 3.49Å
511	I	98.1	Very high	97.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	57.2	106.2	-161.6	-51	-177.2	0	0	0	111.2	F276 I472 A480 T500 R504 G509 Q516 Y517 V520	F276-I511 HydrophobicContact CE2-CB 4.29Å; F276-I511 HydrophobicContact CE2-CG2 3.73Å; F276-I511 HydrophobicContact CZ-CG2 4.38Å; F276-I511 WeakPolarHBondContact CZ-O 3.48Å; I472-I511 PolarHBondContact O-N 2.87Å; A480-I511 HydrophobicContact CB-CD1 3.86Å; T500-I511 HydrophobicContact CG2-CB 4.42Å; T500-I511 HydrophobicContact CG2-CD1 4.13Å; R504-I511 PolarHBondContact NH2-O 3.25Å; G509-I511 CarbonylContact O-C 3.59Å; G509-I511 PolarHBondContact O-N 3.33Å; I511-Q516 HydrophobicContact CG2-CB 3.76Å; I511-Y517 HydrophobicContact CD1-CD2 4.45Å; I511-V520 HydrophobicContact CD1-CG2 4.14Å
512	Q	95.8	Very high	97.3	Very high	74 Å²	74	20.7 Å²	20.7	35%	0.346	11%	0.106	S	C	.	.			trans	-93.6	-21.1	-166.3	-71.5	-178.2	-86.7	0	0	115.4	I472 G473 G509	I472-Q512 HydrophobicContact CD1-CG 3.79Å; I472-Q512 HydrophobicContact CG1-CG 3.84Å; G473-Q512 VanDerWaalsContact CA-OE1 3.27Å; G509-Q512 WeakPolarHBondContact O-CG 3.47Å
513	T	96.1	Very high	97.3	Very high	50 Å²	50	19 Å²	19	31%	0.307	10%	0.098	S	C	.	.	S	Bend	trans	-140.6	160.6	-173.4	80.4	0	0	0	0	112.4	F276 E515 Q516 Y517	F276-T513 VanDerWaalsContact CZ-C 3.45Å; F276-T513 WeakPolarHBondContact CZ-O 3.4Å; T513-E515 VanDerWaalsContact C-N 3.3Å; T513-E515 WeakPolarHBondContact CB-OE2 3.39Å; T513-E515 PolarHBondContact O-N 3.13Å; T513-E515 PolarHBondContact OG1-OE2 2.89Å; T513-Q516 WeakPolarHBondContact O-CB 3.26Å; T513-Q516 PolarHBondContact O-N 3.13Å; T513-Q516 VanDerWaalsContact O-N 3.13Å; T513-Q516 WeakPolarHBondContact OG1-CG 3.42Å; T513-Q516 PolarHBondContact OG1-N 3.41Å; T513-Y517 PolarHBondContact O-N 2.84Å; T513-Y517 VanDerWaalsContact O-N 3.14Å
514	G	95.9	Very high	97.2	Very high	10 Å²	10	18.9 Å²	18.9	10%	0.103	10%	0.097	C	C	.	.	H	α-helix	trans	-62	-38.1	-179.9	0	0	0	0	0	112.4	Q516 Y517 E518	G514-Q516 VanDerWaalsContact C-N 3.31Å; G514-Q516 PolarHBondContact O-N 3.48Å; G514-Y517 PolarHBondContact O-N 3.26Å; G514-E518 WeakPolarHBondContact O-CB 3.4Å; G514-E518 PolarHBondContact O-N 3.45Å
515	E	95.5	Very high	97.2	Very high	98 Å²	98	19.8 Å²	19.8	46%	0.458	10%	0.104	S	C	.	.	H	α-helix	trans	-65.7	-34.5	175.8	-45.6	78.7	-175.7	0	0	111.3	T437 T513 F519	T437-E515 WeakPolarHBondContact CG2-O 3.34Å; T513-E515 VanDerWaalsContact C-N 3.3Å; T513-E515 WeakPolarHBondContact CB-OE2 3.39Å; T513-E515 PolarHBondContact O-N 3.13Å; T513-E515 PolarHBondContact OG1-OE2 2.89Å; E515-F519 VanDerWaalsContact O-CB 3.22Å; E515-F519 WeakPolarHBondContact O-CB 3.43Å; E515-F519 PolarHBondContact O-N 3.45Å
516	Q	96.3	Very high	97.1	Very high	23 Å²	23	22.1 Å²	22.1	11%	0.107	11%	0.114	C	C	.	.	H	α-helix	trans	-68	-36.2	174.6	-75.3	176.3	20.1	0	0	112.4	T437 G473 I511 T513 G514 V520	T437-Q516 HydrophobicContact CG2-CG 4.29Å; G473-Q516 VanDerWaalsContact CA-OE1 3.23Å; I511-Q516 HydrophobicContact CG2-CB 3.76Å; T513-Q516 WeakPolarHBondContact O-CB 3.26Å; T513-Q516 PolarHBondContact O-N 3.13Å; T513-Q516 VanDerWaalsContact O-N 3.13Å; T513-Q516 WeakPolarHBondContact OG1-CG 3.42Å; T513-Q516 PolarHBondContact OG1-N 3.41Å; G514-Q516 VanDerWaalsContact C-N 3.31Å; G514-Q516 PolarHBondContact O-N 3.48Å; Q516-V520 WeakPolarHBondContact O-CG2 3.5Å; Q516-V520 PolarHBondContact O-N 2.96Å
517	Y	97.8	Very high	97	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-73	-40	175.3	-175.1	-110.2	0	0	0	112	L272 E275 F276 I279 V496 L497 T500 I511 T513 G514 V520 H521	L272-Y517 HydrophobicContact CB-CD1 4.21Å; L272-Y517 HydrophobicContact CB-CE1 4.37Å; L272-Y517 HydrophobicContact CD2-CE1 4.23Å; L272-Y517 WeakPolarHBondContact O-CD1 3.29Å; E275-Y517 HydrophobicContact CG-CE1 4.5Å; E275-Y517 WeakPolarHBondContact OE1-CE1 3.38Å; E275-Y517 PolarHBondContact OE1-OH 2.93Å; F276-Y517 HydrophobicContact CB-CD1 3.77Å; F276-Y517 HydrophobicContact CB-CE1 4.26Å; F276-Y517 HydrophobicContact CB-CG 4.12Å; F276-Y517 VanDerWaalsContact CD2-CB 3.41Å; F276-Y517 HydrophobicContact CD2-CD1 4.1Å; F276-Y517 AromaticContact CD2-CD2 3.86Å; F276-Y517 HydrophobicContact CD2-CD2 3.86Å; F276-Y517 AromaticContact CD2-CG 3.55Å; F276-Y517 HydrophobicContact CD2-CG 3.55Å; F276-Y517 HydrophobicContact CE2-CG 4.36Å; F276-Y517 HydrophobicContact CG-CD1 4.34Å; F276-Y517 HydrophobicContact CG-CG 4.19Å; I279-Y517 HydrophobicContact CD1-CE2 4.11Å; V496-Y517 HydrophobicContact CG1-CD2 4.41Å; V496-Y517 HydrophobicContact CG1-CE2 3.92Å; L497-Y517 WeakPolarHBondContact CA-OH 3.49Å; T500-Y517 HydrophobicContact CG2-CD2 4.35Å; T500-Y517 HydrophobicContact CG2-CE2 4.3Å; T500-Y517 WeakPolarHBondContact OG1-CE2 3.21Å; I511-Y517 HydrophobicContact CD1-CD2 4.45Å; T513-Y517 PolarHBondContact O-N 2.84Å; T513-Y517 VanDerWaalsContact O-N 3.14Å; G514-Y517 PolarHBondContact O-N 3.26Å; Y517-V520 PolarHBondContact O-N 3.4Å; Y517-H521 AromaticContact CE1-CE1 3.56Å; Y517-H521 AromaticContact CZ-CE1 3.59Å; Y517-H521 PolarHBondContact O-N 3.03Å; Y517-H521 PolarHBondContact O-ND1 2.94Å
518	E	96.8	Very high	96.9	Very high	36 Å²	36	23.1 Å²	23.1	17%	0.168	12%	0.117	C	C	.	.	H	α-helix	trans	-61.1	-46.6	172.2	-167.4	-161.3	128.7	0	0	111.2	T269 L272 H273 G514 V520 H521 H522	T269-E518 WeakPolarHBondContact CB-OE2 3.49Å; T269-E518 HydrophobicContact CG2-CG 3.92Å; T269-E518 VanDerWaalsContact CG2-OE1 3.26Å; T269-E518 WeakPolarHBondContact CG2-OE1 3.24Å; L272-E518 HydrophobicContact CD1-CG 4.11Å; H273-E518 IonicContact CD2-OE2 2.81Å; H273-E518 IonicContact CE1-OE2 3.71Å; H273-E518 IonicContact NE2-OE2 2.72Å; H273-E518 PolarHBondContact NE2-OE2 3Å; G514-E518 WeakPolarHBondContact O-CB 3.4Å; G514-E518 PolarHBondContact O-N 3.45Å; E518-V520 VanDerWaalsContact C-N 3.3Å; E518-V520 PolarHBondContact O-N 2.98Å; E518-H521 WeakPolarHBondContact O-CA 3.43Å; E518-H521 WeakPolarHBondContact O-CB 3.26Å; E518-H521 PolarHBondContact O-N 3.3Å; E518-H522 PolarHBondContact O-CD2 2.96Å; E518-H522 PolarHBondContact O-N 2.94Å; E518-H522 IonicContact OE1-CD2 2.71Å; E518-H522 IonicContact OE1-CE1 2.71Å; E518-H522 IonicContact OE1-NE2 3.19Å; E518-H522 PolarHBondContact OE1-NE2 3.49Å
519	F	96.9	Very high	96.6	Very high	8 Å²	8	25.4 Å²	25.4	4%	0.035	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-31.9	177.8	170.8	-90.4	0	0	0	113.4	W432 T437 P438 A441 L444 E515 H521 H522 A523	W432-F519 AromaticContact CH2-CD1 3.99Å; W432-F519 HydrophobicContact CH2-CD1 3.99Å; W432-F519 AromaticContact CH2-CE1 3.59Å; W432-F519 HydrophobicContact CH2-CE1 3.59Å; W432-F519 HydrophobicContact CH2-CZ 4.4Å; W432-F519 HydrophobicContact CZ2-CD1 4.32Å; W432-F519 HydrophobicContact CZ2-CE1 4.23Å; W432-F519 HydrophobicContact CZ3-CE1 4.19Å; T437-F519 HydrophobicContact CG2-CB 3.43Å; T437-F519 VanDerWaalsContact CG2-CB 3.43Å; T437-F519 HydrophobicContact CG2-CD1 4.31Å; T437-F519 HydrophobicContact CG2-CD2 4.27Å; T437-F519 HydrophobicContact CG2-CG 3.75Å; P438-F519 HydrophobicContact CB-CE2 4.24Å; P438-F519 HydrophobicContact CB-CZ 4.46Å; P438-F519 HydrophobicContact CG-CE2 4.1Å; P438-F519 HydrophobicContact CG-CZ 3.93Å; A441-F519 HydrophobicContact CB-CE2 3.85Å; A441-F519 HydrophobicContact CB-CZ 3.95Å; L444-F519 HydrophobicContact CD2-CE1 3.62Å; L444-F519 HydrophobicContact CD2-CZ 4.02Å; E515-F519 VanDerWaalsContact O-CB 3.22Å; E515-F519 WeakPolarHBondContact O-CB 3.43Å; E515-F519 PolarHBondContact O-N 3.45Å; F519-H521 VanDerWaalsContact C-N 3.33Å; F519-H522 PolarHBondContact O-N 3.02Å; F519-A523 WeakPolarHBondContact O-CB 3.47Å; F519-A523 PolarHBondContact O-N 3.39Å
520	V	98.2	Very high	96.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.5	-40.2	170.3	170.7	0	0	0	0	110.7	C477 A480 V496 I511 Q516 Y517 E518 A523 L524	C477-V520 HydrophobicContact CB-CG2 3.99Å; A480-V520 HydrophobicContact CB-CG1 4.05Å; A480-V520 HydrophobicContact CB-CG2 4.28Å; V496-V520 HydrophobicContact CG1-CG1 3.73Å; I511-V520 HydrophobicContact CD1-CG2 4.14Å; Q516-V520 WeakPolarHBondContact O-CG2 3.5Å; Q516-V520 PolarHBondContact O-N 2.96Å; Y517-V520 PolarHBondContact O-N 3.4Å; E518-V520 VanDerWaalsContact C-N 3.3Å; E518-V520 PolarHBondContact O-N 2.98Å; V520-A523 PolarHBondContact O-N 3.44Å; V520-L524 HydrophobicContact CG1-CD1 3.75Å; V520-L524 HydrophobicContact CG1-CG 4.39Å; V520-L524 WeakPolarHBondContact O-CB 3.34Å; V520-L524 WeakPolarHBondContact O-CD1 3.29Å; V520-L524 WeakPolarHBondContact O-CG 3.3Å; V520-L524 PolarHBondContact O-N 3.08Å
521	H	98.1	Very high	95.5	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-65.2	-44.2	173.5	-71	78.8	0	0	0	112.5	V266 L272 V496 Y517 E518 F519 A523 L524 S525	V266-H521 HydrophobicContact CG2-CB 3.74Å; V266-H521 WeakPolarHBondContact CG2-O 3.38Å; L272-H521 HydrophobicContact CD1-CB 3.94Å; L272-H521 WeakPolarHBondContact CD2-NE2 3.3Å; V496-H521 VanDerWaalsContact CB-CE1 3.49Å; V496-H521 WeakPolarHBondContact CB-CE1 3.38Å; V496-H521 VanDerWaalsContact CG1-CE1 3.45Å; V496-H521 WeakPolarHBondContact CG1-CE1 3.49Å; Y517-H521 AromaticContact CE1-CE1 3.56Å; Y517-H521 AromaticContact CZ-CE1 3.59Å; Y517-H521 PolarHBondContact O-N 3.03Å; Y517-H521 PolarHBondContact O-ND1 2.94Å; E518-H521 WeakPolarHBondContact O-CA 3.43Å; E518-H521 WeakPolarHBondContact O-CB 3.26Å; E518-H521 PolarHBondContact O-N 3.3Å; F519-H521 VanDerWaalsContact C-N 3.33Å; H521-A523 VanDerWaalsContact C-N 3.33Å; H521-A523 PolarHBondContact O-N 2.98Å; H521-L524 PolarHBondContact O-N 2.93Å; H521-S525 WeakPolarHBondContact O-CB 3.28Å; H521-S525 PolarHBondContact O-N 3.35Å
522	H	96.5	Very high	94.5	Very high	71 Å²	71	33.3 Å²	33.3	33%	0.329	17%	0.173	S	C	.	.	H	α-helix	trans	-56.7	-46.3	173.6	-74.7	-81.1	0	0	0	111.4	V266 E518 F519 S525 L526	V266-H522 VanDerWaalsContact CG1-ND1 3.34Å; V266-H522 WeakPolarHBondContact CG1-ND1 3.38Å; E518-H522 PolarHBondContact O-CD2 2.96Å; E518-H522 PolarHBondContact O-N 2.94Å; E518-H522 IonicContact OE1-CD2 2.71Å; E518-H522 IonicContact OE1-CE1 2.71Å; E518-H522 IonicContact OE1-NE2 3.19Å; E518-H522 PolarHBondContact OE1-NE2 3.49Å; F519-H522 PolarHBondContact O-N 3.02Å; H522-S525 PolarHBondContact O-N 3.25Å; H522-L526 VanDerWaalsContact O-CB 3.29Å; H522-L526 WeakPolarHBondContact O-CB 3.36Å; H522-L526 PolarHBondContact O-N 3.41Å
523	A	97.4	Very high	93.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-43.7	178.3	0	0	0	0	0	112.4	A441 T481 F519 V520 H521 L526 Y527	A441-A523 HydrophobicContact CB-CB 3.63Å; T481-A523 HydrophobicContact CG2-CB 4.05Å; F519-A523 WeakPolarHBondContact O-CB 3.47Å; F519-A523 PolarHBondContact O-N 3.39Å; V520-A523 PolarHBondContact O-N 3.44Å; H521-A523 VanDerWaalsContact C-N 3.33Å; H521-A523 PolarHBondContact O-N 2.98Å; A523-L526 PolarHBondContact O-N 2.72Å; A523-Y527 WeakPolarHBondContact O-CB 3.37Å; A523-Y527 PolarHBondContact O-N 2.95Å
524	L	97.9	Very high	92.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68.6	-39.9	178.7	-69.9	168.1	0	0	0	112.2	L262 C485 L488 V494 V496 V520 H521 L526 Y527 E528	L262-L524 HydrophobicContact CD1-CB 4.24Å; L262-L524 HydrophobicContact CD2-CB 4.03Å; C485-L524 VanDerWaalsContact N-CD2 3.27Å; L488-L524 HydrophobicContact CD1-CB 4.14Å; L488-L524 HydrophobicContact CD1-CD2 4Å; V494-L524 HydrophobicContact CG2-CD1 4.04Å; V496-L524 HydrophobicContact CG2-CD1 3.52Å; V520-L524 HydrophobicContact CG1-CD1 3.75Å; V520-L524 HydrophobicContact CG1-CG 4.39Å; V520-L524 WeakPolarHBondContact O-CB 3.34Å; V520-L524 WeakPolarHBondContact O-CD1 3.29Å; V520-L524 WeakPolarHBondContact O-CG 3.3Å; V520-L524 PolarHBondContact O-N 3.08Å; H521-L524 PolarHBondContact O-N 2.93Å; L524-L526 VanDerWaalsContact C-N 3.33Å; L524-L526 PolarHBondContact O-N 3.43Å; L524-Y527 PolarHBondContact O-N 3.44Å; L524-E528 WeakPolarHBondContact O-CB 3.39Å; L524-E528 PolarHBondContact O-N 3.48Å
525	S	96.4	Very high	90.7	Very high	19 Å²	19	40.4 Å²	40.4	13%	0.133	22%	0.22	C	C	.	.	H	α-helix	trans	-66.4	-35.6	175.1	-170.3	0	0	0	0	112.2	H521 H522 A529	H521-S525 WeakPolarHBondContact O-CB 3.28Å; H521-S525 PolarHBondContact O-N 3.35Å; H522-S525 PolarHBondContact O-N 3.25Å; S525-A529 WeakPolarHBondContact O-CB 3.39Å; S525-A529 PolarHBondContact O-N 3.36Å; S525-A529 VanDerWaalsContact O-N 3.1Å
526	L	95.6	Very high	88.6	Confident	63 Å²	63	38.8 Å²	38.8	33%	0.33	23%	0.23	S	C	.	.	H	α-helix	trans	-72.8	-29.8	175.9	-174.9	56.2	0	0	0	112.3	A441 L442 L445 H522 A523 L524	A441-L526 HydrophobicContact CB-CD2 4.13Å; L442-L526 HydrophobicContact CD2-CD1 4.17Å; L442-L526 HydrophobicContact CD2-CD2 3.45Å; L442-L526 VanDerWaalsContact CD2-CD2 3.45Å; L442-L526 HydrophobicContact CD2-CG 3.77Å; L442-L526 HydrophobicContact CG-CD2 3.82Å; L445-L526 HydrophobicContact CD1-CB 4.3Å; L445-L526 HydrophobicContact CD1-CD2 4.44Å; L445-L526 HydrophobicContact CD1-CG 4.2Å; H522-L526 VanDerWaalsContact O-CB 3.29Å; H522-L526 WeakPolarHBondContact O-CB 3.36Å; H522-L526 PolarHBondContact O-N 3.41Å; A523-L526 PolarHBondContact O-N 2.72Å; L524-L526 VanDerWaalsContact C-N 3.33Å; L524-L526 PolarHBondContact O-N 3.43Å
527	Y	95.9	Very high	85.7	Confident	30 Å²	30	49 Å²	49	12%	0.118	28%	0.278	C	S	.	.	H	α-helix	trans	-72.3	-43.8	171.5	-177.8	-110.4	0	0	0	112.4	L445 C485 L488 Q489 A523 L524 A529 R530 L531	L445-Y527 HydrophobicContact CD2-CD2 4.42Å; L445-Y527 HydrophobicContact CD2-CG 4.41Å; C485-Y527 HydrophobicContact CB-CD1 3.66Å; C485-Y527 HydrophobicContact CB-CE1 3.71Å; C485-Y527 HydrophobicContact CB-CG 4.24Å; C485-Y527 WeakPolarHBondContact O-CE1 3.33Å; C485-Y527 WeakPolarHBondContact SG-CD1 3.28Å; L488-Y527 HydrophobicContact CD1-CD1 4.18Å; Q489-Y527 HydrophobicContact CG-CE1 4.17Å; Q489-Y527 WeakPolarHBondContact CG-OH 3.28Å; Q489-Y527 PolarHBondContact NE2-OH 3.35Å; A523-Y527 WeakPolarHBondContact O-CB 3.37Å; A523-Y527 PolarHBondContact O-N 2.95Å; L524-Y527 PolarHBondContact O-N 3.44Å; Y527-A529 VanDerWaalsContact C-N 3.33Å; Y527-A529 PolarHBondContact O-N 3.28Å; Y527-R530 WeakPolarHBondContact O-CB 3.31Å; Y527-R530 PolarHBondContact O-N 2.96Å; Y527-R530 VanDerWaalsContact O-N 3.14Å; Y527-L531 HydrophobicContact CD1-CD1 4.17Å; Y527-L531 HydrophobicContact CE1-CD1 3.48Å; Y527-L531 VanDerWaalsContact CE1-CD1 3.48Å; Y527-L531 HydrophobicContact CE1-CG 3.9Å; Y527-L531 HydrophobicContact CE2-CG 4.48Å; Y527-L531 PolarHBondContact O-N 3.29Å; Y527-L531 VanDerWaalsContact O-N 3.14Å; Y527-L531 WeakPolarHBondContact OH-CD2 3.36Å
528	E	94.6	Very high	85.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58.3	-44.2	175.1	-178.2	-75.1	134.2	0	0	111.8	R259 L262 R263 L488 L524 R530 L531 S532	R259-E528 HydrophobicContact CB-CG 3.7Å; R259-E528 WeakPolarHBondContact CD-OE1 3.4Å; R259-E528 HydrophobicContact CG-CG 3.6Å; L262-E528 HydrophobicContact CD2-CB 4.33Å; R263-E528 IonicContact CZ-OE1 3.64Å; R263-E528 IonicContact CZ-OE2 3.69Å; R263-E528 IonicContact NE-OE1 2.89Å; R263-E528 IonicContact NE-OE2 3.96Å; R263-E528 PolarHBondContact NE-OE2 2.91Å; R263-E528 IonicContact NH2-OE1 2.79Å; R263-E528 PolarHBondContact NH2-OE1 3.47Å; R263-E528 IonicContact NH2-OE2 2.86Å; R263-E528 PolarHBondContact NH2-OE2 2.94Å; L488-E528 HydrophobicContact CD1-CB 4.26Å; L524-E528 WeakPolarHBondContact O-CB 3.39Å; L524-E528 PolarHBondContact O-N 3.48Å; E528-R530 PolarHBondContact O-N 2.88Å; E528-L531 PolarHBondContact O-N 3.29Å; E528-S532 PolarHBondContact O-N 3.34Å; E528-S532 PolarHBondContact O-OG 2.94Å; E528-S532 WeakPolarHBondContact OE1-CB 3.43Å; E528-S532 PolarHBondContact OE1-OG 3.48Å
529	A	91.9	Very high	84.5	Confident	49 Å²	49	52.3 Å²	52.3	41%	0.405	30%	0.299	S	S	.	.	H	α-helix	trans	-59.7	-29.1	178.2	0	0	0	0	0	113.1	S525 Y527 A533	S525-A529 WeakPolarHBondContact O-CB 3.39Å; S525-A529 PolarHBondContact O-N 3.36Å; S525-A529 VanDerWaalsContact O-N 3.1Å; Y527-A529 VanDerWaalsContact C-N 3.33Å; Y527-A529 PolarHBondContact O-N 3.28Å; A529-A533 PolarHBondContact O-N 2.99Å
530	R	89.3	Confident	83.9	Confident	100 Å²	100	54.8 Å²	54.8	38%	0.377	31%	0.313	S	S	.	.	H	α-helix	trans	-75.1	-49.6	174.2	-71.4	171.6	156.1	-151.1	-13.4	111.7	Y527 E528 S532 A533 E534	Y527-R530 WeakPolarHBondContact O-CB 3.31Å; Y527-R530 PolarHBondContact O-N 2.96Å; Y527-R530 VanDerWaalsContact O-N 3.14Å; E528-R530 PolarHBondContact O-N 2.88Å; R530-S532 VanDerWaalsContact C-N 3.25Å; R530-S532 PolarHBondContact O-N 3.24Å; R530-A533 WeakPolarHBondContact O-CB 3.46Å; R530-A533 PolarHBondContact O-N 2.9Å; R530-E534 PolarHBondContact O-N 3.16Å
531	L	84.8	Confident	83	Confident	26 Å²	26	58 Å²	58	14%	0.136	33%	0.332	C	S	.	.	H	α-helix	trans	-54	-43.2	175.4	-79.4	179.1	0	0	0	112.2	L488 Q489 Y527 E528 A533 E534 S535	L488-L531 HydrophobicContact CB-CD1 4.42Å; Q489-L531 HydrophobicContact CG-CD1 4.23Å; Y527-L531 HydrophobicContact CD1-CD1 4.17Å; Y527-L531 HydrophobicContact CE1-CD1 3.48Å; Y527-L531 VanDerWaalsContact CE1-CD1 3.48Å; Y527-L531 HydrophobicContact CE1-CG 3.9Å; Y527-L531 HydrophobicContact CE2-CG 4.48Å; Y527-L531 PolarHBondContact O-N 3.29Å; Y527-L531 VanDerWaalsContact O-N 3.14Å; Y527-L531 WeakPolarHBondContact OH-CD2 3.36Å; E528-L531 PolarHBondContact O-N 3.29Å; L531-A533 VanDerWaalsContact C-N 3.27Å; L531-A533 PolarHBondContact O-N 3.38Å; L531-E534 PolarHBondContact O-N 3.28Å; L531-S535 PolarHBondContact O-N 3.01Å; L531-S535 PolarHBondContact O-OG 3.5Å
532	S	77.4	Confident	82.1	Confident	40 Å²	40	61.5 Å²	61.5	28%	0.28	35%	0.352	S	S	.	.	H	α-helix	trans	-72.5	-17.3	-179.7	-67.6	0	0	0	0	113.7	R259 E528 R530	R259-S532 PolarHBondContact NH1-OG 3.41Å; E528-S532 PolarHBondContact O-N 3.34Å; E528-S532 PolarHBondContact O-OG 2.94Å; E528-S532 WeakPolarHBondContact OE1-CB 3.43Å; E528-S532 PolarHBondContact OE1-OG 3.48Å; R530-S532 VanDerWaalsContact C-N 3.25Å; R530-S532 PolarHBondContact O-N 3.24Å
533	A	75	Confident	81.1	Confident	62 Å²	62	60.9 Å²	60.9	51%	0.512	35%	0.353	S	S	.	.	H	α-helix	trans	-85	-38.1	170	0	0	0	0	0	111.9	A529 R530 L531 S535 G536	A529-A533 PolarHBondContact O-N 2.99Å; R530-A533 WeakPolarHBondContact O-CB 3.46Å; R530-A533 PolarHBondContact O-N 2.9Å; L531-A533 VanDerWaalsContact C-N 3.27Å; L531-A533 PolarHBondContact O-N 3.38Å; A533-S535 VanDerWaalsContact C-N 3.33Å; A533-G536 PolarHBondContact O-N 3.08Å
534	E	70.7	Confident	79.9	Confident	135 Å²	135	65.2 Å²	65.2	63%	0.631	38%	0.379	S	S	*	.	H	α-helix	trans	-66	-32.9	174.6	-70.5	166.9	-172.6	0	0	112.1	R530 L531 G536	R530-E534 PolarHBondContact O-N 3.16Å; L531-E534 PolarHBondContact O-N 3.28Å; E534-G536 VanDerWaalsContact C-N 3.27Å; E534-G536 PolarHBondContact O-N 3.22Å
535	S	61.9	Low	78.6	Confident	86 Å²	86	70.2 Å²	70.2	60%	0.601	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	10	173.2	70.7	0	0	0	0	114.4	L531 A533	L531-S535 PolarHBondContact O-N 3.01Å; L531-S535 PolarHBondContact O-OG 3.5Å; A533-S535 VanDerWaalsContact C-N 3.33Å
536	G	51.3	Low	77.1	Confident	64 Å²	64	74.5 Å²	74.5	66%	0.66	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	11.8	178.4	0	0	0	0	0	113.9	A533 E534	A533-G536 PolarHBondContact O-N 3.08Å; E534-G536 VanDerWaalsContact C-N 3.27Å; E534-G536 PolarHBondContact O-N 3.22Å
537	Q	36.3	Very low	75.4	Confident	239 Å²	239	75.5 Å²	75.5	100%	1.117	44%	0.44	S	S	*	.			trans	-121.8	0	176.9	-64.5	-173.9	-6.9	0	0	110

Retrieved 537 of 537 residues in 280.8 ms (Link to these results)

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