A0A087XWP9_POEFO Loading...

PDZ and LIM domain protein 4

Suppresses SRC activation by recognizing and binding to active SRC and facilitating PTPN13-mediated dephosphorylation of SRC 'Tyr-419' leading to its inactivation. Inactivated SRC dissociates from this protein allowing the initiation of a new SRC inactivation cycle. Involved in reorganization of the actin cytoskeleton. In nonmuscle cells, binds to ACTN1 (alpha-actinin-1), increases the affinity of ACTN1 to F-actin (filamentous actin), and promotes formation of actin stress fibers. Involved in regulation of the synaptic AMPA receptor transport in dendritic spines of hippocampal pyramidal neurons directing the receptors toward an insertion at the postsynaptic membrane. Links endosomal surface-internalized GRIA1-containing AMPA receptors to the alpha-actinin/actin cytoskeleton. Increases AMPA receptor-mediated excitatory postsynaptic currents in neurons.

AlphaFold DB , UniProt , Accession A0A087XWP9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 364 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	81.9	Confident	92.2	Very high	189 Å²	189	72.2 Å²	72.2	93%	0.931	41%	0.413	S	S	*	.				0	154.1	0	-70.4	172.9	173.8	0	0	108.2	R82	M1-R82 PolarHBondContact N-O 2.88Å; M1-R82 PolarHBondContact O-N 3.39Å
2	S	90.9	Very high	92.3	Very high	84 Å²	84	75.7 Å²	75.7	59%	0.587	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	146.5	171.3	46.8	0	0	0	0	111.9	I80	S2-I80 CarbonylContact C-O 3.54Å; S2-I80 WeakPolarHBondContact CA-O 3.42Å
3	F	94.3	Very high	92.6	Very high	70 Å²	70	70.8 Å²	70.8	31%	0.307	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	160	176.9	61.8	-79.7	0	0	0	110.3	V5 I80 R82	F3-V5 HydrophobicContact CD2-CG2 3.74Å; F3-V5 HydrophobicContact CE2-CG2 3.44Å; F3-V5 VanDerWaalsContact CE2-CG2 3.44Å; F3-I80 HydrophobicContact CD1-CB 4.44Å; F3-I80 HydrophobicContact CE1-CB 4Å; F3-I80 HydrophobicContact CE1-CG2 3.72Å; F3-I80 HydrophobicContact CE2-CB 4.18Å; F3-I80 HydrophobicContact CE2-CG2 4.4Å; F3-I80 HydrophobicContact CZ-CB 3.86Å; F3-I80 HydrophobicContact CZ-CG2 3.62Å; F3-I80 PolarHBondContact N-O 2.97Å; F3-I80 PolarHBondContact O-N 3.17Å; F3-R82 HydrophobicContact CE1-CB 3.85Å
4	T	95.4	Very high	92.8	Very high	90 Å²	90	66.9 Å²	66.9	55%	0.552	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	133.3	-178.1	-54.5	0	0	0	0	110.4	T77 L78	T4-T77 HydrophobicContact CG2-CG2 3.5Å; T4-L78 WeakPolarHBondContact CA-O 3.48Å
5	V	95.5	Very high	93.1	Very high	10 Å²	10	64.5 Å²	64.5	6%	0.061	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126	175.3	175.3	0	0	0	0	109	F3 L7 G41 L43 T77 L78 I80	F3-V5 HydrophobicContact CD2-CG2 3.74Å; F3-V5 HydrophobicContact CE2-CG2 3.44Å; F3-V5 VanDerWaalsContact CE2-CG2 3.44Å; V5-L7 HydrophobicContact CG1-CD2 3.59Å; V5-L7 HydrophobicContact CG1-CG 4.29Å; V5-G41 WeakPolarHBondContact CG1-O 3.27Å; V5-L43 HydrophobicContact CB-CD2 4.06Å; V5-L43 HydrophobicContact CG1-CD1 4.47Å; V5-L43 HydrophobicContact CG1-CD2 4.01Å; V5-L43 HydrophobicContact CG1-CG 4.09Å; V5-L43 HydrophobicContact CG2-CD2 3.85Å; V5-T77 CarbonylContact O-C 3.59Å; V5-T77 WeakPolarHBondContact O-CA 3.42Å; V5-L78 PolarHBondContact N-O 3.08Å; V5-L78 PolarHBondContact O-N 3.44Å; V5-I80 HydrophobicContact CG2-CG1 4.15Å
6	T	96.1	Very high	93.3	Very high	62 Å²	62	70.9 Å²	70.9	38%	0.38	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	108.1	177	-65.3	0	0	0	0	110	K8 E75 T77	T6-K8 HydrophobicContact CG2-CD 4.42Å; T6-E75 HydrophobicContact CG2-CB 4.32Å; T6-E75 WeakPolarHBondContact CG2-OE2 3.2Å; T6-T77 WeakPolarHBondContact CG2-OG1 3.27Å; T6-T77 PolarHBondContact OG1-OG1 2.94Å
7	L	95.1	Very high	93.5	Very high	4 Å²	4	68 Å²	68	2%	0.021	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	128.4	175.8	-51.6	-171.9	0	0	0	109.7	V5 W13 K37 A38 L43 E75 L76	V5-L7 HydrophobicContact CG1-CD2 3.59Å; V5-L7 HydrophobicContact CG1-CG 4.29Å; L7-W13 HydrophobicContact CB-CE3 3.69Å; L7-W13 HydrophobicContact CB-CZ3 3.71Å; L7-W13 HydrophobicContact CD1-CB 4.34Å; L7-W13 HydrophobicContact CD1-CE3 4.09Å; L7-W13 WeakPolarHBondContact O-CZ3 3.39Å; L7-K37 WeakPolarHBondContact CD2-O 3.47Å; L7-A38 HydrophobicContact CD1-CB 4.24Å; L7-L43 HydrophobicContact CD1-CD1 4.06Å; L7-L43 HydrophobicContact CD2-CD1 4.42Å; L7-E75 CarbonylContact O-C 3.55Å; L7-E75 WeakPolarHBondContact O-CA 3.02Å; L7-E75 WeakPolarHBondContact O-CB 3.39Å; L7-L76 HydrophobicContact CB-CB 4.46Å; L7-L76 HydrophobicContact CD1-CD2 4.4Å; L7-L76 PolarHBondContact N-O 2.94Å; L7-L76 PolarHBondContact O-N 2.95Å
8	K	94.9	Very high	93.6	Very high	122 Å²	122	67.7 Å²	67.7	53%	0.53	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	138	173.5	-61.5	-56.1	-171	-179.7	0	111.3	T6 K37 E75	T6-K8 HydrophobicContact CG2-CD 4.42Å; K8-K37 WeakPolarHBondContact O-CD 3.43Å; K8-K37 WeakPolarHBondContact O-CE 3.37Å; K8-E75 HydrophobicContact CD-CB 3.95Å; K8-E75 IonicContact NZ-OE1 3.4Å; K8-E75 PolarHBondContact NZ-OE1 3.49Å; K8-E75 IonicContact NZ-OE2 2.75Å; K8-E75 PolarHBondContact NZ-OE2 3.07Å
9	G	90.5	Very high	93.8	Very high	21 Å²	21	64.7 Å²	64.7	22%	0.216	36%	0.362	C	S	.	.	S	Bend	trans	-84.2	-165.8	-166.3	0	0	0	0	0	115.4	W13 K37 Q74	G9-W13 VanDerWaalsContact CA-CH2 3.41Å; G9-K37 WeakPolarHBondContact O-CE 3.4Å; G9-K37 PolarHBondContact O-NZ 3.03Å; G9-Q74 WeakPolarHBondContact CA-O 3.35Å; G9-Q74 PolarHBondContact N-O 3.39Å
10	P	91.9	Very high	93.9	Very high	82 Å²	82	61.6 Å²	61.6	53%	0.532	34%	0.344	S	S	.	.	S	Bend	cis	-72.4	-177.5	-12.2	33.3	-37	0	0	0	112.6	K37 T73	P10-K37 PolarHBondContact O-NZ 2.83Å; P10-T73 WeakPolarHBondContact CA-O 3.47Å
11	S	88.2	Confident	94	Very high	60 Å²	60	65.8 Å²	65.8	42%	0.42	36%	0.355	S	S	.	.	S	Bend	trans	-58.9	157.4	164.7	59.7	0	0	0	0	111.1
12	P	93.4	Very high	94.7	Very high	114 Å²	114	60.7 Å²	60.7	74%	0.74	33%	0.331	S	S	*	.			cis	-76.4	140.4	3.8	31.7	-35.7	0	0	0	113.8
13	W	95.9	Very high	94.9	Very high	12 Å²	12	62.5 Å²	62.5	5%	0.045	33%	0.329	C	S	.	.			trans	-76	-28	179.3	-57	112.8	0	0	0	113.8	L7 G9 F15 K37 A38 I69 C72 L76	L7-W13 HydrophobicContact CB-CE3 3.69Å; L7-W13 HydrophobicContact CB-CZ3 3.71Å; L7-W13 HydrophobicContact CD1-CB 4.34Å; L7-W13 HydrophobicContact CD1-CE3 4.09Å; L7-W13 WeakPolarHBondContact O-CZ3 3.39Å; G9-W13 VanDerWaalsContact CA-CH2 3.41Å; W13-F15 HydrophobicContact CB-CD1 3.79Å; W13-F15 HydrophobicContact CB-CE1 3.64Å; W13-F15 HydrophobicContact CG-CE1 4.32Å; W13-K37 HydrophobicContact CE3-CD 4.49Å; W13-A38 VanDerWaalsContact O-CB 3.29Å; W13-A38 WeakPolarHBondContact O-CB 3.19Å; W13-A38 PolarHBondContact O-N 2.91Å; W13-I69 PolarHBondContact NE1-O 2.91Å; W13-C72 HydrophobicContact CZ2-CB 3.59Å; W13-C72 WeakPolarHBondContact CZ2-O 3.41Å; W13-L76 HydrophobicContact CB-CD2 4.35Å; W13-L76 HydrophobicContact CD2-CB 3.99Å; W13-L76 HydrophobicContact CD2-CD2 3.76Å; W13-L76 HydrophobicContact CE3-CB 4.05Å; W13-L76 HydrophobicContact CE3-CD2 4.34Å; W13-L76 HydrophobicContact CG-CD2 3.72Å; W13-L76 HydrophobicContact CH2-CB 3.7Å; W13-L76 HydrophobicContact CZ2-CB 3.63Å; W13-L76 HydrophobicContact CZ3-CB 3.9Å
14	G	95.3	Very high	94.9	Very high	17 Å²	17	64.8 Å²	64.8	18%	0.175	35%	0.354	C	S	.	.			trans	89.6	22.9	172.8	0	0	0	0	0	116.5	I32 T33 S36	G14-I32 WeakPolarHBondContact O-CA 3.2Å; G14-T33 PolarHBondContact O-N 3.12Å; G14-S36 PolarHBondContact O-OG 2.92Å
15	F	96.9	Very high	94.9	Very high	30 Å²	30	63.9 Å²	63.9	13%	0.132	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	162.8	172.3	69.9	-85	0	0	0	112.3	W13 I29 R31 I32 A38 I49 I69 L76 L78	W13-F15 HydrophobicContact CB-CD1 3.79Å; W13-F15 HydrophobicContact CB-CE1 3.64Å; W13-F15 HydrophobicContact CG-CE1 4.32Å; F15-I29 HydrophobicContact CB-CG2 4.07Å; F15-I29 HydrophobicContact CD2-CD1 4.31Å; F15-I29 HydrophobicContact CD2-CG1 4.14Å; F15-I29 HydrophobicContact CD2-CG2 4.42Å; F15-R31 CarbonylContact C-O 3.49Å; F15-R31 WeakPolarHBondContact CA-O 3.22Å; F15-I32 HydrophobicContact CB-CG1 4.07Å; F15-A38 HydrophobicContact CB-CB 3.95Å; F15-A38 HydrophobicContact CD1-CB 4Å; F15-A38 HydrophobicContact CG-CB 4.43Å; F15-I49 HydrophobicContact CE2-CD1 4.2Å; F15-I69 HydrophobicContact CE1-CG2 4.45Å; F15-I69 HydrophobicContact CE2-CD1 4.08Å; F15-I69 HydrophobicContact CZ-CD1 3.82Å; F15-I69 HydrophobicContact CZ-CG1 4.3Å; F15-I69 HydrophobicContact CZ-CG2 4.08Å; F15-L76 HydrophobicContact CE1-CD2 3.83Å; F15-L76 HydrophobicContact CZ-CD2 4.12Å; F15-L78 HydrophobicContact CE1-CD1 4.48Å; F15-L78 HydrophobicContact CZ-CD1 4.23Å
16	R	96.3	Very high	94.9	Very high	167 Å²	167	67.3 Å²	67.3	63%	0.63	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	114.5	174.7	-72.6	-169	176.6	-142.1	-1.1	111.3	S30 R31	R16-S30 VanDerWaalsContact CB-OG 3.27Å; R16-S30 WeakPolarHBondContact CB-OG 3.42Å; R16-S30 PolarHBondContact O-N 2.99Å; R16-S30 PolarHBondContact O-OG 3.39Å; R16-R31 HydrophobicContact CB-CB 4.27Å; R16-R31 HydrophobicContact CG-CB 4.46Å; R16-R31 PolarHBondContact N-O 3.07Å
17	L	96.7	Very high	94.9	Very high	22 Å²	22	64.6 Å²	64.6	12%	0.115	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	143.7	173.1	-169.4	67.8	0	0	0	111.7	L27 I49 A65 Q66 I69	L17-L27 HydrophobicContact CD1-CB 4.16Å; L17-L27 HydrophobicContact CD1-CD2 4.15Å; L17-L27 HydrophobicContact CD2-CD2 4.09Å; L17-L27 HydrophobicContact CG-CD2 4.2Å; L17-I49 HydrophobicContact CD1-CD1 3.71Å; L17-A65 HydrophobicContact CD2-CB 3.73Å; L17-Q66 HydrophobicContact CD2-CG 4.3Å; L17-I69 HydrophobicContact CD2-CD1 4.05Å
18	V	96.3	Very high	95	Very high	62 Å²	62	65.9 Å²	65.9	38%	0.376	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	168	164.4	-64.5	0	0	0	0	110.3	L27 T28	V18-L27 WeakPolarHBondContact O-CA 3.2Å; V18-T28 WeakPolarHBondContact CG2-OG1 3.12Å; V18-T28 PolarHBondContact N-O 2.97Å; V18-T28 PolarHBondContact O-N 3.19Å
19	G	96.5	Very high	95	Very high	12 Å²	12	60.1 Å²	60.1	12%	0.124	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.3	-172.4	-173.9	0	0	0	0	0	113.3	T25 L27 H62	G19-T25 WeakPolarHBondContact CA-OG1 3.34Å; G19-L27 WeakPolarHBondContact O-CD2 3.29Å; G19-H62 WeakPolarHBondContact O-CB 3.42Å; G19-H62 PolarHBondContact O-ND1 3.12Å
20	G	96.2	Very high	95.3	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.01	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	142.4	161.1	-176.1	0	0	0	0	0	110.7	D22 F23 S24 T25	G20-D22 VanDerWaalsContact C-OD1 3.29Å; G20-D22 WeakPolarHBondContact CA-OD1 3.5Å; G20-D22 PolarHBondContact O-N 3.36Å; G20-F23 CarbonylContact O-C 3.52Å; G20-F23 WeakPolarHBondContact O-CA 3.33Å; G20-F23 PolarHBondContact O-N 2.65Å; G20-S24 PolarHBondContact O-N 3.14Å; G20-T25 CarbonylContact C-O 3.52Å; G20-T25 WeakPolarHBondContact CA-O 3.5Å; G20-T25 PolarHBondContact N-O 3.18Å; G20-T25 PolarHBondContact O-N 3.33Å; G20-T25 VanDerWaalsContact O-O 3.07Å
21	R	95.9	Very high	95.4	Very high	151 Å²	151	65.3 Å²	65.3	57%	0.57	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-57.5	-36	178.3	-174.6	177.2	66.4	89.4	-1.1	112.6	F23 S24 F59 M60	R21-F23 PolarHBondContact O-N 3.37Å; R21-S24 PolarHBondContact O-N 3.49Å; R21-F59 WeakPolarHBondContact CD-O 3.49Å; R21-F59 PolarHBondContact NE-O 3.45Å; R21-M60 PolarHBondContact N-O 2.85Å
22	D	96.6	Very high	95.8	Very high	81 Å²	81	64.3 Å²	64.3	43%	0.433	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-62.6	-22.4	172.5	50	-28	0	0	0	114.2	G20 T61 H62	G20-D22 VanDerWaalsContact C-OD1 3.29Å; G20-D22 WeakPolarHBondContact CA-OD1 3.5Å; G20-D22 PolarHBondContact O-N 3.36Å; D22-T61 HydrophobicContact CB-CG2 4.1Å; D22-T61 VanDerWaalsContact OD1-CA 3.29Å; D22-T61 WeakPolarHBondContact OD1-CA 3.07Å; D22-H62 PolarHBondContact OD1-N 3.23Å; D22-H62 WeakPolarHBondContact OD2-CB 3.39Å; D22-H62 PolarHBondContact OD2-N 2.64Å
23	F	95.3	Very high	96	Very high	123 Å²	123	63.1 Å²	63.1	54%	0.539	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-106.6	12	175.2	-65.8	-82.5	0	0	0	113.1	G20 R21 T25 H62	G20-F23 CarbonylContact O-C 3.52Å; G20-F23 WeakPolarHBondContact O-CA 3.33Å; G20-F23 PolarHBondContact O-N 2.65Å; R21-F23 PolarHBondContact O-N 3.37Å; F23-T25 WeakPolarHBondContact CB-OG1 3.27Å; F23-T25 PolarHBondContact O-N 2.75Å; F23-T25 PolarHBondContact O-OG1 2.78Å; F23-H62 HydrophobicContact CD2-CB 3.89Å; F23-H62 HydrophobicContact CE2-CB 3.63Å
24	S	94.8	Very high	95.9	Very high	118 Å²	118	68.1 Å²	68.1	83%	0.825	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	31.6	-177	-58.2	0	0	0	0	114.2	G20 R21	G20-S24 PolarHBondContact O-N 3.14Å; R21-S24 PolarHBondContact O-N 3.49Å
25	T	94.3	Very high	95.8	Very high	70 Å²	70	70.4 Å²	70.4	43%	0.429	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	146	-172	38.1	0	0	0	0	110.5	G19 G20 F23	G19-T25 WeakPolarHBondContact CA-OG1 3.34Å; G20-T25 CarbonylContact C-O 3.52Å; G20-T25 WeakPolarHBondContact CA-O 3.5Å; G20-T25 PolarHBondContact N-O 3.18Å; G20-T25 PolarHBondContact O-N 3.33Å; G20-T25 VanDerWaalsContact O-O 3.07Å; F23-T25 WeakPolarHBondContact CB-OG1 3.27Å; F23-T25 PolarHBondContact O-N 2.75Å; F23-T25 PolarHBondContact O-OG1 2.78Å
26	P	95.4	Very high	95.7	Very high	82 Å²	82	69.9 Å²	69.9	53%	0.532	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	145.8	-178	28.6	-35.4	0	0	0	111.7	T28 T48	P26-T28 HydrophobicContact CG-CG2 4.4Å; P26-T28 PolarHBondContact O-N 2.76Å; P26-T28 PolarHBondContact O-OG1 3.32Å; P26-T48 HydrophobicContact CB-CG2 3.97Å
27	L	97.2	Very high	95.6	Very high	5 Å²	5	64.6 Å²	64.6	3%	0.026	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	117.7	173.4	-71.8	-174.9	0	0	0	110.1	L17 V18 G19 T48 I49 T57 M60 A65	L17-L27 HydrophobicContact CD1-CB 4.16Å; L17-L27 HydrophobicContact CD1-CD2 4.15Å; L17-L27 HydrophobicContact CD2-CD2 4.09Å; L17-L27 HydrophobicContact CG-CD2 4.2Å; V18-L27 WeakPolarHBondContact O-CA 3.2Å; G19-L27 WeakPolarHBondContact O-CD2 3.29Å; L27-T48 CarbonylContact O-C 3.37Å; L27-T48 WeakPolarHBondContact O-CA 3.43Å; L27-I49 HydrophobicContact CB-CB 4.31Å; L27-I49 PolarHBondContact O-N 2.72Å; L27-T57 HydrophobicContact CD1-CG2 3.71Å; L27-M60 HydrophobicContact CD1-CE 4.03Å; L27-A65 HydrophobicContact CD1-CB 3.43Å; L27-A65 VanDerWaalsContact CD1-CB 3.43Å; L27-A65 HydrophobicContact CD2-CB 4.06Å; L27-A65 HydrophobicContact CG-CB 4.44Å
28	T	96.4	Very high	95.6	Very high	32 Å²	32	63.6 Å²	63.6	20%	0.196	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	151.3	-173.2	38.9	0	0	0	0	111.9	V18 P26 D47 T48	V18-T28 WeakPolarHBondContact CG2-OG1 3.12Å; V18-T28 PolarHBondContact N-O 2.97Å; V18-T28 PolarHBondContact O-N 3.19Å; P26-T28 HydrophobicContact CG-CG2 4.4Å; P26-T28 PolarHBondContact O-N 2.76Å; P26-T28 PolarHBondContact O-OG1 3.32Å; T28-D47 CarbonylContact C-O 3.55Å; T28-D47 VanDerWaalsContact CA-O 3.27Å; T28-D47 WeakPolarHBondContact CA-O 3.43Å; T28-T48 HydrophobicContact CG2-CG2 4.38Å; T28-T48 WeakPolarHBondContact CG2-OG1 3.1Å
29	I	96.3	Very high	95.5	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	114	176.4	-58.5	-178	0	0	0	109	F15 I32 L43 P45 G46 D47 I49 I80	F15-I29 HydrophobicContact CB-CG2 4.07Å; F15-I29 HydrophobicContact CD2-CD1 4.31Å; F15-I29 HydrophobicContact CD2-CG1 4.14Å; F15-I29 HydrophobicContact CD2-CG2 4.42Å; I29-I32 HydrophobicContact CG2-CD1 3.94Å; I29-I32 HydrophobicContact CG2-CG1 3.62Å; I29-L43 HydrophobicContact CD1-CB 4.07Å; I29-L43 HydrophobicContact CD1-CD1 3.97Å; I29-L43 HydrophobicContact CD1-CD2 4.02Å; I29-L43 HydrophobicContact CD1-CG 4.25Å; I29-P45 CarbonylContact O-C 3.46Å; I29-P45 WeakPolarHBondContact O-CA 3.43Å; I29-G46 PolarHBondContact O-N 2.83Å; I29-D47 HydrophobicContact CB-CB 4.44Å; I29-D47 HydrophobicContact CD1-CB 4.14Å; I29-D47 HydrophobicContact CG1-CB 4.37Å; I29-D47 PolarHBondContact N-O 2.83Å; I29-I49 HydrophobicContact CD1-CD1 4.5Å; I29-I49 HydrophobicContact CG1-CD1 4.12Å; I29-I49 HydrophobicContact CG1-CG1 4.23Å; I29-I80 HydrophobicContact CD1-CD1 4.5Å
30	S	95.8	Very high	95.4	Very high	46 Å²	46	68.6 Å²	68.6	32%	0.322	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-33.2	-178.6	62.8	0	0	0	0	114	R16	R16-S30 VanDerWaalsContact CB-OG 3.27Å; R16-S30 WeakPolarHBondContact CB-OG 3.42Å; R16-S30 PolarHBondContact O-N 2.99Å; R16-S30 PolarHBondContact O-OG 3.39Å
31	R	94.4	Very high	95.2	Very high	166 Å²	166	69.4 Å²	69.4	63%	0.626	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.1	153.5	-179.1	-62.9	-171.1	-176.5	175.9	0.4	110.5	F15 R16	F15-R31 CarbonylContact C-O 3.49Å; F15-R31 WeakPolarHBondContact CA-O 3.22Å; R16-R31 HydrophobicContact CB-CB 4.27Å; R16-R31 HydrophobicContact CG-CB 4.46Å; R16-R31 PolarHBondContact N-O 3.07Å
32	I	96.6	Very high	95	Very high	38 Å²	38	68 Å²	68	20%	0.195	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	141	174.2	-63.1	175.2	0	0	0	108.3	G14 F15 I29 A38 A39 L43	G14-I32 WeakPolarHBondContact O-CA 3.2Å; F15-I32 HydrophobicContact CB-CG1 4.07Å; I29-I32 HydrophobicContact CG2-CD1 3.94Å; I29-I32 HydrophobicContact CG2-CG1 3.62Å; I32-A38 HydrophobicContact CG2-CB 3.98Å; I32-A39 HydrophobicContact CG2-CB 3.93Å; I32-L43 HydrophobicContact CD1-CB 3.56Å; I32-L43 WeakPolarHBondContact CD1-O 3.47Å
33	T	96.1	Very high	94.9	Very high	89 Å²	89	64.6 Å²	64.6	55%	0.546	38%	0.38	S	S	.	.			trans	-84	123.5	175.2	-58.9	0	0	0	0	109.3	G14 G35 S36	G14-T33 PolarHBondContact O-N 3.12Å; T33-G35 PolarHBondContact O-N 3.38Å; T33-S36 WeakPolarHBondContact O-CB 3.37Å; T33-S36 PolarHBondContact O-N 3.29Å; T33-S36 VanDerWaalsContact O-N 3.14Å; T33-S36 PolarHBondContact O-OG 2.81Å
34	S	94.2	Very high	94.8	Very high	117 Å²	117	61.1 Å²	61.1	82%	0.818	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	137.2	176.6	-49.3	0	0	0	0	111.8	S36	S34-S36 PolarHBondContact O-N 2.98Å
35	G	92.9	Very high	94.8	Very high	65 Å²	65	59.6 Å²	59.6	67%	0.67	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	-0.3	-178.9	0	0	0	0	0	115.9	T33 Q40	T33-G35 PolarHBondContact O-N 3.38Å; G35-Q40 PolarHBondContact O-NE2 2.97Å
36	S	95.6	Very high	94.8	Very high	19 Å²	19	58.7 Å²	58.7	13%	0.133	36%	0.362	C	S	.	.	S	Bend	trans	-78.2	168.3	176.4	72.1	0	0	0	0	113.2	G14 T33 S34 A38 A39 Q40	G14-S36 PolarHBondContact O-OG 2.92Å; T33-S36 WeakPolarHBondContact O-CB 3.37Å; T33-S36 PolarHBondContact O-N 3.29Å; T33-S36 VanDerWaalsContact O-N 3.14Å; T33-S36 PolarHBondContact O-OG 2.81Å; S34-S36 PolarHBondContact O-N 2.98Å; S36-A38 VanDerWaalsContact C-N 3.27Å; S36-A38 PolarHBondContact O-N 2.85Å; S36-A39 WeakPolarHBondContact O-CA 3.4Å; S36-A39 WeakPolarHBondContact O-CB 3.35Å; S36-A39 PolarHBondContact O-N 2.65Å; S36-Q40 WeakPolarHBondContact O-CG 3.42Å; S36-Q40 PolarHBondContact O-N 3.46Å
37	K	95	Very high	94.8	Very high	57 Å²	57	54.9 Å²	54.9	25%	0.248	34%	0.337	C	S	.	.	H	α-helix	trans	-52.3	-43.2	174.3	-76.8	155	169.8	170.5	0	112.5	L7 K8 G9 P10 W13 A39 Q40 G41	L7-K37 WeakPolarHBondContact CD2-O 3.47Å; K8-K37 WeakPolarHBondContact O-CD 3.43Å; K8-K37 WeakPolarHBondContact O-CE 3.37Å; G9-K37 WeakPolarHBondContact O-CE 3.4Å; G9-K37 PolarHBondContact O-NZ 3.03Å; P10-K37 PolarHBondContact O-NZ 2.83Å; W13-K37 HydrophobicContact CE3-CD 4.49Å; K37-A39 VanDerWaalsContact C-N 3.31Å; K37-A39 PolarHBondContact O-N 3.21Å; K37-Q40 WeakPolarHBondContact O-CB 3.39Å; K37-Q40 PolarHBondContact O-N 2.83Å; K37-Q40 VanDerWaalsContact O-N 3.12Å; K37-G41 PolarHBondContact O-N 2.82Å; K37-G41 VanDerWaalsContact O-N 3.07Å
38	A	95.9	Very high	94.8	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-59.2	-39	174.8	0	0	0	0	0	113.4	L7 W13 F15 I32 S36 G41 L43	L7-A38 HydrophobicContact CD1-CB 4.24Å; W13-A38 VanDerWaalsContact O-CB 3.29Å; W13-A38 WeakPolarHBondContact O-CB 3.19Å; W13-A38 PolarHBondContact O-N 2.91Å; F15-A38 HydrophobicContact CB-CB 3.95Å; F15-A38 HydrophobicContact CD1-CB 4Å; F15-A38 HydrophobicContact CG-CB 4.43Å; I32-A38 HydrophobicContact CG2-CB 3.98Å; S36-A38 VanDerWaalsContact C-N 3.27Å; S36-A38 PolarHBondContact O-N 2.85Å; A38-G41 PolarHBondContact O-N 2.89Å; A38-L43 HydrophobicContact CB-CD1 3.93Å; A38-L43 WeakPolarHBondContact O-CB 3.47Å; A38-L43 PolarHBondContact O-N 2.84Å
39	A	94.5	Very high	94.8	Very high	39 Å²	39	54.7 Å²	54.7	32%	0.322	34%	0.336	S	S	.	.	H	α-helix	trans	-72.3	-29.5	175.6	0	0	0	0	0	112.6	I32 S36 K37 G41	I32-A39 HydrophobicContact CG2-CB 3.93Å; S36-A39 WeakPolarHBondContact O-CA 3.4Å; S36-A39 WeakPolarHBondContact O-CB 3.35Å; S36-A39 PolarHBondContact O-N 2.65Å; K37-A39 VanDerWaalsContact C-N 3.31Å; K37-A39 PolarHBondContact O-N 3.21Å; A39-G41 VanDerWaalsContact C-N 3.29Å
40	Q	93.8	Very high	94.8	Very high	141 Å²	141	58.1 Å²	58.1	66%	0.659	35%	0.354	S	S	*	.	H	α-helix	trans	-75.1	-16.6	174.3	-65.3	166.5	4.4	0	0	113.2	G35 S36 K37	G35-Q40 PolarHBondContact O-NE2 2.97Å; S36-Q40 WeakPolarHBondContact O-CG 3.42Å; S36-Q40 PolarHBondContact O-N 3.46Å; K37-Q40 WeakPolarHBondContact O-CB 3.39Å; K37-Q40 PolarHBondContact O-N 2.83Å; K37-Q40 VanDerWaalsContact O-N 3.12Å
41	G	92.5	Very high	94.8	Very high	18 Å²	18	56.2 Å²	56.2	19%	0.186	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	22.2	174.7	0	0	0	0	0	114	V5 K37 A38 A39 L43	V5-G41 WeakPolarHBondContact CG1-O 3.27Å; K37-G41 PolarHBondContact O-N 2.82Å; K37-G41 VanDerWaalsContact O-N 3.07Å; A38-G41 PolarHBondContact O-N 2.89Å; A39-G41 VanDerWaalsContact C-N 3.29Å; G41-L43 PolarHBondContact O-N 2.89Å
42	D	92	Very high	94.9	Very high	121 Å²	121	48.3 Å²	48.3	65%	0.647	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	25.1	178.3	-70.5	-67.9	0	0	0	115.7	R82	D42-R82 PolarHBondContact O-NH2 2.81Å
43	L	94.3	Very high	94.8	Very high	9 Å²	9	50.5 Å²	50.5	5%	0.047	32%	0.324	C	S	.	.			trans	-67.1	146.7	169.7	-62.1	174.9	0	0	0	109.6	V5 L7 I29 I32 A38 G41 L78 I80	V5-L43 HydrophobicContact CB-CD2 4.06Å; V5-L43 HydrophobicContact CG1-CD1 4.47Å; V5-L43 HydrophobicContact CG1-CD2 4.01Å; V5-L43 HydrophobicContact CG1-CG 4.09Å; V5-L43 HydrophobicContact CG2-CD2 3.85Å; L7-L43 HydrophobicContact CD1-CD1 4.06Å; L7-L43 HydrophobicContact CD2-CD1 4.42Å; I29-L43 HydrophobicContact CD1-CB 4.07Å; I29-L43 HydrophobicContact CD1-CD1 3.97Å; I29-L43 HydrophobicContact CD1-CD2 4.02Å; I29-L43 HydrophobicContact CD1-CG 4.25Å; I32-L43 HydrophobicContact CD1-CB 3.56Å; I32-L43 WeakPolarHBondContact CD1-O 3.47Å; A38-L43 HydrophobicContact CB-CD1 3.93Å; A38-L43 WeakPolarHBondContact O-CB 3.47Å; A38-L43 PolarHBondContact O-N 2.84Å; G41-L43 PolarHBondContact O-N 2.89Å; L43-L78 HydrophobicContact CD1-CD1 4.05Å; L43-I80 HydrophobicContact CD2-CD1 3.73Å; L43-I80 HydrophobicContact CD2-CG1 3.61Å
44	C	93.4	Very high	94.6	Very high	51 Å²	51	49.3 Å²	49.3	35%	0.345	33%	0.329	S	S	.	.			trans	-128.5	150.9	178.2	-70.5	0	0	0	0	111.4	G46 D47 R82	C44-G46 PolarHBondContact O-N 3.06Å; C44-D47 PolarHBondContact N-OD2 3.37Å; C44-D47 VanDerWaalsContact O-CB 3.27Å; C44-D47 WeakPolarHBondContact O-CB 3.48Å; C44-D47 VanDerWaalsContact O-CG 3.3Å; C44-D47 PolarHBondContact O-N 3.42Å; C44-R82 PolarHBondContact SG-NH2 2.75Å
45	P	95	Very high	94.6	Very high	85 Å²	85	47.5 Å²	47.5	55%	0.552	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	136.1	163.8	-20.8	33.8	0	0	0	110.5	I29	I29-P45 CarbonylContact O-C 3.46Å; I29-P45 WeakPolarHBondContact O-CA 3.43Å
46	G	93.6	Very high	94.7	Very high	51 Å²	51	47.9 Å²	47.9	53%	0.526	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.9	-14.3	-173.3	0	0	0	0	0	114.7	I29 C44 T48	I29-G46 PolarHBondContact O-N 2.83Å; C44-G46 PolarHBondContact O-N 3.06Å; G46-T48 PolarHBondContact O-N 2.77Å
47	D	95.3	Very high	94.7	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.016	30%	0.3	C	S	.	.			trans	-59.8	132.6	174.8	-81	-14.8	0	0	0	111.6	T28 I29 C44 I80 R82	T28-D47 CarbonylContact C-O 3.55Å; T28-D47 VanDerWaalsContact CA-O 3.27Å; T28-D47 WeakPolarHBondContact CA-O 3.43Å; I29-D47 HydrophobicContact CB-CB 4.44Å; I29-D47 HydrophobicContact CD1-CB 4.14Å; I29-D47 HydrophobicContact CG1-CB 4.37Å; I29-D47 PolarHBondContact N-O 2.83Å; C44-D47 PolarHBondContact N-OD2 3.37Å; C44-D47 VanDerWaalsContact O-CB 3.27Å; C44-D47 WeakPolarHBondContact O-CB 3.48Å; C44-D47 VanDerWaalsContact O-CG 3.3Å; C44-D47 PolarHBondContact O-N 3.42Å; D47-I80 HydrophobicContact CB-CG2 3.66Å; D47-R82 IonicContact OD1-CZ 2.64Å; D47-R82 IonicContact OD1-NE 2.63Å; D47-R82 PolarHBondContact OD1-NE 2.89Å; D47-R82 IonicContact OD1-NH2 2.95Å; D47-R82 PolarHBondContact OD1-NH2 2.79Å; D47-R82 IonicContact OD2-CZ 3.68Å; D47-R82 IonicContact OD2-NE 3.4Å; D47-R82 IonicContact OD2-NH2 3.82Å; D47-R82 PolarHBondContact OD2-NH2 2.77Å
48	T	96.4	Very high	94.7	Very high	32 Å²	32	51.5 Å²	51.5	20%	0.196	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	126.2	176.2	-59.2	0	0	0	0	110.1	P26 L27 T28 G46 L50 I80 S81	P26-T48 HydrophobicContact CB-CG2 3.97Å; L27-T48 CarbonylContact O-C 3.37Å; L27-T48 WeakPolarHBondContact O-CA 3.43Å; T28-T48 HydrophobicContact CG2-CG2 4.38Å; T28-T48 WeakPolarHBondContact CG2-OG1 3.1Å; G46-T48 PolarHBondContact O-N 2.77Å; T48-L50 HydrophobicContact CG2-CD2 4.25Å; T48-I80 CarbonylContact O-C 3.53Å; T48-I80 WeakPolarHBondContact O-CA 3.39Å; T48-S81 PolarHBondContact N-O 3.31Å; T48-S81 PolarHBondContact O-N 2.97Å
49	I	96.8	Very high	94.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	115.5	178.4	-50.5	-179.3	0	0	0	108.6	F15 L17 L27 I29 A51 I52 T57 L78 I80	F15-I49 HydrophobicContact CE2-CD1 4.2Å; L17-I49 HydrophobicContact CD1-CD1 3.71Å; L27-I49 HydrophobicContact CB-CB 4.31Å; L27-I49 PolarHBondContact O-N 2.72Å; I29-I49 HydrophobicContact CD1-CD1 4.5Å; I29-I49 HydrophobicContact CG1-CD1 4.12Å; I29-I49 HydrophobicContact CG1-CG1 4.23Å; I49-A51 WeakPolarHBondContact CG2-O 3.4Å; I49-I52 HydrophobicContact CG2-CD1 4.35Å; I49-I52 HydrophobicContact CG2-CG1 3.81Å; I49-T57 HydrophobicContact CB-CG2 4.46Å; I49-T57 HydrophobicContact CG2-CG2 3.94Å; I49-T57 WeakPolarHBondContact O-CB 3.29Å; I49-T57 WeakPolarHBondContact O-CG2 3.36Å; I49-T57 PolarHBondContact O-OG1 2.8Å; I49-L78 HydrophobicContact CD1-CD1 4.33Å; I49-L78 HydrophobicContact CG2-CD2 4.05Å; I49-I80 HydrophobicContact CB-CD1 4.48Å; I49-I80 HydrophobicContact CG1-CD1 3.92Å
50	L	96.1	Very high	94.6	Very high	74 Å²	74	56.9 Å²	56.9	39%	0.387	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-28.4	177.2	-61.2	-174.7	0	0	0	113.4	T48 T57 I79	T48-L50 HydrophobicContact CG2-CD2 4.25Å; L50-T57 VanDerWaalsContact CA-OG1 3.29Å; L50-T57 WeakPolarHBondContact CA-OG1 3.45Å; L50-T57 PolarHBondContact O-N 2.87Å; L50-T57 PolarHBondContact O-OG1 2.93Å; L50-I79 HydrophobicContact CB-CB 4.45Å; L50-I79 HydrophobicContact CB-CG2 4.19Å; L50-I79 HydrophobicContact CD1-CG2 4.47Å; L50-I79 PolarHBondContact N-O 3.2Å
51	A	96.8	Very high	94.7	Very high	6 Å²	6	51.6 Å²	51.6	5%	0.05	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	153.6	175.2	0	0	0	0	0	112.4	I49 D55 L78 I79	I49-A51 WeakPolarHBondContact CG2-O 3.4Å; A51-D55 CarbonylContact C-O 3.44Å; A51-D55 WeakPolarHBondContact CA-O 3.1Å; A51-D55 VanDerWaalsContact CB-O 3.3Å; A51-D55 WeakPolarHBondContact CB-O 3.4Å; A51-L78 WeakPolarHBondContact O-CA 3.45Å; A51-I79 HydrophobicContact CB-CB 3.87Å; A51-I79 HydrophobicContact CB-CD1 3.86Å; A51-I79 HydrophobicContact CB-CG1 3.91Å; A51-I79 PolarHBondContact N-O 3.42Å; A51-I79 PolarHBondContact O-N 3.41Å
52	I	96.8	Very high	94.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	118	175.4	-54.2	-173.1	0	0	0	108.3	I49 G54 D55 T57 M60 A65 K68 I69 L76 L78	I49-I52 HydrophobicContact CG2-CD1 4.35Å; I49-I52 HydrophobicContact CG2-CG1 3.81Å; I52-G54 PolarHBondContact O-N 2.81Å; I52-G54 VanDerWaalsContact O-N 3.1Å; I52-D55 PolarHBondContact N-O 3.02Å; I52-D55 WeakPolarHBondContact O-CB 3.47Å; I52-D55 PolarHBondContact O-N 2.9Å; I52-T57 HydrophobicContact CD1-CG2 4.31Å; I52-T57 HydrophobicContact CG1-CG2 3.89Å; I52-M60 HydrophobicContact CB-CE 4.49Å; I52-M60 HydrophobicContact CD1-CE 3.68Å; I52-M60 HydrophobicContact CG1-CE 4.08Å; I52-A65 HydrophobicContact CD1-CB 4.3Å; I52-K68 HydrophobicContact CG2-CB 4.15Å; I52-I69 HydrophobicContact CD1-CD1 3.91Å; I52-I69 HydrophobicContact CD1-CG1 3.92Å; I52-I69 HydrophobicContact CG2-CG1 4.34Å; I52-L76 HydrophobicContact CG2-CD1 3.83Å; I52-L78 HydrophobicContact CB-CD2 4.34Å; I52-L78 HydrophobicContact CD1-CD2 4.49Å; I52-L78 HydrophobicContact CG1-CD2 3.91Å; I52-L78 HydrophobicContact CG2-CD2 4.15Å
53	N	93.5	Very high	95.2	Very high	84 Å²	84	51.8 Å²	51.8	45%	0.449	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	29.6	-172.8	-71.1	-1	0	0	0	114.8	C72 T77	N53-C72 PolarHBondContact ND2-SG 2.83Å; N53-T77 PolarHBondContact N-O 3.37Å; N53-T77 PolarHBondContact OD1-N 3.42Å; N53-T77 PolarHBondContact OD1-O 3.06Å
54	G	92	Very high	95.3	Very high	64 Å²	64	56 Å²	56	66%	0.66	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.5	-16.6	-178.1	0	0	0	0	0	114.7	I52	I52-G54 PolarHBondContact O-N 2.81Å; I52-G54 VanDerWaalsContact O-N 3.1Å
55	D	94.7	Very high	95.5	Very high	78 Å²	78	53.5 Å²	53.5	42%	0.417	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	126.4	173.7	-67.1	-73.5	0	0	0	111.3	A51 I52 K68	A51-D55 CarbonylContact C-O 3.44Å; A51-D55 WeakPolarHBondContact CA-O 3.1Å; A51-D55 VanDerWaalsContact CB-O 3.3Å; A51-D55 WeakPolarHBondContact CB-O 3.4Å; I52-D55 PolarHBondContact N-O 3.02Å; I52-D55 WeakPolarHBondContact O-CB 3.47Å; I52-D55 PolarHBondContact O-N 2.9Å; D55-K68 HydrophobicContact CB-CD 4.49Å; D55-K68 VanDerWaalsContact CB-NZ 3.35Å; D55-K68 IonicContact OD1-NZ 2.72Å; D55-K68 PolarHBondContact OD1-NZ 2.89Å; D55-K68 IonicContact OD2-NZ 3.69Å; D55-K68 PolarHBondContact OD2-NZ 3.01Å
56	S	95.6	Very high	95.5	Very high	74 Å²	74	52.5 Å²	52.5	52%	0.517	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	140.5	173.5	179.7	0	0	0	0	111.9	E58	S56-E58 PolarHBondContact OG-N 2.9Å
57	T	95.5	Very high	95.6	Very high	14 Å²	14	53.5 Å²	53.5	9%	0.086	29%	0.291	C	S	.	.	S	Bend	trans	-88.6	-13.4	177.6	57.3	0	0	0	0	114.6	L27 I49 L50 I52 F59 M60	L27-T57 HydrophobicContact CD1-CG2 3.71Å; I49-T57 HydrophobicContact CB-CG2 4.46Å; I49-T57 HydrophobicContact CG2-CG2 3.94Å; I49-T57 WeakPolarHBondContact O-CB 3.29Å; I49-T57 WeakPolarHBondContact O-CG2 3.36Å; I49-T57 PolarHBondContact O-OG1 2.8Å; L50-T57 VanDerWaalsContact CA-OG1 3.29Å; L50-T57 WeakPolarHBondContact CA-OG1 3.45Å; L50-T57 PolarHBondContact O-N 2.87Å; L50-T57 PolarHBondContact O-OG1 2.93Å; I52-T57 HydrophobicContact CD1-CG2 4.31Å; I52-T57 HydrophobicContact CG1-CG2 3.89Å; T57-F59 PolarHBondContact O-N 3.22Å; T57-F59 VanDerWaalsContact O-N 3.11Å; T57-M60 HydrophobicContact CG2-CE 3.75Å; T57-M60 WeakPolarHBondContact O-CB 3.34Å; T57-M60 PolarHBondContact O-N 3.17Å
58	E	93.2	Very high	95.6	Very high	138 Å²	138	57 Å²	57	65%	0.645	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-41.3	-169.7	-175.8	177.6	-169.3	0	0	113.4	S56	S56-E58 PolarHBondContact OG-N 2.9Å
59	F	93.4	Very high	95.6	Very high	140 Å²	140	56.2 Å²	56.2	61%	0.614	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	0.9	-178.4	-58.5	-73.5	0	0	0	114.4	R21 T57	R21-F59 WeakPolarHBondContact CD-O 3.49Å; R21-F59 PolarHBondContact NE-O 3.45Å; T57-F59 PolarHBondContact O-N 3.22Å; T57-F59 VanDerWaalsContact O-N 3.11Å
60	M	95.4	Very high	95.4	Very high	12 Å²	12	61.5 Å²	61.5	6%	0.059	32%	0.323	C	S	.	.			trans	-85.3	134.7	-170.5	-169.1	160.7	52.2	0	0	112.2	R21 L27 I52 T57 E64 A65 K68	R21-M60 PolarHBondContact N-O 2.85Å; L27-M60 HydrophobicContact CD1-CE 4.03Å; I52-M60 HydrophobicContact CB-CE 4.49Å; I52-M60 HydrophobicContact CD1-CE 3.68Å; I52-M60 HydrophobicContact CG1-CE 4.08Å; T57-M60 HydrophobicContact CG2-CE 3.75Å; T57-M60 WeakPolarHBondContact O-CB 3.34Å; T57-M60 PolarHBondContact O-N 3.17Å; M60-E64 HydrophobicContact CG-CB 3.5Å; M60-E64 VanDerWaalsContact CG-CB 3.5Å; M60-E64 HydrophobicContact SD-CB 4.01Å; M60-A65 HydrophobicContact CE-CB 3.83Å; M60-A65 HydrophobicContact CG-CB 4.21Å; M60-A65 HydrophobicContact SD-CB 4.22Å; M60-K68 HydrophobicContact SD-CD 3.85Å; M60-K68 HydrophobicContact SD-CG 4.42Å
61	T	97.1	Very high	95.3	Very high	29 Å²	29	63.4 Å²	63.4	18%	0.178	34%	0.338	C	S	.	.			trans	-74.6	161.3	172.5	63.8	0	0	0	0	111.8	D22 M63 E64 A65	D22-T61 HydrophobicContact CB-CG2 4.1Å; D22-T61 VanDerWaalsContact OD1-CA 3.29Å; D22-T61 WeakPolarHBondContact OD1-CA 3.07Å; T61-M63 PolarHBondContact O-N 3.31Å; T61-E64 VanDerWaalsContact CB-OE2 3.28Å; T61-E64 WeakPolarHBondContact CB-OE2 3.29Å; T61-E64 WeakPolarHBondContact CG2-OE2 3.3Å; T61-E64 PolarHBondContact N-OE2 3.09Å; T61-E64 PolarHBondContact O-N 2.93Å; T61-E64 VanDerWaalsContact OG1-CD 3.27Å; T61-E64 VanDerWaalsContact OG1-CG 3.28Å; T61-E64 WeakPolarHBondContact OG1-CG 3.35Å; T61-E64 PolarHBondContact OG1-N 2.82Å; T61-E64 PolarHBondContact OG1-OE2 2.92Å; T61-A65 WeakPolarHBondContact O-CB 3.08Å; T61-A65 PolarHBondContact O-N 3.21Å
62	H	96.8	Very high	95.1	Very high	34 Å²	34	63.5 Å²	63.5	16%	0.157	34%	0.338	C	S	.	.	H	α-helix	trans	-56.1	-39.1	175.1	-169.9	82.9	0	0	0	112.5	G19 D22 F23 Q66	G19-H62 WeakPolarHBondContact O-CB 3.42Å; G19-H62 PolarHBondContact O-ND1 3.12Å; D22-H62 PolarHBondContact OD1-N 3.23Å; D22-H62 WeakPolarHBondContact OD2-CB 3.39Å; D22-H62 PolarHBondContact OD2-N 2.64Å; F23-H62 HydrophobicContact CD2-CB 3.89Å; F23-H62 HydrophobicContact CE2-CB 3.63Å; H62-Q66 PolarHBondContact CD2-NE2 3.1Å; H62-Q66 VanDerWaalsContact CD2-NE2 3.34Å; H62-Q66 PolarHBondContact NE2-NE2 3.15Å; H62-Q66 WeakPolarHBondContact O-CB 3.39Å; H62-Q66 WeakPolarHBondContact O-CG 3.45Å; H62-Q66 PolarHBondContact O-N 2.94Å
63	M	96.8	Very high	94.8	Very high	110 Å²	110	67.8 Å²	67.8	54%	0.542	36%	0.364	S	S	.	.	H	α-helix	trans	-68.9	-46.5	179.6	-175.2	60.2	72	0	0	111.8	T61 A65 Q66 N67	T61-M63 PolarHBondContact O-N 3.31Å; M63-A65 VanDerWaalsContact C-N 3.33Å; M63-A65 PolarHBondContact O-N 3.04Å; M63-Q66 PolarHBondContact O-N 2.78Å; M63-N67 WeakPolarHBondContact O-CB 3.44Å; M63-N67 PolarHBondContact O-N 3.27Å; M63-N67 PolarHBondContact O-ND2 3.5Å; M63-N67 PolarHBondContact O-OD1 3.42Å
64	E	96.8	Very high	94.8	Very high	96 Å²	96	71.7 Å²	71.7	45%	0.449	38%	0.38	S	S	.	.	H	α-helix	trans	-60.9	-43.8	176	-70.7	163.6	127.9	0	0	111.3	M60 T61 N67 K68	M60-E64 HydrophobicContact CG-CB 3.5Å; M60-E64 VanDerWaalsContact CG-CB 3.5Å; M60-E64 HydrophobicContact SD-CB 4.01Å; T61-E64 VanDerWaalsContact CB-OE2 3.28Å; T61-E64 WeakPolarHBondContact CB-OE2 3.29Å; T61-E64 WeakPolarHBondContact CG2-OE2 3.3Å; T61-E64 PolarHBondContact N-OE2 3.09Å; T61-E64 PolarHBondContact O-N 2.93Å; T61-E64 VanDerWaalsContact OG1-CD 3.27Å; T61-E64 VanDerWaalsContact OG1-CG 3.28Å; T61-E64 WeakPolarHBondContact OG1-CG 3.35Å; T61-E64 PolarHBondContact OG1-N 2.82Å; T61-E64 PolarHBondContact OG1-OE2 2.92Å; E64-N67 PolarHBondContact O-N 3.07Å; E64-N67 VanDerWaalsContact O-N 3.15Å; E64-K68 PolarHBondContact O-N 2.87Å
65	A	97.1	Very high	94.9	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-61.1	-48.4	176.9	0	0	0	0	0	112.2	L17 L27 I52 M60 T61 M63 N67 K68 I69	L17-A65 HydrophobicContact CD2-CB 3.73Å; L27-A65 HydrophobicContact CD1-CB 3.43Å; L27-A65 VanDerWaalsContact CD1-CB 3.43Å; L27-A65 HydrophobicContact CD2-CB 4.06Å; L27-A65 HydrophobicContact CG-CB 4.44Å; I52-A65 HydrophobicContact CD1-CB 4.3Å; M60-A65 HydrophobicContact CE-CB 3.83Å; M60-A65 HydrophobicContact CG-CB 4.21Å; M60-A65 HydrophobicContact SD-CB 4.22Å; T61-A65 WeakPolarHBondContact O-CB 3.08Å; T61-A65 PolarHBondContact O-N 3.21Å; M63-A65 VanDerWaalsContact C-N 3.33Å; M63-A65 PolarHBondContact O-N 3.04Å; A65-N67 VanDerWaalsContact C-N 3.27Å; A65-N67 PolarHBondContact O-N 2.93Å; A65-K68 PolarHBondContact O-N 3.2Å; A65-I69 WeakPolarHBondContact O-CD1 3.16Å; A65-I69 VanDerWaalsContact O-CG1 3.29Å; A65-I69 WeakPolarHBondContact O-CG1 3.21Å; A65-I69 PolarHBondContact O-N 3.04Å
66	Q	96.2	Very high	95	Very high	63 Å²	63	68.7 Å²	68.7	29%	0.294	35%	0.346	S	S	.	.	H	α-helix	trans	-56.6	-42.1	172.6	-82.6	-160.9	28.4	0	0	111.8	L17 H62 M63 I69 K70	L17-Q66 HydrophobicContact CD2-CG 4.3Å; H62-Q66 PolarHBondContact CD2-NE2 3.1Å; H62-Q66 VanDerWaalsContact CD2-NE2 3.34Å; H62-Q66 PolarHBondContact NE2-NE2 3.15Å; H62-Q66 WeakPolarHBondContact O-CB 3.39Å; H62-Q66 WeakPolarHBondContact O-CG 3.45Å; H62-Q66 PolarHBondContact O-N 2.94Å; M63-Q66 PolarHBondContact O-N 2.78Å; Q66-I69 PolarHBondContact O-N 3.4Å; Q66-K70 WeakPolarHBondContact O-CB 3.41Å; Q66-K70 WeakPolarHBondContact O-CD 3.37Å; Q66-K70 WeakPolarHBondContact O-CG 3.42Å; Q66-K70 PolarHBondContact O-N 2.97Å
67	N	95.9	Very high	95	Very high	72 Å²	72	66.8 Å²	66.8	39%	0.385	33%	0.332	S	S	.	.	H	α-helix	trans	-70.1	-42.6	-176.9	-69.1	-13.9	0	0	0	111.7	M63 E64 A65 I69 K70 T71	M63-N67 WeakPolarHBondContact O-CB 3.44Å; M63-N67 PolarHBondContact O-N 3.27Å; M63-N67 PolarHBondContact O-ND2 3.5Å; M63-N67 PolarHBondContact O-OD1 3.42Å; E64-N67 PolarHBondContact O-N 3.07Å; E64-N67 VanDerWaalsContact O-N 3.15Å; A65-N67 VanDerWaalsContact C-N 3.27Å; A65-N67 PolarHBondContact O-N 2.93Å; N67-I69 VanDerWaalsContact C-N 3.34Å; N67-I69 PolarHBondContact O-N 2.89Å; N67-K70 PolarHBondContact O-N 3.34Å; N67-T71 WeakPolarHBondContact O-CB 3.43Å; N67-T71 PolarHBondContact O-N 2.87Å; N67-T71 PolarHBondContact O-OG1 2.95Å; N67-T71 VanDerWaalsContact O-OG1 3.1Å
68	K	95.5	Very high	95.1	Very high	76 Å²	76	66.1 Å²	66.1	33%	0.33	33%	0.328	S	S	.	.	H	α-helix	trans	-57.8	-45.4	171.5	-68.7	-164.8	-178.5	-168.6	0	111.6	I52 D55 M60 E64 A65 K70 T71 C72	I52-K68 HydrophobicContact CG2-CB 4.15Å; D55-K68 HydrophobicContact CB-CD 4.49Å; D55-K68 VanDerWaalsContact CB-NZ 3.35Å; D55-K68 IonicContact OD1-NZ 2.72Å; D55-K68 PolarHBondContact OD1-NZ 2.89Å; D55-K68 IonicContact OD2-NZ 3.69Å; D55-K68 PolarHBondContact OD2-NZ 3.01Å; M60-K68 HydrophobicContact SD-CD 3.85Å; M60-K68 HydrophobicContact SD-CG 4.42Å; E64-K68 PolarHBondContact O-N 2.87Å; A65-K68 PolarHBondContact O-N 3.2Å; K68-K70 VanDerWaalsContact C-N 3.35Å; K68-K70 PolarHBondContact O-N 3Å; K68-T71 PolarHBondContact O-N 2.76Å; K68-C72 PolarHBondContact O-N 3.12Å; K68-C72 PolarHBondContact O-SG 2.81Å
69	I	95.9	Very high	95.3	Very high	16 Å²	16	62.3 Å²	62.3	8%	0.082	31%	0.311	C	S	.	.	H	α-helix	trans	-61.7	-38.2	176.7	-69.3	162	0	0	0	112.5	W13 F15 L17 I52 A65 Q66 N67 L76	W13-I69 PolarHBondContact NE1-O 2.91Å; F15-I69 HydrophobicContact CE1-CG2 4.45Å; F15-I69 HydrophobicContact CE2-CD1 4.08Å; F15-I69 HydrophobicContact CZ-CD1 3.82Å; F15-I69 HydrophobicContact CZ-CG1 4.3Å; F15-I69 HydrophobicContact CZ-CG2 4.08Å; L17-I69 HydrophobicContact CD2-CD1 4.05Å; I52-I69 HydrophobicContact CD1-CD1 3.91Å; I52-I69 HydrophobicContact CD1-CG1 3.92Å; I52-I69 HydrophobicContact CG2-CG1 4.34Å; A65-I69 WeakPolarHBondContact O-CD1 3.16Å; A65-I69 VanDerWaalsContact O-CG1 3.29Å; A65-I69 WeakPolarHBondContact O-CG1 3.21Å; A65-I69 PolarHBondContact O-N 3.04Å; Q66-I69 PolarHBondContact O-N 3.4Å; N67-I69 VanDerWaalsContact C-N 3.34Å; N67-I69 PolarHBondContact O-N 2.89Å; I69-L76 HydrophobicContact CG1-CD1 4.26Å; I69-L76 HydrophobicContact CG1-CD2 4.48Å; I69-L76 HydrophobicContact CG2-CD2 4.1Å
70	K	93.3	Very high	95.4	Very high	111 Å²	111	55.6 Å²	55.6	48%	0.483	28%	0.282	S	S	.	.	H	α-helix	trans	-74	-36.4	179	-70.7	162.3	-165.8	165.2	0	113	Q66 N67 K68 C72	Q66-K70 WeakPolarHBondContact O-CB 3.41Å; Q66-K70 WeakPolarHBondContact O-CD 3.37Å; Q66-K70 WeakPolarHBondContact O-CG 3.42Å; Q66-K70 PolarHBondContact O-N 2.97Å; N67-K70 PolarHBondContact O-N 3.34Å; K68-K70 VanDerWaalsContact C-N 3.35Å; K68-K70 PolarHBondContact O-N 3Å; K70-C72 PolarHBondContact O-N 3.33Å
71	T	92.9	Very high	95.4	Very high	114 Å²	114	56.8 Å²	56.8	70%	0.699	29%	0.291	S	S	*	.	H	α-helix	trans	-70.6	-18.1	178.4	-63	0	0	0	0	112.6	N67 K68 T73	N67-T71 WeakPolarHBondContact O-CB 3.43Å; N67-T71 PolarHBondContact O-N 2.87Å; N67-T71 PolarHBondContact O-OG1 2.95Å; N67-T71 VanDerWaalsContact O-OG1 3.1Å; K68-T71 PolarHBondContact O-N 2.76Å; T71-T73 PolarHBondContact O-N 2.76Å
72	C	92.3	Very high	95.1	Very high	8 Å²	8	59.5 Å²	59.5	5%	0.054	30%	0.298	C	S	.	.			trans	-65.8	120.1	170.5	-64.1	0	0	0	0	111	W13 N53 K68 K70 E75 L76	W13-C72 HydrophobicContact CZ2-CB 3.59Å; W13-C72 WeakPolarHBondContact CZ2-O 3.41Å; N53-C72 PolarHBondContact ND2-SG 2.83Å; K68-C72 PolarHBondContact O-N 3.12Å; K68-C72 PolarHBondContact O-SG 2.81Å; K70-C72 PolarHBondContact O-N 3.33Å; C72-E75 WeakPolarHBondContact CB-O 3.49Å; C72-L76 HydrophobicContact CB-CB 4.09Å; C72-L76 HydrophobicContact CB-CD1 4.26Å; C72-L76 VanDerWaalsContact SG-CD1 3.56Å
73	T	91.2	Very high	94.4	Very high	90 Å²	90	62 Å²	62	55%	0.552	32%	0.32	S	S	*	.	S	Bend	trans	-117.9	-35.3	-178.7	52.9	0	0	0	0	114.1	P10 T71	P10-T73 WeakPolarHBondContact CA-O 3.47Å; T71-T73 PolarHBondContact O-N 2.76Å
74	Q	92.8	Very high	92.7	Very high	166 Å²	166	60.9 Å²	60.9	78%	0.776	34%	0.336	S	S	*	.	S	Bend	trans	-97.7	-41.4	-179.2	-65.3	-173.6	79.6	0	0	112.1	G9	G9-Q74 WeakPolarHBondContact CA-O 3.35Å; G9-Q74 PolarHBondContact N-O 3.39Å
75	E	95.1	Very high	90.3	Very high	79 Å²	79	61.2 Å²	61.2	37%	0.369	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	160.5	173.1	62.3	-166.8	109.6	0	0	111.5	T6 L7 K8 C72	T6-E75 HydrophobicContact CG2-CB 4.32Å; T6-E75 WeakPolarHBondContact CG2-OE2 3.2Å; L7-E75 CarbonylContact O-C 3.55Å; L7-E75 WeakPolarHBondContact O-CA 3.02Å; L7-E75 WeakPolarHBondContact O-CB 3.39Å; K8-E75 HydrophobicContact CD-CB 3.95Å; K8-E75 IonicContact NZ-OE1 3.4Å; K8-E75 PolarHBondContact NZ-OE1 3.49Å; K8-E75 IonicContact NZ-OE2 2.75Å; K8-E75 PolarHBondContact NZ-OE2 3.07Å; C72-E75 WeakPolarHBondContact CB-O 3.49Å
76	L	96.3	Very high	88.2	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	113.2	174.3	170.6	67.1	0	0	0	107.9	L7 W13 F15 I52 I69 C72 L78	L7-L76 HydrophobicContact CB-CB 4.46Å; L7-L76 HydrophobicContact CD1-CD2 4.4Å; L7-L76 PolarHBondContact N-O 2.94Å; L7-L76 PolarHBondContact O-N 2.95Å; W13-L76 HydrophobicContact CB-CD2 4.35Å; W13-L76 HydrophobicContact CD2-CB 3.99Å; W13-L76 HydrophobicContact CD2-CD2 3.76Å; W13-L76 HydrophobicContact CE3-CB 4.05Å; W13-L76 HydrophobicContact CE3-CD2 4.34Å; W13-L76 HydrophobicContact CG-CD2 3.72Å; W13-L76 HydrophobicContact CH2-CB 3.7Å; W13-L76 HydrophobicContact CZ2-CB 3.63Å; W13-L76 HydrophobicContact CZ3-CB 3.9Å; F15-L76 HydrophobicContact CE1-CD2 3.83Å; F15-L76 HydrophobicContact CZ-CD2 4.12Å; I52-L76 HydrophobicContact CG2-CD1 3.83Å; I69-L76 HydrophobicContact CG1-CD1 4.26Å; I69-L76 HydrophobicContact CG1-CD2 4.48Å; I69-L76 HydrophobicContact CG2-CD2 4.1Å; C72-L76 HydrophobicContact CB-CB 4.09Å; C72-L76 HydrophobicContact CB-CD1 4.26Å; C72-L76 VanDerWaalsContact SG-CD1 3.56Å; L76-L78 HydrophobicContact CD1-CD2 3.88Å; L76-L78 HydrophobicContact CD2-CD1 4.46Å; L76-L78 HydrophobicContact CD2-CD2 4.36Å; L76-L78 HydrophobicContact CD2-CG 4.46Å; L76-L78 HydrophobicContact CG-CD2 4.05Å; L76-L78 HydrophobicContact CG-CG 4.16Å
77	T	96.7	Very high	85.6	Confident	35 Å²	35	70.9 Å²	70.9	22%	0.215	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126	176.4	-67	0	0	0	0	109.5	T4 V5 T6 N53	T4-T77 HydrophobicContact CG2-CG2 3.5Å; V5-T77 CarbonylContact O-C 3.59Å; V5-T77 WeakPolarHBondContact O-CA 3.42Å; T6-T77 WeakPolarHBondContact CG2-OG1 3.27Å; T6-T77 PolarHBondContact OG1-OG1 2.94Å; N53-T77 PolarHBondContact N-O 3.37Å; N53-T77 PolarHBondContact OD1-N 3.42Å; N53-T77 PolarHBondContact OD1-O 3.06Å
78	L	96.9	Very high	83.3	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.5	178.8	-58.1	177.8	0	0	0	109.1	T4 V5 F15 L43 I49 A51 I52 L76 I80	T4-L78 WeakPolarHBondContact CA-O 3.48Å; V5-L78 PolarHBondContact N-O 3.08Å; V5-L78 PolarHBondContact O-N 3.44Å; F15-L78 HydrophobicContact CE1-CD1 4.48Å; F15-L78 HydrophobicContact CZ-CD1 4.23Å; L43-L78 HydrophobicContact CD1-CD1 4.05Å; I49-L78 HydrophobicContact CD1-CD1 4.33Å; I49-L78 HydrophobicContact CG2-CD2 4.05Å; A51-L78 WeakPolarHBondContact O-CA 3.45Å; I52-L78 HydrophobicContact CB-CD2 4.34Å; I52-L78 HydrophobicContact CD1-CD2 4.49Å; I52-L78 HydrophobicContact CG1-CD2 3.91Å; I52-L78 HydrophobicContact CG2-CD2 4.15Å; L76-L78 HydrophobicContact CD1-CD2 3.88Å; L76-L78 HydrophobicContact CD2-CD1 4.46Å; L76-L78 HydrophobicContact CD2-CD2 4.36Å; L76-L78 HydrophobicContact CD2-CG 4.46Å; L76-L78 HydrophobicContact CG-CD2 4.05Å; L76-L78 HydrophobicContact CG-CG 4.16Å; L78-I80 HydrophobicContact CB-CD1 3.83Å; L78-I80 HydrophobicContact CB-CG1 4.23Å; L78-I80 HydrophobicContact CD1-CD1 4.25Å
79	I	96.6	Very high	80.8	Confident	57 Å²	57	81.1 Å²	81.1	29%	0.292	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	119.3	161.7	-58.7	-178.5	0	0	0	106.8	L50 A51	L50-I79 HydrophobicContact CB-CB 4.45Å; L50-I79 HydrophobicContact CB-CG2 4.19Å; L50-I79 HydrophobicContact CD1-CG2 4.47Å; L50-I79 PolarHBondContact N-O 3.2Å; A51-I79 HydrophobicContact CB-CB 3.87Å; A51-I79 HydrophobicContact CB-CD1 3.86Å; A51-I79 HydrophobicContact CB-CG1 3.91Å; A51-I79 PolarHBondContact N-O 3.42Å; A51-I79 PolarHBondContact O-N 3.41Å
80	I	96.3	Very high	78	Confident	0 Å²	0	92 Å²	92	0%	0	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	139.7	-176.8	-58.7	-59.7	0	0	0	109.2	S2 F3 V5 I29 L43 D47 T48 I49 L78	S2-I80 CarbonylContact C-O 3.54Å; S2-I80 WeakPolarHBondContact CA-O 3.42Å; F3-I80 HydrophobicContact CD1-CB 4.44Å; F3-I80 HydrophobicContact CE1-CB 4Å; F3-I80 HydrophobicContact CE1-CG2 3.72Å; F3-I80 HydrophobicContact CE2-CB 4.18Å; F3-I80 HydrophobicContact CE2-CG2 4.4Å; F3-I80 HydrophobicContact CZ-CB 3.86Å; F3-I80 HydrophobicContact CZ-CG2 3.62Å; F3-I80 PolarHBondContact N-O 2.97Å; F3-I80 PolarHBondContact O-N 3.17Å; V5-I80 HydrophobicContact CG2-CG1 4.15Å; I29-I80 HydrophobicContact CD1-CD1 4.5Å; L43-I80 HydrophobicContact CD2-CD1 3.73Å; L43-I80 HydrophobicContact CD2-CG1 3.61Å; D47-I80 HydrophobicContact CB-CG2 3.66Å; T48-I80 CarbonylContact O-C 3.53Å; T48-I80 WeakPolarHBondContact O-CA 3.39Å; I49-I80 HydrophobicContact CB-CD1 4.48Å; I49-I80 HydrophobicContact CG1-CD1 3.92Å; L78-I80 HydrophobicContact CB-CD1 3.83Å; L78-I80 HydrophobicContact CB-CG1 4.23Å; L78-I80 HydrophobicContact CD1-CD1 4.25Å
81	S	94.9	Very high	75.3	Confident	37 Å²	37	90.1 Å²	90.1	26%	0.259	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	123	160.8	-171.2	0	0	0	0	109.4	T48	T48-S81 PolarHBondContact N-O 3.31Å; T48-S81 PolarHBondContact O-N 2.97Å
82	R	91.3	Very high	72.3	Confident	85 Å²	85	90 Å²	90	32%	0.321	50%	0.5	S	S	.	.			trans	-111.2	114.8	170.3	-170.5	173.4	-66.7	167.1	2	108.4	M1 F3 D42 C44 D47	M1-R82 PolarHBondContact N-O 2.88Å; M1-R82 PolarHBondContact O-N 3.39Å; F3-R82 HydrophobicContact CE1-CB 3.85Å; D42-R82 PolarHBondContact O-NH2 2.81Å; C44-R82 PolarHBondContact SG-NH2 2.75Å; D47-R82 IonicContact OD1-CZ 2.64Å; D47-R82 IonicContact OD1-NE 2.63Å; D47-R82 PolarHBondContact OD1-NE 2.89Å; D47-R82 IonicContact OD1-NH2 2.95Å; D47-R82 PolarHBondContact OD1-NH2 2.79Å; D47-R82 IonicContact OD2-CZ 3.68Å; D47-R82 IonicContact OD2-NE 3.4Å; D47-R82 IonicContact OD2-NH2 3.82Å; D47-R82 PolarHBondContact OD2-NH2 2.77Å
83	S	81.2	Confident	69.6	Low	88 Å²	88	95.4 Å²	95.4	62%	0.615	53%	0.532	S	S	*	.			trans	-66.1	138.6	167.1	27.5	0	0	0	0	109.2	S85	S83-S85 VanDerWaalsContact C-N 3.33Å; S83-S85 PolarHBondContact O-N 3.1Å
84	G	61.7	Low	67	Low	86 Å²	86	97.2 Å²	97.2	89%	0.887	54%	0.543	S	S	*	.	S	Bend	trans	-81.8	62.9	-163.8	0	0	0	0	0	115.4
85	S	47.2	Very low	64.4	Low	102 Å²	102	94 Å²	94	71%	0.713	54%	0.538	S	S	*	.			trans	-164.8	127.5	162.7	43	0	0	0	0	108.4	S83	S83-S85 VanDerWaalsContact C-N 3.33Å; S83-S85 PolarHBondContact O-N 3.1Å
86	G	51.4	Low	62.1	Low	68 Å²	68	97.8 Å²	97.8	70%	0.701	56%	0.556	S	S	*	*			cis	79.6	98	31.5	0	0	0	0	0	107.7
87	E	43.2	Very low	59.5	Low	198 Å²	198	105.4 Å²	105.4	93%	0.925	60%	0.597	S	S	*	*			trans	63.6	55.3	-177.8	-52	-164.9	142.2	0	0	116.5
88	R	47.4	Very low	57.1	Low	240 Å²	240	107.2 Å²	107.2	91%	0.906	62%	0.623	S	S	*	*			trans	-139.1	59.9	147.6	-128.3	171.4	-156.9	166.2	8.9	115	W90	R88-W90 PolarHBondContact O-N 2.93Å
89	V	42.7	Very low	54.2	Low	123 Å²	123	117.1 Å²	117.1	75%	0.745	67%	0.666	S	S	*	*			trans	-52.8	128.3	145.7	175.9	0	0	0	0	107.1	S91	V89-S91 PolarHBondContact O-N 3.39Å
90	W	37.4	Very low	51.5	Low	244 Å²	244	122.1 Å²	122.1	92%	0.924	69%	0.692	S	S	*	*			trans	-76.5	73.5	173.4	-170.1	-13.9	0	0	0	109.6	R88	R88-W90 PolarHBondContact O-N 2.93Å
91	S	36	Very low	48.7	Very low	73 Å²	73	127.2 Å²	127.2	51%	0.51	73%	0.727	S	S	.	*			trans	-64.5	129.7	159.8	-57.3	0	0	0	0	108.3	V89 T93	V89-S91 PolarHBondContact O-N 3.39Å; S91-T93 VanDerWaalsContact C-N 3.25Å; S91-T93 PolarHBondContact O-N 2.8Å
92	P	30.4	Very low	45.8	Very low	112 Å²	112	131.6 Å²	131.6	73%	0.727	76%	0.755	S	S	*	*			trans	-70.3	91.8	159.3	29.8	-30.1	0	0	0	106.8	V94	P92-V94 PolarHBondContact O-N 3.13Å
93	T	35	Very low	43	Very low	121 Å²	121	137.2 Å²	137.2	74%	0.742	78%	0.782	S	S	*	*			trans	-63.8	101.7	174.8	-12.8	0	0	0	0	108.2	S91 S95	S91-T93 VanDerWaalsContact C-N 3.25Å; S91-T93 PolarHBondContact O-N 2.8Å; T93-S95 VanDerWaalsContact C-N 3.31Å; T93-S95 PolarHBondContact O-N 3.27Å
94	V	36.7	Very low	40.7	Very low	128 Å²	128	137.3 Å²	137.3	78%	0.776	79%	0.788	S	S	*	*			trans	-69.3	99.6	159.2	178.3	0	0	0	0	105.3	P92 E96	P92-V94 PolarHBondContact O-N 3.13Å; V94-E96 PolarHBondContact O-N 3.38Å; V94-E96 VanDerWaalsContact O-N 3.08Å
95	S	37.7	Very low	39.2	Very low	97 Å²	97	141.3 Å²	141.3	68%	0.678	78%	0.784	S	S	*	*			trans	-68.5	101.1	165.7	-70	0	0	0	0	108.4	T93	T93-S95 VanDerWaalsContact C-N 3.31Å; T93-S95 PolarHBondContact O-N 3.27Å
96	E	47.6	Very low	39	Very low	160 Å²	160	142 Å²	142	75%	0.748	79%	0.786	S	S	*	*	S	Bend	trans	-59.9	169.7	138.1	-69.2	-178.4	64.5	0	0	109.3	V94	V94-E96 PolarHBondContact O-N 3.38Å; V94-E96 VanDerWaalsContact O-N 3.08Å
97	D	41.1	Very low	37.9	Very low	159 Å²	159	145.6 Å²	145.6	85%	0.85	79%	0.789	S	S	*	*	S	Bend	trans	46.7	68.6	-175.4	58.2	-82.9	0	0	0	116.4	K99	D97-K99 PolarHBondContact O-N 3.11Å
98	G	46.5	Very low	37.4	Very low	74 Å²	74	139.1 Å²	139.1	76%	0.763	77%	0.769	S	S	*	*			trans	-64.5	115	170.3	0	0	0	0	0	113.3
99	K	36	Very low	36.8	Very low	207 Å²	207	136 Å²	136	90%	0.9	77%	0.765	S	S	*	*			trans	-149.5	130	152.1	-116	162.2	-172.5	174.8	0	113.8	D97	D97-K99 PolarHBondContact O-N 3.11Å
100	I	39.4	Very low	36.5	Very low	162 Å²	162	136.2 Å²	136.2	83%	0.831	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-61.4	152.7	177.9	45.3	175.1	0	0	0	113.4
101	S	37.6	Very low	36.3	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-64.6	142.9	173.2	51.5	0	0	0	0	112.5
102	P	35.4	Very low	36.6	Very low	129 Å²	129	141.8 Å²	141.8	84%	0.838	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-78.5	124.7	-178.2	31	-34.3	0	0	0	112.7
103	F	31.7	Very low	36.8	Very low	203 Å²	203	142.4 Å²	142.4	89%	0.89	78%	0.782	S	S	*	*			trans	-148.9	134.9	155.9	-157.3	-91.7	0	0	0	109.3
104	A	32.3	Very low	36.6	Very low	90 Å²	90	144.5 Å²	144.5	74%	0.744	79%	0.786	S	S	*	*			trans	61.6	103.3	-179.5	0	0	0	0	0	117.6
105	E	31.6	Very low	36.5	Very low	170 Å²	170	144.1 Å²	144.1	79%	0.794	79%	0.79	S	S	*	*			trans	-145.5	156	152.5	-92.3	-116.6	75.9	0	0	105.1
106	P	41.5	Very low	36.2	Very low	117 Å²	117	144.7 Å²	144.7	76%	0.76	79%	0.793	S	S	*	*			cis	-134.4	166.4	27	41.9	-26.7	0	0	0	116.8
107	D	28.9	Very low	35.4	Very low	144 Å²	144	142.3 Å²	142.3	77%	0.77	79%	0.794	S	S	*	*				-156.8	162.8	121.7	-165.7	-135.2	0	0	0	112.7
108	A	33	Very low	34.9	Very low	62 Å²	62	140.5 Å²	140.5	51%	0.512	79%	0.794	S	S	.	*			trans	73.7	88	160.3	0	0	0	0	0	120.4
109	Q	35.4	Very low	34.1	Very low	174 Å²	174	139.9 Å²	139.9	81%	0.813	79%	0.788	S	S	*	*				71.4	124	124.5	-63.3	165.1	45.3	0	0	121.5
110	N	35.1	Very low	33.8	Very low	127 Å²	127	134.2 Å²	134.2	68%	0.679	77%	0.774	S	S	*	*			trans	33.5	140	139.4	-54.9	-7.4	0	0	0	120.7
111	F	33	Very low	33.4	Very low	194 Å²	194	137 Å²	137	85%	0.851	78%	0.775	S	S	*	*			cis	-150	167.2	39.1	-79.6	-91.1	0	0	0	113.1
112	R	43.3	Very low	33	Very low	240 Å²	240	135.2 Å²	135.2	91%	0.906	77%	0.774	S	S	*	*			trans	-101	144	172.5	-57.2	-179.8	-176.8	-175.4	0.7	112.2
113	P	33.3	Very low	32.8	Very low	126 Å²	126	141 Å²	141	82%	0.818	78%	0.779	S	S	*	*			trans	-94.1	165.5	151.2	34.5	-28.3	0	0	0	111.8
114	I	32.6	Very low	33	Very low	164 Å²	164	140.4 Å²	140.4	84%	0.841	78%	0.776	S	S	*	*			trans	-113.9	146.9	-176.1	-66.8	171.4	0	0	0	110.3
115	S	33.8	Very low	33.5	Very low	121 Å²	121	142.2 Å²	142.2	85%	0.846	78%	0.781	S	S	*	*			trans	-89.1	129.2	-178.6	-49.8	0	0	0	0	113.8
116	S	30.7	Very low	33.7	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	78%	0.78	S	S	*	*			trans	-167.8	157.4	161.9	51.5	0	0	0	0	111.3
117	S	30.4	Very low	33.2	Very low	110 Å²	110	144.3 Å²	144.3	77%	0.769	79%	0.785	S	S	*	*			cis	-178.3	95.1	-45.6	47.6	0	0	0	0	110.4
118	S	32.3	Very low	33.3	Very low	122 Å²	122	142.2 Å²	142.2	85%	0.853	78%	0.777	S	S	*	*			trans	-178.2	144.3	167.3	45.9	0	0	0	0	107
119	G	28	Very low	33.2	Very low	60 Å²	60	144.2 Å²	144.2	62%	0.619	79%	0.788	S	S	*	*			cis	99.6	123.7	31.9	0	0	0	0	0	108.4
120	S	31	Very low	33.1	Very low	88 Å²	88	142.7 Å²	142.7	62%	0.615	79%	0.785	S	S	*	*			cis	-159.8	-163.6	5.1	-73.2	0	0	0	0	108.7
121	Y	31.2	Very low	33.6	Very low	220 Å²	220	142 Å²	142	86%	0.863	79%	0.788	S	S	*	*			trans	45.5	131.2	159.8	34.8	-114.8	0	0	0	120.8
122	G	29.4	Very low	33.5	Very low	70 Å²	70	141.2 Å²	141.2	72%	0.722	79%	0.787	S	S	*	*			cis	139.2	111.6	-4.8	0	0	0	0	0	113.5
123	R	30.9	Very low	33.2	Very low	251 Å²	251	134.8 Å²	134.8	95%	0.947	78%	0.778	S	S	*	*			trans	-179	147.8	156.1	-105.4	177	-146.2	-100.3	5.5	112.2
124	K	35.7	Very low	33.9	Very low	190 Å²	190	134.4 Å²	134.4	83%	0.826	78%	0.776	S	S	*	*			trans	-116	164.4	144.1	-65.7	-172.5	177.3	-176.3	0	107
125	P	43.2	Very low	33.9	Very low	129 Å²	129	134.7 Å²	134.7	84%	0.838	78%	0.778	S	S	*	*				-143.7	-178.9	89.9	37.4	-20.3	0	0	0	114
126	S	34.7	Very low	33.9	Very low	110 Å²	110	135 Å²	135	77%	0.769	78%	0.775	S	S	*	*			trans	-111.4	153.8	-174.2	-38.4	0	0	0	0	112.5
127	Y	32.1	Very low	34.5	Very low	220 Å²	220	135.8 Å²	135.8	86%	0.863	78%	0.778	S	S	*	*			trans	-154.9	156.1	148.3	-145.8	-109.1	0	0	0	115
128	T	30.8	Very low	34.6	Very low	100 Å²	100	139 Å²	139	61%	0.613	78%	0.78	S	S	*	*			trans	-54.4	166.8	176.9	-10	0	0	0	0	113.7
129	S	30.7	Very low	35.3	Very low	105 Å²	105	137.8 Å²	137.8	73%	0.734	77%	0.77	S	S	*	*			cis	-160.4	170.1	31.8	-40.9	0	0	0	0	116.2
130	D	33.6	Very low	35.6	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	78%	0.775	S	S	*	*			trans	-67.1	165.3	163.2	-129.5	-82.8	0	0	0	112.6	Q132	D130-Q132 PolarHBondContact OD1-N 2.97Å
131	P	45.4	Very low	35.7	Very low	114 Å²	114	144.2 Å²	144.2	74%	0.74	78%	0.782	S	S	*	*				-154.2	133.3	78.8	37.5	-15.4	0	0	0	119.9
132	Q	30.8	Very low	35.7	Very low	177 Å²	177	140.8 Å²	140.8	83%	0.827	78%	0.778	S	S	*	*				75.9	152.9	121.6	-155.1	163.8	-1.4	0	0	123.3	D130	D130-Q132 PolarHBondContact OD1-N 2.97Å
133	S	37.4	Very low	35.9	Very low	105 Å²	105	143.2 Å²	143.2	73%	0.734	77%	0.774	S	S	*	*			trans	-94.6	-179.7	-166.9	-30.7	0	0	0	0	116.6
134	P	46.9	Very low	36	Very low	118 Å²	118	137.6 Å²	137.6	77%	0.766	76%	0.763	S	S	*	*				-152.9	136.3	108.2	37.2	-19	0	0	0	119.7
135	L	33.9	Very low	35.7	Very low	170 Å²	170	132.4 Å²	132.4	89%	0.89	76%	0.764	S	S	*	*			trans	53	165.6	133.5	-67.6	173.1	0	0	0	125.2
136	T	32.3	Very low	35.6	Very low	127 Å²	127	134.7 Å²	134.7	78%	0.779	76%	0.763	S	S	*	*			trans	-106.1	176.5	-168.6	57.5	0	0	0	0	113.7
137	P	43	Very low	35.5	Very low	124 Å²	124	136.5 Å²	136.5	81%	0.805	77%	0.769	S	S	*	*				-149.2	173.2	100.6	39.9	-23.3	0	0	0	117.1
138	Q	34	Very low	35.8	Very low	178 Å²	178	136.1 Å²	136.1	83%	0.832	77%	0.766	S	S	*	*			trans	-99.4	-174.4	164.3	-112.7	-159.3	83.6	0	0	109.5
139	P	46	Very low	36.7	Very low	96 Å²	96	137.1 Å²	137.1	62%	0.623	77%	0.774	S	S	*	*			cis	-153.5	-159.2	29.7	42.7	-18.1	0	0	0	117.6
140	T	33.8	Very low	37	Very low	121 Å²	121	137.7 Å²	137.7	74%	0.742	77%	0.769	S	S	*	*			trans	72.3	163.3	152.6	52.9	0	0	0	0	121.4
141	H	33.9	Very low	37.2	Very low	162 Å²	162	137.9 Å²	137.9	75%	0.75	77%	0.77	S	S	*	*			cis	-175.9	164.2	-40.6	-157.6	-111.1	0	0	0	110.1
142	L	31.1	Very low	36.6	Very low	148 Å²	148	135.1 Å²	135.1	78%	0.775	76%	0.762	S	S	*	*			trans	62	175.5	173	-66.4	119.7	0	0	0	118
143	N	34.6	Very low	36.8	Very low	121 Å²	121	135.9 Å²	135.9	65%	0.647	77%	0.765	S	S	*	*				-169.1	165.3	-52.7	-167.9	24.7	0	0	0	110.4
144	N	32.5	Very low	36.5	Very low	134 Å²	134	134.5 Å²	134.5	72%	0.717	76%	0.756	S	S	*	*			trans	-0.9	141.7	163.8	-69	-10.2	0	0	0	121.7
145	G	28.2	Very low	35.9	Very low	81 Å²	81	139.8 Å²	139.8	84%	0.835	76%	0.762	S	S	*	*			trans	-159.4	112.8	156.7	0	0	0	0	0	112.5
146	H	42.1	Very low	35.7	Very low	177 Å²	177	135.4 Å²	135.4	82%	0.819	76%	0.758	S	S	*	*			trans	-93.8	158.9	175	-64.6	-91.4	0	0	0	111.7
147	T	32.8	Very low	35.6	Very low	148 Å²	148	141.2 Å²	141.2	91%	0.908	77%	0.768	S	S	*	*			trans	-140.2	135.2	149.8	-0.2	0	0	0	0	112.1
148	R	38.4	Very low	34.8	Very low	212 Å²	212	138.8 Å²	138.8	80%	0.8	77%	0.765	S	S	*	*			trans	-107.7	150	170.1	-159	178.7	76.1	-138.1	4.8	107.3
149	P	49.4	Very low	34.7	Very low	120 Å²	120	138.7 Å²	138.7	78%	0.779	77%	0.77	S	S	*	*				-148.1	-172.9	112.3	26.6	-4.6	0	0	0	112
150	N	36.1	Very low	34	Very low	117 Å²	117	137 Å²	137	63%	0.626	77%	0.771	S	S	*	*			cis	-164.2	156.8	-45.1	-173.8	37.5	0	0	0	109.1
151	N	39.6	Very low	34	Very low	145 Å²	145	138.2 Å²	138.2	78%	0.775	78%	0.778	S	S	*	*			trans	21	131	164.6	-78.5	0.4	0	0	0	123.5
152	G	31.6	Very low	33.9	Very low	56 Å²	56	134.1 Å²	134.1	58%	0.577	78%	0.779	S	S	*	*				133.1	118.4	98.3	0	0	0	0	0	120.6
153	H	34.5	Very low	34.1	Very low	193 Å²	193	134.3 Å²	134.3	89%	0.894	78%	0.776	S	S	*	*			trans	69.4	151.3	157.5	-45.2	99.6	0	0	0	117.3
154	S	31.6	Very low	34.2	Very low	77 Å²	77	133.6 Å²	133.6	54%	0.538	79%	0.787	S	S	.	*			cis	-156.4	165.7	-8.3	-151	0	0	0	0	112.5
155	Y	35.2	Very low	34.5	Very low	229 Å²	229	133.1 Å²	133.1	90%	0.898	78%	0.78	S	S	*	*			trans	49.7	132.8	160.5	-51.3	-58.7	0	0	0	121.9
156	G	28.5	Very low	34.8	Very low	78 Å²	78	137.7 Å²	137.7	80%	0.804	77%	0.774	S	S	*	*			trans	160.9	124.1	160.7	0	0	0	0	0	115.9
157	Y	29.9	Very low	34.6	Very low	249 Å²	249	137 Å²	137	98%	0.976	78%	0.776	S	S	*	*			trans	-73.9	152.7	179.3	-63.8	-101.2	0	0	0	113.8
158	G	28.1	Very low	35	Very low	73 Å²	73	136.1 Å²	136.1	75%	0.753	77%	0.765	S	S	*	*			trans	155.3	80.1	154.7	0	0	0	0	0	120.2
159	N	30	Very low	35	Very low	175 Å²	175	131.8 Å²	131.8	94%	0.936	77%	0.765	S	S	*	*			trans	28.8	133.2	143.2	-166.1	22.1	0	0	0	122.3
160	G	31.5	Very low	34.6	Very low	62 Å²	62	130.9 Å²	130.9	64%	0.639	77%	0.768	S	S	*	*			trans	148.6	115	152.2	0	0	0	0	0	117.6
161	T	34.5	Very low	35	Very low	146 Å²	146	129 Å²	129	90%	0.896	78%	0.776	S	S	*	*			trans	-23.9	131.3	160.3	50.3	0	0	0	0	115.3
162	G	32.4	Very low	35	Very low	75 Å²	75	130 Å²	130	77%	0.773	78%	0.781	S	S	*	*				95	143.7	57.9	0	0	0	0	0	110.1
163	H	35.7	Very low	35.2	Very low	153 Å²	153	138 Å²	138	71%	0.708	80%	0.795	S	S	*	*			cis	-160.5	128.8	0.2	171.7	-93.6	0	0	0	108.5	Q165	H163-Q165 PolarHBondContact CE1-OE1 3.22Å; H163-Q165 VanDerWaalsContact CE1-OE1 3.29Å
164	A	36.6	Very low	35.3	Very low	105 Å²	105	133.8 Å²	133.8	87%	0.868	79%	0.793	S	S	*	*			trans	-123.9	103.4	-176.3	0	0	0	0	0	112.4
165	Q	37.3	Very low	35.6	Very low	125 Å²	125	138.9 Å²	138.9	58%	0.584	81%	0.808	S	S	*	*			trans	-140.6	148.1	173.7	-85.2	-175.4	-8.6	0	0	106.5	H163	H163-Q165 PolarHBondContact CE1-OE1 3.22Å; H163-Q165 VanDerWaalsContact CE1-OE1 3.29Å
166	Y	35.9	Very low	35.7	Very low	177 Å²	177	135.6 Å²	135.6	69%	0.694	81%	0.806	S	S	*	*			cis	-145.4	161.3	9.5	-112.7	-75.3	0	0	0	108.7
167	N	36.2	Very low	35.9	Very low	161 Å²	161	135.2 Å²	135.2	86%	0.861	80%	0.802	S	S	*	*				-158.1	115.1	123.7	-133.2	-46	0	0	0	112.2
168	N	43	Very low	36	Very low	130 Å²	130	128.8 Å²	128.8	70%	0.695	79%	0.794	S	S	*	*			trans	-155.2	119	168.5	-169.3	18.1	0	0	0	107.9	A170	N168-A170 PolarHBondContact O-N 2.6Å
169	P	38.4	Very low	36.4	Very low	121 Å²	121	133.3 Å²	133.3	79%	0.786	80%	0.801	S	S	*	*			trans	-88.3	94.6	-163.2	32.8	-35.5	0	0	0	113.6
170	A	39.5	Very low	36.5	Very low	102 Å²	102	129 Å²	129	84%	0.843	80%	0.798	S	S	*	*			trans	-145.3	99	166.8	0	0	0	0	0	110.7	N168	N168-A170 PolarHBondContact O-N 2.6Å
171	G	44.9	Very low	36.6	Very low	78 Å²	78	132.3 Å²	132.3	80%	0.804	80%	0.801	S	S	*	*			trans	177.5	26.4	-175.9	0	0	0	0	0	117.7
172	L	38.8	Very low	36.7	Very low	165 Å²	165	135.2 Å²	135.2	86%	0.864	80%	0.795	S	S	*	*			trans	-94.6	5.4	-175.4	-80.4	175.2	0	0	0	115.9
173	Y	36.4	Very low	36.8	Very low	224 Å²	224	136.5 Å²	136.5	88%	0.878	79%	0.792	S	S	*	*	S	Bend	trans	-135.5	117.4	175.8	-78.2	-75.5	0	0	0	114.8
174	A	36.3	Very low	37	Very low	104 Å²	104	137 Å²	137	86%	0.86	80%	0.8	S	S	*	*			trans	57.3	108.4	150.1	0	0	0	0	0	119.9
175	H	37.8	Very low	37.7	Very low	184 Å²	184	137.1 Å²	137.1	85%	0.852	79%	0.791	S	S	*	*			trans	-100.4	139.2	156.9	-138	-87.5	0	0	0	109.5
176	N	37.2	Very low	37.7	Very low	160 Å²	160	134.6 Å²	134.6	86%	0.856	80%	0.799	S	S	*	*			trans	119.4	139.9	170.1	-72.3	-9.2	0	0	0	114.1
177	G	33.6	Very low	37.7	Very low	70 Å²	70	135.6 Å²	135.6	72%	0.722	81%	0.807	S	S	*	*			cis	165.1	90.6	-2.7	0	0	0	0	0	111.8
178	S	33	Very low	37.8	Very low	115 Å²	115	136.8 Å²	136.8	80%	0.804	81%	0.809	S	S	*	*			trans	-81.9	119.6	-174.2	-58.2	0	0	0	0	112.6
179	N	35.4	Very low	37.5	Very low	168 Å²	168	133.8 Å²	133.8	90%	0.898	81%	0.809	S	S	*	*				-179.8	115	126.8	-88.6	-15.9	0	0	0	109.7
180	G	33.1	Very low	37.3	Very low	84 Å²	84	131.4 Å²	131.4	87%	0.866	81%	0.807	S	S	*	*			trans	-169.2	141.4	180	0	0	0	0	0	111.3
181	D	33.5	Very low	36.9	Very low	131 Å²	131	135.1 Å²	135.1	70%	0.701	81%	0.812	S	S	*	*			trans	-99.8	146.3	-165.6	-172.1	-141.3	0	0	0	113.7
182	R	35.8	Very low	36.8	Very low	208 Å²	208	136.7 Å²	136.7	79%	0.785	81%	0.811	S	S	*	*			trans	37.9	121.9	158.3	-76.2	152.8	108.1	-171	4.2	121.5
183	S	34.7	Very low	36.6	Very low	101 Å²	101	137.1 Å²	137.1	71%	0.706	81%	0.813	S	S	*	*				144.5	108.3	113.3	-64.5	0	0	0	0	117.4
184	L	38.7	Very low	36.8	Very low	165 Å²	165	131.5 Å²	131.5	86%	0.864	81%	0.806	S	S	*	*			trans	62.2	170.9	134.7	-57.5	-179.6	0	0	0	120.5
185	P	53.2	Low	36.6	Very low	106 Å²	106	131 Å²	131	69%	0.688	80%	0.802	S	S	*	*				-138.8	126.5	-55.4	37.8	-21.5	0	0	0	116.7
186	G	37.3	Very low	36.4	Very low	73 Å²	73	127.7 Å²	127.7	75%	0.753	80%	0.795	S	S	*	*			trans	54.5	165.3	137.7	0	0	0	0	0	124.3
187	K	35.9	Very low	36.5	Very low	198 Å²	198	129.5 Å²	129.5	86%	0.861	80%	0.798	S	S	*	*			trans	140.9	144.5	146.5	-76.7	158.4	-171.9	176.2	0	113.8
188	M	38.5	Very low	36.8	Very low	185 Å²	185	131.8 Å²	131.8	91%	0.911	80%	0.803	S	S	*	*			trans	53.8	151.9	162.2	67.1	-179.5	-78	0	0	120.5
189	G	34.9	Very low	37.8	Very low	67 Å²	67	131.4 Å²	131.4	69%	0.691	80%	0.797	S	S	*	*			cis	139.5	126.2	-12.7	0	0	0	0	0	115
190	G	35.7	Very low	37.9	Very low	72 Å²	72	132.3 Å²	132.3	74%	0.742	80%	0.796	S	S	*	*			trans	91.4	159.9	177.7	0	0	0	0	0	114.2
191	L	30.8	Very low	39.1	Very low	179 Å²	179	133.5 Å²	133.5	94%	0.937	79%	0.789	S	S	*	*			cis	-143.2	157.2	4.5	-67.1	170.8	0	0	0	111.1
192	S	42.6	Very low	39.9	Very low	112 Å²	112	132.7 Å²	132.7	78%	0.783	79%	0.791	S	S	*	*			trans	-96.4	162.2	167.2	-52.6	0	0	0	0	111.2
193	L	35	Very low	40.5	Very low	173 Å²	173	128.8 Å²	128.8	91%	0.906	79%	0.792	S	S	*	*				179	171.1	122.2	-94.5	163.8	0	0	0	112.2
194	S	40.3	Very low	41	Very low	106 Å²	106	133.2 Å²	133.2	74%	0.741	80%	0.802	S	S	*	*			trans	-116.5	164.9	-162.3	52.3	0	0	0	0	115
195	A	31.6	Very low	40.9	Very low	95 Å²	95	130.6 Å²	130.6	79%	0.785	80%	0.797	S	S	*	*			trans	-145.2	153.2	164.9	0	0	0	0	0	110.4
196	T	34.5	Very low	40.6	Very low	113 Å²	113	131.4 Å²	131.4	69%	0.693	80%	0.803	S	S	*	*			trans	-150.5	126.5	-160.1	52.2	0	0	0	0	114.3
197	H	38.1	Very low	41.2	Very low	199 Å²	199	134.7 Å²	134.7	92%	0.921	81%	0.808	S	S	*	*			trans	-144.5	166.9	170	-61.9	-71.7	0	0	0	111.6
198	S	40.3	Very low	41.6	Very low	117 Å²	117	130 Å²	130	82%	0.818	80%	0.8	S	S	*	*			trans	-138.8	-174.6	-157.8	-127	0	0	0	0	111.7
199	P	53.7	Low	42.3	Very low	107 Å²	107	132.5 Å²	132.5	70%	0.695	80%	0.799	S	S	*	*			cis	-139.7	175.3	-18.9	39.2	-20.7	0	0	0	117
200	E	37.6	Very low	43.3	Very low	188 Å²	188	136.2 Å²	136.2	88%	0.879	80%	0.803	S	S	*	*			trans	79.1	153.7	151.6	-78.9	-157.7	49.6	0	0	124.3
201	P	59.4	Low	44	Very low	108 Å²	108	136 Å²	136	70%	0.701	80%	0.802	S	S	*	*			trans	-114.6	-136.7	-155.6	47.8	-33.1	0	0	0	111.2
202	P	49.5	Very low	45	Very low	115 Å²	115	135.4 Å²	135.4	75%	0.747	79%	0.791	S	S	*	*			cis	-119.2	-163.2	-3.2	46.4	-30.7	0	0	0	112.8
203	P	48	Very low	45.9	Very low	126 Å²	126	134.7 Å²	134.7	82%	0.818	78%	0.779	S	S	*	*			cis	-124.6	-168.7	-8.7	43.3	-27.1	0	0	0	114.8
204	Q	45.7	Very low	47.1	Very low	194 Å²	194	131 Å²	131	91%	0.907	77%	0.765	S	S	*	*			trans	-91.6	153.3	-171.5	-59.5	165.2	-2.3	0	0	114.3
205	S	36.3	Very low	48	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	76%	0.762	S	S	*	*			trans	-127.4	150.4	148.2	64.9	0	0	0	0	109.3
206	P	47.6	Very low	50	Low	124 Å²	124	130.3 Å²	130.3	81%	0.805	74%	0.739	S	S	*	*			trans	-81.5	135	-166.2	30.6	-34.8	0	0	0	113.2	S208	P206-S208 PolarHBondContact O-N 3.17Å
207	V	50.2	Low	51.4	Low	142 Å²	142	130.4 Å²	130.4	86%	0.861	74%	0.735	S	S	*	*			trans	-67.8	101.1	167.6	177.9	0	0	0	0	109.1
208	S	43.1	Very low	52.8	Low	99 Å²	99	125.7 Å²	125.7	69%	0.692	72%	0.72	S	S	*	*			trans	-70.1	133	168.6	-168.3	0	0	0	0	109.9	P206 N210	P206-S208 PolarHBondContact O-N 3.17Å; S208-N210 PolarHBondContact O-N 2.98Å
209	R	52.9	Low	53.9	Low	237 Å²	237	124.1 Å²	124.1	89%	0.894	70%	0.697	S	S	*	*	S	Bend	trans	-82.4	58.1	-167.3	-165.7	-171.6	178.4	-153.2	1.3	112.7
210	N	55.6	Low	54.6	Low	145 Å²	145	124.3 Å²	124.3	78%	0.775	69%	0.687	S	S	*	*	S	Bend	trans	-178.6	77.7	159	-90.8	-16	0	0	0	106.3	S208 F212	S208-N210 PolarHBondContact O-N 2.98Å; N210-F212 PolarHBondContact O-N 2.86Å
211	G	51.3	Low	55.8	Low	69 Å²	69	123.1 Å²	123.1	71%	0.711	68%	0.683	S	S	*	*			trans	-74.5	85.7	-158.4	0	0	0	0	0	115.8
212	F	52.3	Low	56.2	Low	165 Å²	165	124 Å²	124	72%	0.724	68%	0.681	S	S	*	*			trans	-121.3	118.9	155.9	-51.7	-73.5	0	0	0	107.9	N210 P214	N210-F212 PolarHBondContact O-N 2.86Å; F212-P214 WeakPolarHBondContact O-CD 3.4Å
213	D	60.4	Low	56.6	Low	97 Å²	97	124 Å²	124	52%	0.519	67%	0.671	S	S	.	*			trans	-88.9	109.4	171.4	174.4	7.4	0	0	0	108.5	Q215 S216 Y219	D213-Q215 PolarHBondContact O-N 2.79Å; D213-Q215 WeakPolarHBondContact OD1-CB 3.42Å; D213-Q215 PolarHBondContact OD1-N 3.08Å; D213-S216 WeakPolarHBondContact O-CB 3.39Å; D213-S216 PolarHBondContact O-N 3.1Å; D213-Y219 WeakPolarHBondContact O-CB 3.45Å
214	P	61.1	Low	56.6	Low	95 Å²	95	125 Å²	125	62%	0.617	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-13	-177.5	30.8	-36.3	0	0	0	113.2	F212 Y219	F212-P214 WeakPolarHBondContact O-CD 3.4Å; P214-Y219 HydrophobicContact CB-CD1 4.48Å; P214-Y219 HydrophobicContact CB-CE1 4.43Å
215	Q	58.2	Low	56.6	Low	144 Å²	144	125.6 Å²	125.6	67%	0.673	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-8.9	178	-159	65.4	11.7	0	0	112.7	D213 D217	D213-Q215 PolarHBondContact O-N 2.79Å; D213-Q215 WeakPolarHBondContact OD1-CB 3.42Å; D213-Q215 PolarHBondContact OD1-N 3.08Å; Q215-D217 PolarHBondContact O-N 2.86Å
216	S	74.7	Confident	57.4	Low	43 Å²	43	129.3 Å²	129.3	30%	0.301	67%	0.671	S	S	.	*			trans	-63.4	129.5	177.7	176	0	0	0	0	111.5	D213 V218 Y219 K220	D213-S216 WeakPolarHBondContact O-CB 3.39Å; D213-S216 PolarHBondContact O-N 3.1Å; S216-V218 PolarHBondContact O-N 3.45Å; S216-V218 PolarHBondContact OG-N 3.44Å; S216-Y219 WeakPolarHBondContact O-CA 3.16Å; S216-Y219 WeakPolarHBondContact O-CB 3.46Å; S216-Y219 PolarHBondContact O-N 3.14Å; S216-K220 WeakPolarHBondContact O-CB 3.47Å; S216-K220 PolarHBondContact O-N 2.98Å
217	D	64.4	Low	57.7	Low	116 Å²	116	130.5 Å²	130.5	62%	0.62	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-21.2	178.1	-67.9	-50.6	0	0	0	113	Q215 K220 M221	Q215-D217 PolarHBondContact O-N 2.86Å; D217-K220 IonicContact OD1-NZ 3.18Å; D217-M221 WeakPolarHBondContact O-CB 3.45Å; D217-M221 WeakPolarHBondContact O-CG 3.25Å; D217-M221 PolarHBondContact O-N 3.1Å; D217-M221 VanDerWaalsContact O-N 3.09Å
218	V	66.4	Low	57.5	Low	99 Å²	99	129 Å²	129	60%	0.6	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-42.7	171.6	-179.5	0	0	0	0	111.2	S216 K220 M221 L222	S216-V218 PolarHBondContact O-N 3.45Å; S216-V218 PolarHBondContact OG-N 3.44Å; V218-K220 VanDerWaalsContact C-N 3.3Å; V218-K220 PolarHBondContact O-N 3.34Å; V218-M221 PolarHBondContact O-N 3.28Å; V218-L222 HydrophobicContact CG1-CD1 3.95Å; V218-L222 WeakPolarHBondContact O-CB 3.35Å; V218-L222 WeakPolarHBondContact O-CG 3.37Å; V218-L222 PolarHBondContact O-N 3.08Å
219	Y	64.5	Low	58.1	Low	84 Å²	84	131.1 Å²	131.1	33%	0.329	67%	0.667	S	S	.	*	H	α-helix	trans	-64.9	-39.3	173.9	-168.8	-101.5	0	0	0	110.6	D213 P214 S216 M221 L222 Q223	D213-Y219 WeakPolarHBondContact O-CB 3.45Å; P214-Y219 HydrophobicContact CB-CD1 4.48Å; P214-Y219 HydrophobicContact CB-CE1 4.43Å; S216-Y219 WeakPolarHBondContact O-CA 3.16Å; S216-Y219 WeakPolarHBondContact O-CB 3.46Å; S216-Y219 PolarHBondContact O-N 3.14Å; Y219-M221 PolarHBondContact O-N 3.39Å; Y219-L222 CarbonylContact O-C 3.52Å; Y219-L222 PolarHBondContact O-N 2.87Å; Y219-L222 VanDerWaalsContact O-N 3.13Å; Y219-Q223 VanDerWaalsContact CE1-OE1 3.31Å; Y219-Q223 WeakPolarHBondContact O-CB 3.34Å; Y219-Q223 PolarHBondContact O-N 2.8Å
220	K	66.9	Low	58.3	Low	111 Å²	111	123 Å²	123	48%	0.483	65%	0.647	S	S	.	*	H	α-helix	trans	-67.2	-15.6	176.1	-148.2	177.5	-173	177.4	0	115	S216 D217 V218	S216-K220 WeakPolarHBondContact O-CB 3.47Å; S216-K220 PolarHBondContact O-N 2.98Å; D217-K220 IonicContact OD1-NZ 3.18Å; V218-K220 VanDerWaalsContact C-N 3.3Å; V218-K220 PolarHBondContact O-N 3.34Å
221	M	63.4	Low	58.6	Low	164 Å²	164	120 Å²	120	81%	0.808	64%	0.642	S	S	*	*	H	α-helix	trans	-98.5	-22.8	172.3	-74.6	-92.2	-68	0	0	112.7	D217 V218 Y219	D217-M221 WeakPolarHBondContact O-CB 3.45Å; D217-M221 WeakPolarHBondContact O-CG 3.25Å; D217-M221 PolarHBondContact O-N 3.1Å; D217-M221 VanDerWaalsContact O-N 3.09Å; V218-M221 PolarHBondContact O-N 3.28Å; Y219-M221 PolarHBondContact O-N 3.39Å
222	L	67.4	Low	58.8	Low	127 Å²	127	122.1 Å²	122.1	67%	0.665	64%	0.643	S	S	*	*	H	α-helix	trans	-94.4	-17.9	177.7	-72.5	171.6	0	0	0	113.3	V218 Y219 D224	V218-L222 HydrophobicContact CG1-CD1 3.95Å; V218-L222 WeakPolarHBondContact O-CB 3.35Å; V218-L222 WeakPolarHBondContact O-CG 3.37Å; V218-L222 PolarHBondContact O-N 3.08Å; Y219-L222 CarbonylContact O-C 3.52Å; Y219-L222 PolarHBondContact O-N 2.87Å; Y219-L222 VanDerWaalsContact O-N 3.13Å; L222-D224 PolarHBondContact O-N 3.19Å; L222-D224 VanDerWaalsContact O-N 3.14Å
223	Q	58.4	Low	59.3	Low	113 Å²	113	123.5 Å²	123.5	53%	0.528	65%	0.649	S	S	.	*	S	Bend	trans	-75.4	95.4	165.4	-164.9	123.4	75.8	0	0	106.6	Y219 Y225	Y219-Q223 VanDerWaalsContact CE1-OE1 3.31Å; Y219-Q223 WeakPolarHBondContact O-CB 3.34Å; Y219-Q223 PolarHBondContact O-N 2.8Å; Q223-Y225 PolarHBondContact O-N 3.2Å
224	D	48.4	Very low	59	Low	148 Å²	148	122.3 Å²	122.3	79%	0.791	64%	0.64	S	S	*	*			trans	-45.2	126.7	-179.8	-68.2	-63	0	0	0	110.1	L222 E226	L222-D224 PolarHBondContact O-N 3.19Å; L222-D224 VanDerWaalsContact O-N 3.14Å; D224-E226 PolarHBondContact O-N 2.89Å
225	Y	45	Very low	58.9	Low	206 Å²	206	120.8 Å²	120.8	81%	0.808	63%	0.632	S	S	*	*			trans	-61.3	109.4	165.4	-88.8	-106.4	0	0	0	106.6	Q223 E227	Q223-Y225 PolarHBondContact O-N 3.2Å; Y225-E227 PolarHBondContact O-N 3.37Å
226	E	53.8	Low	59.5	Low	188 Å²	188	116.9 Å²	116.9	88%	0.879	63%	0.63	S	S	*	*			trans	-61.7	89.1	169.6	-171.2	179.8	166.9	0	0	107.2	D224 P228	D224-E226 PolarHBondContact O-N 2.89Å; E226-P228 WeakPolarHBondContact O-CD 2.83Å
227	E	53	Low	59	Low	148 Å²	148	118.5 Å²	118.5	69%	0.692	64%	0.642	S	S	*	*			trans	-62.3	111.5	-165.5	-169.7	-177.2	169.1	0	0	108.2	Y225 V229	Y225-E227 PolarHBondContact O-N 3.37Å; E227-V229 PolarHBondContact O-N 3.25Å
228	P	47.2	Very low	59.3	Low	111 Å²	111	118.8 Å²	118.8	72%	0.721	64%	0.637	S	S	*	*			trans	-69.2	99.5	-170.3	26.5	-33.3	0	0	0	108	E226 S230	E226-P228 WeakPolarHBondContact O-CD 2.83Å; P228-S230 WeakPolarHBondContact O-CA 3.32Å; P228-S230 PolarHBondContact O-N 2.79Å
229	V	55.8	Low	59.6	Low	143 Å²	143	120.8 Å²	120.8	87%	0.867	64%	0.638	S	S	*	*			trans	-42.4	95.3	-157.9	-178.3	0	0	0	0	110.9	E227 A231	E227-V229 PolarHBondContact O-N 3.25Å; V229-A231 PolarHBondContact O-N 3.29Å
230	S	55.9	Low	60	Low	67 Å²	67	124 Å²	124	47%	0.469	65%	0.651	S	S	.	*			trans	-76.1	105.9	-164.7	75.9	0	0	0	0	108.7	P228	P228-S230 WeakPolarHBondContact O-CA 3.32Å; P228-S230 PolarHBondContact O-N 2.79Å
231	A	61.8	Low	60.3	Low	81 Å²	81	123 Å²	123	67%	0.669	65%	0.651	S	S	*	*			trans	-48.2	134.1	178.5	0	0	0	0	0	108.9	V229 K233	V229-A231 PolarHBondContact O-N 3.29Å; A231-K233 PolarHBondContact O-N 3.33Å
232	P	55	Low	60.7	Low	115 Å²	115	118.9 Å²	118.9	75%	0.747	63%	0.629	S	S	*	*			trans	-47.2	129.5	-165.3	-32	35.3	0	0	0	112.2	Q234	P232-Q234 PolarHBondContact O-N 3.47Å
233	K	63.1	Low	60.5	Low	194 Å²	194	119.3 Å²	119.3	84%	0.843	63%	0.628	S	S	*	*			trans	-72.6	63.3	-179.1	-74.5	174.5	-179.9	162	0	111.1	A231 S235	A231-K233 PolarHBondContact O-N 3.33Å; K233-S235 PolarHBondContact O-N 2.91Å
234	Q	55.7	Low	61	Low	71 Å²	71	118.1 Å²	118.1	33%	0.332	62%	0.624	S	S	.	*			trans	-63	120.7	177	-179.6	157.9	1.5	0	0	108.6	P232 F238 K239	P232-Q234 PolarHBondContact O-N 3.47Å; Q234-F238 HydrophobicContact CG-CB 4.03Å; Q234-F238 HydrophobicContact CG-CD1 3.76Å; Q234-F238 HydrophobicContact CG-CG 4.31Å; Q234-F238 PolarHBondContact NE2-O 2.62Å; Q234-F238 VanDerWaalsContact NE2-O 3.08Å; Q234-K239 HydrophobicContact CG-CB 4.14Å
235	S	57.5	Low	61.8	Low	63 Å²	63	115.7 Å²	115.7	44%	0.441	61%	0.611	S	S	.	*			trans	-57.7	146.3	174.6	55.4	0	0	0	0	109.8	K233 S237 F238 K239	K233-S235 PolarHBondContact O-N 2.91Å; S235-S237 PolarHBondContact O-N 3.22Å; S235-S237 PolarHBondContact OG-OG 2.96Å; S235-F238 PolarHBondContact O-N 3.01Å; S235-F238 PolarHBondContact OG-N 3.5Å; S235-K239 PolarHBondContact O-N 2.82Å
236	G	71.9	Confident	62.5	Low	62 Å²	62	111.7 Å²	111.7	64%	0.639	60%	0.603	S	S	*	*	H	α-helix	trans	-54.8	-30.2	179.4	0	0	0	0	0	112.9	K239 Y240	G236-K239 PolarHBondContact O-N 3.34Å; G236-Y240 VanDerWaalsContact O-CB 3.27Å; G236-Y240 WeakPolarHBondContact O-CB 3.36Å; G236-Y240 PolarHBondContact O-N 2.97Å
237	S	63.4	Low	62.7	Low	78 Å²	78	105.8 Å²	105.8	55%	0.545	59%	0.586	S	S	.	*	H	α-helix	trans	-66.8	-40.6	171.9	47.1	0	0	0	0	113.9	S235 Y240 L241	S235-S237 PolarHBondContact O-N 3.22Å; S235-S237 PolarHBondContact OG-OG 2.96Å; S237-Y240 PolarHBondContact O-N 3.32Å; S237-L241 WeakPolarHBondContact O-CG 3.32Å; S237-L241 PolarHBondContact O-N 3.15Å
238	F	70.7	Confident	62.7	Low	121 Å²	121	106.2 Å²	106.2	53%	0.531	59%	0.588	S	S	.	*	H	α-helix	trans	-77.3	-24.4	175.5	-168.4	-124.7	0	0	0	112.2	Q234 S235 L241 Q242	Q234-F238 HydrophobicContact CG-CB 4.03Å; Q234-F238 HydrophobicContact CG-CD1 3.76Å; Q234-F238 HydrophobicContact CG-CG 4.31Å; Q234-F238 PolarHBondContact NE2-O 2.62Å; Q234-F238 VanDerWaalsContact NE2-O 3.08Å; S235-F238 PolarHBondContact O-N 3.01Å; S235-F238 PolarHBondContact OG-N 3.5Å; F238-L241 HydrophobicContact CD2-CB 4.48Å; F238-Q242 WeakPolarHBondContact O-CB 3.35Å; F238-Q242 PolarHBondContact O-N 2.91Å; F238-Q242 VanDerWaalsContact O-N 3.09Å
239	K	72.9	Confident	63.2	Low	142 Å²	142	108.5 Å²	108.5	62%	0.617	60%	0.595	S	S	*	*	H	α-helix	trans	-70.3	-40.8	168.2	-157.7	-175.7	-178.1	-170.5	0	111.8	Q234 S235 G236 Q242 E243	Q234-K239 HydrophobicContact CG-CB 4.14Å; S235-K239 PolarHBondContact O-N 2.82Å; G236-K239 PolarHBondContact O-N 3.34Å; K239-Q242 PolarHBondContact O-N 3.29Å; K239-E243 PolarHBondContact O-N 2.7Å
240	Y	73.6	Confident	62.8	Low	150 Å²	150	105.1 Å²	105.1	59%	0.588	59%	0.589	S	S	*	*	H	α-helix	trans	-64.8	-38.4	174.8	178.2	-111.7	0	0	0	112.8	G236 S237 E243 I244	G236-Y240 VanDerWaalsContact O-CB 3.27Å; G236-Y240 WeakPolarHBondContact O-CB 3.36Å; G236-Y240 PolarHBondContact O-N 2.97Å; S237-Y240 PolarHBondContact O-N 3.32Å; Y240-E243 PolarHBondContact O-N 3.18Å; Y240-I244 HydrophobicContact CD1-CD1 3.96Å; Y240-I244 HydrophobicContact CE1-CD1 3.58Å; Y240-I244 HydrophobicContact CE2-CD1 4.3Å; Y240-I244 HydrophobicContact CG-CD1 4.49Å; Y240-I244 WeakPolarHBondContact O-CG1 3.43Å; Y240-I244 PolarHBondContact O-N 3.22Å; Y240-I244 VanDerWaalsContact O-N 3.11Å
241	L	72.9	Confident	62.6	Low	92 Å²	92	105.1 Å²	105.1	48%	0.482	60%	0.599	S	S	.	*	H	α-helix	trans	-67.1	-36.1	172.6	-73.6	169.7	0	0	0	112.3	S237 F238 I244 L245	S237-L241 WeakPolarHBondContact O-CG 3.32Å; S237-L241 PolarHBondContact O-N 3.15Å; F238-L241 HydrophobicContact CD2-CB 4.48Å; L241-I244 PolarHBondContact O-N 2.94Å; L241-L245 WeakPolarHBondContact O-CG 3.2Å; L241-L245 PolarHBondContact O-N 3.14Å; L241-L245 VanDerWaalsContact O-N 3.12Å
242	Q	71.2	Confident	62	Low	77 Å²	77	109.5 Å²	109.5	36%	0.36	61%	0.61	S	S	.	*	H	α-helix	trans	-65.4	-42	172	-178.7	172.1	-4.2	0	0	111.5	F238 K239 I244 L245 D246	F238-Q242 WeakPolarHBondContact O-CB 3.35Å; F238-Q242 PolarHBondContact O-N 2.91Å; F238-Q242 VanDerWaalsContact O-N 3.09Å; K239-Q242 PolarHBondContact O-N 3.29Å; Q242-I244 PolarHBondContact O-N 3.22Å; Q242-L245 PolarHBondContact O-N 3.09Å; Q242-L245 VanDerWaalsContact O-N 3.08Å; Q242-D246 VanDerWaalsContact CG-OD2 3.28Å; Q242-D246 WeakPolarHBondContact CG-OD2 3.38Å; Q242-D246 PolarHBondContact NE2-OD2 2.84Å; Q242-D246 WeakPolarHBondContact O-CB 3.34Å; Q242-D246 PolarHBondContact O-N 3.49Å
243	E	62.4	Low	61.6	Low	136 Å²	136	107.9 Å²	107.9	64%	0.636	60%	0.601	S	S	*	*	H	α-helix	trans	-62.6	-22.5	174.5	-168.6	178.6	164.6	0	0	113.5	K239 Y240	K239-E243 PolarHBondContact O-N 2.7Å; Y240-E243 PolarHBondContact O-N 3.18Å
244	I	69.1	Low	60.7	Low	87 Å²	87	104.8 Å²	104.8	45%	0.446	60%	0.602	S	S	.	*	H	α-helix	trans	-81.7	-34.4	172.7	-71.7	165.8	0	0	0	112.1	Y240 L241 Q242	Y240-I244 HydrophobicContact CD1-CD1 3.96Å; Y240-I244 HydrophobicContact CE1-CD1 3.58Å; Y240-I244 HydrophobicContact CE2-CD1 4.3Å; Y240-I244 HydrophobicContact CG-CD1 4.49Å; Y240-I244 WeakPolarHBondContact O-CG1 3.43Å; Y240-I244 PolarHBondContact O-N 3.22Å; Y240-I244 VanDerWaalsContact O-N 3.11Å; L241-I244 PolarHBondContact O-N 2.94Å; Q242-I244 PolarHBondContact O-N 3.22Å
245	L	65.3	Low	60.8	Low	98 Å²	98	107.1 Å²	107.1	51%	0.513	62%	0.621	S	S	.	*	H	α-helix	trans	-81.9	-43.7	179.6	-67.6	170	0	0	0	111.8	L241 Q242 A247 E248	L241-L245 WeakPolarHBondContact O-CG 3.2Å; L241-L245 PolarHBondContact O-N 3.14Å; L241-L245 VanDerWaalsContact O-N 3.12Å; Q242-L245 PolarHBondContact O-N 3.09Å; Q242-L245 VanDerWaalsContact O-N 3.08Å; L245-A247 PolarHBondContact O-N 3.49Å; L245-E248 WeakPolarHBondContact O-CB 3.29Å; L245-E248 VanDerWaalsContact O-CG 3.25Å; L245-E248 WeakPolarHBondContact O-CG 3.4Å; L245-E248 PolarHBondContact O-N 2.82Å
246	D	60.5	Low	60.3	Low	121 Å²	121	112.1 Å²	112.1	65%	0.647	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-6.4	173.9	-67	-8.8	0	0	0	112.6	Q242	Q242-D246 VanDerWaalsContact CG-OD2 3.28Å; Q242-D246 WeakPolarHBondContact CG-OD2 3.38Å; Q242-D246 PolarHBondContact NE2-OD2 2.84Å; Q242-D246 WeakPolarHBondContact O-CB 3.34Å; Q242-D246 PolarHBondContact O-N 3.49Å
247	A	59	Low	59.3	Low	64 Å²	64	120.7 Å²	120.7	53%	0.529	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98	8.6	173.2	0	0	0	0	0	114.3	L245	L245-A247 PolarHBondContact O-N 3.49Å
248	E	51.4	Low	58.6	Low	157 Å²	157	126.5 Å²	126.5	73%	0.734	67%	0.671	S	S	*	*			trans	-82.4	-16.1	-177.9	80.2	-171.9	131.3	0	0	114.9	L245	L245-E248 WeakPolarHBondContact O-CB 3.29Å; L245-E248 VanDerWaalsContact O-CG 3.25Å; L245-E248 WeakPolarHBondContact O-CG 3.4Å; L245-E248 PolarHBondContact O-N 2.82Å
249	D	57.3	Low	57.8	Low	160 Å²	160	131.5 Å²	131.5	86%	0.856	69%	0.687	S	S	*	*	S	Bend	trans	-93.6	114.9	168.8	-162.8	-107.1	0	0	0	111.1
250	G	49.2	Very low	56.6	Low	72 Å²	72	129.6 Å²	129.6	74%	0.742	69%	0.691	S	S	*	*	S	Bend	trans	96.2	58.4	-176.2	0	0	0	0	0	114.5
251	G	50.3	Low	55.2	Low	66 Å²	66	131 Å²	131	68%	0.68	71%	0.707	S	S	*	*			trans	-67.4	147.2	-168.5	0	0	0	0	0	117.2
252	L	50.8	Low	54.1	Low	174 Å²	174	137.7 Å²	137.7	91%	0.911	73%	0.727	S	S	*	*			trans	-159.7	156.3	151.6	-102.9	172.4	0	0	0	109.1
253	S	45.2	Very low	52.4	Low	80 Å²	80	139.4 Å²	139.4	56%	0.559	75%	0.747	S	S	*	*			trans	-63.9	136.4	-169.1	-178.3	0	0	0	0	114.5	T255	S253-T255 PolarHBondContact O-N 2.8Å; S253-T255 PolarHBondContact OG-OG1 2.84Å; S253-T255 VanDerWaalsContact OG-OG1 3.1Å
254	P	45.4	Very low	52	Low	130 Å²	130	138.1 Å²	138.1	84%	0.844	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-2	-179.5	-26	35.8	0	0	0	117.8	E256	P254-E256 PolarHBondContact O-N 3.49Å
255	T	56.8	Low	50.4	Low	120 Å²	120	141.1 Å²	141.1	74%	0.736	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-9	-161.2	38.2	0	0	0	0	117.5	S253	S253-T255 PolarHBondContact O-N 2.8Å; S253-T255 PolarHBondContact OG-OG1 2.84Å; S253-T255 VanDerWaalsContact OG-OG1 3.1Å
256	E	47.6	Very low	49.5	Very low	168 Å²	168	148.2 Å²	148.2	79%	0.785	79%	0.792	S	S	*	*	S	Bend	trans	-119.1	-16.6	-165.3	-65.9	-166.4	99.9	0	0	117.5	P254 M258	P254-E256 PolarHBondContact O-N 3.49Å; E256-M258 VanDerWaalsContact C-N 3.3Å; E256-M258 PolarHBondContact O-N 3.12Å
257	R	51.5	Low	48.2	Very low	242 Å²	242	147.4 Å²	147.4	91%	0.913	80%	0.796	S	S	*	*	G	3₁₀ helix	trans	-72.2	-12.1	-170.4	-81.8	-176	172.4	149.9	0.9	115.9	R259	R257-R259 VanDerWaalsContact C-N 3.27Å; R257-R259 PolarHBondContact O-N 2.94Å
258	M	46.9	Very low	47.4	Very low	200 Å²	200	150.6 Å²	150.6	99%	0.985	81%	0.812	S	S	*	*	G	3₁₀ helix	trans	-80.6	23.9	-173.2	-112.9	-175.4	-176.6	0	0	116.3	E256	E256-M258 VanDerWaalsContact C-N 3.3Å; E256-M258 PolarHBondContact O-N 3.12Å
259	R	54.1	Low	47.3	Very low	226 Å²	226	149.6 Å²	149.6	85%	0.853	81%	0.81	S	S	*	*	G	3₁₀ helix	trans	-100.8	-22.4	-175.4	-170.1	162.6	-74.9	-175.5	1	115.7	R257	R257-R259 VanDerWaalsContact C-N 3.27Å; R257-R259 PolarHBondContact O-N 2.94Å
260	S	49	Very low	46.6	Very low	102 Å²	102	147.9 Å²	147.9	71%	0.713	81%	0.807	S	S	*	*	S	Bend	trans	-134.5	133	175	-63.8	0	0	0	0	108
261	L	44.4	Very low	46.4	Very low	178 Å²	178	152.9 Å²	152.9	93%	0.932	81%	0.809	S	S	*	*			cis	-115.2	160.7	21.7	-60.3	164.3	0	0	0	112.7
262	R	48	Very low	45.8	Very low	234 Å²	234	157.6 Å²	157.6	88%	0.883	82%	0.817	S	S	*	*			trans	-143	130.4	178.8	-172.1	-170.6	-62.5	-127.1	-1.8	111.3
263	S	36	Very low	45	Very low	112 Å²	112	152.3 Å²	152.3	78%	0.783	81%	0.805	S	S	*	*			trans	-150.4	160.2	174.1	-135.8	0	0	0	0	110
264	P	54.9	Low	44.7	Very low	110 Å²	110	154.6 Å²	154.6	71%	0.714	82%	0.821	S	S	*	*				-137.7	124.8	-86.6	35.5	-17.6	0	0	0	115.9
265	V	34.2	Very low	45.3	Very low	150 Å²	150	153.6 Å²	153.6	91%	0.909	82%	0.815	S	S	*	*			trans	-138.9	142	142.7	177.9	0	0	0	0	107.9
266	R	47.8	Very low	44.6	Very low	246 Å²	246	155.6 Å²	155.6	93%	0.928	82%	0.819	S	S	*	*			trans	-97.4	137.9	176.2	-87	179.8	167.8	177.9	-3.6	111.3
267	S	32.1	Very low	44.6	Very low	104 Å²	104	152.5 Å²	152.5	73%	0.727	81%	0.814	S	S	*	*			trans	-132.7	153.2	140.4	54.3	0	0	0	0	108.8
268	P	41.7	Very low	44.3	Very low	132 Å²	132	146.4 Å²	146.4	86%	0.857	81%	0.808	S	S	*	*			trans	-80.7	142.7	-156.7	-17.3	33.6	0	0	0	114.9
269	I	50.4	Low	44.6	Very low	135 Å²	135	142.7 Å²	142.7	69%	0.692	80%	0.799	S	S	*	*			trans	-125	121.8	170.4	-50.2	169.6	0	0	0	108.7	K271	I269-K271 HydrophobicContact CG2-CG 4.46Å
270	P	42.7	Very low	43.9	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	80%	0.8	S	S	*	*			trans	-77.4	115.9	153.8	-14.7	31.5	0	0	0	109.7
271	K	44.9	Very low	44.1	Very low	177 Å²	177	141.1 Å²	141.1	77%	0.77	80%	0.802	S	S	*	*			trans	-79.7	170.7	160	-49.1	174.3	-171.5	170.5	0	106.9	I269	I269-K271 HydrophobicContact CG2-CG 4.46Å
272	L	36.6	Very low	44.3	Very low	165 Å²	165	136.2 Å²	136.2	86%	0.864	80%	0.795	S	S	*	*			cis	-163.5	139.6	25.5	-164.1	71.2	0	0	0	105.2
273	G	35.7	Very low	44.4	Very low	64 Å²	64	133 Å²	133	66%	0.66	79%	0.794	S	S	*	*				104.6	154.7	94.2	0	0	0	0	0	113.5
274	S	38.6	Very low	45.6	Very low	128 Å²	128	136.5 Å²	136.5	90%	0.895	80%	0.798	S	S	*	*			trans	69.8	161	173.3	-67.1	0	0	0	0	118.2
275	P	57.6	Low	46.3	Very low	108 Å²	108	138.7 Å²	138.7	70%	0.701	80%	0.797	S	S	*	*			trans	-118.6	161.4	-151.3	42.9	-32.7	0	0	0	116.3
276	I	41.9	Very low	48.1	Very low	162 Å²	162	136.2 Å²	136.2	83%	0.831	78%	0.778	S	S	*	*			trans	70.5	145.9	171	-46.9	168.7	0	0	0	113.6
277	P	47.8	Very low	50	Low	104 Å²	104	127 Å²	127	68%	0.675	75%	0.75	S	S	*	*			cis	-122.3	158.1	-29.9	34.9	-19.7	0	0	0	114.2
278	S	44.4	Very low	52.8	Low	114 Å²	114	126.4 Å²	126.4	80%	0.797	74%	0.735	S	S	*	*			trans	60	-163.5	157.2	-53.5	0	0	0	0	116.2
279	P	54.8	Low	55.1	Low	121 Å²	121	120.1 Å²	120.1	79%	0.786	70%	0.695	S	S	*	*				-113	123.9	-104.6	32.8	-16.9	0	0	0	114.5
280	M	39.1	Very low	56.9	Low	180 Å²	180	116.7 Å²	116.7	89%	0.887	68%	0.682	S	S	*	*			trans	-86.1	126.8	171.4	-85.7	-64	-70.4	0	0	112.3
281	P	52.7	Low	59	Low	116 Å²	116	115 Å²	115	75%	0.753	66%	0.66	S	S	*	*			trans	-83.3	154.4	172.5	34.5	-34.3	0	0	0	111.8
282	G	49.1	Very low	61.1	Low	75 Å²	75	108.7 Å²	108.7	77%	0.773	64%	0.638	S	S	*	*			trans	136.9	-37.6	163.8	0	0	0	0	0	115.4
283	L	50.2	Low	63.5	Low	165 Å²	165	105.1 Å²	105.1	86%	0.864	63%	0.625	S	S	*	*	S	Bend	trans	-76.5	128.3	167.6	-151.7	76.9	0	0	0	108.3	K285	L283-K285 PolarHBondContact O-N 3.25Å
284	Q	59.8	Low	66	Low	187 Å²	187	107.1 Å²	107.1	87%	0.874	62%	0.621	S	S	*	*			trans	-64.1	83.8	175.3	-72.4	-91.6	6.4	0	0	109.1	L286	Q284-L286 PolarHBondContact O-N 2.93Å; Q284-L286 VanDerWaalsContact O-N 3.12Å
285	K	69.4	Low	68.4	Low	156 Å²	156	102.6 Å²	102.6	68%	0.678	60%	0.595	S	S	*	*			trans	-74.6	108.3	-167	-169.4	174.7	178.4	-167.9	0	109.7	L283	L283-K285 PolarHBondContact O-N 3.25Å
286	L	73.6	Confident	69.9	Low	98 Å²	98	97.7 Å²	97.7	51%	0.513	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-48.2	132.2	178.3	-70.3	168.8	0	0	0	110.6	Q284 Q288 V297	Q284-L286 PolarHBondContact O-N 2.93Å; Q284-L286 VanDerWaalsContact O-N 3.12Å; L286-Q288 PolarHBondContact O-N 2.63Å; L286-V297 HydrophobicContact CD1-CG2 3.98Å
287	P	86.9	Confident	72.1	Confident	52 Å²	52	95.4 Å²	95.4	34%	0.338	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-57.2	122.6	-176.4	19.7	-30.2	0	0	0	110.1	I296 I300 L307	P287-I296 HydrophobicContact CG-CB 4.35Å; P287-I296 WeakPolarHBondContact O-CB 3.34Å; P287-I296 VanDerWaalsContact O-CG1 3.32Å; P287-I296 WeakPolarHBondContact O-CG1 3.28Å; P287-I296 PolarHBondContact O-N 2.7Å; P287-I300 HydrophobicContact CB-CD1 3.7Å; P287-I300 HydrophobicContact CG-CD1 3.58Å; P287-L307 HydrophobicContact CB-CD1 3.56Å
288	Q	89.9	Confident	73.9	Confident	91 Å²	91	93.9 Å²	93.9	43%	0.425	56%	0.559	S	S	.	*	B	Isolated β-bridge	trans	-83.4	137.1	-174.8	-66.3	-171.8	-106.3	0	0	111.2	L286 S290 C293	L286-Q288 PolarHBondContact O-N 2.63Å; Q288-S290 PolarHBondContact O-N 3.4Å; Q288-C293 PolarHBondContact NE2-O 2.86Å
289	C	91.5	Very high	75.8	Confident	1 Å²	1	93.6 Å²	93.6	1%	0.007	55%	0.552	C	S	.	*	P	Polyproline II helix	trans	-73.6	123	175.6	177.2	0	0	0	0	111	R291 C292 C293 N294 I296 L307 H309	C289-R291 PolarHBondContact O-N 2.76Å; C289-R291 VanDerWaalsContact O-N 3.12Å; C289-C292 VanDerWaalsContact CB-SG 3.6Å; C289-C292 PolarHBondContact O-N 2.93Å; C289-C293 WeakPolarHBondContact O-CA 3.28Å; C289-C293 PolarHBondContact O-N 2.92Å; C289-N294 PolarHBondContact N-O 3.41Å; C289-I296 HydrophobicContact CB-CD1 4.01Å; C289-I296 HydrophobicContact CB-CG1 3.83Å; C289-L307 CarbonylContact C-O 3.58Å; C289-L307 VanDerWaalsContact CA-O 3.28Å; C289-L307 WeakPolarHBondContact CA-O 3.28Å; C289-H309 WeakPolarHBondContact CB-CE1 3.44Å; C289-H309 WeakPolarHBondContact CB-ND1 3.43Å; C289-H309 PolarHBondContact SG-ND1 2.91Å
290	S	88.3	Confident	77.5	Confident	62 Å²	62	91.6 Å²	91.6	43%	0.434	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.1	-178	-52.3	0	0	0	0	114.4	Q288 K306 L307	Q288-S290 PolarHBondContact O-N 3.4Å; S290-K306 WeakPolarHBondContact OG-CB 3.5Å; S290-L307 PolarHBondContact N-O 3.1Å; S290-L307 PolarHBondContact OG-O 3.18Å
291	R	86.7	Confident	79.9	Confident	89 Å²	89	84.4 Å²	84.4	34%	0.336	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-37.4	175.5	-166.3	177.2	-160.6	140	5.2	114.3	C289 Y308 C312 M314 C315 D316	C289-R291 PolarHBondContact O-N 2.76Å; C289-R291 VanDerWaalsContact O-N 3.12Å; R291-Y308 HydrophobicContact CB-CD1 4.11Å; R291-Y308 HydrophobicContact CB-CE1 4.21Å; R291-C312 HydrophobicContact CB-CB 4.25Å; R291-C312 VanDerWaalsContact CD-O 3.28Å; R291-C312 WeakPolarHBondContact CD-O 3.22Å; R291-C312 PolarHBondContact NH1-O 3.05Å; R291-M314 PolarHBondContact NH1-O 3.49Å; R291-C315 PolarHBondContact NH2-O 2.9Å; R291-D316 IonicContact CZ-OD1 3.23Å; R291-D316 IonicContact NH2-OD1 2.95Å; R291-D316 PolarHBondContact NH2-OD1 3.15Å
292	C	89.1	Confident	81.6	Confident	45 Å²	45	85.5 Å²	85.5	30%	0.304	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	5.2	-175.7	71.2	0	0	0	0	113.9	C289 N294 H309	C289-C292 VanDerWaalsContact CB-SG 3.6Å; C289-C292 PolarHBondContact O-N 2.93Å; C292-N294 PolarHBondContact O-N 3.19Å; C292-N294 PolarHBondContact O-ND2 3.38Å; C292-H309 PolarHBondContact SG-CE1 3.11Å; C292-H309 PolarHBondContact SG-ND1 2.76Å; C292-H309 VanDerWaalsContact SG-ND1 3.44Å
293	C	87.2	Confident	83.4	Confident	89 Å²	89	81.9 Å²	81.9	60%	0.601	46%	0.457	S	S	*	.			trans	59.6	-12.9	179.8	-61.4	0	0	0	0	116.7	Q288 C289	Q288-C293 PolarHBondContact NE2-O 2.86Å; C289-C293 WeakPolarHBondContact O-CA 3.28Å; C289-C293 PolarHBondContact O-N 2.92Å
294	N	86.5	Confident	84.8	Confident	107 Å²	107	81.3 Å²	81.3	57%	0.572	44%	0.443	S	S	*	.	S	Bend	trans	-70.4	154.1	179.3	-66	-46.6	0	0	0	112.5	C289 C292	C289-N294 PolarHBondContact N-O 3.41Å; C292-N294 PolarHBondContact O-N 3.19Å; C292-N294 PolarHBondContact O-ND2 3.38Å
295	G	90.2	Very high	85.9	Confident	33 Å²	33	79.2 Å²	79.2	34%	0.34	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-62.1	139.7	171.7	0	0	0	0	0	112.1	H309	G295-H309 PolarHBondContact O-NE2 3.41Å; G295-H309 VanDerWaalsContact O-NE2 3.08Å
296	I	89.6	Confident	86.7	Confident	4 Å²	4	74.4 Å²	74.4	2%	0.021	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-89	123.9	173.5	-57.9	163.8	0	0	0	107.9	P287 C289 T299 I300 L307	P287-I296 HydrophobicContact CG-CB 4.35Å; P287-I296 WeakPolarHBondContact O-CB 3.34Å; P287-I296 VanDerWaalsContact O-CG1 3.32Å; P287-I296 WeakPolarHBondContact O-CG1 3.28Å; P287-I296 PolarHBondContact O-N 2.7Å; C289-I296 HydrophobicContact CB-CD1 4.01Å; C289-I296 HydrophobicContact CB-CG1 3.83Å; I296-T299 WeakPolarHBondContact CG2-O 3.32Å; I296-I300 HydrophobicContact CB-CD1 4.34Å; I296-I300 HydrophobicContact CD1-CD1 3.77Å; I296-I300 HydrophobicContact CD1-CG1 3.92Å; I296-I300 HydrophobicContact CG2-CB 4.01Å; I296-I300 HydrophobicContact CG2-CD1 4.21Å; I296-I300 HydrophobicContact CG2-CG1 4.13Å; I296-L307 HydrophobicContact CD1-CB 3.93Å
297	V	87.8	Confident	87.5	Confident	115 Å²	115	72 Å²	72	70%	0.697	40%	0.404	S	S	*	.			trans	-117.9	126.3	177.8	-179.5	0	0	0	0	107.7	L286	L286-V297 HydrophobicContact CD1-CG2 3.98Å
298	G	84.5	Confident	87.7	Confident	72 Å²	72	70.1 Å²	70.1	74%	0.742	39%	0.39	S	S	*	.	S	Bend	trans	83.6	-130.9	-174.9	0	0	0	0	0	112.7
299	T	85.6	Confident	87.8	Confident	107 Å²	107	67.7 Å²	67.7	66%	0.656	38%	0.379	S	S	*	.			trans	-70.4	140.9	-173.1	49.3	0	0	0	0	112.4	I296 P310	I296-T299 WeakPolarHBondContact CG2-O 3.32Å; T299-P310 WeakPolarHBondContact O-CD 3.27Å; T299-P310 WeakPolarHBondContact OG1-CG 3.4Å
300	I	89.4	Confident	87.8	Confident	79 Å²	79	68.8 Å²	68.8	41%	0.405	39%	0.386	S	S	.	.			trans	-131	138.4	-171.8	-173.5	156.8	0	0	0	110.6	P287 I296 L307	P287-I300 HydrophobicContact CB-CD1 3.7Å; P287-I300 HydrophobicContact CG-CD1 3.58Å; I296-I300 HydrophobicContact CB-CD1 4.34Å; I296-I300 HydrophobicContact CD1-CD1 3.77Å; I296-I300 HydrophobicContact CD1-CG1 3.92Å; I296-I300 HydrophobicContact CG2-CB 4.01Å; I296-I300 HydrophobicContact CG2-CD1 4.21Å; I296-I300 HydrophobicContact CG2-CG1 4.13Å; I300-L307 HydrophobicContact CD1-CB 4.13Å; I300-L307 HydrophobicContact CD1-CD1 4.1Å; I300-L307 HydrophobicContact CD1-CD2 4.06Å; I300-L307 HydrophobicContact CD1-CG 4.31Å; I300-L307 HydrophobicContact CG1-CB 4.49Å; I300-L307 HydrophobicContact CG1-CD2 4.35Å
301	V	90.2	Very high	87.9	Confident	30 Å²	30	71.3 Å²	71.3	18%	0.182	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	116.8	171.2	-176.6	0	0	0	0	108.3	Y308 P310 F313	V301-Y308 PolarHBondContact N-O 3.25Å; V301-Y308 PolarHBondContact O-N 2.78Å; V301-P310 HydrophobicContact CG2-CB 4.44Å; V301-P310 HydrophobicContact CG2-CG 4.49Å; V301-F313 HydrophobicContact CB-CB 4.28Å; V301-F313 HydrophobicContact CB-CD2 4.48Å; V301-F313 HydrophobicContact CB-CG 4.26Å; V301-F313 HydrophobicContact CG1-CB 4.18Å; V301-F313 HydrophobicContact CG1-CD1 3.8Å; V301-F313 HydrophobicContact CG1-CD2 3.77Å; V301-F313 HydrophobicContact CG1-CE1 4.09Å; V301-F313 HydrophobicContact CG1-CE2 4.07Å; V301-F313 HydrophobicContact CG1-CG 3.63Å; V301-F313 HydrophobicContact CG1-CZ 4.22Å; V301-F313 HydrophobicContact CG2-CB 4.39Å
302	K	88.8	Confident	88	Confident	138 Å²	138	68.2 Å²	68.2	60%	0.6	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	129.9	172	178.5	171.7	179.4	177.9	0	109.3	R304 L307	K302-R304 WeakPolarHBondContact CE-O 3.47Å; K302-R304 WeakPolarHBondContact CG-O 3.28Å; K302-L307 HydrophobicContact CB-CD2 3.78Å; K302-L307 HydrophobicContact CD-CD2 4.23Å; K302-L307 HydrophobicContact CG-CD2 3.85Å
303	A	85.4	Confident	88.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	116.2	174.5	0	0	0	0	0	109.1	D305 K306 Y308 F313 Y327 L334	A303-D305 PolarHBondContact O-N 2.79Å; A303-K306 PolarHBondContact N-O 3.29Å; A303-K306 PolarHBondContact O-N 2.75Å; A303-K306 VanDerWaalsContact O-N 3.09Å; A303-Y308 HydrophobicContact CB-CD2 4.49Å; A303-Y308 HydrophobicContact CB-CE2 4.25Å; A303-F313 HydrophobicContact CB-CE2 3.51Å; A303-F313 HydrophobicContact CB-CZ 4.02Å; A303-Y327 HydrophobicContact CB-CE2 3.8Å; A303-L334 HydrophobicContact CB-CD2 4.43Å
304	R	81.1	Confident	88.4	Confident	153 Å²	153	64.6 Å²	64.6	58%	0.577	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	-122.2	-159	-64.5	-177.5	171.5	176.9	-1.2	109.3	K302	K302-R304 WeakPolarHBondContact CE-O 3.47Å; K302-R304 WeakPolarHBondContact CG-O 3.28Å
305	D	81.5	Confident	88.7	Confident	143 Å²	143	59.5 Å²	59.5	77%	0.765	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	0.2	-176.2	-53.9	-73.7	0	0	0	113.3	A303	A303-D305 PolarHBondContact O-N 2.79Å
306	K	87.8	Confident	88.6	Confident	54 Å²	54	61.9 Å²	61.9	24%	0.235	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	151.1	177.7	-66.7	-173.8	-173.7	178.2	0	111.6	S290 A303 Y308 F329 D332	S290-K306 WeakPolarHBondContact OG-CB 3.5Å; A303-K306 PolarHBondContact N-O 3.29Å; A303-K306 PolarHBondContact O-N 2.75Å; A303-K306 VanDerWaalsContact O-N 3.09Å; K306-Y308 HydrophobicContact CB-CD2 4.48Å; K306-Y308 HydrophobicContact CB-CE2 3.48Å; K306-Y308 VanDerWaalsContact CB-CE2 3.48Å; K306-Y308 WeakPolarHBondContact CB-OH 3.19Å; K306-Y308 VanDerWaalsContact CD-OH 3.28Å; K306-Y308 WeakPolarHBondContact CD-OH 3.47Å; K306-F329 HydrophobicContact CD-CE2 4.14Å; K306-F329 HydrophobicContact CD-CZ 4.05Å; K306-D332 WeakPolarHBondContact CE-OD1 3.41Å; K306-D332 PolarHBondContact NZ-O 3.19Å; K306-D332 IonicContact NZ-OD1 2.68Å; K306-D332 PolarHBondContact NZ-OD1 3.02Å
307	L	89.9	Confident	88.6	Confident	48 Å²	48	65.5 Å²	65.5	25%	0.251	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.3	-173.9	-59.7	176.8	0	0	0	109.3	P287 C289 S290 I296 I300 K302	P287-L307 HydrophobicContact CB-CD1 3.56Å; C289-L307 CarbonylContact C-O 3.58Å; C289-L307 VanDerWaalsContact CA-O 3.28Å; C289-L307 WeakPolarHBondContact CA-O 3.28Å; S290-L307 PolarHBondContact N-O 3.1Å; S290-L307 PolarHBondContact OG-O 3.18Å; I296-L307 HydrophobicContact CD1-CB 3.93Å; I300-L307 HydrophobicContact CD1-CB 4.13Å; I300-L307 HydrophobicContact CD1-CD1 4.1Å; I300-L307 HydrophobicContact CD1-CD2 4.06Å; I300-L307 HydrophobicContact CD1-CG 4.31Å; I300-L307 HydrophobicContact CG1-CB 4.49Å; I300-L307 HydrophobicContact CG1-CD2 4.35Å; K302-L307 HydrophobicContact CB-CD2 3.78Å; K302-L307 HydrophobicContact CD-CD2 4.23Å; K302-L307 HydrophobicContact CG-CD2 3.85Å
308	Y	91.7	Very high	88.7	Confident	12 Å²	12	62.5 Å²	62.5	5%	0.047	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	147.4	-174.3	-57.6	-90.6	0	0	0	111.3	R291 V301 A303 K306 F313 L334	R291-Y308 HydrophobicContact CB-CD1 4.11Å; R291-Y308 HydrophobicContact CB-CE1 4.21Å; V301-Y308 PolarHBondContact N-O 3.25Å; V301-Y308 PolarHBondContact O-N 2.78Å; A303-Y308 HydrophobicContact CB-CD2 4.49Å; A303-Y308 HydrophobicContact CB-CE2 4.25Å; K306-Y308 HydrophobicContact CB-CD2 4.48Å; K306-Y308 HydrophobicContact CB-CE2 3.48Å; K306-Y308 VanDerWaalsContact CB-CE2 3.48Å; K306-Y308 WeakPolarHBondContact CB-OH 3.19Å; K306-Y308 VanDerWaalsContact CD-OH 3.28Å; K306-Y308 WeakPolarHBondContact CD-OH 3.47Å; Y308-F313 AromaticContact CD2-CD2 3.88Å; Y308-F313 HydrophobicContact CD2-CD2 3.88Å; Y308-F313 HydrophobicContact CD2-CE2 4.32Å; Y308-F313 HydrophobicContact CE2-CD2 4.5Å; Y308-F313 HydrophobicContact CG-CD2 4.03Å; Y308-L334 HydrophobicContact CD1-CD1 4.36Å; Y308-L334 HydrophobicContact CD2-CD1 4.26Å; Y308-L334 HydrophobicContact CE1-CD1 3.83Å; Y308-L334 HydrophobicContact CE2-CD1 3.72Å; Y308-L334 VanDerWaalsContact CZ-CD1 3.47Å
309	H	92	Very high	88.9	Confident	40 Å²	40	60.8 Å²	60.8	19%	0.185	32%	0.319	C	S	.	.			trans	-63	151.8	161.6	-57.1	90.5	0	0	0	109.8	C289 C292 G295 D311 C312 F313	C289-H309 WeakPolarHBondContact CB-CE1 3.44Å; C289-H309 WeakPolarHBondContact CB-ND1 3.43Å; C289-H309 PolarHBondContact SG-ND1 2.91Å; C292-H309 PolarHBondContact SG-CE1 3.11Å; C292-H309 PolarHBondContact SG-ND1 2.76Å; C292-H309 VanDerWaalsContact SG-ND1 3.44Å; G295-H309 PolarHBondContact O-NE2 3.41Å; G295-H309 VanDerWaalsContact O-NE2 3.08Å; H309-D311 PolarHBondContact O-N 3Å; H309-D311 VanDerWaalsContact O-N 3.1Å; H309-C312 HydrophobicContact CB-CB 4.05Å; H309-C312 PolarHBondContact O-N 2.64Å; H309-F313 PolarHBondContact O-N 3.04Å; H309-F313 VanDerWaalsContact O-N 3.1Å
310	P	90.6	Very high	89	Confident	25 Å²	25	59.8 Å²	59.8	16%	0.162	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-32.2	176.2	-25.8	34.3	0	0	0	113.8	T299 V301 N321	T299-P310 WeakPolarHBondContact O-CD 3.27Å; T299-P310 WeakPolarHBondContact OG1-CG 3.4Å; V301-P310 HydrophobicContact CG2-CB 4.44Å; V301-P310 HydrophobicContact CG2-CG 4.49Å; P310-N321 PolarHBondContact O-ND2 2.95Å
311	D	89.8	Confident	89.1	Confident	115 Å²	115	58.2 Å²	58.2	62%	0.615	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-21.4	179.2	-51.3	-76.1	0	0	0	113	H309 M314	H309-D311 PolarHBondContact O-N 3Å; H309-D311 VanDerWaalsContact O-N 3.1Å; D311-M314 WeakPolarHBondContact O-CE 3.34Å; D311-M314 WeakPolarHBondContact O-CG 3.28Å
312	C	89.8	Confident	89	Confident	23 Å²	23	56.8 Å²	56.8	16%	0.155	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-15.3	173.2	-67.6	0	0	0	0	113.3	R291 H309 M314	R291-C312 HydrophobicContact CB-CB 4.25Å; R291-C312 VanDerWaalsContact CD-O 3.28Å; R291-C312 WeakPolarHBondContact CD-O 3.22Å; R291-C312 PolarHBondContact NH1-O 3.05Å; H309-C312 HydrophobicContact CB-CB 4.05Å; H309-C312 PolarHBondContact O-N 2.64Å; C312-M314 VanDerWaalsContact C-N 3.26Å; C312-M314 PolarHBondContact O-N 2.99Å
313	F	91.8	Very high	88.7	Confident	3 Å²	3	55.7 Å²	55.7	1%	0.013	29%	0.288	C	S	.	.			trans	-77.8	74	178.8	-165.6	-110.5	0	0	0	111.6	V301 A303 Y308 H309 L322 K323 Y327 L334	V301-F313 HydrophobicContact CB-CB 4.28Å; V301-F313 HydrophobicContact CB-CD2 4.48Å; V301-F313 HydrophobicContact CB-CG 4.26Å; V301-F313 HydrophobicContact CG1-CB 4.18Å; V301-F313 HydrophobicContact CG1-CD1 3.8Å; V301-F313 HydrophobicContact CG1-CD2 3.77Å; V301-F313 HydrophobicContact CG1-CE1 4.09Å; V301-F313 HydrophobicContact CG1-CE2 4.07Å; V301-F313 HydrophobicContact CG1-CG 3.63Å; V301-F313 HydrophobicContact CG1-CZ 4.22Å; V301-F313 HydrophobicContact CG2-CB 4.39Å; A303-F313 HydrophobicContact CB-CE2 3.51Å; A303-F313 HydrophobicContact CB-CZ 4.02Å; Y308-F313 AromaticContact CD2-CD2 3.88Å; Y308-F313 HydrophobicContact CD2-CD2 3.88Å; Y308-F313 HydrophobicContact CD2-CE2 4.32Å; Y308-F313 HydrophobicContact CE2-CD2 4.5Å; Y308-F313 HydrophobicContact CG-CD2 4.03Å; H309-F313 PolarHBondContact O-N 3.04Å; H309-F313 VanDerWaalsContact O-N 3.1Å; F313-L322 HydrophobicContact CD1-CB 3.72Å; F313-L322 HydrophobicContact CE1-CB 3.5Å; F313-L322 VanDerWaalsContact CE1-CB 3.5Å; F313-L322 HydrophobicContact CZ-CB 4.21Å; F313-L322 PolarHBondContact O-N 3.23Å; F313-K323 HydrophobicContact CD1-CB 4.16Å; F313-Y327 AromaticContact CE1-CD1 3.99Å; F313-Y327 HydrophobicContact CE1-CD1 3.99Å; F313-Y327 HydrophobicContact CE1-CE1 4.36Å; F313-Y327 HydrophobicContact CE1-CG 4.32Å; F313-Y327 AromaticContact CZ-CD1 3.67Å; F313-Y327 HydrophobicContact CZ-CD1 3.67Å; F313-Y327 AromaticContact CZ-CD2 3.99Å; F313-Y327 HydrophobicContact CZ-CD2 3.99Å; F313-Y327 AromaticContact CZ-CE1 3.87Å; F313-Y327 HydrophobicContact CZ-CE1 3.87Å; F313-Y327 HydrophobicContact CZ-CE2 4.19Å; F313-Y327 AromaticContact CZ-CG 3.73Å; F313-Y327 HydrophobicContact CZ-CG 3.73Å; F313-L334 HydrophobicContact CD2-CD1 3.63Å; F313-L334 HydrophobicContact CE2-CD1 3.46Å; F313-L334 VanDerWaalsContact CE2-CD1 3.46Å; F313-L334 HydrophobicContact CE2-CD2 3.76Å; F313-L334 HydrophobicContact CE2-CG 4.28Å; F313-L334 HydrophobicContact CZ-CD1 4.5Å; F313-L334 HydrophobicContact CZ-CD2 4.18Å
314	M	92.7	Very high	88.5	Confident	56 Å²	56	64 Å²	64	28%	0.276	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-126.4	158.3	-175.5	-59.2	-179.9	-65.7	0	0	111	R291 D311 C312 G319 I320 N321	R291-M314 PolarHBondContact NH1-O 3.49Å; D311-M314 WeakPolarHBondContact O-CE 3.34Å; D311-M314 WeakPolarHBondContact O-CG 3.28Å; C312-M314 VanDerWaalsContact C-N 3.26Å; C312-M314 PolarHBondContact O-N 2.99Å; M314-G319 WeakPolarHBondContact CB-O 3.03Å; M314-G319 WeakPolarHBondContact CG-O 3.35Å; M314-I320 CarbonylContact C-O 3.56Å; M314-I320 VanDerWaalsContact CA-O 3.27Å; M314-I320 WeakPolarHBondContact CA-O 3.39Å; M314-N321 HydrophobicContact CG-CB 4.36Å
315	C	92	Very high	88.3	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.332	C	S	.	.			trans	-58.2	150.9	167	-171.3	0	0	0	0	110.3	R291 C318 G319 I320 L322 L334 C336	R291-C315 PolarHBondContact NH2-O 2.9Å; C315-C318 VanDerWaalsContact CB-SG 3.54Å; C315-G319 WeakPolarHBondContact O-CA 3.45Å; C315-G319 PolarHBondContact O-N 3.46Å; C315-I320 PolarHBondContact N-O 3.48Å; C315-L322 HydrophobicContact CB-CD1 4.43Å; C315-L322 HydrophobicContact CB-CD2 4.29Å; C315-L322 HydrophobicContact CB-CG 4.49Å; C315-L334 CarbonylContact C-O 3.53Å; C315-L334 WeakPolarHBondContact CA-O 3.45Å; C315-C336 HydrophobicContact CB-CB 4.3Å; C315-C336 PolarHBondContact SG-N 3.08Å
316	D	89.5	Confident	88.3	Confident	83 Å²	83	60.6 Å²	60.6	44%	0.444	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-53.3	176.3	-143.8	48.9	0	0	0	112.2	R291 L334 Y335	R291-D316 IonicContact CZ-OD1 3.23Å; R291-D316 IonicContact NH2-OD1 2.95Å; R291-D316 PolarHBondContact NH2-OD1 3.15Å; D316-L334 PolarHBondContact N-O 2.95Å; D316-Y335 HydrophobicContact CB-CD1 4.45Å; D316-Y335 HydrophobicContact CB-CE1 3.83Å
317	D	88.3	Confident	88.3	Confident	80 Å²	80	62.7 Å²	62.7	43%	0.428	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-39.2	-174.5	-32	-82.9	0	0	0	114.8	Y335 H339 R343	D317-Y335 WeakPolarHBondContact OD2-CD1 3.46Å; D317-Y335 WeakPolarHBondContact OD2-CE1 3.33Å; D317-H339 WeakPolarHBondContact CB-ND1 3.46Å; D317-H339 WeakPolarHBondContact OD2-CB 3.34Å; D317-H339 IonicContact OD2-CE1 3.85Å; D317-H339 IonicContact OD2-CG 3.4Å; D317-H339 IonicContact OD2-ND1 2.86Å; D317-H339 PolarHBondContact OD2-ND1 3.18Å; D317-R343 IonicContact OD1-CZ 3.21Å; D317-R343 IonicContact OD1-NH1 3.18Å; D317-R343 PolarHBondContact OD1-NH1 2.9Å; D317-R343 IonicContact OD1-NH2 2.6Å; D317-R343 PolarHBondContact OD1-NH2 2.96Å; D317-R343 IonicContact OD2-CZ 2.65Å; D317-R343 IonicContact OD2-NH1 2.7Å; D317-R343 PolarHBondContact OD2-NH1 3.12Å; D317-R343 IonicContact OD2-NH2 3.85Å
318	C	90.4	Very high	88.3	Confident	52 Å²	52	64.6 Å²	64.6	35%	0.351	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	0.2	-172.3	59.6	0	0	0	0	115	C315 I320	C315-C318 VanDerWaalsContact CB-SG 3.54Å; C318-I320 HydrophobicContact CB-CD1 4.34Å; C318-I320 HydrophobicContact CB-CG1 4.22Å; C318-I320 PolarHBondContact O-N 3.33Å
319	G	88.6	Confident	88	Confident	35 Å²	35	65.6 Å²	65.6	36%	0.361	34%	0.335	S	S	.	.			trans	61.3	6	179.5	0	0	0	0	0	115.8	M314 C315 N321	M314-G319 WeakPolarHBondContact CB-O 3.03Å; M314-G319 WeakPolarHBondContact CG-O 3.35Å; C315-G319 WeakPolarHBondContact O-CA 3.45Å; C315-G319 PolarHBondContact O-N 3.46Å; G319-N321 PolarHBondContact O-N 2.93Å
320	I	88.4	Confident	87.7	Confident	87 Å²	87	65 Å²	65	45%	0.446	33%	0.333	S	S	.	.			trans	-67.4	129.5	-179.5	-63.5	176.8	0	0	0	109.5	M314 C315 C318 L322	M314-I320 CarbonylContact C-O 3.56Å; M314-I320 VanDerWaalsContact CA-O 3.27Å; M314-I320 WeakPolarHBondContact CA-O 3.39Å; C315-I320 PolarHBondContact N-O 3.48Å; C318-I320 HydrophobicContact CB-CD1 4.34Å; C318-I320 HydrophobicContact CB-CG1 4.22Å; C318-I320 PolarHBondContact O-N 3.33Å; I320-L322 PolarHBondContact O-N 3.33Å
321	N	90.5	Very high	87.3	Confident	45 Å²	45	72 Å²	72	24%	0.241	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-64.5	126.8	178	-166.6	-74	0	0	0	111.7	P310 M314 G319 K323	P310-N321 PolarHBondContact O-ND2 2.95Å; M314-N321 HydrophobicContact CG-CB 4.36Å; G319-N321 PolarHBondContact O-N 2.93Å; N321-K323 WeakPolarHBondContact OD1-CB 3.46Å; N321-K323 WeakPolarHBondContact OD1-CD 3.22Å; N321-K323 WeakPolarHBondContact OD1-CG 3.28Å; N321-K323 PolarHBondContact OD1-N 2.92Å; N321-K323 VanDerWaalsContact OD1-N 3.14Å
322	L	87.6	Confident	86.7	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	36%	0.36	C	S	.	.			trans	-94	-5.8	-169.8	-66.4	175.4	0	0	0	113.6	F313 C315 I320 Q324 R325 L334 C336	F313-L322 HydrophobicContact CD1-CB 3.72Å; F313-L322 HydrophobicContact CE1-CB 3.5Å; F313-L322 VanDerWaalsContact CE1-CB 3.5Å; F313-L322 HydrophobicContact CZ-CB 4.21Å; F313-L322 PolarHBondContact O-N 3.23Å; C315-L322 HydrophobicContact CB-CD1 4.43Å; C315-L322 HydrophobicContact CB-CD2 4.29Å; C315-L322 HydrophobicContact CB-CG 4.49Å; I320-L322 PolarHBondContact O-N 3.33Å; L322-Q324 PolarHBondContact O-N 3.48Å; L322-R325 PolarHBondContact O-N 3.48Å; L322-R325 VanDerWaalsContact O-N 3.08Å; L322-L334 HydrophobicContact CD1-CB 4.01Å; L322-C336 HydrophobicContact CD2-CB 3.81Å
323	K	82.6	Confident	86.4	Confident	114 Å²	114	72.1 Å²	72.1	50%	0.496	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-13.9	-170.1	83	-162	169	-165.5	0	115.3	F313 N321	F313-K323 HydrophobicContact CD1-CB 4.16Å; N321-K323 WeakPolarHBondContact OD1-CB 3.46Å; N321-K323 WeakPolarHBondContact OD1-CD 3.22Å; N321-K323 WeakPolarHBondContact OD1-CG 3.28Å; N321-K323 PolarHBondContact OD1-N 2.92Å; N321-K323 VanDerWaalsContact OD1-N 3.14Å
324	Q	81.5	Confident	86.3	Confident	175 Å²	175	72.3 Å²	72.3	82%	0.818	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.5	15.3	178.4	-61.4	-176.1	-89.3	0	0	112.5	L322	L322-Q324 PolarHBondContact O-N 3.48Å
325	R	77.3	Confident	86.1	Confident	181 Å²	181	70.3 Å²	70.3	68%	0.683	36%	0.356	S	S	*	.	S	Bend	trans	-134.7	160.7	-180	-77.7	-170.6	157.4	95.2	2.2	110.7	L322 Y327	L322-R325 PolarHBondContact O-N 3.48Å; L322-R325 VanDerWaalsContact O-N 3.08Å; R325-Y327 PolarHBondContact O-N 2.95Å
326	G	82.4	Confident	86.1	Confident	43 Å²	43	71 Å²	71	44%	0.443	36%	0.361	S	S	.	.			trans	-57.9	125.8	168.8	0	0	0	0	0	110.1
327	Y	87.5	Confident	86	Confident	99 Å²	99	71.4 Å²	71.4	39%	0.388	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	146.5	175	71.3	-93.8	0	0	0	110.1	A303 F313 R325 L334	A303-Y327 HydrophobicContact CB-CE2 3.8Å; F313-Y327 AromaticContact CE1-CD1 3.99Å; F313-Y327 HydrophobicContact CE1-CD1 3.99Å; F313-Y327 HydrophobicContact CE1-CE1 4.36Å; F313-Y327 HydrophobicContact CE1-CG 4.32Å; F313-Y327 AromaticContact CZ-CD1 3.67Å; F313-Y327 HydrophobicContact CZ-CD1 3.67Å; F313-Y327 AromaticContact CZ-CD2 3.99Å; F313-Y327 HydrophobicContact CZ-CD2 3.99Å; F313-Y327 AromaticContact CZ-CE1 3.87Å; F313-Y327 HydrophobicContact CZ-CE1 3.87Å; F313-Y327 HydrophobicContact CZ-CE2 4.19Å; F313-Y327 AromaticContact CZ-CG 3.73Å; F313-Y327 HydrophobicContact CZ-CG 3.73Å; R325-Y327 PolarHBondContact O-N 2.95Å; Y327-L334 HydrophobicContact CD2-CD2 3.74Å; Y327-L334 HydrophobicContact CE2-CD2 4.3Å; Y327-L334 HydrophobicContact CG-CD2 4.49Å
328	F	88.7	Confident	86	Confident	88 Å²	88	72.5 Å²	72.5	39%	0.386	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	152.7	179.3	-63.7	-101.7	0	0	0	108.4	Y335 E337 A340	F328-Y335 PolarHBondContact N-O 2.87Å; F328-Y335 PolarHBondContact O-N 2.96Å; F328-E337 HydrophobicContact CD2-CB 4.4Å; F328-E337 HydrophobicContact CE2-CB 3.78Å; F328-E337 HydrophobicContact CE2-CG 3.84Å; F328-E337 HydrophobicContact CZ-CG 4.27Å; F328-A340 HydrophobicContact CB-CB 3.34Å; F328-A340 HydrophobicContact CD1-CB 4.17Å; F328-A340 HydrophobicContact CD2-CB 3.71Å; F328-A340 HydrophobicContact CG-CB 3.47Å; F328-A340 VanDerWaalsContact CG-CB 3.47Å
329	F	87.1	Confident	85.9	Confident	32 Å²	32	72.6 Å²	72.6	14%	0.14	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	107.8	-172.2	-168.5	-78.7	0	0	0	108.8	K306 D332 S333 L334	K306-F329 HydrophobicContact CD-CE2 4.14Å; K306-F329 HydrophobicContact CD-CZ 4.05Å; F329-D332 HydrophobicContact CE1-CB 4.49Å; F329-S333 WeakPolarHBondContact CA-O 3.27Å; F329-L334 HydrophobicContact CD2-CD2 3.98Å; F329-L334 HydrophobicContact CD2-CG 4.32Å
330	I	85	Confident	86	Confident	29 Å²	29	71 Å²	71	15%	0.149	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.7	-171.7	-58.1	157.2	0	0	0	106.1	D332 S333 Y335 A340 R343 V344	I330-D332 PolarHBondContact O-N 3.07Å; I330-D332 VanDerWaalsContact O-N 3.14Å; I330-S333 PolarHBondContact N-O 3.4Å; I330-S333 VanDerWaalsContact N-O 3.11Å; I330-S333 PolarHBondContact O-N 3.14Å; I330-Y335 HydrophobicContact CB-CD2 3.91Å; I330-Y335 HydrophobicContact CB-CE2 4.03Å; I330-Y335 HydrophobicContact CD1-CD2 3.98Å; I330-Y335 HydrophobicContact CG1-CD2 4.33Å; I330-A340 HydrophobicContact CD1-CB 3.8Å; I330-R343 HydrophobicContact CD1-CB 4.13Å; I330-V344 HydrophobicContact CD1-CG2 3.47Å; I330-V344 VanDerWaalsContact CD1-CG2 3.47Å; I330-V344 HydrophobicContact CG1-CG2 3.78Å
331	E	82.1	Confident	85.8	Confident	172 Å²	172	72.5 Å²	72.5	80%	0.804	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	47.4	177.4	-65	177.6	168.3	0	0	113.1	S333	E331-S333 PolarHBondContact O-N 3.14Å
332	D	77.1	Confident	85.5	Confident	101 Å²	101	74 Å²	74	54%	0.54	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	3.9	-179.1	-98.1	-68	0	0	0	117.2	K306 F329 I330	K306-D332 WeakPolarHBondContact CE-OD1 3.41Å; K306-D332 PolarHBondContact NZ-O 3.19Å; K306-D332 IonicContact NZ-OD1 2.68Å; K306-D332 PolarHBondContact NZ-OD1 3.02Å; F329-D332 HydrophobicContact CE1-CB 4.49Å; I330-D332 PolarHBondContact O-N 3.07Å; I330-D332 VanDerWaalsContact O-N 3.14Å
333	S	84	Confident	85.1	Confident	38 Å²	38	79 Å²	79	27%	0.266	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	158.9	-176.6	-76.3	0	0	0	0	113.6	F329 I330 E331 Y335	F329-S333 WeakPolarHBondContact CA-O 3.27Å; I330-S333 PolarHBondContact N-O 3.4Å; I330-S333 VanDerWaalsContact N-O 3.11Å; I330-S333 PolarHBondContact O-N 3.14Å; E331-S333 PolarHBondContact O-N 3.14Å; S333-Y335 WeakPolarHBondContact CB-OH 3.46Å
334	L	88.8	Confident	84.7	Confident	8 Å²	8	78.2 Å²	78.2	4%	0.042	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	124.5	-174.9	-78.9	165.5	0	0	0	112	A303 Y308 F313 C315 D316 L322 Y327 F329	A303-L334 HydrophobicContact CB-CD2 4.43Å; Y308-L334 HydrophobicContact CD1-CD1 4.36Å; Y308-L334 HydrophobicContact CD2-CD1 4.26Å; Y308-L334 HydrophobicContact CE1-CD1 3.83Å; Y308-L334 HydrophobicContact CE2-CD1 3.72Å; Y308-L334 VanDerWaalsContact CZ-CD1 3.47Å; F313-L334 HydrophobicContact CD2-CD1 3.63Å; F313-L334 HydrophobicContact CE2-CD1 3.46Å; F313-L334 VanDerWaalsContact CE2-CD1 3.46Å; F313-L334 HydrophobicContact CE2-CD2 3.76Å; F313-L334 HydrophobicContact CE2-CG 4.28Å; F313-L334 HydrophobicContact CZ-CD1 4.5Å; F313-L334 HydrophobicContact CZ-CD2 4.18Å; C315-L334 CarbonylContact C-O 3.53Å; C315-L334 WeakPolarHBondContact CA-O 3.45Å; D316-L334 PolarHBondContact N-O 2.95Å; L322-L334 HydrophobicContact CD1-CB 4.01Å; Y327-L334 HydrophobicContact CD2-CD2 3.74Å; Y327-L334 HydrophobicContact CE2-CD2 4.3Å; Y327-L334 HydrophobicContact CG-CD2 4.49Å; F329-L334 HydrophobicContact CD2-CD2 3.98Å; F329-L334 HydrophobicContact CD2-CG 4.32Å
335	Y	89.3	Confident	83.8	Confident	14 Å²	14	76.7 Å²	76.7	6%	0.055	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	148	-178.2	-62.1	-71.9	0	0	0	112.3	D316 D317 F328 I330 S333 H339 R343	D316-Y335 HydrophobicContact CB-CD1 4.45Å; D316-Y335 HydrophobicContact CB-CE1 3.83Å; D317-Y335 WeakPolarHBondContact OD2-CD1 3.46Å; D317-Y335 WeakPolarHBondContact OD2-CE1 3.33Å; F328-Y335 PolarHBondContact N-O 2.87Å; F328-Y335 PolarHBondContact O-N 2.96Å; I330-Y335 HydrophobicContact CB-CD2 3.91Å; I330-Y335 HydrophobicContact CB-CE2 4.03Å; I330-Y335 HydrophobicContact CD1-CD2 3.98Å; I330-Y335 HydrophobicContact CG1-CD2 4.33Å; S333-Y335 WeakPolarHBondContact CB-OH 3.46Å; Y335-H339 HydrophobicContact CD1-CB 4.32Å; Y335-R343 VanDerWaalsContact CD1-NH1 3.34Å; Y335-R343 VanDerWaalsContact CE1-NH1 3.25Å
336	C	91	Very high	82.8	Confident	13 Å²	13	72 Å²	72	9%	0.088	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	161.8	166.3	70.6	0	0	0	0	110.4	C315 L322 T338 H339 A340	C315-C336 HydrophobicContact CB-CB 4.3Å; C315-C336 PolarHBondContact SG-N 3.08Å; L322-C336 HydrophobicContact CD2-CB 3.81Å; C336-T338 VanDerWaalsContact C-N 3.28Å; C336-T338 PolarHBondContact O-N 3.12Å; C336-H339 PolarHBondContact O-N 3.03Å; C336-H339 VanDerWaalsContact O-N 3.15Å; C336-H339 VanDerWaalsContact SG-CG 3.56Å; C336-A340 VanDerWaalsContact O-CB 3.28Å; C336-A340 WeakPolarHBondContact O-CB 3.39Å; C336-A340 PolarHBondContact O-N 3.33Å
337	E	87.4	Confident	81.8	Confident	93 Å²	93	75.3 Å²	75.3	44%	0.435	39%	0.393	S	S	.	.	H	α-helix	trans	-48.1	-45	-179.8	-171.8	-179.6	163.2	0	0	114.3	F328 A340 K341	F328-E337 HydrophobicContact CD2-CB 4.4Å; F328-E337 HydrophobicContact CE2-CB 3.78Å; F328-E337 HydrophobicContact CE2-CG 3.84Å; F328-E337 HydrophobicContact CZ-CG 4.27Å; E337-A340 PolarHBondContact O-N 3.4Å; E337-K341 HydrophobicContact CG-CD 4.1Å; E337-K341 WeakPolarHBondContact O-CB 3.41Å; E337-K341 WeakPolarHBondContact O-CG 3.4Å; E337-K341 PolarHBondContact O-N 2.95Å; E337-K341 WeakPolarHBondContact OE1-CE 3.37Å; E337-K341 IonicContact OE1-NZ 3.83Å; E337-K341 PolarHBondContact OE1-NZ 2.86Å
338	T	89	Confident	80.2	Confident	103 Å²	103	80 Å²	80	63%	0.632	42%	0.419	S	S	*	.	H	α-helix	trans	-61.7	-50.4	179.7	-44	0	0	0	0	112	C336 A340 K341 A342	C336-T338 VanDerWaalsContact C-N 3.28Å; C336-T338 PolarHBondContact O-N 3.12Å; T338-A340 VanDerWaalsContact C-N 3.3Å; T338-A340 PolarHBondContact O-N 2.68Å; T338-K341 PolarHBondContact O-N 3.23Å; T338-A342 WeakPolarHBondContact O-CB 3.31Å; T338-A342 PolarHBondContact O-N 3.3Å; T338-A342 VanDerWaalsContact O-N 3.09Å
339	H	89.1	Confident	78.6	Confident	54 Å²	54	79.8 Å²	79.8	25%	0.25	44%	0.441	C	S	.	.	H	α-helix	trans	-78.7	-16.3	-176	-62.8	179.2	0	0	0	113.5	D317 Y335 C336 R343	D317-H339 WeakPolarHBondContact CB-ND1 3.46Å; D317-H339 WeakPolarHBondContact OD2-CB 3.34Å; D317-H339 IonicContact OD2-CE1 3.85Å; D317-H339 IonicContact OD2-CG 3.4Å; D317-H339 IonicContact OD2-ND1 2.86Å; D317-H339 PolarHBondContact OD2-ND1 3.18Å; Y335-H339 HydrophobicContact CD1-CB 4.32Å; C336-H339 PolarHBondContact O-N 3.03Å; C336-H339 VanDerWaalsContact O-N 3.15Å; C336-H339 VanDerWaalsContact SG-CG 3.56Å; H339-R343 WeakPolarHBondContact O-CG 3.37Å; H339-R343 PolarHBondContact O-NH1 3.09Å
340	A	88.9	Confident	77	Confident	2 Å²	2	88 Å²	88	2%	0.017	47%	0.472	C	S	.	.	H	α-helix	trans	-77.9	-48.8	170.4	0	0	0	0	0	111.4	F328 I330 C336 E337 T338 A342 R343 V344	F328-A340 HydrophobicContact CB-CB 3.34Å; F328-A340 HydrophobicContact CD1-CB 4.17Å; F328-A340 HydrophobicContact CD2-CB 3.71Å; F328-A340 HydrophobicContact CG-CB 3.47Å; F328-A340 VanDerWaalsContact CG-CB 3.47Å; I330-A340 HydrophobicContact CD1-CB 3.8Å; C336-A340 VanDerWaalsContact O-CB 3.28Å; C336-A340 WeakPolarHBondContact O-CB 3.39Å; C336-A340 PolarHBondContact O-N 3.33Å; E337-A340 PolarHBondContact O-N 3.4Å; T338-A340 VanDerWaalsContact C-N 3.3Å; T338-A340 PolarHBondContact O-N 2.68Å; A340-A342 VanDerWaalsContact C-N 3.3Å; A340-A342 PolarHBondContact O-N 3.11Å; A340-R343 PolarHBondContact O-N 3.21Å; A340-V344 WeakPolarHBondContact O-CG2 3.41Å; A340-V344 PolarHBondContact O-N 3.26Å
341	K	85	Confident	75.4	Confident	118 Å²	118	93.3 Å²	93.3	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-58	-43.7	175.1	-74	172.9	175.3	177.1	0	111.1	E337 T338 R343 V344 Q345	E337-K341 HydrophobicContact CG-CD 4.1Å; E337-K341 WeakPolarHBondContact O-CB 3.41Å; E337-K341 WeakPolarHBondContact O-CG 3.4Å; E337-K341 PolarHBondContact O-N 2.95Å; E337-K341 WeakPolarHBondContact OE1-CE 3.37Å; E337-K341 IonicContact OE1-NZ 3.83Å; E337-K341 PolarHBondContact OE1-NZ 2.86Å; T338-K341 PolarHBondContact O-N 3.23Å; K341-R343 PolarHBondContact O-N 3.35Å; K341-R343 VanDerWaalsContact O-N 3.12Å; K341-V344 PolarHBondContact O-N 3.09Å; K341-Q345 WeakPolarHBondContact O-CB 3.46Å; K341-Q345 PolarHBondContact O-N 3.08Å; K341-Q345 VanDerWaalsContact O-N 3.08Å
342	A	83.7	Confident	74.3	Confident	75 Å²	75	91.1 Å²	91.1	62%	0.62	50%	0.499	S	S	*	.	H	α-helix	trans	-62.6	-14.8	175.9	0	0	0	0	0	115.4	T338 A340	T338-A342 WeakPolarHBondContact O-CB 3.31Å; T338-A342 PolarHBondContact O-N 3.3Å; T338-A342 VanDerWaalsContact O-N 3.09Å; A340-A342 VanDerWaalsContact C-N 3.3Å; A340-A342 PolarHBondContact O-N 3.11Å
343	R	79.7	Confident	73.4	Confident	106 Å²	106	91.8 Å²	91.8	40%	0.4	51%	0.507	S	S	.	.	H	α-helix	trans	-105.7	-31.2	177.9	-77.9	-179.9	169.4	90.8	-4.6	114.2	D317 I330 Y335 H339 A340 K341	D317-R343 IonicContact OD1-CZ 3.21Å; D317-R343 IonicContact OD1-NH1 3.18Å; D317-R343 PolarHBondContact OD1-NH1 2.9Å; D317-R343 IonicContact OD1-NH2 2.6Å; D317-R343 PolarHBondContact OD1-NH2 2.96Å; D317-R343 IonicContact OD2-CZ 2.65Å; D317-R343 IonicContact OD2-NH1 2.7Å; D317-R343 PolarHBondContact OD2-NH1 3.12Å; D317-R343 IonicContact OD2-NH2 3.85Å; I330-R343 HydrophobicContact CD1-CB 4.13Å; Y335-R343 VanDerWaalsContact CD1-NH1 3.34Å; Y335-R343 VanDerWaalsContact CE1-NH1 3.25Å; H339-R343 WeakPolarHBondContact O-CG 3.37Å; H339-R343 PolarHBondContact O-NH1 3.09Å; A340-R343 PolarHBondContact O-N 3.21Å; K341-R343 PolarHBondContact O-N 3.35Å; K341-R343 VanDerWaalsContact O-N 3.12Å
344	V	73.5	Confident	71.6	Confident	98 Å²	98	93.5 Å²	93.5	59%	0.594	52%	0.523	S	S	*	.	H	α-helix	trans	-98.2	-1.1	-175.5	-174.3	0	0	0	0	111.6	I330 A340 K341 P346	I330-V344 HydrophobicContact CD1-CG2 3.47Å; I330-V344 VanDerWaalsContact CD1-CG2 3.47Å; I330-V344 HydrophobicContact CG1-CG2 3.78Å; A340-V344 WeakPolarHBondContact O-CG2 3.41Å; A340-V344 PolarHBondContact O-N 3.26Å; K341-V344 PolarHBondContact O-N 3.09Å; V344-P346 VanDerWaalsContact O-CD 3.31Å; V344-P346 WeakPolarHBondContact O-CD 3.25Å
345	Q	63.3	Low	70	Confident	144 Å²	144	99.1 Å²	99.1	67%	0.673	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-62.1	116	171.3	-170.6	154.2	15.4	0	0	109.4	K341	K341-Q345 WeakPolarHBondContact O-CB 3.46Å; K341-Q345 PolarHBondContact O-N 3.08Å; K341-Q345 VanDerWaalsContact O-N 3.08Å
346	P	57.3	Low	67.7	Low	83 Å²	83	108 Å²	108	54%	0.539	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-65.2	151.9	178.4	28.6	-34.7	0	0	0	109.8	V344 E348	V344-P346 VanDerWaalsContact O-CD 3.31Å; V344-P346 WeakPolarHBondContact O-CD 3.25Å; P346-E348 PolarHBondContact O-N 3.27Å
347	P	59.9	Low	66.1	Low	112 Å²	112	113.1 Å²	113.1	73%	0.727	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-57.9	135.1	174.4	25.4	-33.9	0	0	0	110.2	G349	P347-G349 PolarHBondContact O-N 3.1Å
348	E	53.8	Low	64.2	Low	197 Å²	197	116.3 Å²	116.3	92%	0.921	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	123.4	-179.6	-66	-170.7	123.5	0	0	110.6	P346	P346-E348 PolarHBondContact O-N 3.27Å
349	G	55.4	Low	62.1	Low	83 Å²	83	116.7 Å²	116.7	86%	0.856	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	127	-3.4	175.8	0	0	0	0	0	116.8	P347	P347-G349 PolarHBondContact O-N 3.1Å
350	Y	54.7	Low	60.2	Low	204 Å²	204	122 Å²	122	80%	0.8	67%	0.674	S	S	*	*			trans	-104.5	119.1	170.9	-122.3	-91.8	0	0	0	111.8
351	D	51.4	Low	58.2	Low	142 Å²	142	128.1 Å²	128.1	76%	0.759	71%	0.711	S	S	*	*			trans	-78.9	140.7	-179.9	-166.5	10	0	0	0	111.6	V353	D351-V353 PolarHBondContact O-N 2.99Å; D351-V353 VanDerWaalsContact O-N 3.14Å
352	V	58.9	Low	56.4	Low	125 Å²	125	128.9 Å²	128.9	76%	0.758	72%	0.717	S	S	*	*			trans	-94.4	72.3	-167.3	-167.8	0	0	0	0	110.2	A354	V352-A354 PolarHBondContact O-N 3.23Å
353	V	56.6	Low	54.5	Low	116 Å²	116	133.5 Å²	133.5	70%	0.703	73%	0.73	S	S	*	*			trans	-61.7	107	179.2	-177.8	0	0	0	0	110.7	D351 V355	D351-V353 PolarHBondContact O-N 2.99Å; D351-V353 VanDerWaalsContact O-N 3.14Å; V353-V355 HydrophobicContact CG1-CG2 4.45Å; V353-V355 PolarHBondContact O-N 3.4Å
354	A	47.8	Very low	53.2	Low	73 Å²	73	138.5 Å²	138.5	60%	0.603	77%	0.772	S	S	*	*			trans	-73.1	90.8	178.7	0	0	0	0	0	111.6	V352 Y356	V352-A354 PolarHBondContact O-N 3.23Å; A354-Y356 HydrophobicContact CB-CE2 4.27Å; A354-Y356 WeakPolarHBondContact O-CD2 3.39Å; A354-Y356 PolarHBondContact O-N 2.92Å
355	V	55	Low	52.2	Low	127 Å²	127	140.6 Å²	140.6	77%	0.77	78%	0.781	S	S	*	*			trans	-75	102.7	172.9	-176.8	0	0	0	0	109.6	V353 P357	V353-V355 HydrophobicContact CG1-CG2 4.45Å; V353-V355 PolarHBondContact O-N 3.4Å; V355-P357 WeakPolarHBondContact O-CD 3.35Å
356	Y	39.8	Very low	51.6	Low	200 Å²	200	140.4 Å²	140.4	78%	0.784	79%	0.787	S	S	*	*			trans	-71.5	121	175.2	-78	-95.3	0	0	0	111.1	A354 N358	A354-Y356 HydrophobicContact CB-CE2 4.27Å; A354-Y356 WeakPolarHBondContact O-CD2 3.39Å; A354-Y356 PolarHBondContact O-N 2.92Å; Y356-N358 VanDerWaalsContact C-N 3.31Å; Y356-N358 PolarHBondContact O-N 2.8Å
357	P	58	Low	51.3	Low	121 Å²	121	143.6 Å²	143.6	79%	0.786	80%	0.801	S	S	*	*	S	Bend	trans	-81.1	74.9	178.7	33.6	-35	0	0	0	111.1	V355	V355-P357 WeakPolarHBondContact O-CD 3.35Å
358	N	47	Very low	50.8	Low	160 Å²	160	145.4 Å²	145.4	86%	0.856	81%	0.805	S	S	*	*			trans	-164	94.9	162.7	-102.9	-34	0	0	0	112.5	Y356	Y356-N358 VanDerWaalsContact C-N 3.31Å; Y356-N358 PolarHBondContact O-N 2.8Å
359	S	44.5	Very low	50.6	Low	110 Å²	110	142.2 Å²	142.2	77%	0.769	80%	0.798	S	S	*	*			trans	-133	108	153.1	48.4	0	0	0	0	108.8	V361	S359-V361 PolarHBondContact O-N 2.92Å; S359-V361 VanDerWaalsContact O-N 3.1Å
360	K	49.2	Very low	50.3	Low	165 Å²	165	146.1 Å²	146.1	72%	0.717	79%	0.794	S	S	*	*			trans	-65.4	105.6	178.4	-178.4	-163.5	-173.5	-168.1	0	108.8	E362	K360-E362 HydrophobicContact CD-CG 4Å; K360-E362 VanDerWaalsContact CE-OE1 3.25Å; K360-E362 WeakPolarHBondContact CE-OE1 3.28Å; K360-E362 HydrophobicContact CG-CG 4.23Å; K360-E362 IonicContact NZ-OE1 3.83Å; K360-E362 PolarHBondContact NZ-OE1 3.28Å; K360-E362 PolarHBondContact O-N 3.08Å
361	V	47.4	Very low	49.9	Very low	131 Å²	131	142 Å²	142	79%	0.794	79%	0.794	S	S	*	*			trans	-79.4	100.6	172.1	-147.4	0	0	0	0	107.9	S359	S359-V361 PolarHBondContact O-N 2.92Å; S359-V361 VanDerWaalsContact O-N 3.1Å
362	E	46.8	Very low	49.8	Very low	135 Å²	135	142 Å²	142	63%	0.631	80%	0.796	S	S	*	*			trans	-76.1	129	167.7	-70.1	-173.2	150	0	0	109.2	K360	K360-E362 HydrophobicContact CD-CG 4Å; K360-E362 VanDerWaalsContact CE-OE1 3.25Å; K360-E362 WeakPolarHBondContact CE-OE1 3.28Å; K360-E362 HydrophobicContact CG-CG 4.23Å; K360-E362 IonicContact NZ-OE1 3.83Å; K360-E362 PolarHBondContact NZ-OE1 3.28Å; K360-E362 PolarHBondContact O-N 3.08Å
363	L	44.1	Very low	49.1	Very low	172 Å²	172	143.4 Å²	143.4	90%	0.901	80%	0.799	S	S	*	*			trans	-83.8	134	168.8	-71	164.1	0	0	0	108.6
364	V	52.6	Low	48.4	Very low	211 Å²	211	145.9 Å²	145.9	100%	1.279	81%	0.808	S	S	*	*			trans	-122.9	0	169.9	178.1	0	0	0	0	107.5

Retrieved 364 of 364 residues in 206.2 ms (Link to these results)

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